NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
610545 | 2nax | 25953 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 533 H1 GLY 533 12.284 2.987 -12.209 2 H2 GLY 533 H2 GLY 533 13.516 3.216 -11.138 3 H3 GLY 533 H3 GLY 533 12.780 4.507 -11.823 4 HA2 GLY 533 HA2 GLY 533 12.080 4.191 -9.518 5 HA3 GLY 533 HA3 GLY 533 10.744 4.086 -10.675 6 H GLY 534 H GLY 534 13.067 2.083 -8.817 7 HA2 GLY 534 HA2 GLY 534 11.722 -0.432 -9.196 8 HA3 GLY 534 HA3 GLY 534 12.878 -0.043 -7.925 9 H SER 535 H SER 535 10.387 -1.627 -7.785 10 HA SER 535 HA SER 535 8.346 -0.170 -6.351 11 HB2 SER 535 HB2 SER 535 7.494 -2.445 -5.838 12 HB3 SER 535 HB3 SER 535 7.811 -2.190 -7.559 13 HG SER 535 HG SER 535 8.635 -4.194 -6.825 14 H GLU 536 H GLU 536 10.898 -2.404 -5.271 15 HA GLU 536 HA GLU 536 11.020 -1.016 -2.614 16 HB2 GLU 536 HB2 GLU 536 11.086 -4.019 -3.096 17 HB3 GLU 536 HB3 GLU 536 11.431 -3.217 -1.558 18 HG2 GLU 536 HG2 GLU 536 9.119 -2.186 -1.669 19 HG3 GLU 536 HG3 GLU 536 8.770 -3.251 -3.028 20 H PHE 537 H PHE 537 12.810 -2.454 -5.265 21 HA PHE 537 HA PHE 537 15.402 -2.462 -3.959 22 HB2 PHE 537 HB2 PHE 537 14.685 -2.337 -6.908 23 HB3 PHE 537 HB3 PHE 537 16.275 -2.679 -6.250 24 HD1 PHE 537 HD1 PHE 537 16.597 -4.781 -4.812 25 HD2 PHE 537 HD2 PHE 537 13.093 -4.105 -7.234 26 HE1 PHE 537 HE1 PHE 537 16.078 -7.209 -4.744 27 HE2 PHE 537 HE2 PHE 537 12.574 -6.530 -7.152 28 HZ PHE 537 HZ PHE 537 14.067 -8.084 -5.912 29 H SER 538 H SER 538 17.004 -0.912 -3.972 30 HA SER 538 HA SER 538 16.278 1.877 -4.584 31 HB2 SER 538 HB2 SER 538 17.579 1.412 -2.582 32 HB3 SER 538 HB3 SER 538 18.863 0.668 -3.557 33 HG SER 538 HG SER 538 19.160 2.926 -2.981 34 H ASP 539 H ASP 539 16.845 3.006 -6.331 35 HA ASP 539 HA ASP 539 18.308 1.710 -8.556 36 HB2 ASP 539 HB2 ASP 539 16.809 4.343 -8.377 37 HB3 ASP 539 HB3 ASP 539 17.554 3.700 -9.837 38 H ARG 540 H ARG 540 19.339 3.320 -5.893 39 HA ARG 540 HA ARG 540 21.123 5.312 -7.020 40 HB2 ARG 540 HB2 ARG 540 20.796 4.294 -4.200 41 HB3 ARG 540 HB3 ARG 540 21.836 5.643 -4.687 42 HG2 ARG 540 HG2 ARG 540 19.890 6.837 -5.656 43 HG3 ARG 540 HG3 ARG 540 18.829 5.513 -5.153 44 HD2 ARG 540 HD2 ARG 540 18.596 7.189 -3.515 45 HD3 ARG 540 HD3 ARG 540 19.526 5.869 -2.807 46 HE ARG 540 HE ARG 540 21.378 7.260 -2.579 47 HH11 ARG 540 HH11 ARG 540 19.031 8.976 -4.547 48 HH12 ARG 540 HH12 ARG 540 19.934 10.473 -4.468 49 HH21 ARG 540 HH21 ARG 540 22.477 9.179 -2.532 50 HH22 ARG 540 HH22 ARG 540 21.826 10.577 -3.348 51 H SER 541 H SER 541 21.658 2.695 -8.037 52 HA SER 541 HA SER 541 23.293 1.287 -8.649 53 HB2 SER 541 HB2 SER 541 24.377 3.499 -9.097 54 HB3 SER 541 HB3 SER 541 25.259 3.317 -7.574 55 HG SER 541 HG SER 541 25.494 1.876 -9.966 56 H ASN 542 H ASN 542 25.374 0.089 -7.994 57 HA ASN 542 HA ASN 542 24.777 -1.471 -5.635 58 HB2 ASN 542 HB2 ASN 542 25.662 -2.350 -7.819 59 HB3 ASN 542 HB3 ASN 542 27.195 -1.535 -7.489 60 HD21 ASN 542 HD21 ASN 542 28.736 -2.848 -6.595 61 HD22 ASN 542 HD22 ASN 542 28.365 -4.296 -5.661 62 H GLU 543 H GLU 543 26.628 1.393 -6.017 63 HA GLU 543 HA GLU 543 28.812 1.087 -4.315 64 HB2 GLU 543 HB2 GLU 543 28.294 3.034 -5.785 65 HB3 GLU 543 HB3 GLU 543 27.014 3.514 -4.690 66 HG2 GLU 543 HG2 GLU 543 28.941 4.913 -4.337 67 HG3 GLU 543 HG3 GLU 543 28.644 3.956 -2.902 68 H LEU 544 H LEU 544 25.454 1.850 -3.357 69 HA LEU 544 HA LEU 544 26.076 2.065 -0.507 70 HB2 LEU 544 HB2 LEU 544 23.414 1.718 -1.937 71 HB3 LEU 544 HB3 LEU 544 23.634 2.208 -0.260 72 HG LEU 544 HG LEU 544 24.416 3.820 -2.733 73 HD11 LEU 544 HD11 LEU 544 22.638 5.319 -2.021 74 HD12 LEU 544 HD12 LEU 544 22.299 4.301 -0.599 75 HD13 LEU 544 HD13 LEU 544 21.989 3.684 -2.236 76 HD21 LEU 544 HD21 LEU 544 24.673 4.512 0.227 77 HD22 LEU 544 HD22 LEU 544 24.871 5.661 -1.113 78 HD23 LEU 544 HD23 LEU 544 26.010 4.321 -0.936 79 H GLU 545 H GLU 545 25.095 -0.531 -2.663 80 HA GLU 545 HA GLU 545 23.995 -2.262 -0.645 81 HB2 GLU 545 HB2 GLU 545 23.373 -2.349 -3.040 82 HB3 GLU 545 HB3 GLU 545 25.005 -2.834 -3.465 83 HG2 GLU 545 HG2 GLU 545 23.463 -4.724 -3.518 84 HG3 GLU 545 HG3 GLU 545 24.752 -4.967 -2.362 85 H ILE 546 H ILE 546 27.274 -1.893 -1.913 86 HA ILE 546 HA ILE 546 28.463 -4.199 -0.673 87 HB ILE 546 HB ILE 546 29.641 -1.451 -1.206 88 HG12 ILE 546 HG12 ILE 546 28.784 -2.608 -3.288 89 HG13 ILE 546 HG13 ILE 546 30.489 -2.195 -3.274 90 HG21 ILE 546 HG21 ILE 546 31.068 -2.601 0.368 91 HG22 ILE 546 HG22 ILE 546 30.964 -4.108 -0.543 92 HG23 ILE 546 HG23 ILE 546 31.833 -2.720 -1.230 93 HD11 ILE 546 HD11 ILE 546 31.117 -4.504 -2.826 94 HD12 ILE 546 HD12 ILE 546 29.391 -4.972 -2.709 95 HD13 ILE 546 HD13 ILE 546 30.074 -4.416 -4.253 96 H ARG 547 H ARG 547 27.776 -0.929 0.567 97 HA ARG 547 HA ARG 547 29.077 -1.372 3.148 98 HB2 ARG 547 HB2 ARG 547 29.061 0.790 1.986 99 HB3 ARG 547 HB3 ARG 547 27.310 0.883 2.116 100 HG2 ARG 547 HG2 ARG 547 28.872 0.552 4.670 101 HG3 ARG 547 HG3 ARG 547 29.047 2.087 3.833 102 HD2 ARG 547 HD2 ARG 547 26.342 0.924 4.577 103 HD3 ARG 547 HD3 ARG 547 27.258 2.031 5.600 104 HE ARG 547 HE ARG 547 27.112 3.264 3.080 105 HH11 ARG 547 HH11 ARG 547 24.811 2.358 5.563 106 HH12 ARG 547 HH12 ARG 547 23.687 3.622 5.113 107 HH21 ARG 547 HH21 ARG 547 25.667 4.864 2.574 108 HH22 ARG 547 HH22 ARG 547 24.166 4.998 3.455 109 H GLY 548 H GLY 548 25.850 -1.811 1.929 110 HA2 GLY 548 HA2 GLY 548 24.449 -1.962 4.433 111 HA3 GLY 548 HA3 GLY 548 23.923 -2.628 2.887 112 H LYS 549 H LYS 549 26.703 -4.231 3.107 113 HA LYS 549 HA LYS 549 25.552 -6.708 4.049 114 HB2 LYS 549 HB2 LYS 549 28.463 -5.977 3.499 115 HB3 LYS 549 HB3 LYS 549 27.819 -7.612 3.680 116 HG2 LYS 549 HG2 LYS 549 27.341 -5.653 1.416 117 HG3 LYS 549 HG3 LYS 549 28.180 -7.200 1.374 118 HD2 LYS 549 HD2 LYS 549 25.971 -8.341 1.832 119 HD3 LYS 549 HD3 LYS 549 25.192 -6.745 1.726 120 HE2 LYS 549 HE2 LYS 549 26.188 -6.449 -0.552 121 HE3 LYS 549 HE3 LYS 549 26.820 -8.096 -0.456 122 HZ1 LYS 549 HZ1 LYS 549 24.752 -8.182 -1.624 123 HZ2 LYS 549 HZ2 LYS 549 23.986 -7.264 -0.540 124 HZ3 LYS 549 HZ3 LYS 549 24.421 -8.796 -0.147 125 H TYR 550 H TYR 550 26.129 -8.023 5.791 126 HA TYR 550 HA TYR 550 27.973 -7.110 7.836 127 HB2 TYR 550 HB2 TYR 550 26.360 -7.204 9.709 128 HB3 TYR 550 HB3 TYR 550 26.040 -5.879 8.636 129 HD1 TYR 550 HD1 TYR 550 23.962 -5.819 7.278 130 HD2 TYR 550 HD2 TYR 550 24.862 -9.175 9.843 131 HE1 TYR 550 HE1 TYR 550 21.613 -6.611 7.075 132 HE2 TYR 550 HE2 TYR 550 22.500 -9.947 9.650 133 HH TYR 550 HH TYR 550 20.091 -8.196 7.705 134 H VAL 551 H VAL 551 28.198 -8.652 9.614 135 HA VAL 551 HA VAL 551 27.351 -11.447 9.089 136 HB VAL 551 HB VAL 551 29.730 -12.103 9.894 137 HG11 VAL 551 HG11 VAL 551 28.783 -12.602 7.640 138 HG12 VAL 551 HG12 VAL 551 29.389 -11.027 7.061 139 HG13 VAL 551 HG13 VAL 551 30.520 -12.291 7.588 140 HG21 VAL 551 HG21 VAL 551 30.452 -9.405 8.710 141 HG22 VAL 551 HG22 VAL 551 30.652 -9.927 10.408 142 HG23 VAL 551 HG23 VAL 551 31.572 -10.720 9.127 143 H VAL 552 H VAL 552 26.922 -12.664 10.949 144 HA VAL 552 HA VAL 552 26.313 -11.111 13.310 145 HB VAL 552 HB VAL 552 26.198 -14.081 12.768 146 HG11 VAL 552 HG11 VAL 552 24.787 -14.310 14.783 147 HG12 VAL 552 HG12 VAL 552 26.420 -13.808 15.222 148 HG13 VAL 552 HG13 VAL 552 25.104 -12.618 15.208 149 HG21 VAL 552 HG21 VAL 552 23.767 -13.707 12.679 150 HG22 VAL 552 HG22 VAL 552 23.988 -11.984 13.025 151 HG23 VAL 552 HG23 VAL 552 24.587 -12.689 11.500 152 H VAL 553 H VAL 553 27.359 -10.793 15.147 153 HA VAL 553 HA VAL 553 30.123 -11.742 15.487 154 HB VAL 553 HB VAL 553 28.534 -10.088 17.486 155 HG11 VAL 553 HG11 VAL 553 31.500 -10.583 16.970 156 HG12 VAL 553 HG12 VAL 553 30.846 -9.431 18.147 157 HG13 VAL 553 HG13 VAL 553 30.553 -11.164 18.361 158 HG21 VAL 553 HG21 VAL 553 28.500 -8.641 15.629 159 HG22 VAL 553 HG22 VAL 553 29.933 -8.160 16.568 160 HG23 VAL 553 HG23 VAL 553 30.117 -9.152 15.097 161 HA PRO 554 HA PRO 554 28.413 -15.138 18.000 162 HB2 PRO 554 HB2 PRO 554 30.680 -16.537 18.500 163 HB3 PRO 554 HB3 PRO 554 29.946 -16.476 16.865 164 HG2 PRO 554 HG2 PRO 554 32.256 -14.819 17.902 165 HG3 PRO 554 HG3 PRO 554 32.143 -15.736 16.368 166 HD2 PRO 554 HD2 PRO 554 31.602 -13.044 16.522 167 HD3 PRO 554 HD3 PRO 554 30.747 -14.135 15.387 168 H GLU 555 H GLU 555 28.418 -15.747 20.238 169 HA GLU 555 HA GLU 555 29.186 -13.750 22.138 170 HB2 GLU 555 HB2 GLU 555 28.240 -15.146 23.755 171 HB3 GLU 555 HB3 GLU 555 27.209 -15.270 22.353 172 HG2 GLU 555 HG2 GLU 555 29.308 -17.339 23.185 173 HG3 GLU 555 HG3 GLU 555 27.641 -17.374 23.690 174 H THR 556 H THR 556 30.972 -16.324 20.743 175 HA THR 556 HA THR 556 33.032 -16.521 22.826 176 HB THR 556 HB THR 556 34.194 -17.957 21.201 177 HG1 THR 556 HG1 THR 556 33.647 -17.207 19.239 178 HG21 THR 556 HG21 THR 556 32.612 -19.791 21.131 179 HG22 THR 556 HG22 THR 556 31.247 -18.689 21.377 180 HG23 THR 556 HG23 THR 556 32.432 -18.944 22.677 181 H SER 557 H SER 557 32.346 -14.215 20.406 182 HA SER 557 HA SER 557 34.910 -13.574 19.394 183 HB2 SER 557 HB2 SER 557 32.817 -12.661 18.465 184 HB3 SER 557 HB3 SER 557 32.566 -11.733 19.961 185 HG SER 557 HG SER 557 34.606 -11.433 18.027 186 H GLN 558 H GLN 558 36.528 -12.235 19.975 187 HA GLN 558 HA GLN 558 36.874 -11.500 22.800 188 HB2 GLN 558 HB2 GLN 558 38.638 -11.000 20.372 189 HB3 GLN 558 HB3 GLN 558 39.081 -10.674 22.045 190 HG2 GLN 558 HG2 GLN 558 38.472 -13.403 20.832 191 HG3 GLN 558 HG3 GLN 558 40.059 -12.800 21.264 192 HE21 GLN 558 HE21 GLN 558 38.500 -15.236 22.239 193 HE22 GLN 558 HE22 GLN 558 38.500 -15.048 23.987 194 H ASP 559 H ASP 559 35.410 -9.976 23.329 195 HA ASP 559 HA ASP 559 34.376 -8.004 23.562 196 HB2 ASP 559 HB2 ASP 559 36.965 -6.794 22.559 197 HB3 ASP 559 HB3 ASP 559 35.739 -6.006 23.543 198 H MET 560 H MET 560 33.947 -9.267 20.889 199 HA MET 560 HA MET 560 32.929 -8.892 18.959 200 HB2 MET 560 HB2 MET 560 31.768 -6.444 20.348 201 HB3 MET 560 HB3 MET 560 31.146 -7.248 18.899 202 HG2 MET 560 HG2 MET 560 31.158 -9.399 20.361 203 HG3 MET 560 HG3 MET 560 31.202 -8.286 21.733 204 HE1 MET 560 HE1 MET 560 28.994 -10.556 20.098 205 HE2 MET 560 HE2 MET 560 28.972 -10.231 21.844 206 HE3 MET 560 HE3 MET 560 27.510 -9.969 20.863 207 H ALA 561 H ALA 561 35.634 -7.955 18.924 208 HA ALA 561 HA ALA 561 35.404 -5.901 16.799 209 HB1 ALA 561 HB1 ALA 561 35.863 -4.772 18.942 210 HB2 ALA 561 HB2 ALA 561 37.323 -5.762 19.161 211 HB3 ALA 561 HB3 ALA 561 37.216 -4.605 17.811 212 H PHE 562 H PHE 562 36.964 -5.712 15.328 213 HA PHE 562 HA PHE 562 39.383 -7.327 15.260 214 HB2 PHE 562 HB2 PHE 562 37.110 -7.795 13.304 215 HB3 PHE 562 HB3 PHE 562 38.767 -7.981 12.785 216 HD1 PHE 562 HD1 PHE 562 40.320 -9.439 14.408 217 HD2 PHE 562 HD2 PHE 562 36.045 -9.798 14.013 218 HE1 PHE 562 HE1 PHE 562 40.432 -11.772 15.259 219 HE2 PHE 562 HE2 PHE 562 36.170 -12.131 14.870 220 HZ PHE 562 HZ PHE 562 38.352 -13.107 15.504 221 H LYS 563 H LYS 563 40.743 -6.649 13.302 222 HA LYS 563 HA LYS 563 40.203 -3.782 12.630 223 HB2 LYS 563 HB2 LYS 563 42.035 -4.252 14.329 224 HB3 LYS 563 HB3 LYS 563 42.958 -4.973 13.002 225 HG2 LYS 563 HG2 LYS 563 42.730 -2.765 11.764 226 HG3 LYS 563 HG3 LYS 563 41.928 -2.099 13.190 227 HD2 LYS 563 HD2 LYS 563 44.783 -3.119 12.961 228 HD3 LYS 563 HD3 LYS 563 44.279 -1.443 13.130 229 HE2 LYS 563 HE2 LYS 563 43.909 -3.615 15.240 230 HE3 LYS 563 HE3 LYS 563 45.227 -2.458 15.211 231 HZ1 LYS 563 HZ1 LYS 563 43.472 -1.717 16.694 232 HZ2 LYS 563 HZ2 LYS 563 42.363 -1.722 15.509 233 HZ3 LYS 563 HZ3 LYS 563 43.606 -0.665 15.464 234 H CYS 564 H CYS 564 40.256 -3.153 10.662 235 HA CYS 564 HA CYS 564 40.587 -4.850 8.348 236 HB2 CYS 564 HB2 CYS 564 39.015 -2.789 8.723 237 HB3 CYS 564 HB3 CYS 564 40.422 -1.810 8.545 238 HA PRO 565 HA PRO 565 45.098 -3.765 8.392 239 HB2 PRO 565 HB2 PRO 565 45.963 -5.549 6.510 240 HB3 PRO 565 HB3 PRO 565 45.552 -6.034 8.180 241 HG2 PRO 565 HG2 PRO 565 43.760 -6.144 5.732 242 HG3 PRO 565 HG3 PRO 565 44.140 -7.479 6.875 243 HD2 PRO 565 HD2 PRO 565 41.886 -6.041 7.190 244 HD3 PRO 565 HD3 PRO 565 42.879 -6.461 8.606 245 H ILE 566 H ILE 566 42.762 -3.506 5.802 246 HA ILE 566 HA ILE 566 44.543 -2.418 3.786 247 HB ILE 566 HB ILE 566 41.529 -2.406 4.072 248 HG12 ILE 566 HG12 ILE 566 43.388 -4.043 2.275 249 HG13 ILE 566 HG13 ILE 566 42.644 -4.641 3.753 250 HG21 ILE 566 HG21 ILE 566 43.241 -1.537 1.695 251 HG22 ILE 566 HG22 ILE 566 41.481 -1.740 1.646 252 HG23 ILE 566 HG23 ILE 566 42.171 -0.494 2.656 253 HD11 ILE 566 HD11 ILE 566 41.383 -5.491 1.899 254 HD12 ILE 566 HD12 ILE 566 40.371 -4.291 2.724 255 HD13 ILE 566 HD13 ILE 566 41.179 -3.887 1.193 256 H CYS 567 H CYS 567 42.005 -0.876 5.833 257 HA CYS 567 HA CYS 567 43.304 1.747 5.396 258 HB2 CYS 567 HB2 CYS 567 41.243 2.737 5.866 259 HB3 CYS 567 HB3 CYS 567 40.921 1.420 4.733 260 H LYS 568 H LYS 568 43.455 -0.609 7.661 261 HA LYS 568 HA LYS 568 44.214 -0.829 9.788 262 HB2 LYS 568 HB2 LYS 568 45.179 2.030 9.638 263 HB3 LYS 568 HB3 LYS 568 45.738 0.779 10.725 264 HG2 LYS 568 HG2 LYS 568 46.116 0.764 7.698 265 HG3 LYS 568 HG3 LYS 568 47.310 1.264 8.902 266 HD2 LYS 568 HD2 LYS 568 47.373 -1.006 9.851 267 HD3 LYS 568 HD3 LYS 568 46.131 -1.533 8.707 268 HE2 LYS 568 HE2 LYS 568 48.234 -2.263 7.846 269 HE3 LYS 568 HE3 LYS 568 47.632 -0.981 6.807 270 HZ1 LYS 568 HZ1 LYS 568 49.708 -0.633 8.912 271 HZ2 LYS 568 HZ2 LYS 568 49.178 0.554 7.917 272 HZ3 LYS 568 HZ3 LYS 568 49.995 -0.706 7.309 273 H GLU 569 H GLU 569 41.504 -0.473 9.647 274 HA GLU 569 HA GLU 569 40.932 1.257 12.051 275 HB2 GLU 569 HB2 GLU 569 39.296 0.895 9.546 276 HB3 GLU 569 HB3 GLU 569 38.630 1.532 11.026 277 HG2 GLU 569 HG2 GLU 569 40.969 2.763 9.494 278 HG3 GLU 569 HG3 GLU 569 39.306 3.317 9.406 279 H THR 570 H THR 570 39.416 0.639 13.537 280 HA THR 570 HA THR 570 39.123 -2.307 13.719 281 HB THR 570 HB THR 570 38.691 -0.203 15.856 282 HG1 THR 570 HG1 THR 570 40.773 -0.141 15.285 283 HG21 THR 570 HG21 THR 570 39.054 -2.085 17.404 284 HG22 THR 570 HG22 THR 570 39.168 -3.216 16.043 285 HG23 THR 570 HG23 THR 570 37.629 -2.380 16.395 286 H VAL 571 H VAL 571 37.238 -3.306 13.312 287 HA VAL 571 HA VAL 571 34.663 -1.852 13.193 288 HB VAL 571 HB VAL 571 33.705 -4.113 12.672 289 HG11 VAL 571 HG11 VAL 571 34.329 -4.052 10.358 290 HG12 VAL 571 HG12 VAL 571 34.076 -2.420 10.977 291 HG13 VAL 571 HG13 VAL 571 35.738 -3.022 10.713 292 HG21 VAL 571 HG21 VAL 571 36.562 -4.929 12.120 293 HG22 VAL 571 HG22 VAL 571 35.581 -5.523 13.496 294 HG23 VAL 571 HG23 VAL 571 35.083 -5.867 11.826 295 H THR 572 H THR 572 32.937 -2.276 14.509 296 HA THR 572 HA THR 572 33.329 -4.024 16.885 297 HB THR 572 HB THR 572 32.123 -2.364 18.273 298 HG1 THR 572 HG1 THR 572 31.223 -1.090 16.617 299 HG21 THR 572 HG21 THR 572 34.009 -0.939 18.734 300 HG22 THR 572 HG22 THR 572 34.715 -1.243 17.130 301 HG23 THR 572 HG23 THR 572 34.608 -2.552 18.330 302 H GLY 573 H GLY 573 31.554 -5.130 17.563 303 HA2 GLY 573 HA2 GLY 573 29.408 -5.632 15.768 304 HA3 GLY 573 HA3 GLY 573 29.519 -6.188 17.434 305 H VAL 574 H VAL 574 27.214 -5.231 15.903 306 HA VAL 574 HA VAL 574 26.183 -3.230 17.844 307 HB VAL 574 HB VAL 574 25.562 -3.327 14.847 308 HG11 VAL 574 HG11 VAL 574 24.368 -1.173 15.263 309 HG12 VAL 574 HG12 VAL 574 23.610 -2.499 16.121 310 HG13 VAL 574 HG13 VAL 574 24.655 -1.357 17.003 311 HG21 VAL 574 HG21 VAL 574 27.806 -2.393 15.203 312 HG22 VAL 574 HG22 VAL 574 26.685 -1.107 14.753 313 HG23 VAL 574 HG23 VAL 574 27.187 -1.306 16.454 314 H TYR 575 H TYR 575 24.117 -3.612 18.691 315 HA TYR 575 HA TYR 575 23.273 -6.319 18.605 316 HB2 TYR 575 HB2 TYR 575 23.136 -4.855 20.565 317 HB3 TYR 575 HB3 TYR 575 21.892 -3.905 19.778 318 HD1 TYR 575 HD1 TYR 575 19.749 -4.311 20.675 319 HD2 TYR 575 HD2 TYR 575 22.555 -7.581 20.396 320 HE1 TYR 575 HE1 TYR 575 18.081 -5.845 21.720 321 HE2 TYR 575 HE2 TYR 575 20.887 -9.104 21.405 322 HH TYR 575 HH TYR 575 17.669 -7.974 22.483 323 H ASP 576 H ASP 576 21.606 -7.387 17.760 324 HA ASP 576 HA ASP 576 19.623 -6.065 15.964 325 HB2 ASP 576 HB2 ASP 576 21.106 -7.622 14.765 326 HB3 ASP 576 HB3 ASP 576 20.748 -8.894 15.916 327 H GLU 577 H GLU 577 17.851 -5.770 17.138 328 HA GLU 577 HA GLU 577 17.042 -7.256 19.435 329 HB2 GLU 577 HB2 GLU 577 15.417 -5.467 17.572 330 HB3 GLU 577 HB3 GLU 577 14.950 -5.976 19.202 331 HG2 GLU 577 HG2 GLU 577 16.899 -4.744 20.129 332 HG3 GLU 577 HG3 GLU 577 17.338 -4.228 18.495 333 H GLU 578 H GLU 578 16.382 -7.868 16.009 334 HA GLU 578 HA GLU 578 13.946 -9.398 16.475 335 HB2 GLU 578 HB2 GLU 578 14.291 -8.190 14.387 336 HB3 GLU 578 HB3 GLU 578 15.698 -9.173 13.991 337 HG2 GLU 578 HG2 GLU 578 14.299 -11.192 13.861 338 HG3 GLU 578 HG3 GLU 578 12.889 -10.279 14.397 339 H SER 579 H SER 579 17.308 -10.344 15.531 340 HA SER 579 HA SER 579 16.808 -13.182 16.015 341 HB2 SER 579 HB2 SER 579 18.425 -12.317 14.334 342 HB3 SER 579 HB3 SER 579 19.423 -11.674 15.658 343 HG SER 579 HG SER 579 20.076 -13.761 14.923 344 H GLY 580 H GLY 580 18.170 -10.456 17.856 345 HA2 GLY 580 HA2 GLY 580 18.441 -10.265 20.167 346 HA3 GLY 580 HA3 GLY 580 18.132 -11.988 20.389 347 H GLU 581 H GLU 581 20.406 -10.592 18.071 348 HA GLU 581 HA GLU 581 22.774 -11.645 19.533 349 HB2 GLU 581 HB2 GLU 581 22.101 -12.137 16.600 350 HB3 GLU 581 HB3 GLU 581 23.617 -12.578 17.367 351 HG2 GLU 581 HG2 GLU 581 20.887 -13.744 17.999 352 HG3 GLU 581 HG3 GLU 581 22.162 -14.506 17.073 353 H TRP 582 H TRP 582 24.762 -10.913 17.875 354 HA TRP 582 HA TRP 582 24.366 -7.983 17.386 355 HB2 TRP 582 HB2 TRP 582 26.722 -9.478 18.559 356 HB3 TRP 582 HB3 TRP 582 26.790 -7.793 18.043 357 HD1 TRP 582 HD1 TRP 582 24.875 -9.996 20.588 358 HE1 TRP 582 HE1 TRP 582 24.342 -8.640 22.673 359 HE3 TRP 582 HE3 TRP 582 26.831 -5.512 19.125 360 HZ2 TRP 582 HZ2 TRP 582 24.631 -5.913 23.575 361 HZ3 TRP 582 HZ3 TRP 582 26.710 -3.540 20.620 362 HH2 TRP 582 HH2 TRP 582 25.597 -3.719 22.855 363 H VAL 583 H VAL 583 25.618 -7.048 15.710 364 HA VAL 583 HA VAL 583 26.713 -8.889 13.628 365 HB VAL 583 HB VAL 583 25.575 -7.579 11.871 366 HG11 VAL 583 HG11 VAL 583 24.705 -9.750 12.517 367 HG12 VAL 583 HG12 VAL 583 23.683 -9.014 13.771 368 HG13 VAL 583 HG13 VAL 583 23.389 -8.646 12.064 369 HG21 VAL 583 HG21 VAL 583 24.995 -5.526 13.165 370 HG22 VAL 583 HG22 VAL 583 23.627 -6.219 12.300 371 HG23 VAL 583 HG23 VAL 583 23.774 -6.472 14.052 372 H TRP 584 H TRP 584 28.284 -8.206 12.380 373 HA TRP 584 HA TRP 584 29.737 -5.696 13.027 374 HB2 TRP 584 HB2 TRP 584 30.372 -8.363 11.811 375 HB3 TRP 584 HB3 TRP 584 31.309 -6.984 11.280 376 HD1 TRP 584 HD1 TRP 584 32.056 -5.484 13.801 377 HE1 TRP 584 HE1 TRP 584 33.442 -6.532 15.710 378 HE3 TRP 584 HE3 TRP 584 31.476 -10.423 12.615 379 HZ2 TRP 584 HZ2 TRP 584 34.398 -9.160 16.452 380 HZ3 TRP 584 HZ3 TRP 584 32.662 -12.171 13.908 381 HH2 TRP 584 HH2 TRP 584 34.117 -11.560 15.811 382 H LYS 585 H LYS 585 28.911 -4.049 11.922 383 HA LYS 585 HA LYS 585 27.520 -4.248 9.376 384 HB2 LYS 585 HB2 LYS 585 28.544 -1.811 10.891 385 HB3 LYS 585 HB3 LYS 585 27.346 -1.801 9.602 386 HG2 LYS 585 HG2 LYS 585 26.993 -3.174 12.321 387 HG3 LYS 585 HG3 LYS 585 26.427 -1.562 11.951 388 HD2 LYS 585 HD2 LYS 585 25.474 -4.035 10.437 389 HD3 LYS 585 HD3 LYS 585 24.679 -3.357 11.865 390 HE2 LYS 585 HE2 LYS 585 24.423 -1.187 10.744 391 HE3 LYS 585 HE3 LYS 585 25.155 -1.833 9.274 392 HZ1 LYS 585 HZ1 LYS 585 22.617 -2.777 10.494 393 HZ2 LYS 585 HZ2 LYS 585 23.300 -3.432 9.156 394 HZ3 LYS 585 HZ3 LYS 585 22.747 -1.901 9.136 395 H ASN 586 H ASN 586 28.196 -3.665 7.322 396 HA ASN 586 HA ASN 586 29.585 -3.567 5.579 397 HB2 ASN 586 HB2 ASN 586 29.558 -1.193 6.312 398 HB3 ASN 586 HB3 ASN 586 31.049 -1.490 7.224 399 HD21 ASN 586 HD21 ASN 586 32.041 0.224 5.914 400 HD22 ASN 586 HD22 ASN 586 32.575 -0.184 4.286 401 H THR 587 H THR 587 30.187 -5.795 7.156 402 HA THR 587 HA THR 587 33.189 -5.990 7.063 403 HB THR 587 HB THR 587 31.318 -7.214 9.095 404 HG1 THR 587 HG1 THR 587 31.756 -4.939 9.298 405 HG21 THR 587 HG21 THR 587 33.425 -7.747 10.341 406 HG22 THR 587 HG22 THR 587 34.356 -7.287 8.906 407 HG23 THR 587 HG23 THR 587 33.246 -8.690 8.862 408 H ILE 588 H ILE 588 34.158 -7.864 6.534 409 HA ILE 588 HA ILE 588 32.631 -10.183 5.554 410 HB ILE 588 HB ILE 588 32.831 -8.891 3.588 411 HG12 ILE 588 HG12 ILE 588 35.153 -10.854 3.467 412 HG13 ILE 588 HG13 ILE 588 33.454 -11.358 3.504 413 HG21 ILE 588 HG21 ILE 588 34.910 -7.968 2.676 414 HG22 ILE 588 HG22 ILE 588 34.675 -7.328 4.303 415 HG23 ILE 588 HG23 ILE 588 35.824 -8.660 4.029 416 HD11 ILE 588 HD11 ILE 588 33.064 -10.056 1.388 417 HD12 ILE 588 HD12 ILE 588 34.809 -9.721 1.322 418 HD13 ILE 588 HD13 ILE 588 34.230 -11.388 1.213 419 H GLU 589 H GLU 589 33.592 -12.088 5.925 420 HA GLU 589 HA GLU 589 36.381 -12.187 7.002 421 HB2 GLU 589 HB2 GLU 589 34.609 -12.953 8.573 422 HB3 GLU 589 HB3 GLU 589 34.102 -14.152 7.365 423 HG2 GLU 589 HG2 GLU 589 36.452 -15.111 7.456 424 HG3 GLU 589 HG3 GLU 589 36.803 -13.981 8.757 425 H VAL 590 H VAL 590 37.851 -13.377 5.866 426 HA VAL 590 HA VAL 590 37.078 -15.394 3.864 427 HB VAL 590 HB VAL 590 36.851 -13.403 2.551 428 HG11 VAL 590 HG11 VAL 590 38.275 -11.825 3.773 429 HG12 VAL 590 HG12 VAL 590 39.733 -12.697 3.221 430 HG13 VAL 590 HG13 VAL 590 38.679 -11.872 2.058 431 HG21 VAL 590 HG21 VAL 590 39.452 -14.783 1.817 432 HG22 VAL 590 HG22 VAL 590 37.820 -15.433 1.502 433 HG23 VAL 590 HG23 VAL 590 38.343 -13.929 0.730 434 H ASN 591 H ASN 591 38.251 -17.023 4.037 435 HA ASN 591 HA ASN 591 39.874 -18.454 4.701 436 HB2 ASN 591 HB2 ASN 591 41.448 -16.366 3.147 437 HB3 ASN 591 HB3 ASN 591 42.034 -17.984 3.537 438 HD21 ASN 591 HD21 ASN 591 40.429 -19.842 2.865 439 HD22 ASN 591 HD22 ASN 591 39.763 -19.630 1.249 440 H GLY 592 H GLY 592 39.238 -16.980 6.914 441 HA2 GLY 592 HA2 GLY 592 40.032 -17.021 9.101 442 HA3 GLY 592 HA3 GLY 592 41.677 -17.280 8.522 443 H LYS 593 H LYS 593 40.528 -14.595 6.870 444 HA LYS 593 HA LYS 593 41.576 -12.654 8.900 445 HB2 LYS 593 HB2 LYS 593 41.754 -12.649 5.875 446 HB3 LYS 593 HB3 LYS 593 42.180 -11.264 6.896 447 HG2 LYS 593 HG2 LYS 593 43.909 -12.633 8.035 448 HG3 LYS 593 HG3 LYS 593 43.522 -14.002 6.973 449 HD2 LYS 593 HD2 LYS 593 44.124 -12.616 4.993 450 HD3 LYS 593 HD3 LYS 593 44.551 -11.273 6.071 451 HE2 LYS 593 HE2 LYS 593 46.252 -12.702 7.176 452 HE3 LYS 593 HE3 LYS 593 45.835 -14.038 6.109 453 HZ1 LYS 593 HZ1 LYS 593 46.962 -11.437 5.210 454 HZ2 LYS 593 HZ2 LYS 593 46.569 -12.679 4.223 455 HZ3 LYS 593 HZ3 LYS 593 47.784 -12.843 5.291 456 H TYR 594 H TYR 594 40.672 -10.604 8.984 457 HA TYR 594 HA TYR 594 37.830 -10.385 8.065 458 HB2 TYR 594 HB2 TYR 594 39.187 -9.483 10.607 459 HB3 TYR 594 HB3 TYR 594 37.723 -8.714 10.032 460 HD1 TYR 594 HD1 TYR 594 39.080 -11.986 11.217 461 HD2 TYR 594 HD2 TYR 594 35.569 -9.706 10.148 462 HE1 TYR 594 HE1 TYR 594 37.624 -13.770 12.157 463 HE2 TYR 594 HE2 TYR 594 34.125 -11.469 11.116 464 HH TYR 594 HH TYR 594 34.064 -13.568 12.058 465 H PHE 595 H PHE 595 37.102 -8.557 7.195 466 HA PHE 595 HA PHE 595 38.832 -6.191 6.764 467 HB2 PHE 595 HB2 PHE 595 37.672 -7.961 4.577 468 HB3 PHE 595 HB3 PHE 595 38.364 -6.396 4.285 469 HD1 PHE 595 HD1 PHE 595 38.988 -9.939 4.833 470 HD2 PHE 595 HD2 PHE 595 40.840 -6.076 4.452 471 HE1 PHE 595 HE1 PHE 595 41.140 -11.035 4.256 472 HE2 PHE 595 HE2 PHE 595 42.991 -7.173 3.823 473 HZ PHE 595 HZ PHE 595 43.147 -9.644 3.755 474 H HIS 596 H HIS 596 37.653 -4.459 5.639 475 HA HIS 596 HA HIS 596 34.764 -4.303 6.277 476 HB2 HIS 596 HB2 HIS 596 36.788 -2.491 4.967 477 HB3 HIS 596 HB3 HIS 596 35.104 -2.103 4.827 478 HD2 HIS 596 HD2 HIS 596 34.043 -2.223 7.799 479 HE1 HIS 596 HE1 HIS 596 37.437 0.156 8.787 480 HE2 HIS 596 HE2 HIS 596 35.141 -0.622 9.561 481 H SER 597 H SER 597 33.127 -4.381 4.658 482 HA SER 597 HA SER 597 33.664 -5.999 2.344 483 HB2 SER 597 HB2 SER 597 31.476 -5.893 3.566 484 HB3 SER 597 HB3 SER 597 31.226 -4.274 2.886 485 HG SER 597 HG SER 597 30.240 -5.613 1.520 486 H THR 598 H THR 598 33.038 -2.456 2.674 487 HA THR 598 HA THR 598 33.406 -1.806 -0.083 488 HB THR 598 HB THR 598 33.904 0.516 0.820 489 HG1 THR 598 HG1 THR 598 34.715 0.154 2.805 490 HG21 THR 598 HG21 THR 598 31.654 0.918 1.690 491 HG22 THR 598 HG22 THR 598 31.392 -0.828 1.895 492 HG23 THR 598 HG23 THR 598 31.611 -0.140 0.270 493 H CYS 599 H CYS 599 35.843 -2.158 2.501 494 HA CYS 599 HA CYS 599 38.027 -1.104 0.915 495 HB2 CYS 599 HB2 CYS 599 37.971 -2.848 3.403 496 HB3 CYS 599 HB3 CYS 599 39.413 -2.168 2.725 497 H TYR 600 H TYR 600 37.079 -4.469 1.819 498 HA TYR 600 HA TYR 600 39.070 -5.780 0.266 499 HB2 TYR 600 HB2 TYR 600 37.826 -6.784 2.136 500 HB3 TYR 600 HB3 TYR 600 36.361 -6.798 1.171 501 HD1 TYR 600 HD1 TYR 600 39.842 -8.142 1.451 502 HD2 TYR 600 HD2 TYR 600 36.008 -8.554 -0.479 503 HE1 TYR 600 HE1 TYR 600 40.575 -10.308 0.451 504 HE2 TYR 600 HE2 TYR 600 36.727 -10.724 -1.451 505 HH TYR 600 HH TYR 600 38.456 -12.224 -1.688 506 H HIS 601 H HIS 601 35.755 -4.736 -0.681 507 HA HIS 601 HA HIS 601 35.575 -5.994 -3.176 508 HB2 HIS 601 HB2 HIS 601 33.734 -4.807 -2.141 509 HB3 HIS 601 HB3 HIS 601 34.598 -3.276 -2.230 510 HD2 HIS 601 HD2 HIS 601 33.973 -1.782 -4.226 511 HE1 HIS 601 HE1 HIS 601 32.318 -4.692 -6.862 512 HE2 HIS 601 HE2 HIS 601 32.776 -2.214 -6.528 513 H GLU 602 H GLU 602 37.540 -3.133 -2.382 514 HA GLU 602 HA GLU 602 38.209 -2.505 -5.148 515 HB2 GLU 602 HB2 GLU 602 38.176 -0.856 -3.326 516 HB3 GLU 602 HB3 GLU 602 39.529 -1.677 -2.534 517 HG2 GLU 602 HG2 GLU 602 41.018 -1.166 -4.373 518 HG3 GLU 602 HG3 GLU 602 39.690 -0.536 -5.343 519 H THR 603 H THR 603 39.453 -4.813 -2.812 520 HA THR 603 HA THR 603 41.950 -5.237 -4.393 521 HB THR 603 HB THR 603 42.914 -6.236 -2.441 522 HG1 THR 603 HG1 THR 603 41.843 -6.398 -0.555 523 HG21 THR 603 HG21 THR 603 42.993 -3.740 -2.645 524 HG22 THR 603 HG22 THR 603 43.070 -4.319 -0.973 525 HG23 THR 603 HG23 THR 603 41.557 -3.637 -1.599 526 H SER 604 H SER 604 38.933 -6.632 -4.194 527 HA SER 604 HA SER 604 39.430 -9.397 -4.118 528 HB2 SER 604 HB2 SER 604 37.273 -7.917 -5.668 529 HB3 SER 604 HB3 SER 604 37.256 -9.635 -5.250 530 HG SER 604 HG SER 604 37.234 -8.994 -3.045 531 H GLN 605 H GLN 605 41.351 -9.866 -5.374 532 HA GLN 605 HA GLN 605 41.439 -9.657 -8.245 533 HB2 GLN 605 HB2 GLN 605 42.800 -11.587 -6.326 534 HB3 GLN 605 HB3 GLN 605 43.122 -11.508 -8.061 535 HG2 GLN 605 HG2 GLN 605 43.790 -9.120 -7.829 536 HG3 GLN 605 HG3 GLN 605 43.578 -9.234 -6.080 537 HE21 GLN 605 HE21 GLN 605 46.026 -9.019 -8.153 538 HE22 GLN 605 HE22 GLN 605 47.160 -10.145 -7.415 539 H ASN 606 H ASN 606 40.144 -10.599 -9.687 540 HA ASN 606 HA ASN 606 39.266 -13.375 -9.413 541 HB2 ASN 606 HB2 ASN 606 36.927 -12.965 -9.402 542 HB3 ASN 606 HB3 ASN 606 37.586 -12.003 -8.089 543 HD21 ASN 606 HD21 ASN 606 37.827 -9.571 -8.534 544 HD22 ASN 606 HD22 ASN 606 36.702 -8.881 -9.691 545 H SER 607 H SER 607 38.538 -14.307 -11.322 546 HA SER 607 HA SER 607 37.953 -12.864 -13.742 547 HB2 SER 607 HB2 SER 607 39.822 -13.696 -15.126 548 HB3 SER 607 HB3 SER 607 40.367 -12.556 -13.895 549 HG SER 607 HG SER 607 41.727 -14.365 -13.986 550 H SER 608 H SER 608 39.124 -15.982 -12.432 551 HA SER 608 HA SER 608 37.645 -17.687 -14.225 552 HB2 SER 608 HB2 SER 608 38.306 -19.467 -12.615 553 HB3 SER 608 HB3 SER 608 39.647 -18.496 -13.220 554 HG SER 608 HG SER 608 38.363 -18.213 -10.694 Start of MODEL 2 1 H1 GLY 533 H1 GLY 533 14.735 0.356 -6.706 2 H2 GLY 533 H2 GLY 533 13.436 -0.425 -6.078 3 H3 GLY 533 H3 GLY 533 14.855 -0.397 -5.250 4 HA2 GLY 533 HA2 GLY 533 13.294 1.134 -4.250 5 HA3 GLY 533 HA3 GLY 533 14.701 1.978 -4.923 6 H GLY 534 H GLY 534 12.792 3.649 -4.610 7 HA2 GLY 534 HA2 GLY 534 10.730 3.799 -6.612 8 HA3 GLY 534 HA3 GLY 534 11.271 5.109 -5.572 9 H SER 535 H SER 535 10.522 5.158 -8.420 10 HA SER 535 HA SER 535 12.858 5.514 -10.073 11 HB2 SER 535 HB2 SER 535 11.251 6.469 -11.682 12 HB3 SER 535 HB3 SER 535 10.703 4.923 -11.017 13 HG SER 535 HG SER 535 9.042 6.508 -11.044 14 H GLU 536 H GLU 536 11.153 7.662 -7.902 15 HA GLU 536 HA GLU 536 13.236 9.734 -8.304 16 HB2 GLU 536 HB2 GLU 536 11.321 10.419 -9.687 17 HB3 GLU 536 HB3 GLU 536 10.251 10.331 -8.281 18 HG2 GLU 536 HG2 GLU 536 11.470 12.146 -7.187 19 HG3 GLU 536 HG3 GLU 536 12.730 12.093 -8.415 20 H PHE 537 H PHE 537 14.217 9.213 -6.436 21 HA PHE 537 HA PHE 537 12.907 9.645 -3.833 22 HB2 PHE 537 HB2 PHE 537 12.363 7.298 -4.590 23 HB3 PHE 537 HB3 PHE 537 14.080 6.959 -4.672 24 HD1 PHE 537 HD1 PHE 537 15.078 5.938 -2.778 25 HD2 PHE 537 HD2 PHE 537 11.475 8.248 -2.273 26 HE1 PHE 537 HE1 PHE 537 15.002 5.305 -0.378 27 HE2 PHE 537 HE2 PHE 537 11.410 7.620 0.126 28 HZ PHE 537 HZ PHE 537 13.173 6.149 1.078 29 H SER 538 H SER 538 14.678 8.860 -2.079 30 HA SER 538 HA SER 538 16.948 10.536 -2.178 31 HB2 SER 538 HB2 SER 538 16.491 8.020 -0.534 32 HB3 SER 538 HB3 SER 538 17.669 9.293 -0.184 33 HG SER 538 HG SER 538 15.726 9.549 1.005 34 H ASP 539 H ASP 539 19.206 9.924 -2.030 35 HA ASP 539 HA ASP 539 20.054 8.494 -4.369 36 HB2 ASP 539 HB2 ASP 539 21.670 9.771 -2.145 37 HB3 ASP 539 HB3 ASP 539 22.303 9.251 -3.704 38 H ARG 540 H ARG 540 19.081 6.400 -3.603 39 HA ARG 540 HA ARG 540 20.612 4.661 -1.837 40 HB2 ARG 540 HB2 ARG 540 18.427 4.098 -3.887 41 HB3 ARG 540 HB3 ARG 540 19.118 2.884 -2.824 42 HG2 ARG 540 HG2 ARG 540 17.533 5.339 -1.977 43 HG3 ARG 540 HG3 ARG 540 17.001 3.663 -1.935 44 HD2 ARG 540 HD2 ARG 540 19.144 4.948 -0.204 45 HD3 ARG 540 HD3 ARG 540 17.551 4.386 0.301 46 HE ARG 540 HE ARG 540 18.807 2.138 -0.803 47 HH11 ARG 540 HH11 ARG 540 19.367 4.200 1.970 48 HH12 ARG 540 HH12 ARG 540 20.218 2.949 2.847 49 HH21 ARG 540 HH21 ARG 540 19.919 0.597 0.334 50 HH22 ARG 540 HH22 ARG 540 20.509 0.952 1.937 51 H SER 541 H SER 541 22.598 5.472 -2.965 52 HA SER 541 HA SER 541 23.517 4.324 -5.425 53 HB2 SER 541 HB2 SER 541 24.563 6.279 -4.426 54 HB3 SER 541 HB3 SER 541 25.035 5.348 -2.996 55 HG SER 541 HG SER 541 26.666 5.648 -4.709 56 H ASN 542 H ASN 542 25.007 2.661 -5.816 57 HA ASN 542 HA ASN 542 24.757 0.171 -4.407 58 HB2 ASN 542 HB2 ASN 542 26.957 1.128 -6.290 59 HB3 ASN 542 HB3 ASN 542 26.640 -0.541 -5.839 60 HD21 ASN 542 HD21 ASN 542 26.286 1.452 -8.388 61 HD22 ASN 542 HD22 ASN 542 24.808 0.780 -9.063 62 H GLU 543 H GLU 543 26.881 2.939 -3.914 63 HA GLU 543 HA GLU 543 28.940 1.841 -2.306 64 HB2 GLU 543 HB2 GLU 543 28.920 4.147 -3.176 65 HB3 GLU 543 HB3 GLU 543 27.484 4.509 -2.239 66 HG2 GLU 543 HG2 GLU 543 29.312 5.559 -1.178 67 HG3 GLU 543 HG3 GLU 543 28.735 4.287 -0.129 68 H LEU 544 H LEU 544 25.573 2.697 -1.455 69 HA LEU 544 HA LEU 544 25.955 2.310 1.411 70 HB2 LEU 544 HB2 LEU 544 23.353 2.347 -0.155 71 HB3 LEU 544 HB3 LEU 544 23.571 2.602 1.575 72 HG LEU 544 HG LEU 544 24.437 4.473 -0.671 73 HD11 LEU 544 HD11 LEU 544 22.020 4.426 -0.118 74 HD12 LEU 544 HD12 LEU 544 22.778 5.982 0.280 75 HD13 LEU 544 HD13 LEU 544 22.409 4.817 1.573 76 HD21 LEU 544 HD21 LEU 544 24.803 4.795 2.343 77 HD22 LEU 544 HD22 LEU 544 25.068 6.066 1.132 78 HD23 LEU 544 HD23 LEU 544 26.099 4.632 1.135 79 H GLU 545 H GLU 545 24.828 0.297 -1.278 80 HA GLU 545 HA GLU 545 23.850 -1.863 0.378 81 HB2 GLU 545 HB2 GLU 545 24.659 -1.852 -2.562 82 HB3 GLU 545 HB3 GLU 545 23.755 -3.126 -1.718 83 HG2 GLU 545 HG2 GLU 545 22.058 -1.261 -1.126 84 HG3 GLU 545 HG3 GLU 545 22.855 -0.302 -2.374 85 H ILE 546 H ILE 546 27.024 -1.241 -1.108 86 HA ILE 546 HA ILE 546 28.195 -3.763 -0.304 87 HB ILE 546 HB ILE 546 29.482 -1.061 -0.812 88 HG12 ILE 546 HG12 ILE 546 28.249 -2.088 -2.803 89 HG13 ILE 546 HG13 ILE 546 29.935 -1.676 -3.021 90 HG21 ILE 546 HG21 ILE 546 30.755 -3.825 -0.545 91 HG22 ILE 546 HG22 ILE 546 31.580 -2.395 -1.202 92 HG23 ILE 546 HG23 ILE 546 31.029 -2.423 0.485 93 HD11 ILE 546 HD11 ILE 546 30.605 -4.002 -2.868 94 HD12 ILE 546 HD12 ILE 546 28.948 -4.508 -2.443 95 HD13 ILE 546 HD13 ILE 546 29.304 -3.847 -4.055 96 H ARG 547 H ARG 547 27.730 -0.650 1.361 97 HA ARG 547 HA ARG 547 29.271 -1.437 3.734 98 HB2 ARG 547 HB2 ARG 547 27.403 0.920 3.182 99 HB3 ARG 547 HB3 ARG 547 28.293 0.671 4.692 100 HG2 ARG 547 HG2 ARG 547 30.430 0.636 3.435 101 HG3 ARG 547 HG3 ARG 547 29.561 0.955 1.938 102 HD2 ARG 547 HD2 ARG 547 28.706 3.085 2.886 103 HD3 ARG 547 HD3 ARG 547 29.598 2.787 4.385 104 HE ARG 547 HE ARG 547 30.682 3.653 1.793 105 HH11 ARG 547 HH11 ARG 547 31.732 2.032 4.745 106 HH12 ARG 547 HH12 ARG 547 33.347 2.658 4.561 107 HH21 ARG 547 HH21 ARG 547 32.654 4.226 1.574 108 HH22 ARG 547 HH22 ARG 547 33.893 3.903 2.778 109 H GLY 548 H GLY 548 25.914 -1.650 2.794 110 HA2 GLY 548 HA2 GLY 548 24.755 -2.243 5.317 111 HA3 GLY 548 HA3 GLY 548 24.111 -2.676 3.735 112 H LYS 549 H LYS 549 26.944 -4.208 3.541 113 HA LYS 549 HA LYS 549 26.050 -6.853 4.282 114 HB2 LYS 549 HB2 LYS 549 28.848 -5.770 3.774 115 HB3 LYS 549 HB3 LYS 549 28.424 -7.475 3.845 116 HG2 LYS 549 HG2 LYS 549 27.416 -5.491 1.756 117 HG3 LYS 549 HG3 LYS 549 28.701 -6.673 1.530 118 HD2 LYS 549 HD2 LYS 549 27.072 -8.512 1.930 119 HD3 LYS 549 HD3 LYS 549 25.771 -7.317 2.103 120 HE2 LYS 549 HE2 LYS 549 26.218 -6.476 -0.179 121 HE3 LYS 549 HE3 LYS 549 27.540 -7.630 -0.352 122 HZ1 LYS 549 HZ1 LYS 549 24.698 -8.378 0.031 123 HZ2 LYS 549 HZ2 LYS 549 25.933 -9.433 -0.142 124 HZ3 LYS 549 HZ3 LYS 549 25.507 -8.468 -1.379 125 H TYR 550 H TYR 550 26.739 -8.197 5.962 126 HA TYR 550 HA TYR 550 28.446 -7.215 8.093 127 HB2 TYR 550 HB2 TYR 550 26.816 -7.416 9.908 128 HB3 TYR 550 HB3 TYR 550 26.349 -6.159 8.810 129 HD1 TYR 550 HD1 TYR 550 24.305 -6.273 7.533 130 HD2 TYR 550 HD2 TYR 550 25.551 -9.589 9.989 131 HE1 TYR 550 HE1 TYR 550 22.031 -7.292 7.323 132 HE2 TYR 550 HE2 TYR 550 23.298 -10.607 9.785 133 HH TYR 550 HH TYR 550 21.211 -10.433 8.842 134 H VAL 551 H VAL 551 28.734 -8.771 9.807 135 HA VAL 551 HA VAL 551 27.948 -11.586 9.268 136 HB VAL 551 HB VAL 551 30.173 -12.301 10.208 137 HG11 VAL 551 HG11 VAL 551 30.305 -10.837 7.531 138 HG12 VAL 551 HG12 VAL 551 31.324 -12.191 8.054 139 HG13 VAL 551 HG13 VAL 551 29.582 -12.439 7.784 140 HG21 VAL 551 HG21 VAL 551 32.111 -10.844 9.917 141 HG22 VAL 551 HG22 VAL 551 31.037 -9.471 9.587 142 HG23 VAL 551 HG23 VAL 551 31.022 -10.289 11.182 143 H VAL 552 H VAL 552 27.370 -12.752 11.130 144 HA VAL 552 HA VAL 552 26.499 -11.086 13.352 145 HB VAL 552 HB VAL 552 26.301 -14.047 12.829 146 HG11 VAL 552 HG11 VAL 552 25.133 -12.589 15.232 147 HG12 VAL 552 HG12 VAL 552 24.780 -14.255 14.735 148 HG13 VAL 552 HG13 VAL 552 26.407 -13.832 15.260 149 HG21 VAL 552 HG21 VAL 552 24.159 -11.886 12.994 150 HG22 VAL 552 HG22 VAL 552 24.852 -12.529 11.490 151 HG23 VAL 552 HG23 VAL 552 23.915 -13.587 12.552 152 H VAL 553 H VAL 553 27.458 -10.701 15.251 153 HA VAL 553 HA VAL 553 30.095 -11.849 15.841 154 HB VAL 553 HB VAL 553 28.569 -9.973 17.677 155 HG11 VAL 553 HG11 VAL 553 30.874 -9.390 18.375 156 HG12 VAL 553 HG12 VAL 553 30.499 -11.095 18.646 157 HG13 VAL 553 HG13 VAL 553 31.510 -10.599 17.250 158 HG21 VAL 553 HG21 VAL 553 28.624 -8.597 15.783 159 HG22 VAL 553 HG22 VAL 553 30.134 -8.192 16.631 160 HG23 VAL 553 HG23 VAL 553 30.167 -9.275 15.219 161 HA PRO 554 HA PRO 554 27.963 -15.096 18.095 162 HB2 PRO 554 HB2 PRO 554 30.073 -16.268 19.423 163 HB3 PRO 554 HB3 PRO 554 29.811 -16.441 17.654 164 HG2 PRO 554 HG2 PRO 554 31.625 -14.478 19.075 165 HG3 PRO 554 HG3 PRO 554 32.026 -15.570 17.710 166 HD2 PRO 554 HD2 PRO 554 31.375 -12.985 17.292 167 HD3 PRO 554 HD3 PRO 554 30.765 -14.256 16.190 168 H GLU 555 H GLU 555 27.017 -15.372 20.099 169 HA GLU 555 HA GLU 555 27.172 -13.308 22.061 170 HB2 GLU 555 HB2 GLU 555 25.646 -14.627 23.343 171 HB3 GLU 555 HB3 GLU 555 25.196 -14.715 21.633 172 HG2 GLU 555 HG2 GLU 555 26.359 -16.960 21.510 173 HG3 GLU 555 HG3 GLU 555 26.641 -16.869 23.239 174 H THR 556 H THR 556 29.155 -16.103 21.662 175 HA THR 556 HA THR 556 30.280 -16.372 24.286 176 HB THR 556 HB THR 556 31.661 -16.809 21.654 177 HG1 THR 556 HG1 THR 556 30.001 -18.597 23.083 178 HG21 THR 556 HG21 THR 556 33.181 -17.130 23.518 179 HG22 THR 556 HG22 THR 556 32.760 -18.708 22.848 180 HG23 THR 556 HG23 THR 556 32.007 -18.165 24.364 181 H SER 557 H SER 557 30.866 -14.011 21.684 182 HA SER 557 HA SER 557 33.290 -12.921 22.976 183 HB2 SER 557 HB2 SER 557 33.087 -12.905 20.497 184 HB3 SER 557 HB3 SER 557 31.693 -11.826 20.648 185 HG SER 557 HG SER 557 34.389 -11.360 21.209 186 H GLN 558 H GLN 558 33.282 -11.363 24.467 187 HA GLN 558 HA GLN 558 30.886 -9.644 24.929 188 HB2 GLN 558 HB2 GLN 558 31.487 -9.370 27.073 189 HB3 GLN 558 HB3 GLN 558 31.781 -11.080 26.802 190 HG2 GLN 558 HG2 GLN 558 33.920 -8.927 26.712 191 HG3 GLN 558 HG3 GLN 558 33.479 -9.810 28.169 192 HE21 GLN 558 HE21 GLN 558 34.791 -11.568 28.641 193 HE22 GLN 558 HE22 GLN 558 35.685 -12.479 27.430 194 H ASP 559 H ASP 559 34.228 -9.615 23.841 195 HA ASP 559 HA ASP 559 34.594 -6.738 24.023 196 HB2 ASP 559 HB2 ASP 559 36.110 -8.894 22.507 197 HB3 ASP 559 HB3 ASP 559 36.612 -7.218 22.645 198 H MET 560 H MET 560 33.579 -8.960 21.408 199 HA MET 560 HA MET 560 32.872 -8.644 19.318 200 HB2 MET 560 HB2 MET 560 31.418 -6.298 20.594 201 HB3 MET 560 HB3 MET 560 30.980 -7.144 19.103 202 HG2 MET 560 HG2 MET 560 31.028 -9.289 20.647 203 HG3 MET 560 HG3 MET 560 30.781 -8.111 21.936 204 HE1 MET 560 HE1 MET 560 29.078 -10.654 20.624 205 HE2 MET 560 HE2 MET 560 28.422 -9.916 22.123 206 HE3 MET 560 HE3 MET 560 27.384 -10.123 20.699 207 H ALA 561 H ALA 561 35.456 -7.558 19.478 208 HA ALA 561 HA ALA 561 35.298 -5.365 17.465 209 HB1 ALA 561 HB1 ALA 561 35.755 -4.420 19.685 210 HB2 ALA 561 HB2 ALA 561 37.170 -5.480 19.854 211 HB3 ALA 561 HB3 ALA 561 37.125 -4.226 18.582 212 H PHE 562 H PHE 562 36.858 -5.186 15.938 213 HA PHE 562 HA PHE 562 39.214 -6.862 15.852 214 HB2 PHE 562 HB2 PHE 562 37.090 -8.183 14.858 215 HB3 PHE 562 HB3 PHE 562 37.433 -7.216 13.438 216 HD1 PHE 562 HD1 PHE 562 39.454 -7.715 12.081 217 HD2 PHE 562 HD2 PHE 562 38.725 -9.762 15.803 218 HE1 PHE 562 HE1 PHE 562 41.301 -9.288 11.588 219 HE2 PHE 562 HE2 PHE 562 40.541 -11.369 15.279 220 HZ PHE 562 HZ PHE 562 41.834 -11.132 13.166 221 H LYS 563 H LYS 563 40.295 -6.393 13.461 222 HA LYS 563 HA LYS 563 39.803 -3.545 12.703 223 HB2 LYS 563 HB2 LYS 563 41.640 -3.811 14.440 224 HB3 LYS 563 HB3 LYS 563 42.563 -4.703 13.232 225 HG2 LYS 563 HG2 LYS 563 42.457 -2.684 11.729 226 HG3 LYS 563 HG3 LYS 563 41.623 -1.808 13.019 227 HD2 LYS 563 HD2 LYS 563 44.413 -3.020 13.195 228 HD3 LYS 563 HD3 LYS 563 44.076 -1.328 12.873 229 HE2 LYS 563 HE2 LYS 563 43.292 -2.779 15.442 230 HE3 LYS 563 HE3 LYS 563 44.746 -1.822 15.225 231 HZ1 LYS 563 HZ1 LYS 563 41.966 -0.785 15.113 232 HZ2 LYS 563 HZ2 LYS 563 43.281 0.104 14.709 233 HZ3 LYS 563 HZ3 LYS 563 43.077 -0.457 16.229 234 H CYS 564 H CYS 564 39.974 -3.033 10.639 235 HA CYS 564 HA CYS 564 40.300 -4.967 8.527 236 HB2 CYS 564 HB2 CYS 564 38.871 -2.805 8.555 237 HB3 CYS 564 HB3 CYS 564 40.357 -1.929 8.424 238 HA PRO 565 HA PRO 565 44.851 -4.200 8.607 239 HB2 PRO 565 HB2 PRO 565 45.646 -6.133 6.848 240 HB3 PRO 565 HB3 PRO 565 45.086 -6.518 8.499 241 HG2 PRO 565 HG2 PRO 565 43.442 -6.530 5.937 242 HG3 PRO 565 HG3 PRO 565 43.618 -7.860 7.135 243 HD2 PRO 565 HD2 PRO 565 41.519 -6.159 7.228 244 HD3 PRO 565 HD3 PRO 565 42.302 -6.701 8.732 245 H ILE 566 H ILE 566 42.643 -3.926 5.882 246 HA ILE 566 HA ILE 566 44.599 -3.034 3.918 247 HB ILE 566 HB ILE 566 41.589 -2.792 4.008 248 HG12 ILE 566 HG12 ILE 566 43.335 -4.636 2.300 249 HG13 ILE 566 HG13 ILE 566 42.639 -5.130 3.835 250 HG21 ILE 566 HG21 ILE 566 41.763 -2.263 1.534 251 HG22 ILE 566 HG22 ILE 566 42.456 -1.013 2.548 252 HG23 ILE 566 HG23 ILE 566 43.523 -2.162 1.723 253 HD11 ILE 566 HD11 ILE 566 40.352 -4.739 2.949 254 HD12 ILE 566 HD12 ILE 566 41.041 -4.341 1.360 255 HD13 ILE 566 HD13 ILE 566 41.252 -5.965 2.041 256 H CYS 567 H CYS 567 42.066 -1.271 5.765 257 HA CYS 567 HA CYS 567 43.519 1.268 5.267 258 HB2 CYS 567 HB2 CYS 567 41.478 2.377 5.589 259 HB3 CYS 567 HB3 CYS 567 41.162 1.042 4.476 260 H LYS 568 H LYS 568 43.512 -0.975 7.605 261 HA LYS 568 HA LYS 568 44.066 -1.144 9.790 262 HB2 LYS 568 HB2 LYS 568 45.699 0.271 10.779 263 HB3 LYS 568 HB3 LYS 568 46.130 -0.255 9.165 264 HG2 LYS 568 HG2 LYS 568 45.703 1.966 8.258 265 HG3 LYS 568 HG3 LYS 568 45.078 2.530 9.831 266 HD2 LYS 568 HD2 LYS 568 47.307 2.153 10.835 267 HD3 LYS 568 HD3 LYS 568 47.916 1.559 9.278 268 HE2 LYS 568 HE2 LYS 568 47.361 3.775 8.254 269 HE3 LYS 568 HE3 LYS 568 46.804 4.351 9.820 270 HZ1 LYS 568 HZ1 LYS 568 49.099 5.024 9.401 271 HZ2 LYS 568 HZ2 LYS 568 49.578 3.476 9.215 272 HZ3 LYS 568 HZ3 LYS 568 49.074 4.006 10.672 273 H GLU 569 H GLU 569 41.446 -0.606 9.533 274 HA GLU 569 HA GLU 569 40.919 1.349 11.751 275 HB2 GLU 569 HB2 GLU 569 39.325 0.841 9.236 276 HB3 GLU 569 HB3 GLU 569 38.628 1.613 10.644 277 HG2 GLU 569 HG2 GLU 569 40.956 2.637 9.006 278 HG3 GLU 569 HG3 GLU 569 39.311 3.255 8.979 279 H THR 570 H THR 570 39.635 0.892 13.379 280 HA THR 570 HA THR 570 39.044 -1.872 13.947 281 HB THR 570 HB THR 570 38.317 0.643 15.473 282 HG1 THR 570 HG1 THR 570 40.205 0.218 16.560 283 HG21 THR 570 HG21 THR 570 38.349 -0.828 17.473 284 HG22 THR 570 HG22 THR 570 38.560 -2.244 16.424 285 HG23 THR 570 HG23 THR 570 37.058 -1.288 16.357 286 H VAL 571 H VAL 571 37.153 -2.964 14.068 287 HA VAL 571 HA VAL 571 34.561 -1.630 13.448 288 HB VAL 571 HB VAL 571 33.812 -4.035 12.909 289 HG11 VAL 571 HG11 VAL 571 33.735 -2.213 11.337 290 HG12 VAL 571 HG12 VAL 571 35.465 -2.432 10.944 291 HG13 VAL 571 HG13 VAL 571 34.266 -3.701 10.550 292 HG21 VAL 571 HG21 VAL 571 36.725 -4.338 12.124 293 HG22 VAL 571 HG22 VAL 571 35.941 -5.166 13.496 294 HG23 VAL 571 HG23 VAL 571 35.402 -5.483 11.835 295 H THR 572 H THR 572 32.834 -2.097 14.728 296 HA THR 572 HA THR 572 33.242 -3.871 17.083 297 HB THR 572 HB THR 572 32.044 -2.244 18.489 298 HG1 THR 572 HG1 THR 572 31.131 -0.933 16.917 299 HG21 THR 572 HG21 THR 572 34.531 -2.431 18.538 300 HG22 THR 572 HG22 THR 572 33.946 -0.808 18.945 301 HG23 THR 572 HG23 THR 572 34.638 -1.127 17.340 302 H GLY 573 H GLY 573 31.502 -5.032 17.728 303 HA2 GLY 573 HA2 GLY 573 29.358 -5.512 15.906 304 HA3 GLY 573 HA3 GLY 573 29.511 -6.194 17.519 305 H VAL 574 H VAL 574 27.199 -5.098 15.996 306 HA VAL 574 HA VAL 574 26.108 -3.299 18.118 307 HB VAL 574 HB VAL 574 25.577 -3.178 15.112 308 HG11 VAL 574 HG11 VAL 574 23.525 -2.538 16.271 309 HG12 VAL 574 HG12 VAL 574 24.446 -1.454 17.357 310 HG13 VAL 574 HG13 VAL 574 24.301 -1.098 15.636 311 HG21 VAL 574 HG21 VAL 574 27.754 -2.170 15.660 312 HG22 VAL 574 HG22 VAL 574 26.591 -0.913 15.252 313 HG23 VAL 574 HG23 VAL 574 27.021 -1.218 16.956 314 H TYR 575 H TYR 575 23.983 -3.661 18.831 315 HA TYR 575 HA TYR 575 23.126 -6.360 18.729 316 HB2 TYR 575 HB2 TYR 575 22.793 -4.883 20.640 317 HB3 TYR 575 HB3 TYR 575 21.697 -3.875 19.704 318 HD1 TYR 575 HD1 TYR 575 19.391 -4.243 20.024 319 HD2 TYR 575 HD2 TYR 575 22.138 -7.501 20.693 320 HE1 TYR 575 HE1 TYR 575 17.516 -5.683 20.821 321 HE2 TYR 575 HE2 TYR 575 20.269 -8.933 21.464 322 HH TYR 575 HH TYR 575 16.913 -7.721 21.674 323 H ASP 576 H ASP 576 21.749 -7.448 17.552 324 HA ASP 576 HA ASP 576 20.225 -6.219 15.334 325 HB2 ASP 576 HB2 ASP 576 21.803 -8.066 14.817 326 HB3 ASP 576 HB3 ASP 576 20.949 -9.115 15.932 327 H GLU 577 H GLU 577 18.374 -5.465 16.263 328 HA GLU 577 HA GLU 577 16.833 -6.730 18.309 329 HB2 GLU 577 HB2 GLU 577 16.003 -4.715 16.186 330 HB3 GLU 577 HB3 GLU 577 15.079 -5.123 17.638 331 HG2 GLU 577 HG2 GLU 577 16.962 -4.325 19.049 332 HG3 GLU 577 HG3 GLU 577 17.800 -3.770 17.590 333 H GLU 578 H GLU 578 16.896 -7.422 14.850 334 HA GLU 578 HA GLU 578 14.187 -8.373 14.628 335 HB2 GLU 578 HB2 GLU 578 15.621 -7.513 12.756 336 HB3 GLU 578 HB3 GLU 578 16.580 -8.985 12.855 337 HG2 GLU 578 HG2 GLU 578 15.000 -9.124 11.039 338 HG3 GLU 578 HG3 GLU 578 14.644 -10.342 12.236 339 H SER 579 H SER 579 17.252 -9.950 15.361 340 HA SER 579 HA SER 579 15.841 -12.552 15.880 341 HB2 SER 579 HB2 SER 579 18.635 -12.114 14.808 342 HB3 SER 579 HB3 SER 579 17.941 -13.679 15.249 343 HG SER 579 HG SER 579 16.413 -13.430 13.631 344 H GLY 580 H GLY 580 17.848 -10.110 17.342 345 HA2 GLY 580 HA2 GLY 580 18.183 -9.865 19.604 346 HA3 GLY 580 HA3 GLY 580 17.682 -11.536 19.914 347 H GLU 581 H GLU 581 20.178 -10.388 17.637 348 HA GLU 581 HA GLU 581 22.321 -11.748 19.222 349 HB2 GLU 581 HB2 GLU 581 21.966 -11.864 16.204 350 HB3 GLU 581 HB3 GLU 581 23.288 -12.581 17.151 351 HG2 GLU 581 HG2 GLU 581 21.488 -13.903 18.411 352 HG3 GLU 581 HG3 GLU 581 20.376 -13.409 17.135 353 H TRP 582 H TRP 582 24.475 -10.989 17.545 354 HA TRP 582 HA TRP 582 24.291 -8.012 17.373 355 HB2 TRP 582 HB2 TRP 582 26.501 -9.714 18.533 356 HB3 TRP 582 HB3 TRP 582 26.653 -7.996 18.167 357 HD1 TRP 582 HD1 TRP 582 24.623 -10.350 20.453 358 HE1 TRP 582 HE1 TRP 582 23.881 -9.112 22.538 359 HE3 TRP 582 HE3 TRP 582 26.563 -5.747 19.367 360 HZ2 TRP 582 HZ2 TRP 582 24.066 -6.421 23.618 361 HZ3 TRP 582 HZ3 TRP 582 26.288 -3.857 20.971 362 HH2 TRP 582 HH2 TRP 582 25.038 -4.188 23.087 363 H VAL 583 H VAL 583 25.675 -7.034 15.788 364 HA VAL 583 HA VAL 583 26.791 -8.841 13.701 365 HB VAL 583 HB VAL 583 25.734 -7.423 11.958 366 HG11 VAL 583 HG11 VAL 583 23.553 -8.531 12.044 367 HG12 VAL 583 HG12 VAL 583 24.859 -9.642 12.502 368 HG13 VAL 583 HG13 VAL 583 23.796 -8.943 13.746 369 HG21 VAL 583 HG21 VAL 583 23.878 -6.450 14.164 370 HG22 VAL 583 HG22 VAL 583 25.101 -5.444 13.338 371 HG23 VAL 583 HG23 VAL 583 23.739 -6.130 12.432 372 H TRP 584 H TRP 584 28.523 -8.272 12.717 373 HA TRP 584 HA TRP 584 29.939 -5.729 13.272 374 HB2 TRP 584 HB2 TRP 584 30.647 -8.480 12.269 375 HB3 TRP 584 HB3 TRP 584 31.567 -7.150 11.628 376 HD1 TRP 584 HD1 TRP 584 32.111 -5.389 14.078 377 HE1 TRP 584 HE1 TRP 584 33.576 -6.195 16.033 378 HE3 TRP 584 HE3 TRP 584 31.890 -10.446 13.266 379 HZ2 TRP 584 HZ2 TRP 584 34.703 -8.687 16.975 380 HZ3 TRP 584 HZ3 TRP 584 33.186 -12.000 14.703 381 HH2 TRP 584 HH2 TRP 584 34.545 -11.143 16.581 382 H LYS 585 H LYS 585 28.852 -4.202 12.101 383 HA LYS 585 HA LYS 585 27.862 -4.596 9.380 384 HB2 LYS 585 HB2 LYS 585 28.128 -2.112 11.094 385 HB3 LYS 585 HB3 LYS 585 27.360 -2.167 9.504 386 HG2 LYS 585 HG2 LYS 585 25.751 -3.893 10.353 387 HG3 LYS 585 HG3 LYS 585 26.461 -3.730 11.965 388 HD2 LYS 585 HD2 LYS 585 25.914 -1.333 11.991 389 HD3 LYS 585 HD3 LYS 585 25.160 -1.461 10.401 390 HE2 LYS 585 HE2 LYS 585 24.256 -3.057 12.847 391 HE3 LYS 585 HE3 LYS 585 23.596 -1.483 12.419 392 HZ1 LYS 585 HZ1 LYS 585 22.860 -2.433 10.300 393 HZ2 LYS 585 HZ2 LYS 585 22.211 -3.250 11.555 394 HZ3 LYS 585 HZ3 LYS 585 23.451 -3.890 10.698 395 H ASN 586 H ASN 586 28.556 -3.634 7.494 396 HA ASN 586 HA ASN 586 29.974 -3.137 5.858 397 HB2 ASN 586 HB2 ASN 586 30.327 -1.103 7.490 398 HB3 ASN 586 HB3 ASN 586 31.912 -1.798 7.765 399 HD21 ASN 586 HD21 ASN 586 32.512 -2.569 5.021 400 HD22 ASN 586 HD22 ASN 586 32.734 -1.040 4.166 401 H THR 587 H THR 587 30.689 -5.443 8.096 402 HA THR 587 HA THR 587 33.458 -6.024 7.293 403 HB THR 587 HB THR 587 31.671 -7.404 9.311 404 HG1 THR 587 HG1 THR 587 33.755 -5.519 9.618 405 HG21 THR 587 HG21 THR 587 33.781 -8.160 10.364 406 HG22 THR 587 HG22 THR 587 34.693 -7.562 8.961 407 HG23 THR 587 HG23 THR 587 33.528 -8.897 8.778 408 H ILE 588 H ILE 588 34.214 -7.897 6.469 409 HA ILE 588 HA ILE 588 32.433 -10.063 5.551 410 HB ILE 588 HB ILE 588 32.668 -8.694 3.598 411 HG12 ILE 588 HG12 ILE 588 34.641 -10.988 3.271 412 HG13 ILE 588 HG13 ILE 588 32.881 -11.199 3.357 413 HG21 ILE 588 HG21 ILE 588 35.696 -8.908 3.845 414 HG22 ILE 588 HG22 ILE 588 34.782 -8.018 2.602 415 HG23 ILE 588 HG23 ILE 588 34.762 -7.452 4.263 416 HD11 ILE 588 HD11 ILE 588 33.538 -11.236 1.039 417 HD12 ILE 588 HD12 ILE 588 32.666 -9.714 1.332 418 HD13 ILE 588 HD13 ILE 588 34.448 -9.730 1.201 419 H GLU 589 H GLU 589 33.406 -12.101 5.541 420 HA GLU 589 HA GLU 589 36.168 -12.327 6.676 421 HB2 GLU 589 HB2 GLU 589 34.325 -13.227 8.100 422 HB3 GLU 589 HB3 GLU 589 33.916 -14.353 6.794 423 HG2 GLU 589 HG2 GLU 589 36.258 -15.263 6.925 424 HG3 GLU 589 HG3 GLU 589 36.579 -14.191 8.275 425 H VAL 590 H VAL 590 37.683 -13.125 5.351 426 HA VAL 590 HA VAL 590 37.143 -15.079 3.232 427 HB VAL 590 HB VAL 590 36.461 -13.088 2.069 428 HG11 VAL 590 HG11 VAL 590 39.189 -11.885 2.672 429 HG12 VAL 590 HG12 VAL 590 37.952 -11.219 1.584 430 HG13 VAL 590 HG13 VAL 590 37.616 -11.326 3.304 431 HG21 VAL 590 HG21 VAL 590 39.227 -13.860 1.086 432 HG22 VAL 590 HG22 VAL 590 37.751 -14.820 0.826 433 HG23 VAL 590 HG23 VAL 590 37.886 -13.196 0.143 434 H ASN 591 H ASN 591 38.705 -16.297 2.717 435 HA ASN 591 HA ASN 591 40.569 -17.508 3.104 436 HB2 ASN 591 HB2 ASN 591 41.824 -14.773 2.700 437 HB3 ASN 591 HB3 ASN 591 42.629 -16.334 2.526 438 HD21 ASN 591 HD21 ASN 591 42.374 -14.291 0.470 439 HD22 ASN 591 HD22 ASN 591 41.471 -15.057 -0.835 440 H GLY 592 H GLY 592 39.311 -16.935 5.498 441 HA2 GLY 592 HA2 GLY 592 39.657 -17.442 7.714 442 HA3 GLY 592 HA3 GLY 592 41.387 -17.607 7.402 443 H LYS 593 H LYS 593 40.177 -14.519 6.469 444 HA LYS 593 HA LYS 593 40.864 -13.239 9.080 445 HB2 LYS 593 HB2 LYS 593 41.925 -12.533 6.323 446 HB3 LYS 593 HB3 LYS 593 42.094 -11.490 7.734 447 HG2 LYS 593 HG2 LYS 593 43.379 -13.221 8.915 448 HG3 LYS 593 HG3 LYS 593 43.224 -14.325 7.545 449 HD2 LYS 593 HD2 LYS 593 44.621 -11.618 7.444 450 HD3 LYS 593 HD3 LYS 593 45.423 -13.181 7.650 451 HE2 LYS 593 HE2 LYS 593 44.470 -13.946 5.472 452 HE3 LYS 593 HE3 LYS 593 43.765 -12.348 5.232 453 HZ1 LYS 593 HZ1 LYS 593 45.893 -12.534 4.096 454 HZ2 LYS 593 HZ2 LYS 593 46.666 -12.917 5.477 455 HZ3 LYS 593 HZ3 LYS 593 46.031 -11.426 5.283 456 H TYR 594 H TYR 594 40.048 -11.150 9.408 457 HA TYR 594 HA TYR 594 37.487 -10.608 8.019 458 HB2 TYR 594 HB2 TYR 594 38.686 -9.523 10.568 459 HB3 TYR 594 HB3 TYR 594 37.180 -8.936 9.870 460 HD1 TYR 594 HD1 TYR 594 35.361 -10.679 9.299 461 HD2 TYR 594 HD2 TYR 594 38.551 -11.373 12.110 462 HE1 TYR 594 HE1 TYR 594 34.045 -12.508 10.316 463 HE2 TYR 594 HE2 TYR 594 37.239 -13.229 13.137 464 HH TYR 594 HH TYR 594 34.083 -14.267 11.847 465 H PHE 595 H PHE 595 36.951 -8.740 7.142 466 HA PHE 595 HA PHE 595 38.887 -6.568 6.572 467 HB2 PHE 595 HB2 PHE 595 37.650 -8.480 4.544 468 HB3 PHE 595 HB3 PHE 595 38.365 -6.953 4.083 469 HD1 PHE 595 HD1 PHE 595 38.963 -10.443 4.903 470 HD2 PHE 595 HD2 PHE 595 40.858 -6.608 4.418 471 HE1 PHE 595 HE1 PHE 595 41.109 -11.577 4.425 472 HE2 PHE 595 HE2 PHE 595 43.029 -7.749 3.958 473 HZ PHE 595 HZ PHE 595 43.154 -10.225 3.960 474 H HIS 596 H HIS 596 37.748 -4.879 5.150 475 HA HIS 596 HA HIS 596 34.858 -4.556 5.848 476 HB2 HIS 596 HB2 HIS 596 36.978 -2.804 4.623 477 HB3 HIS 596 HB3 HIS 596 35.308 -2.372 4.417 478 HD2 HIS 596 HD2 HIS 596 34.162 -2.541 7.407 479 HE1 HIS 596 HE1 HIS 596 37.536 -0.160 8.454 480 HE2 HIS 596 HE2 HIS 596 35.221 -0.932 9.179 481 H SER 597 H SER 597 33.267 -4.768 4.294 482 HA SER 597 HA SER 597 33.703 -6.197 1.874 483 HB2 SER 597 HB2 SER 597 31.384 -4.379 2.637 484 HB3 SER 597 HB3 SER 597 31.401 -5.540 1.293 485 HG SER 597 HG SER 597 31.481 -6.051 4.074 486 H THR 598 H THR 598 33.402 -2.668 2.408 487 HA THR 598 HA THR 598 33.572 -1.858 -0.345 488 HB THR 598 HB THR 598 34.377 0.338 0.801 489 HG1 THR 598 HG1 THR 598 35.049 -0.204 2.752 490 HG21 THR 598 HG21 THR 598 31.744 -0.793 1.819 491 HG22 THR 598 HG22 THR 598 31.992 -0.109 0.183 492 HG23 THR 598 HG23 THR 598 32.194 0.915 1.610 493 H CYS 599 H CYS 599 36.094 -2.262 2.180 494 HA CYS 599 HA CYS 599 38.283 -1.400 0.562 495 HB2 CYS 599 HB2 CYS 599 38.112 -3.209 3.003 496 HB3 CYS 599 HB3 CYS 599 39.599 -2.607 2.333 497 H TYR 600 H TYR 600 37.103 -4.702 1.340 498 HA TYR 600 HA TYR 600 38.921 -6.138 -0.249 499 HB2 TYR 600 HB2 TYR 600 37.577 -7.198 1.448 500 HB3 TYR 600 HB3 TYR 600 36.087 -6.775 0.612 501 HD1 TYR 600 HD1 TYR 600 39.285 -8.694 0.158 502 HD2 TYR 600 HD2 TYR 600 35.137 -8.301 -0.939 503 HE1 TYR 600 HE1 TYR 600 39.442 -10.794 -1.163 504 HE2 TYR 600 HE2 TYR 600 35.288 -10.404 -2.269 505 HH TYR 600 HH TYR 600 38.326 -12.276 -2.523 506 H HIS 601 H HIS 601 35.804 -4.630 -1.193 507 HA HIS 601 HA HIS 601 35.735 -5.627 -3.870 508 HB2 HIS 601 HB2 HIS 601 34.299 -3.596 -2.260 509 HB3 HIS 601 HB3 HIS 601 34.416 -3.163 -3.931 510 HD2 HIS 601 HD2 HIS 601 32.981 -5.980 -1.685 511 HE1 HIS 601 HE1 HIS 601 31.363 -6.569 -5.581 512 HE2 HIS 601 HE2 HIS 601 31.287 -7.345 -3.160 513 H GLU 602 H GLU 602 37.789 -3.109 -2.554 514 HA GLU 602 HA GLU 602 38.577 -2.204 -5.279 515 HB2 GLU 602 HB2 GLU 602 39.546 -1.347 -2.530 516 HB3 GLU 602 HB3 GLU 602 40.104 -0.705 -4.077 517 HG2 GLU 602 HG2 GLU 602 37.721 -0.052 -4.592 518 HG3 GLU 602 HG3 GLU 602 37.298 -0.473 -2.934 519 H THR 603 H THR 603 39.828 -4.221 -2.611 520 HA THR 603 HA THR 603 42.445 -4.524 -3.931 521 HB THR 603 HB THR 603 43.141 -5.681 -1.924 522 HG1 THR 603 HG1 THR 603 41.784 -6.048 -0.285 523 HG21 THR 603 HG21 THR 603 42.975 -3.875 -0.307 524 HG22 THR 603 HG22 THR 603 41.611 -3.150 -1.185 525 HG23 THR 603 HG23 THR 603 43.230 -3.199 -1.921 526 H SER 604 H SER 604 39.639 -6.058 -4.563 527 HA SER 604 HA SER 604 40.182 -8.820 -4.363 528 HB2 SER 604 HB2 SER 604 38.381 -9.085 -5.980 529 HB3 SER 604 HB3 SER 604 37.974 -7.822 -4.810 530 HG SER 604 HG SER 604 37.522 -6.896 -6.707 531 H GLN 605 H GLN 605 41.429 -6.541 -6.709 532 HA GLN 605 HA GLN 605 42.445 -8.705 -8.487 533 HB2 GLN 605 HB2 GLN 605 42.572 -5.708 -8.931 534 HB3 GLN 605 HB3 GLN 605 42.893 -6.988 -10.099 535 HG2 GLN 605 HG2 GLN 605 40.212 -6.198 -8.899 536 HG3 GLN 605 HG3 GLN 605 40.720 -6.052 -10.571 537 HE21 GLN 605 HE21 GLN 605 38.861 -7.937 -8.508 538 HE22 GLN 605 HE22 GLN 605 38.827 -9.400 -9.488 539 H ASN 606 H ASN 606 44.561 -9.244 -8.628 540 HA ASN 606 HA ASN 606 46.458 -8.167 -6.693 541 HB2 ASN 606 HB2 ASN 606 46.236 -10.605 -7.378 542 HB3 ASN 606 HB3 ASN 606 46.931 -10.169 -8.938 543 HD21 ASN 606 HD21 ASN 606 49.086 -10.779 -8.967 544 HD22 ASN 606 HD22 ASN 606 50.171 -10.607 -7.594 545 H SER 607 H SER 607 48.674 -7.465 -7.322 546 HA SER 607 HA SER 607 48.646 -5.285 -9.220 547 HB2 SER 607 HB2 SER 607 50.958 -4.961 -8.445 548 HB3 SER 607 HB3 SER 607 49.830 -5.156 -7.098 549 HG SER 607 HG SER 607 51.712 -6.416 -6.812 550 H SER 608 H SER 608 49.315 -8.618 -9.666 551 HA SER 608 HA SER 608 51.387 -8.532 -11.643 552 HB2 SER 608 HB2 SER 608 50.654 -10.861 -12.133 553 HB3 SER 608 HB3 SER 608 51.013 -10.545 -10.437 554 HG SER 608 HG SER 608 48.439 -10.668 -11.643 Start of MODEL 3 1 H1 GLY 533 H1 GLY 533 22.428 15.459 -18.369 2 H2 GLY 533 H2 GLY 533 22.279 17.095 -18.346 3 H3 GLY 533 H3 GLY 533 22.769 16.295 -16.998 4 HA2 GLY 533 HA2 GLY 533 24.277 16.487 -19.529 5 HA3 GLY 533 HA3 GLY 533 24.651 17.367 -18.038 6 H GLY 534 H GLY 534 26.524 16.510 -17.322 7 HA2 GLY 534 HA2 GLY 534 27.220 13.675 -17.459 8 HA3 GLY 534 HA3 GLY 534 28.133 14.971 -16.698 9 H SER 535 H SER 535 28.451 13.070 -15.183 10 HA SER 535 HA SER 535 26.405 12.189 -13.386 11 HB2 SER 535 HB2 SER 535 28.516 10.974 -13.664 12 HB3 SER 535 HB3 SER 535 29.416 12.357 -13.026 13 HG SER 535 HG SER 535 27.714 10.575 -11.680 14 H GLU 536 H GLU 536 25.690 12.893 -11.435 15 HA GLU 536 HA GLU 536 26.125 15.662 -10.661 16 HB2 GLU 536 HB2 GLU 536 24.482 15.258 -8.976 17 HB3 GLU 536 HB3 GLU 536 23.905 14.651 -10.512 18 HG2 GLU 536 HG2 GLU 536 25.219 12.698 -8.603 19 HG3 GLU 536 HG3 GLU 536 23.643 13.332 -8.199 20 H PHE 537 H PHE 537 27.752 12.722 -9.823 21 HA PHE 537 HA PHE 537 29.431 14.110 -7.890 22 HB2 PHE 537 HB2 PHE 537 27.595 13.574 -6.395 23 HB3 PHE 537 HB3 PHE 537 27.563 11.909 -6.952 24 HD1 PHE 537 HD1 PHE 537 28.451 10.354 -5.446 25 HD2 PHE 537 HD2 PHE 537 30.118 14.330 -5.556 26 HE1 PHE 537 HE1 PHE 537 30.053 9.736 -3.654 27 HE2 PHE 537 HE2 PHE 537 31.707 13.708 -3.756 28 HZ PHE 537 HZ PHE 537 31.682 11.411 -2.807 29 H SER 538 H SER 538 28.565 10.694 -8.706 30 HA SER 538 HA SER 538 31.162 10.215 -9.919 31 HB2 SER 538 HB2 SER 538 32.001 8.575 -8.406 32 HB3 SER 538 HB3 SER 538 31.661 10.015 -7.447 33 HG SER 538 HG SER 538 29.859 9.041 -6.635 34 H ASP 539 H ASP 539 31.415 7.799 -10.420 35 HA ASP 539 HA ASP 539 29.042 6.872 -11.832 36 HB2 ASP 539 HB2 ASP 539 30.530 5.221 -12.789 37 HB3 ASP 539 HB3 ASP 539 31.225 6.824 -12.893 38 H ARG 540 H ARG 540 29.758 6.497 -8.629 39 HA ARG 540 HA ARG 540 29.382 3.648 -8.234 40 HB2 ARG 540 HB2 ARG 540 29.336 6.081 -6.436 41 HB3 ARG 540 HB3 ARG 540 28.720 4.551 -5.843 42 HG2 ARG 540 HG2 ARG 540 31.046 4.896 -5.197 43 HG3 ARG 540 HG3 ARG 540 30.811 3.432 -6.149 44 HD2 ARG 540 HD2 ARG 540 31.739 4.521 -8.137 45 HD3 ARG 540 HD3 ARG 540 31.905 6.048 -7.242 46 HE ARG 540 HE ARG 540 33.264 4.014 -5.796 47 HH11 ARG 540 HH11 ARG 540 33.740 5.534 -8.936 48 HH12 ARG 540 HH12 ARG 540 35.476 5.452 -8.777 49 HH21 ARG 540 HH21 ARG 540 35.331 3.854 -5.718 50 HH22 ARG 540 HH22 ARG 540 36.394 4.457 -6.987 51 H SER 541 H SER 541 27.697 2.473 -7.711 52 HA SER 541 HA SER 541 25.018 3.606 -7.195 53 HB2 SER 541 HB2 SER 541 23.922 2.214 -8.891 54 HB3 SER 541 HB3 SER 541 25.064 3.334 -9.631 55 HG SER 541 HG SER 541 25.299 0.546 -9.272 56 H ASN 542 H ASN 542 27.316 1.825 -6.051 57 HA ASN 542 HA ASN 542 25.835 -0.607 -5.183 58 HB2 ASN 542 HB2 ASN 542 28.111 -1.583 -5.049 59 HB3 ASN 542 HB3 ASN 542 27.770 -0.983 -6.664 60 HD21 ASN 542 HD21 ASN 542 30.217 -1.058 -4.375 61 HD22 ASN 542 HD22 ASN 542 31.037 0.419 -4.851 62 H GLU 543 H GLU 543 26.949 2.372 -3.950 63 HA GLU 543 HA GLU 543 28.296 1.611 -1.571 64 HB2 GLU 543 HB2 GLU 543 28.252 3.822 -0.954 65 HB3 GLU 543 HB3 GLU 543 28.423 3.805 -2.698 66 HG2 GLU 543 HG2 GLU 543 25.895 4.324 -1.116 67 HG3 GLU 543 HG3 GLU 543 26.901 5.567 -1.861 68 H LEU 544 H LEU 544 24.800 1.914 -2.126 69 HA LEU 544 HA LEU 544 24.048 1.737 0.660 70 HB2 LEU 544 HB2 LEU 544 22.580 2.637 -1.112 71 HB3 LEU 544 HB3 LEU 544 22.572 1.076 -1.921 72 HG LEU 544 HG LEU 544 21.380 0.065 0.024 73 HD11 LEU 544 HD11 LEU 544 21.276 2.938 1.046 74 HD12 LEU 544 HD12 LEU 544 22.087 1.567 1.842 75 HD13 LEU 544 HD13 LEU 544 20.329 1.579 1.692 76 HD21 LEU 544 HD21 LEU 544 20.046 2.542 -1.147 77 HD22 LEU 544 HD22 LEU 544 19.218 1.146 -0.419 78 HD23 LEU 544 HD23 LEU 544 20.137 0.944 -1.917 79 H GLU 545 H GLU 545 24.671 -0.678 -1.877 80 HA GLU 545 HA GLU 545 23.572 -2.870 -0.284 81 HB2 GLU 545 HB2 GLU 545 25.028 -2.891 -2.966 82 HB3 GLU 545 HB3 GLU 545 24.174 -4.256 -2.231 83 HG2 GLU 545 HG2 GLU 545 22.077 -2.824 -2.229 84 HG3 GLU 545 HG3 GLU 545 22.942 -1.655 -3.215 85 H ILE 546 H ILE 546 26.862 -1.863 -1.250 86 HA ILE 546 HA ILE 546 28.204 -4.104 -0.035 87 HB ILE 546 HB ILE 546 29.158 -1.286 -0.641 88 HG12 ILE 546 HG12 ILE 546 28.449 -2.574 -2.666 89 HG13 ILE 546 HG13 ILE 546 30.145 -2.133 -2.649 90 HG21 ILE 546 HG21 ILE 546 30.768 -3.761 0.113 91 HG22 ILE 546 HG22 ILE 546 31.447 -2.260 -0.557 92 HG23 ILE 546 HG23 ILE 546 30.653 -2.243 1.024 93 HD11 ILE 546 HD11 ILE 546 29.749 -4.410 -3.522 94 HD12 ILE 546 HD12 ILE 546 30.796 -4.419 -2.098 95 HD13 ILE 546 HD13 ILE 546 29.083 -4.909 -1.957 96 H ARG 547 H ARG 547 27.026 -1.022 1.261 97 HA ARG 547 HA ARG 547 28.234 -1.382 3.912 98 HB2 ARG 547 HB2 ARG 547 26.162 0.554 2.803 99 HB3 ARG 547 HB3 ARG 547 26.664 0.548 4.495 100 HG2 ARG 547 HG2 ARG 547 28.989 0.976 3.899 101 HG3 ARG 547 HG3 ARG 547 28.596 0.898 2.168 102 HD2 ARG 547 HD2 ARG 547 27.074 2.856 2.484 103 HD3 ARG 547 HD3 ARG 547 27.557 2.931 4.188 104 HE ARG 547 HE ARG 547 29.908 2.952 2.575 105 HH11 ARG 547 HH11 ARG 547 27.275 5.133 3.381 106 HH12 ARG 547 HH12 ARG 547 28.236 6.555 3.037 107 HH21 ARG 547 HH21 ARG 547 31.044 4.787 2.093 108 HH22 ARG 547 HH22 ARG 547 30.302 6.351 2.308 109 H GLY 548 H GLY 548 25.297 -2.463 2.397 110 HA2 GLY 548 HA2 GLY 548 23.808 -3.087 4.793 111 HA3 GLY 548 HA3 GLY 548 23.529 -3.711 3.165 112 H LYS 549 H LYS 549 26.564 -4.639 3.394 113 HA LYS 549 HA LYS 549 25.999 -7.369 4.193 114 HB2 LYS 549 HB2 LYS 549 28.689 -6.013 3.716 115 HB3 LYS 549 HB3 LYS 549 28.411 -7.751 3.790 116 HG2 LYS 549 HG2 LYS 549 27.366 -5.840 1.658 117 HG3 LYS 549 HG3 LYS 549 28.681 -6.989 1.484 118 HD2 LYS 549 HD2 LYS 549 27.079 -8.872 1.835 119 HD3 LYS 549 HD3 LYS 549 25.749 -7.692 1.957 120 HE2 LYS 549 HE2 LYS 549 26.255 -6.854 -0.309 121 HE3 LYS 549 HE3 LYS 549 27.612 -7.977 -0.431 122 HZ1 LYS 549 HZ1 LYS 549 24.763 -8.764 -0.163 123 HZ2 LYS 549 HZ2 LYS 549 26.012 -9.810 -0.301 124 HZ3 LYS 549 HZ3 LYS 549 25.627 -8.836 -1.542 125 H TYR 550 H TYR 550 26.606 -8.533 5.968 126 HA TYR 550 HA TYR 550 28.251 -7.370 8.051 127 HB2 TYR 550 HB2 TYR 550 26.665 -7.671 9.892 128 HB3 TYR 550 HB3 TYR 550 26.101 -6.453 8.796 129 HD1 TYR 550 HD1 TYR 550 25.534 -9.855 10.128 130 HD2 TYR 550 HD2 TYR 550 24.086 -6.816 7.440 131 HE1 TYR 550 HE1 TYR 550 23.365 -11.074 9.921 132 HE2 TYR 550 HE2 TYR 550 21.910 -8.029 7.238 133 HH TYR 550 HH TYR 550 20.711 -9.875 7.848 134 H VAL 551 H VAL 551 28.723 -8.846 9.793 135 HA VAL 551 HA VAL 551 28.118 -11.728 9.382 136 HB VAL 551 HB VAL 551 30.423 -12.238 10.256 137 HG11 VAL 551 HG11 VAL 551 29.755 -12.538 7.863 138 HG12 VAL 551 HG12 VAL 551 30.324 -10.891 7.515 139 HG13 VAL 551 HG13 VAL 551 31.468 -12.140 8.050 140 HG21 VAL 551 HG21 VAL 551 31.053 -9.380 9.458 141 HG22 VAL 551 HG22 VAL 551 31.179 -10.124 11.084 142 HG23 VAL 551 HG23 VAL 551 32.242 -10.651 9.783 143 H VAL 552 H VAL 552 27.646 -12.832 11.307 144 HA VAL 552 HA VAL 552 26.800 -11.105 13.470 145 HB VAL 552 HB VAL 552 25.534 -13.092 12.706 146 HG11 VAL 552 HG11 VAL 552 27.522 -14.752 14.313 147 HG12 VAL 552 HG12 VAL 552 26.050 -15.320 13.503 148 HG13 VAL 552 HG13 VAL 552 27.407 -14.734 12.542 149 HG21 VAL 552 HG21 VAL 552 24.984 -12.048 14.819 150 HG22 VAL 552 HG22 VAL 552 24.764 -13.803 14.938 151 HG23 VAL 552 HG23 VAL 552 26.180 -13.053 15.678 152 H VAL 553 H VAL 553 27.589 -10.764 15.480 153 HA VAL 553 HA VAL 553 30.355 -11.600 16.084 154 HB VAL 553 HB VAL 553 28.552 -9.898 17.852 155 HG11 VAL 553 HG11 VAL 553 30.778 -9.178 18.709 156 HG12 VAL 553 HG12 VAL 553 30.498 -10.909 18.957 157 HG13 VAL 553 HG13 VAL 553 31.561 -10.361 17.632 158 HG21 VAL 553 HG21 VAL 553 30.433 -8.990 15.660 159 HG22 VAL 553 HG22 VAL 553 28.719 -8.558 15.886 160 HG23 VAL 553 HG23 VAL 553 29.934 -7.965 17.028 161 HA PRO 554 HA PRO 554 28.360 -14.952 18.444 162 HB2 PRO 554 HB2 PRO 554 30.544 -16.354 19.212 163 HB3 PRO 554 HB3 PRO 554 30.021 -16.304 17.498 164 HG2 PRO 554 HG2 PRO 554 32.148 -14.609 18.822 165 HG3 PRO 554 HG3 PRO 554 32.284 -15.564 17.313 166 HD2 PRO 554 HD2 PRO 554 31.707 -12.889 17.298 167 HD3 PRO 554 HD3 PRO 554 30.983 -13.998 16.102 168 H GLU 555 H GLU 555 28.125 -15.547 20.672 169 HA GLU 555 HA GLU 555 28.524 -13.487 22.626 170 HB2 GLU 555 HB2 GLU 555 26.742 -15.183 22.695 171 HB3 GLU 555 HB3 GLU 555 27.945 -16.461 22.973 172 HG2 GLU 555 HG2 GLU 555 28.482 -15.581 25.155 173 HG3 GLU 555 HG3 GLU 555 27.582 -14.098 24.829 174 H THR 556 H THR 556 30.660 -16.078 21.583 175 HA THR 556 HA THR 556 32.461 -16.030 23.856 176 HB THR 556 HB THR 556 33.938 -17.366 22.369 177 HG1 THR 556 HG1 THR 556 33.530 -16.673 20.367 178 HG21 THR 556 HG21 THR 556 31.029 -18.294 22.338 179 HG22 THR 556 HG22 THR 556 32.171 -18.500 23.675 180 HG23 THR 556 HG23 THR 556 32.468 -19.310 22.118 181 H SER 557 H SER 557 32.115 -13.905 21.125 182 HA SER 557 HA SER 557 34.883 -12.886 21.212 183 HB2 SER 557 HB2 SER 557 32.385 -12.131 19.704 184 HB3 SER 557 HB3 SER 557 33.746 -11.005 19.832 185 HG SER 557 HG SER 557 33.947 -13.683 18.925 186 H GLN 558 H GLN 558 35.303 -12.288 23.251 187 HA GLN 558 HA GLN 558 33.630 -11.208 25.147 188 HB2 GLN 558 HB2 GLN 558 36.631 -10.762 24.886 189 HB3 GLN 558 HB3 GLN 558 35.688 -10.594 26.360 190 HG2 GLN 558 HG2 GLN 558 35.043 -13.021 26.205 191 HG3 GLN 558 HG3 GLN 558 36.151 -13.182 24.830 192 HE21 GLN 558 HE21 GLN 558 38.425 -11.726 25.665 193 HE22 GLN 558 HE22 GLN 558 39.059 -12.509 27.106 194 H ASP 559 H ASP 559 35.726 -9.301 22.956 195 HA ASP 559 HA ASP 559 34.784 -6.766 24.151 196 HB2 ASP 559 HB2 ASP 559 36.843 -7.304 21.985 197 HB3 ASP 559 HB3 ASP 559 36.545 -5.758 22.761 198 H MET 560 H MET 560 33.746 -8.708 21.575 199 HA MET 560 HA MET 560 32.760 -8.443 19.564 200 HB2 MET 560 HB2 MET 560 31.365 -6.087 20.903 201 HB3 MET 560 HB3 MET 560 30.813 -6.951 19.472 202 HG2 MET 560 HG2 MET 560 30.901 -9.091 20.890 203 HG3 MET 560 HG3 MET 560 31.075 -8.027 22.281 204 HE1 MET 560 HE1 MET 560 27.308 -9.747 21.380 205 HE2 MET 560 HE2 MET 560 28.622 -10.022 20.228 206 HE3 MET 560 HE3 MET 560 28.903 -10.252 21.976 207 H ALA 561 H ALA 561 35.324 -7.230 19.678 208 HA ALA 561 HA ALA 561 35.051 -5.228 17.501 209 HB1 ALA 561 HB1 ALA 561 37.035 -5.106 19.801 210 HB2 ALA 561 HB2 ALA 561 36.942 -3.992 18.426 211 HB3 ALA 561 HB3 ALA 561 35.600 -4.084 19.588 212 H PHE 562 H PHE 562 36.649 -5.201 15.927 213 HA PHE 562 HA PHE 562 38.858 -7.107 15.917 214 HB2 PHE 562 HB2 PHE 562 36.504 -8.114 14.934 215 HB3 PHE 562 HB3 PHE 562 37.139 -7.372 13.482 216 HD1 PHE 562 HD1 PHE 562 37.634 -9.935 16.080 217 HD2 PHE 562 HD2 PHE 562 39.210 -8.283 12.430 218 HE1 PHE 562 HE1 PHE 562 39.127 -11.912 15.824 219 HE2 PHE 562 HE2 PHE 562 40.733 -10.230 12.201 220 HZ PHE 562 HZ PHE 562 40.674 -12.056 13.895 221 H LYS 563 H LYS 563 40.109 -6.790 13.696 222 HA LYS 563 HA LYS 563 39.831 -3.936 12.878 223 HB2 LYS 563 HB2 LYS 563 41.780 -3.353 13.538 224 HB3 LYS 563 HB3 LYS 563 41.929 -4.861 14.391 225 HG2 LYS 563 HG2 LYS 563 42.928 -4.301 11.567 226 HG3 LYS 563 HG3 LYS 563 43.897 -4.198 13.015 227 HD2 LYS 563 HD2 LYS 563 42.629 -6.792 12.019 228 HD3 LYS 563 HD3 LYS 563 44.294 -6.280 11.740 229 HE2 LYS 563 HE2 LYS 563 44.676 -6.165 14.195 230 HE3 LYS 563 HE3 LYS 563 43.039 -6.731 14.476 231 HZ1 LYS 563 HZ1 LYS 563 44.620 -8.561 14.567 232 HZ2 LYS 563 HZ2 LYS 563 45.158 -8.258 13.061 233 HZ3 LYS 563 HZ3 LYS 563 43.627 -8.792 13.291 234 H CYS 564 H CYS 564 40.530 -3.234 10.945 235 HA CYS 564 HA CYS 564 40.333 -5.084 8.632 236 HB2 CYS 564 HB2 CYS 564 38.948 -2.914 8.898 237 HB3 CYS 564 HB3 CYS 564 40.430 -2.046 8.733 238 HA PRO 565 HA PRO 565 44.908 -4.569 8.652 239 HB2 PRO 565 HB2 PRO 565 44.582 -6.537 6.399 240 HB3 PRO 565 HB3 PRO 565 45.794 -6.511 7.716 241 HG2 PRO 565 HG2 PRO 565 43.681 -8.211 7.828 242 HG3 PRO 565 HG3 PRO 565 44.214 -7.331 9.295 243 HD2 PRO 565 HD2 PRO 565 41.898 -6.692 7.456 244 HD3 PRO 565 HD3 PRO 565 41.984 -6.662 9.234 245 H ILE 566 H ILE 566 42.603 -4.011 6.053 246 HA ILE 566 HA ILE 566 44.558 -3.050 4.111 247 HB ILE 566 HB ILE 566 41.556 -2.778 4.270 248 HG12 ILE 566 HG12 ILE 566 43.292 -4.471 2.391 249 HG13 ILE 566 HG13 ILE 566 42.630 -5.086 3.884 250 HG21 ILE 566 HG21 ILE 566 42.398 -0.889 2.928 251 HG22 ILE 566 HG22 ILE 566 43.435 -1.980 1.998 252 HG23 ILE 566 HG23 ILE 566 41.671 -2.065 1.844 253 HD11 ILE 566 HD11 ILE 566 41.216 -5.817 2.101 254 HD12 ILE 566 HD12 ILE 566 40.311 -4.624 3.054 255 HD13 ILE 566 HD13 ILE 566 41.021 -4.173 1.481 256 H CYS 567 H CYS 567 42.027 -1.260 5.969 257 HA CYS 567 HA CYS 567 43.577 1.214 5.582 258 HB2 CYS 567 HB2 CYS 567 41.590 2.366 6.070 259 HB3 CYS 567 HB3 CYS 567 41.205 1.113 4.891 260 H LYS 568 H LYS 568 43.555 -1.090 7.879 261 HA LYS 568 HA LYS 568 44.252 -1.297 10.051 262 HB2 LYS 568 HB2 LYS 568 45.487 1.460 9.760 263 HB3 LYS 568 HB3 LYS 568 45.895 0.236 10.951 264 HG2 LYS 568 HG2 LYS 568 46.366 0.014 7.952 265 HG3 LYS 568 HG3 LYS 568 47.563 0.395 9.191 266 HD2 LYS 568 HD2 LYS 568 47.113 -1.839 10.251 267 HD3 LYS 568 HD3 LYS 568 46.077 -2.251 8.882 268 HE2 LYS 568 HE2 LYS 568 49.038 -1.516 8.708 269 HE3 LYS 568 HE3 LYS 568 48.398 -3.159 8.701 270 HZ1 LYS 568 HZ1 LYS 568 48.801 -2.423 6.452 271 HZ2 LYS 568 HZ2 LYS 568 47.847 -1.107 6.621 272 HZ3 LYS 568 HZ3 LYS 568 47.195 -2.601 6.650 273 H GLU 569 H GLU 569 41.629 -0.810 9.872 274 HA GLU 569 HA GLU 569 41.097 1.191 12.073 275 HB2 GLU 569 HB2 GLU 569 39.459 0.544 9.629 276 HB3 GLU 569 HB3 GLU 569 38.744 1.275 11.030 277 HG2 GLU 569 HG2 GLU 569 41.073 2.505 9.513 278 HG3 GLU 569 HG3 GLU 569 39.380 2.911 9.273 279 H THR 570 H THR 570 39.202 0.806 13.428 280 HA THR 570 HA THR 570 38.937 -2.098 14.019 281 HB THR 570 HB THR 570 38.384 0.312 15.775 282 HG1 THR 570 HG1 THR 570 40.495 -1.556 15.854 283 HG21 THR 570 HG21 THR 570 38.442 -1.345 17.647 284 HG22 THR 570 HG22 THR 570 38.432 -2.654 16.450 285 HG23 THR 570 HG23 THR 570 37.051 -1.544 16.575 286 H VAL 571 H VAL 571 37.073 -3.149 13.788 287 HA VAL 571 HA VAL 571 34.513 -1.688 13.327 288 HB VAL 571 HB VAL 571 33.583 -3.992 12.925 289 HG11 VAL 571 HG11 VAL 571 34.253 -4.050 10.607 290 HG12 VAL 571 HG12 VAL 571 33.914 -2.396 11.135 291 HG13 VAL 571 HG13 VAL 571 35.607 -2.940 10.939 292 HG21 VAL 571 HG21 VAL 571 35.047 -5.749 12.147 293 HG22 VAL 571 HG22 VAL 571 36.486 -4.759 12.491 294 HG23 VAL 571 HG23 VAL 571 35.456 -5.337 13.825 295 H THR 572 H THR 572 32.724 -2.064 14.646 296 HA THR 572 HA THR 572 33.093 -3.689 17.114 297 HB THR 572 HB THR 572 31.837 -1.993 18.388 298 HG1 THR 572 HG1 THR 572 30.942 -0.809 16.688 299 HG21 THR 572 HG21 THR 572 34.331 -2.118 18.481 300 HG22 THR 572 HG22 THR 572 33.688 -0.502 18.805 301 HG23 THR 572 HG23 THR 572 34.412 -0.857 17.225 302 H GLY 573 H GLY 573 31.335 -4.825 17.762 303 HA2 GLY 573 HA2 GLY 573 29.282 -5.459 15.890 304 HA3 GLY 573 HA3 GLY 573 29.349 -5.951 17.589 305 H VAL 574 H VAL 574 27.071 -5.101 15.903 306 HA VAL 574 HA VAL 574 25.934 -3.166 17.844 307 HB VAL 574 HB VAL 574 25.441 -3.201 14.820 308 HG11 VAL 574 HG11 VAL 574 23.386 -2.560 15.982 309 HG12 VAL 574 HG12 VAL 574 24.274 -1.376 16.962 310 HG13 VAL 574 HG13 VAL 574 24.107 -1.159 15.205 311 HG21 VAL 574 HG21 VAL 574 26.421 -0.902 14.888 312 HG22 VAL 574 HG22 VAL 574 26.863 -1.174 16.592 313 HG23 VAL 574 HG23 VAL 574 27.591 -2.160 15.313 314 H TYR 575 H TYR 575 23.976 -3.679 18.725 315 HA TYR 575 HA TYR 575 23.162 -6.377 18.508 316 HB2 TYR 575 HB2 TYR 575 23.067 -5.019 20.562 317 HB3 TYR 575 HB3 TYR 575 21.798 -4.028 19.853 318 HD1 TYR 575 HD1 TYR 575 22.439 -7.733 20.301 319 HD2 TYR 575 HD2 TYR 575 19.683 -4.447 20.707 320 HE1 TYR 575 HE1 TYR 575 20.741 -9.274 21.269 321 HE2 TYR 575 HE2 TYR 575 17.969 -6.000 21.631 322 HH TYR 575 HH TYR 575 17.526 -8.161 22.317 323 H ASP 576 H ASP 576 21.710 -7.425 17.280 324 HA ASP 576 HA ASP 576 19.610 -5.951 15.786 325 HB2 ASP 576 HB2 ASP 576 21.163 -7.561 14.582 326 HB3 ASP 576 HB3 ASP 576 20.444 -8.863 15.510 327 H GLU 577 H GLU 577 17.751 -5.767 16.888 328 HA GLU 577 HA GLU 577 17.210 -7.194 19.306 329 HB2 GLU 577 HB2 GLU 577 15.227 -5.517 17.723 330 HB3 GLU 577 HB3 GLU 577 15.229 -5.885 19.430 331 HG2 GLU 577 HG2 GLU 577 16.102 -3.848 19.654 332 HG3 GLU 577 HG3 GLU 577 17.627 -4.644 19.338 333 H GLU 578 H GLU 578 16.231 -7.834 16.006 334 HA GLU 578 HA GLU 578 13.957 -9.551 16.790 335 HB2 GLU 578 HB2 GLU 578 13.782 -8.110 14.835 336 HB3 GLU 578 HB3 GLU 578 15.130 -8.924 14.051 337 HG2 GLU 578 HG2 GLU 578 13.894 -11.015 13.922 338 HG3 GLU 578 HG3 GLU 578 12.584 -10.362 14.898 339 H SER 579 H SER 579 17.194 -9.981 15.283 340 HA SER 579 HA SER 579 17.137 -12.888 15.448 341 HB2 SER 579 HB2 SER 579 19.498 -10.976 15.233 342 HB3 SER 579 HB3 SER 579 19.560 -12.722 15.021 343 HG SER 579 HG SER 579 18.226 -12.538 13.205 344 H GLY 580 H GLY 580 18.135 -10.302 17.628 345 HA2 GLY 580 HA2 GLY 580 18.453 -10.339 19.917 346 HA3 GLY 580 HA3 GLY 580 18.217 -12.092 19.947 347 H GLU 581 H GLU 581 20.544 -10.398 17.848 348 HA GLU 581 HA GLU 581 22.873 -11.396 19.365 349 HB2 GLU 581 HB2 GLU 581 22.206 -12.248 16.519 350 HB3 GLU 581 HB3 GLU 581 23.775 -12.475 17.303 351 HG2 GLU 581 HG2 GLU 581 22.659 -13.832 19.078 352 HG3 GLU 581 HG3 GLU 581 21.141 -13.724 18.195 353 H TRP 582 H TRP 582 24.868 -10.410 18.681 354 HA TRP 582 HA TRP 582 24.468 -7.705 17.539 355 HB2 TRP 582 HB2 TRP 582 26.816 -9.054 18.887 356 HB3 TRP 582 HB3 TRP 582 26.821 -7.395 18.316 357 HD1 TRP 582 HD1 TRP 582 24.797 -9.559 20.841 358 HE1 TRP 582 HE1 TRP 582 24.151 -8.118 22.847 359 HE3 TRP 582 HE3 TRP 582 26.814 -5.099 19.327 360 HZ2 TRP 582 HZ2 TRP 582 24.396 -5.370 23.668 361 HZ3 TRP 582 HZ3 TRP 582 26.543 -3.066 20.734 362 HH2 TRP 582 HH2 TRP 582 25.342 -3.197 22.898 363 H VAL 583 H VAL 583 25.624 -6.896 15.750 364 HA VAL 583 HA VAL 583 26.935 -8.877 13.931 365 HB VAL 583 HB VAL 583 25.822 -7.767 12.020 366 HG11 VAL 583 HG11 VAL 583 24.990 -9.926 12.830 367 HG12 VAL 583 HG12 VAL 583 23.922 -9.105 13.991 368 HG13 VAL 583 HG13 VAL 583 23.654 -8.920 12.255 369 HG21 VAL 583 HG21 VAL 583 23.854 -6.586 14.004 370 HG22 VAL 583 HG22 VAL 583 25.103 -5.642 13.152 371 HG23 VAL 583 HG23 VAL 583 23.832 -6.466 12.238 372 H TRP 584 H TRP 584 28.572 -8.261 12.704 373 HA TRP 584 HA TRP 584 29.855 -5.596 13.088 374 HB2 TRP 584 HB2 TRP 584 30.715 -8.350 12.191 375 HB3 TRP 584 HB3 TRP 584 31.605 -6.976 11.590 376 HD1 TRP 584 HD1 TRP 584 31.935 -5.243 14.143 377 HE1 TRP 584 HE1 TRP 584 33.262 -6.039 16.199 378 HE3 TRP 584 HE3 TRP 584 32.044 -10.263 13.157 379 HZ2 TRP 584 HZ2 TRP 584 34.459 -8.491 17.134 380 HZ3 TRP 584 HZ3 TRP 584 33.330 -11.796 14.627 381 HH2 TRP 584 HH2 TRP 584 34.519 -10.927 16.618 382 H LYS 585 H LYS 585 28.773 -4.195 11.798 383 HA LYS 585 HA LYS 585 27.767 -4.913 9.137 384 HB2 LYS 585 HB2 LYS 585 27.833 -2.255 10.615 385 HB3 LYS 585 HB3 LYS 585 27.011 -2.561 9.081 386 HG2 LYS 585 HG2 LYS 585 25.684 -4.394 10.228 387 HG3 LYS 585 HG3 LYS 585 26.357 -3.851 11.764 388 HD2 LYS 585 HD2 LYS 585 24.682 -2.175 9.845 389 HD3 LYS 585 HD3 LYS 585 24.101 -2.943 11.327 390 HE2 LYS 585 HE2 LYS 585 25.665 -1.554 12.671 391 HE3 LYS 585 HE3 LYS 585 26.258 -0.799 11.194 392 HZ1 LYS 585 HZ1 LYS 585 24.030 0.088 10.810 393 HZ2 LYS 585 HZ2 LYS 585 24.567 0.578 12.259 394 HZ3 LYS 585 HZ3 LYS 585 23.457 -0.618 12.164 395 H ASN 586 H ASN 586 28.328 -3.780 7.178 396 HA ASN 586 HA ASN 586 29.786 -3.352 5.536 397 HB2 ASN 586 HB2 ASN 586 29.791 -1.131 6.828 398 HB3 ASN 586 HB3 ASN 586 31.364 -1.611 7.466 399 HD21 ASN 586 HD21 ASN 586 33.180 -1.236 6.103 400 HD22 ASN 586 HD22 ASN 586 33.013 -0.583 4.475 401 H THR 587 H THR 587 30.283 -5.754 7.037 402 HA THR 587 HA THR 587 33.272 -6.007 6.933 403 HB THR 587 HB THR 587 31.393 -7.318 8.905 404 HG1 THR 587 HG1 THR 587 31.808 -5.071 9.245 405 HG21 THR 587 HG21 THR 587 33.466 -7.957 10.113 406 HG22 THR 587 HG22 THR 587 34.449 -7.334 8.775 407 HG23 THR 587 HG23 THR 587 33.380 -8.735 8.535 408 H ILE 588 H ILE 588 34.174 -7.889 6.249 409 HA ILE 588 HA ILE 588 32.529 -10.069 5.134 410 HB ILE 588 HB ILE 588 32.885 -8.590 3.271 411 HG12 ILE 588 HG12 ILE 588 34.913 -10.840 2.991 412 HG13 ILE 588 HG13 ILE 588 33.164 -11.118 2.985 413 HG21 ILE 588 HG21 ILE 588 35.893 -8.810 3.673 414 HG22 ILE 588 HG22 ILE 588 35.041 -7.850 2.447 415 HG23 ILE 588 HG23 ILE 588 34.941 -7.384 4.139 416 HD11 ILE 588 HD11 ILE 588 32.999 -9.578 0.981 417 HD12 ILE 588 HD12 ILE 588 34.779 -9.513 0.960 418 HD13 ILE 588 HD13 ILE 588 33.949 -11.052 0.697 419 H GLU 589 H GLU 589 33.445 -12.056 5.205 420 HA GLU 589 HA GLU 589 36.123 -12.359 6.496 421 HB2 GLU 589 HB2 GLU 589 34.185 -13.379 7.700 422 HB3 GLU 589 HB3 GLU 589 33.884 -14.385 6.278 423 HG2 GLU 589 HG2 GLU 589 36.264 -15.260 6.502 424 HG3 GLU 589 HG3 GLU 589 36.394 -14.359 8.008 425 H VAL 590 H VAL 590 37.744 -13.074 5.217 426 HA VAL 590 HA VAL 590 37.345 -14.865 2.929 427 HB VAL 590 HB VAL 590 36.812 -12.776 1.846 428 HG11 VAL 590 HG11 VAL 590 39.494 -11.701 2.787 429 HG12 VAL 590 HG12 VAL 590 38.390 -10.926 1.624 430 HG13 VAL 590 HG13 VAL 590 37.884 -11.142 3.297 431 HG21 VAL 590 HG21 VAL 590 38.406 -12.812 0.049 432 HG22 VAL 590 HG22 VAL 590 39.643 -13.561 1.065 433 HG23 VAL 590 HG23 VAL 590 38.174 -14.469 0.614 434 H ASN 591 H ASN 591 38.886 -16.137 2.551 435 HA ASN 591 HA ASN 591 40.706 -17.398 3.013 436 HB2 ASN 591 HB2 ASN 591 42.052 -14.677 2.822 437 HB3 ASN 591 HB3 ASN 591 42.826 -16.257 2.664 438 HD21 ASN 591 HD21 ASN 591 42.770 -14.118 0.662 439 HD22 ASN 591 HD22 ASN 591 41.992 -14.842 -0.744 440 H GLY 592 H GLY 592 39.275 -17.013 5.304 441 HA2 GLY 592 HA2 GLY 592 39.442 -17.569 7.528 442 HA3 GLY 592 HA3 GLY 592 41.184 -17.714 7.343 443 H LYS 593 H LYS 593 40.031 -14.620 6.429 444 HA LYS 593 HA LYS 593 40.672 -13.369 9.067 445 HB2 LYS 593 HB2 LYS 593 41.850 -12.767 6.327 446 HB3 LYS 593 HB3 LYS 593 41.997 -11.675 7.710 447 HG2 LYS 593 HG2 LYS 593 43.188 -13.370 8.999 448 HG3 LYS 593 HG3 LYS 593 43.028 -14.552 7.704 449 HD2 LYS 593 HD2 LYS 593 44.501 -11.893 7.469 450 HD3 LYS 593 HD3 LYS 593 45.279 -13.434 7.836 451 HE2 LYS 593 HE2 LYS 593 43.750 -12.803 5.268 452 HE3 LYS 593 HE3 LYS 593 45.496 -12.731 5.463 453 HZ1 LYS 593 HZ1 LYS 593 45.425 -15.135 6.033 454 HZ2 LYS 593 HZ2 LYS 593 44.927 -14.837 4.514 455 HZ3 LYS 593 HZ3 LYS 593 43.834 -15.175 5.666 456 H TYR 594 H TYR 594 39.978 -11.201 9.320 457 HA TYR 594 HA TYR 594 37.441 -10.620 7.876 458 HB2 TYR 594 HB2 TYR 594 38.483 -9.764 10.567 459 HB3 TYR 594 HB3 TYR 594 37.033 -9.101 9.833 460 HD1 TYR 594 HD1 TYR 594 35.150 -10.636 9.112 461 HD2 TYR 594 HD2 TYR 594 38.313 -11.925 11.740 462 HE1 TYR 594 HE1 TYR 594 33.749 -12.548 9.864 463 HE2 TYR 594 HE2 TYR 594 36.914 -13.833 12.495 464 HH TYR 594 HH TYR 594 34.906 -14.927 12.271 465 H PHE 595 H PHE 595 36.922 -8.738 7.068 466 HA PHE 595 HA PHE 595 38.829 -6.496 6.773 467 HB2 PHE 595 HB2 PHE 595 37.791 -8.316 4.569 468 HB3 PHE 595 HB3 PHE 595 38.452 -6.742 4.234 469 HD1 PHE 595 HD1 PHE 595 40.909 -6.286 4.854 470 HD2 PHE 595 HD2 PHE 595 39.184 -10.226 4.929 471 HE1 PHE 595 HE1 PHE 595 43.177 -7.284 4.662 472 HE2 PHE 595 HE2 PHE 595 41.434 -11.227 4.724 473 HZ PHE 595 HZ PHE 595 43.449 -9.759 4.611 474 H HIS 596 H HIS 596 37.748 -4.698 5.487 475 HA HIS 596 HA HIS 596 34.858 -4.452 6.145 476 HB2 HIS 596 HB2 HIS 596 36.926 -2.631 4.962 477 HB3 HIS 596 HB3 HIS 596 35.243 -2.226 4.782 478 HD2 HIS 596 HD2 HIS 596 34.119 -2.425 7.763 479 HE1 HIS 596 HE1 HIS 596 37.524 -0.096 8.828 480 HE2 HIS 596 HE2 HIS 596 35.196 -0.845 9.551 481 H SER 597 H SER 597 33.249 -4.419 4.570 482 HA SER 597 HA SER 597 33.617 -5.951 2.172 483 HB2 SER 597 HB2 SER 597 31.281 -5.271 1.712 484 HB3 SER 597 HB3 SER 597 31.498 -5.904 3.346 485 HG SER 597 HG SER 597 30.290 -3.804 2.990 486 H THR 598 H THR 598 33.257 -2.406 2.675 487 HA THR 598 HA THR 598 33.560 -1.641 -0.050 488 HB THR 598 HB THR 598 34.303 0.583 0.976 489 HG1 THR 598 HG1 THR 598 35.083 0.150 2.913 490 HG21 THR 598 HG21 THR 598 32.118 1.130 1.927 491 HG22 THR 598 HG22 THR 598 31.720 -0.586 2.079 492 HG23 THR 598 HG23 THR 598 31.923 0.142 0.465 493 H CYS 599 H CYS 599 36.052 -1.964 2.528 494 HA CYS 599 HA CYS 599 38.259 -1.067 1.037 495 HB2 CYS 599 HB2 CYS 599 38.046 -3.000 3.358 496 HB3 CYS 599 HB3 CYS 599 39.561 -2.405 2.744 497 H TYR 600 H TYR 600 36.967 -4.399 1.435 498 HA TYR 600 HA TYR 600 38.967 -5.528 -0.294 499 HB2 TYR 600 HB2 TYR 600 37.929 -6.822 1.488 500 HB3 TYR 600 HB3 TYR 600 36.334 -6.566 0.822 501 HD1 TYR 600 HD1 TYR 600 39.576 -8.323 0.346 502 HD2 TYR 600 HD2 TYR 600 35.509 -7.932 -1.025 503 HE1 TYR 600 HE1 TYR 600 39.833 -10.405 -0.995 504 HE2 TYR 600 HE2 TYR 600 35.750 -10.027 -2.347 505 HH TYR 600 HH TYR 600 37.163 -11.704 -2.999 506 H HIS 601 H HIS 601 35.692 -4.258 -0.911 507 HA HIS 601 HA HIS 601 35.440 -5.465 -3.497 508 HB2 HIS 601 HB2 HIS 601 33.507 -4.952 -2.093 509 HB3 HIS 601 HB3 HIS 601 33.849 -3.232 -2.202 510 HD2 HIS 601 HD2 HIS 601 32.740 -6.195 -4.449 511 HE1 HIS 601 HE1 HIS 601 31.529 -2.613 -6.408 512 HE2 HIS 601 HE2 HIS 601 31.422 -5.154 -6.481 513 H GLU 602 H GLU 602 35.251 -1.917 -3.158 514 HA GLU 602 HA GLU 602 36.441 -1.724 -5.869 515 HB2 GLU 602 HB2 GLU 602 35.487 0.468 -5.952 516 HB3 GLU 602 HB3 GLU 602 34.270 -0.706 -5.478 517 HG2 GLU 602 HG2 GLU 602 34.410 0.041 -3.136 518 HG3 GLU 602 HG3 GLU 602 35.742 1.129 -3.538 519 H THR 603 H THR 603 37.644 -1.518 -2.790 520 HA THR 603 HA THR 603 39.581 0.698 -3.309 521 HB THR 603 HB THR 603 38.623 -0.806 -0.927 522 HG1 THR 603 HG1 THR 603 37.720 1.140 -1.511 523 HG21 THR 603 HG21 THR 603 40.336 0.310 0.511 524 HG22 THR 603 HG22 THR 603 41.253 0.734 -0.954 525 HG23 THR 603 HG23 THR 603 40.995 -0.976 -0.492 526 H SER 604 H SER 604 39.722 -2.803 -2.457 527 HA SER 604 HA SER 604 42.543 -3.033 -3.079 528 HB2 SER 604 HB2 SER 604 41.308 -4.588 -1.574 529 HB3 SER 604 HB3 SER 604 40.429 -5.212 -2.980 530 HG SER 604 HG SER 604 42.308 -6.450 -2.447 531 H GLN 605 H GLN 605 43.488 -4.152 -4.916 532 HA GLN 605 HA GLN 605 42.387 -3.343 -7.464 533 HB2 GLN 605 HB2 GLN 605 44.782 -3.454 -7.023 534 HB3 GLN 605 HB3 GLN 605 44.699 -5.208 -6.815 535 HG2 GLN 605 HG2 GLN 605 44.058 -5.516 -9.150 536 HG3 GLN 605 HG3 GLN 605 43.856 -3.777 -9.369 537 HE21 GLN 605 HE21 GLN 605 45.360 -4.542 -11.267 538 HE22 GLN 605 HE22 GLN 605 47.082 -4.379 -10.934 539 H ASN 606 H ASN 606 40.902 -4.338 -8.683 540 HA ASN 606 HA ASN 606 39.526 -6.582 -7.652 541 HB2 ASN 606 HB2 ASN 606 38.493 -4.693 -8.874 542 HB3 ASN 606 HB3 ASN 606 39.274 -5.236 -10.364 543 HD21 ASN 606 HD21 ASN 606 37.508 -5.910 -11.593 544 HD22 ASN 606 HD22 ASN 606 36.373 -7.135 -11.035 545 H SER 607 H SER 607 39.605 -8.703 -7.985 546 HA SER 607 HA SER 607 41.540 -9.956 -9.784 547 HB2 SER 607 HB2 SER 607 39.374 -11.177 -8.033 548 HB3 SER 607 HB3 SER 607 40.693 -12.051 -8.828 549 HG SER 607 HG SER 607 41.152 -11.563 -6.635 550 H SER 608 H SER 608 40.905 -11.744 -11.242 551 HA SER 608 HA SER 608 38.830 -11.104 -13.151 552 HB2 SER 608 HB2 SER 608 39.485 -13.284 -14.165 553 HB3 SER 608 HB3 SER 608 40.829 -12.170 -13.921 554 HG SER 608 HG SER 608 40.130 -14.350 -12.225 Start of MODEL 4 1 H1 GLY 533 H1 GLY 533 20.330 16.325 -11.704 2 H2 GLY 533 H2 GLY 533 21.142 14.962 -11.280 3 H3 GLY 533 H3 GLY 533 20.794 16.100 -10.147 4 HA2 GLY 533 HA2 GLY 533 18.804 14.469 -11.590 5 HA3 GLY 533 HA3 GLY 533 19.319 14.205 -9.914 6 H GLY 534 H GLY 534 16.663 14.950 -11.185 7 HA2 GLY 534 HA2 GLY 534 15.980 17.600 -10.090 8 HA3 GLY 534 HA3 GLY 534 14.913 16.455 -10.891 9 H SER 535 H SER 535 13.324 16.862 -9.265 10 HA SER 535 HA SER 535 13.643 16.160 -6.480 11 HB2 SER 535 HB2 SER 535 11.175 16.252 -6.457 12 HB3 SER 535 HB3 SER 535 11.900 17.665 -7.230 13 HG SER 535 HG SER 535 10.526 15.509 -8.423 14 H GLU 536 H GLU 536 13.358 14.229 -9.309 15 HA GLU 536 HA GLU 536 13.288 11.751 -7.685 16 HB2 GLU 536 HB2 GLU 536 10.997 12.074 -8.486 17 HB3 GLU 536 HB3 GLU 536 11.577 12.275 -10.142 18 HG2 GLU 536 HG2 GLU 536 12.388 9.938 -10.153 19 HG3 GLU 536 HG3 GLU 536 11.922 9.758 -8.464 20 H PHE 537 H PHE 537 14.989 10.510 -8.185 21 HA PHE 537 HA PHE 537 16.069 10.242 -10.869 22 HB2 PHE 537 HB2 PHE 537 18.251 11.127 -10.466 23 HB3 PHE 537 HB3 PHE 537 17.103 12.389 -10.106 24 HD1 PHE 537 HD1 PHE 537 16.616 13.005 -7.700 25 HD2 PHE 537 HD2 PHE 537 19.779 10.282 -8.783 26 HE1 PHE 537 HE1 PHE 537 17.656 13.322 -5.471 27 HE2 PHE 537 HE2 PHE 537 20.813 10.602 -6.551 28 HZ PHE 537 HZ PHE 537 19.756 12.122 -4.892 29 H SER 538 H SER 538 18.139 8.844 -10.760 30 HA SER 538 HA SER 538 18.299 6.982 -8.488 31 HB2 SER 538 HB2 SER 538 16.434 6.162 -9.974 32 HB3 SER 538 HB3 SER 538 17.612 6.013 -11.284 33 HG SER 538 HG SER 538 17.378 4.551 -8.895 34 H ASP 539 H ASP 539 20.119 5.454 -8.727 35 HA ASP 539 HA ASP 539 22.240 6.124 -10.655 36 HB2 ASP 539 HB2 ASP 539 23.875 6.781 -9.088 37 HB3 ASP 539 HB3 ASP 539 22.479 7.787 -8.781 38 H ARG 540 H ARG 540 24.270 4.745 -10.141 39 HA ARG 540 HA ARG 540 23.365 1.957 -9.505 40 HB2 ARG 540 HB2 ARG 540 25.151 2.863 -11.794 41 HB3 ARG 540 HB3 ARG 540 24.696 1.197 -11.443 42 HG2 ARG 540 HG2 ARG 540 22.755 3.405 -12.241 43 HG3 ARG 540 HG3 ARG 540 23.401 2.167 -13.308 44 HD2 ARG 540 HD2 ARG 540 22.283 0.402 -12.105 45 HD3 ARG 540 HD3 ARG 540 21.782 1.486 -10.816 46 HE ARG 540 HE ARG 540 20.670 1.364 -13.574 47 HH11 ARG 540 HH11 ARG 540 20.449 2.877 -10.393 48 HH12 ARG 540 HH12 ARG 540 18.872 3.519 -10.718 49 HH21 ARG 540 HH21 ARG 540 18.634 2.249 -13.901 50 HH22 ARG 540 HH22 ARG 540 17.875 3.158 -12.615 51 H SER 541 H SER 541 24.983 3.901 -7.824 52 HA SER 541 HA SER 541 27.618 2.750 -7.550 53 HB2 SER 541 HB2 SER 541 27.113 4.924 -6.601 54 HB3 SER 541 HB3 SER 541 25.890 4.210 -5.530 55 HG SER 541 HG SER 541 28.008 4.509 -4.570 56 H ASN 542 H ASN 542 28.138 0.769 -6.913 57 HA ASN 542 HA ASN 542 26.202 -1.034 -5.614 58 HB2 ASN 542 HB2 ASN 542 29.073 -1.322 -6.593 59 HB3 ASN 542 HB3 ASN 542 28.244 -2.581 -5.683 60 HD21 ASN 542 HD21 ASN 542 26.698 -0.563 -8.300 61 HD22 ASN 542 HD22 ASN 542 26.450 -1.972 -9.314 62 H GLU 543 H GLU 543 28.667 1.181 -4.556 63 HA GLU 543 HA GLU 543 29.695 -0.211 -2.334 64 HB2 GLU 543 HB2 GLU 543 29.498 2.764 -2.922 65 HB3 GLU 543 HB3 GLU 543 30.294 2.110 -1.498 66 HG2 GLU 543 HG2 GLU 543 32.055 2.402 -2.954 67 HG3 GLU 543 HG3 GLU 543 31.734 0.685 -3.043 68 H LEU 544 H LEU 544 26.679 1.640 -2.495 69 HA LEU 544 HA LEU 544 26.165 1.776 0.338 70 HB2 LEU 544 HB2 LEU 544 24.277 1.680 -2.062 71 HB3 LEU 544 HB3 LEU 544 23.765 1.967 -0.419 72 HG LEU 544 HG LEU 544 23.765 4.016 -1.560 73 HD11 LEU 544 HD11 LEU 544 25.151 5.409 -0.142 74 HD12 LEU 544 HD12 LEU 544 26.205 4.040 0.255 75 HD13 LEU 544 HD13 LEU 544 24.512 4.050 0.803 76 HD21 LEU 544 HD21 LEU 544 25.447 3.480 -3.330 77 HD22 LEU 544 HD22 LEU 544 26.734 3.835 -2.146 78 HD23 LEU 544 HD23 LEU 544 25.590 5.100 -2.623 79 H GLU 545 H GLU 545 25.487 -0.711 -2.121 80 HA GLU 545 HA GLU 545 24.030 -2.439 -0.251 81 HB2 GLU 545 HB2 GLU 545 25.146 -2.941 -3.052 82 HB3 GLU 545 HB3 GLU 545 24.094 -4.041 -2.171 83 HG2 GLU 545 HG2 GLU 545 23.397 -1.274 -3.218 84 HG3 GLU 545 HG3 GLU 545 22.822 -2.816 -3.829 85 H ILE 546 H ILE 546 27.343 -2.194 -1.429 86 HA ILE 546 HA ILE 546 28.357 -4.568 -0.112 87 HB ILE 546 HB ILE 546 29.670 -1.941 -0.882 88 HG12 ILE 546 HG12 ILE 546 28.771 -3.405 -2.794 89 HG13 ILE 546 HG13 ILE 546 30.452 -2.911 -2.860 90 HG21 ILE 546 HG21 ILE 546 30.967 -4.503 0.086 91 HG22 ILE 546 HG22 ILE 546 31.821 -3.162 -0.717 92 HG23 ILE 546 HG23 ILE 546 31.033 -2.900 0.842 93 HD11 ILE 546 HD11 ILE 546 29.514 -5.646 -1.903 94 HD12 ILE 546 HD12 ILE 546 30.115 -5.264 -3.537 95 HD13 ILE 546 HD13 ILE 546 31.200 -5.118 -2.149 96 H ARG 547 H ARG 547 27.880 -1.177 0.946 97 HA ARG 547 HA ARG 547 29.166 -1.473 3.505 98 HB2 ARG 547 HB2 ARG 547 28.776 0.675 2.336 99 HB3 ARG 547 HB3 ARG 547 27.042 0.518 2.629 100 HG2 ARG 547 HG2 ARG 547 27.439 0.631 5.075 101 HG3 ARG 547 HG3 ARG 547 29.195 0.682 4.790 102 HD2 ARG 547 HD2 ARG 547 28.925 2.820 3.561 103 HD3 ARG 547 HD3 ARG 547 27.172 2.738 3.838 104 HE ARG 547 HE ARG 547 28.532 2.543 6.346 105 HH11 ARG 547 HH11 ARG 547 27.846 4.989 3.927 106 HH12 ARG 547 HH12 ARG 547 27.906 6.286 5.103 107 HH21 ARG 547 HH21 ARG 547 28.584 4.235 7.782 108 HH22 ARG 547 HH22 ARG 547 28.311 5.864 7.223 109 H GLY 548 H GLY 548 25.888 -2.179 2.440 110 HA2 GLY 548 HA2 GLY 548 24.707 -2.598 5.034 111 HA3 GLY 548 HA3 GLY 548 24.104 -3.174 3.483 112 H LYS 549 H LYS 549 27.099 -4.536 3.491 113 HA LYS 549 HA LYS 549 26.162 -7.171 4.281 114 HB2 LYS 549 HB2 LYS 549 28.964 -6.173 3.635 115 HB3 LYS 549 HB3 LYS 549 28.507 -7.861 3.787 116 HG2 LYS 549 HG2 LYS 549 27.359 -5.955 1.697 117 HG3 LYS 549 HG3 LYS 549 28.708 -7.051 1.430 118 HD2 LYS 549 HD2 LYS 549 27.320 -8.996 1.822 119 HD3 LYS 549 HD3 LYS 549 25.918 -8.003 2.259 120 HE2 LYS 549 HE2 LYS 549 27.293 -7.775 -0.440 121 HE3 LYS 549 HE3 LYS 549 26.032 -8.963 -0.128 122 HZ1 LYS 549 HZ1 LYS 549 24.508 -7.194 0.420 123 HZ2 LYS 549 HZ2 LYS 549 25.112 -6.929 -1.072 124 HZ3 LYS 549 HZ3 LYS 549 25.638 -6.043 0.191 125 H TYR 550 H TYR 550 26.725 -8.444 6.033 126 HA TYR 550 HA TYR 550 28.484 -7.383 8.120 127 HB2 TYR 550 HB2 TYR 550 26.809 -7.589 9.911 128 HB3 TYR 550 HB3 TYR 550 26.398 -6.334 8.782 129 HD1 TYR 550 HD1 TYR 550 24.336 -6.435 7.501 130 HD2 TYR 550 HD2 TYR 550 25.546 -9.778 9.932 131 HE1 TYR 550 HE1 TYR 550 22.066 -7.431 7.258 132 HE2 TYR 550 HE2 TYR 550 23.297 -10.791 9.666 133 HH TYR 550 HH TYR 550 21.196 -10.547 8.774 134 H VAL 551 H VAL 551 28.762 -8.807 9.936 135 HA VAL 551 HA VAL 551 28.225 -11.697 9.518 136 HB VAL 551 HB VAL 551 30.584 -12.133 10.369 137 HG11 VAL 551 HG11 VAL 551 29.859 -12.544 8.016 138 HG12 VAL 551 HG12 VAL 551 30.383 -10.896 7.591 139 HG13 VAL 551 HG13 VAL 551 31.564 -12.096 8.145 140 HG21 VAL 551 HG21 VAL 551 31.287 -9.967 11.101 141 HG22 VAL 551 HG22 VAL 551 32.342 -10.527 9.797 142 HG23 VAL 551 HG23 VAL 551 31.110 -9.288 9.457 143 H VAL 552 H VAL 552 27.784 -12.823 11.455 144 HA VAL 552 HA VAL 552 27.012 -11.190 13.714 145 HB VAL 552 HB VAL 552 26.995 -14.168 13.214 146 HG11 VAL 552 HG11 VAL 552 27.278 -13.967 15.635 147 HG12 VAL 552 HG12 VAL 552 25.950 -12.776 15.702 148 HG13 VAL 552 HG13 VAL 552 25.632 -14.460 15.239 149 HG21 VAL 552 HG21 VAL 552 24.739 -12.163 13.578 150 HG22 VAL 552 HG22 VAL 552 25.316 -12.753 12.008 151 HG23 VAL 552 HG23 VAL 552 24.582 -13.887 13.158 152 H VAL 553 H VAL 553 27.962 -10.828 15.633 153 HA VAL 553 HA VAL 553 30.787 -11.628 15.941 154 HB VAL 553 HB VAL 553 29.348 -9.727 17.800 155 HG11 VAL 553 HG11 VAL 553 32.252 -10.246 16.974 156 HG12 VAL 553 HG12 VAL 553 31.748 -8.929 18.028 157 HG13 VAL 553 HG13 VAL 553 31.517 -10.605 18.558 158 HG21 VAL 553 HG21 VAL 553 29.072 -8.559 15.744 159 HG22 VAL 553 HG22 VAL 553 30.536 -7.903 16.490 160 HG23 VAL 553 HG23 VAL 553 30.668 -9.088 15.158 161 HA PRO 554 HA PRO 554 29.413 -14.394 19.307 162 HB2 PRO 554 HB2 PRO 554 31.693 -15.791 19.689 163 HB3 PRO 554 HB3 PRO 554 30.712 -15.996 18.200 164 HG2 PRO 554 HG2 PRO 554 33.182 -14.282 18.553 165 HG3 PRO 554 HG3 PRO 554 32.836 -15.469 17.251 166 HD2 PRO 554 HD2 PRO 554 32.362 -12.768 16.996 167 HD3 PRO 554 HD3 PRO 554 31.370 -14.011 16.170 168 H GLU 555 H GLU 555 29.752 -14.340 21.643 169 HA GLU 555 HA GLU 555 30.999 -11.961 22.674 170 HB2 GLU 555 HB2 GLU 555 30.408 -12.775 24.850 171 HB3 GLU 555 HB3 GLU 555 29.057 -13.026 23.748 172 HG2 GLU 555 HG2 GLU 555 29.600 -15.418 23.576 173 HG3 GLU 555 HG3 GLU 555 31.032 -15.205 24.577 174 H THR 556 H THR 556 32.368 -15.046 21.927 175 HA THR 556 HA THR 556 34.745 -14.845 23.616 176 HB THR 556 HB THR 556 33.654 -16.941 22.580 177 HG1 THR 556 HG1 THR 556 35.454 -17.013 23.901 178 HG21 THR 556 HG21 THR 556 34.052 -16.036 20.280 179 HG22 THR 556 HG22 THR 556 34.737 -17.677 20.571 180 HG23 THR 556 HG23 THR 556 35.796 -16.224 20.588 181 H SER 557 H SER 557 33.862 -13.304 20.605 182 HA SER 557 HA SER 557 36.614 -12.586 19.893 183 HB2 SER 557 HB2 SER 557 33.878 -11.802 18.859 184 HB3 SER 557 HB3 SER 557 35.342 -10.881 18.407 185 HG SER 557 HG SER 557 34.932 -12.569 16.952 186 H GLN 558 H GLN 558 37.765 -11.069 20.835 187 HA GLN 558 HA GLN 558 37.100 -9.995 23.280 188 HB2 GLN 558 HB2 GLN 558 39.386 -10.326 22.361 189 HB3 GLN 558 HB3 GLN 558 39.166 -8.898 21.344 190 HG2 GLN 558 HG2 GLN 558 40.429 -8.179 23.211 191 HG3 GLN 558 HG3 GLN 558 38.812 -7.538 23.480 192 HE21 GLN 558 HE21 GLN 558 37.978 -7.968 25.612 193 HE22 GLN 558 HE22 GLN 558 38.629 -9.236 26.634 194 H ASP 559 H ASP 559 35.688 -8.550 23.902 195 HA ASP 559 HA ASP 559 34.268 -6.826 24.037 196 HB2 ASP 559 HB2 ASP 559 36.432 -5.203 22.682 197 HB3 ASP 559 HB3 ASP 559 35.199 -4.623 23.788 198 H MET 560 H MET 560 34.033 -8.355 21.398 199 HA MET 560 HA MET 560 33.224 -8.265 19.373 200 HB2 MET 560 HB2 MET 560 31.485 -5.997 20.398 201 HB3 MET 560 HB3 MET 560 31.196 -6.958 18.949 202 HG2 MET 560 HG2 MET 560 31.216 -9.034 20.384 203 HG3 MET 560 HG3 MET 560 31.184 -7.993 21.807 204 HE1 MET 560 HE1 MET 560 29.146 -9.880 22.099 205 HE2 MET 560 HE2 MET 560 27.625 -9.788 21.187 206 HE3 MET 560 HE3 MET 560 29.100 -10.361 20.387 207 H ALA 561 H ALA 561 35.655 -6.843 19.708 208 HA ALA 561 HA ALA 561 35.472 -4.888 17.481 209 HB1 ALA 561 HB1 ALA 561 37.208 -3.582 18.625 210 HB2 ALA 561 HB2 ALA 561 35.737 -3.729 19.602 211 HB3 ALA 561 HB3 ALA 561 37.164 -4.724 19.992 212 H PHE 562 H PHE 562 36.866 -5.076 15.847 213 HA PHE 562 HA PHE 562 39.396 -6.533 16.090 214 HB2 PHE 562 HB2 PHE 562 37.623 -8.261 15.446 215 HB3 PHE 562 HB3 PHE 562 37.424 -7.364 13.938 216 HD1 PHE 562 HD1 PHE 562 38.920 -7.750 12.105 217 HD2 PHE 562 HD2 PHE 562 39.930 -9.188 16.046 218 HE1 PHE 562 HE1 PHE 562 40.883 -8.949 11.167 219 HE2 PHE 562 HE2 PHE 562 41.879 -10.390 15.106 220 HZ PHE 562 HZ PHE 562 42.372 -10.267 12.673 221 H LYS 563 H LYS 563 40.716 -6.233 14.048 222 HA LYS 563 HA LYS 563 40.183 -3.470 13.009 223 HB2 LYS 563 HB2 LYS 563 41.979 -3.662 14.683 224 HB3 LYS 563 HB3 LYS 563 42.867 -4.751 13.606 225 HG2 LYS 563 HG2 LYS 563 42.948 -2.937 11.892 226 HG3 LYS 563 HG3 LYS 563 42.090 -1.859 13.006 227 HD2 LYS 563 HD2 LYS 563 44.842 -3.087 13.488 228 HD3 LYS 563 HD3 LYS 563 44.535 -1.476 12.851 229 HE2 LYS 563 HE2 LYS 563 44.878 -0.921 15.016 230 HE3 LYS 563 HE3 LYS 563 43.126 -1.105 15.021 231 HZ1 LYS 563 HZ1 LYS 563 45.086 -3.152 15.941 232 HZ2 LYS 563 HZ2 LYS 563 43.462 -3.333 15.990 233 HZ3 LYS 563 HZ3 LYS 563 44.183 -2.203 16.908 234 H CYS 564 H CYS 564 40.096 -3.071 10.973 235 HA CYS 564 HA CYS 564 40.439 -4.968 8.847 236 HB2 CYS 564 HB2 CYS 564 38.947 -2.831 8.975 237 HB3 CYS 564 HB3 CYS 564 40.393 -1.914 8.785 238 HA PRO 565 HA PRO 565 44.981 -4.097 8.966 239 HB2 PRO 565 HB2 PRO 565 45.849 -6.021 7.232 240 HB3 PRO 565 HB3 PRO 565 45.316 -6.395 8.898 241 HG2 PRO 565 HG2 PRO 565 43.671 -6.527 6.348 242 HG3 PRO 565 HG3 PRO 565 43.906 -7.824 7.571 243 HD2 PRO 565 HD2 PRO 565 41.728 -6.231 7.675 244 HD3 PRO 565 HD3 PRO 565 42.595 -6.676 9.174 245 H ILE 566 H ILE 566 42.782 -3.965 6.245 246 HA ILE 566 HA ILE 566 44.629 -3.076 4.222 247 HB ILE 566 HB ILE 566 41.619 -2.754 4.460 248 HG12 ILE 566 HG12 ILE 566 43.189 -4.788 2.803 249 HG13 ILE 566 HG13 ILE 566 42.530 -5.145 4.398 250 HG21 ILE 566 HG21 ILE 566 41.683 -2.385 1.970 251 HG22 ILE 566 HG22 ILE 566 42.487 -1.110 2.852 252 HG23 ILE 566 HG23 ILE 566 43.453 -2.372 2.045 253 HD11 ILE 566 HD11 ILE 566 40.880 -4.448 1.936 254 HD12 ILE 566 HD12 ILE 566 41.053 -6.021 2.706 255 HD13 ILE 566 HD13 ILE 566 40.233 -4.710 3.575 256 H CYS 567 H CYS 567 42.274 -1.271 6.257 257 HA CYS 567 HA CYS 567 43.726 1.249 5.633 258 HB2 CYS 567 HB2 CYS 567 41.701 2.390 5.930 259 HB3 CYS 567 HB3 CYS 567 41.366 1.041 4.837 260 H LYS 568 H LYS 568 43.559 -0.950 8.054 261 HA LYS 568 HA LYS 568 44.132 -1.061 10.246 262 HB2 LYS 568 HB2 LYS 568 45.354 1.698 9.922 263 HB3 LYS 568 HB3 LYS 568 45.696 0.523 11.188 264 HG2 LYS 568 HG2 LYS 568 46.344 0.161 8.234 265 HG3 LYS 568 HG3 LYS 568 47.465 0.647 9.493 266 HD2 LYS 568 HD2 LYS 568 47.105 -1.539 10.661 267 HD3 LYS 568 HD3 LYS 568 45.989 -2.018 9.382 268 HE2 LYS 568 HE2 LYS 568 48.074 -3.063 8.893 269 HE3 LYS 568 HE3 LYS 568 47.810 -1.808 7.698 270 HZ1 LYS 568 HZ1 LYS 568 50.085 -1.789 8.545 271 HZ2 LYS 568 HZ2 LYS 568 49.582 -1.520 10.071 272 HZ3 LYS 568 HZ3 LYS 568 49.355 -0.385 8.919 273 H GLU 569 H GLU 569 41.526 -0.597 9.893 274 HA GLU 569 HA GLU 569 40.845 1.396 12.054 275 HB2 GLU 569 HB2 GLU 569 39.362 0.714 9.525 276 HB3 GLU 569 HB3 GLU 569 38.591 1.500 10.907 277 HG2 GLU 569 HG2 GLU 569 40.177 3.351 10.823 278 HG3 GLU 569 HG3 GLU 569 41.003 2.637 9.441 279 H THR 570 H THR 570 39.477 0.861 13.682 280 HA THR 570 HA THR 570 38.942 -2.004 14.042 281 HB THR 570 HB THR 570 38.493 0.331 15.912 282 HG1 THR 570 HG1 THR 570 40.646 -0.116 15.553 283 HG21 THR 570 HG21 THR 570 38.287 -2.674 16.391 284 HG22 THR 570 HG22 THR 570 36.992 -1.482 16.585 285 HG23 THR 570 HG23 THR 570 38.387 -1.447 17.677 286 H VAL 571 H VAL 571 37.127 -2.986 13.529 287 HA VAL 571 HA VAL 571 34.556 -1.534 13.174 288 HB VAL 571 HB VAL 571 33.699 -3.866 12.604 289 HG11 VAL 571 HG11 VAL 571 34.358 -3.649 10.279 290 HG12 VAL 571 HG12 VAL 571 33.905 -2.098 10.992 291 HG13 VAL 571 HG13 VAL 571 35.632 -2.490 10.728 292 HG21 VAL 571 HG21 VAL 571 35.700 -5.159 13.370 293 HG22 VAL 571 HG22 VAL 571 35.225 -5.477 11.690 294 HG23 VAL 571 HG23 VAL 571 36.626 -4.439 12.027 295 H THR 572 H THR 572 32.797 -1.886 14.504 296 HA THR 572 HA THR 572 33.213 -3.530 16.956 297 HB THR 572 HB THR 572 31.896 -1.877 18.204 298 HG1 THR 572 HG1 THR 572 31.615 0.151 17.298 299 HG21 THR 572 HG21 THR 572 33.661 -0.222 18.453 300 HG22 THR 572 HG22 THR 572 34.359 -0.651 16.877 301 HG23 THR 572 HG23 THR 572 34.387 -1.817 18.222 302 H GLY 573 H GLY 573 31.551 -4.729 17.718 303 HA2 GLY 573 HA2 GLY 573 29.460 -5.484 15.908 304 HA3 GLY 573 HA3 GLY 573 29.692 -6.088 17.545 305 H VAL 574 H VAL 574 27.264 -5.185 16.007 306 HA VAL 574 HA VAL 574 26.097 -3.411 18.079 307 HB VAL 574 HB VAL 574 25.639 -3.248 15.054 308 HG11 VAL 574 HG11 VAL 574 24.496 -1.517 17.284 309 HG12 VAL 574 HG12 VAL 574 24.361 -1.183 15.549 310 HG13 VAL 574 HG13 VAL 574 23.581 -2.615 16.230 311 HG21 VAL 574 HG21 VAL 574 27.046 -1.290 16.913 312 HG22 VAL 574 HG22 VAL 574 27.798 -2.262 15.620 313 HG23 VAL 574 HG23 VAL 574 26.655 -0.985 15.207 314 H TYR 575 H TYR 575 23.952 -3.796 18.696 315 HA TYR 575 HA TYR 575 23.114 -6.511 18.371 316 HB2 TYR 575 HB2 TYR 575 22.832 -5.205 20.433 317 HB3 TYR 575 HB3 TYR 575 21.713 -4.136 19.607 318 HD1 TYR 575 HD1 TYR 575 19.413 -4.550 19.913 319 HD2 TYR 575 HD2 TYR 575 22.197 -7.814 20.271 320 HE1 TYR 575 HE1 TYR 575 17.563 -6.063 20.616 321 HE2 TYR 575 HE2 TYR 575 20.348 -9.327 20.971 322 HH TYR 575 HH TYR 575 18.123 -9.427 21.613 323 H ASP 576 H ASP 576 21.818 -7.445 17.017 324 HA ASP 576 HA ASP 576 20.092 -5.982 15.095 325 HB2 ASP 576 HB2 ASP 576 21.685 -7.629 14.168 326 HB3 ASP 576 HB3 ASP 576 21.023 -8.883 15.205 327 H GLU 577 H GLU 577 18.252 -5.493 16.125 328 HA GLU 577 HA GLU 577 17.015 -6.944 18.233 329 HB2 GLU 577 HB2 GLU 577 15.813 -4.921 16.293 330 HB3 GLU 577 HB3 GLU 577 15.119 -5.419 17.845 331 HG2 GLU 577 HG2 GLU 577 17.016 -4.425 19.037 332 HG3 GLU 577 HG3 GLU 577 17.789 -3.994 17.511 333 H GLU 578 H GLU 578 16.670 -7.395 14.750 334 HA GLU 578 HA GLU 578 14.063 -8.726 14.936 335 HB2 GLU 578 HB2 GLU 578 14.763 -7.382 12.955 336 HB3 GLU 578 HB3 GLU 578 16.066 -8.508 12.653 337 HG2 GLU 578 HG2 GLU 578 14.200 -8.926 11.166 338 HG3 GLU 578 HG3 GLU 578 14.483 -10.320 12.184 339 H SER 579 H SER 579 17.464 -9.758 14.423 340 HA SER 579 HA SER 579 16.799 -12.605 14.463 341 HB2 SER 579 HB2 SER 579 18.600 -11.655 13.067 342 HB3 SER 579 HB3 SER 579 19.491 -11.217 14.545 343 HG SER 579 HG SER 579 20.092 -13.269 13.587 344 H GLY 580 H GLY 580 18.134 -10.216 16.753 345 HA2 GLY 580 HA2 GLY 580 18.190 -10.320 19.088 346 HA3 GLY 580 HA3 GLY 580 17.786 -12.042 19.049 347 H GLU 581 H GLU 581 20.381 -10.408 17.236 348 HA GLU 581 HA GLU 581 22.500 -11.873 18.765 349 HB2 GLU 581 HB2 GLU 581 22.117 -11.801 15.739 350 HB3 GLU 581 HB3 GLU 581 23.567 -12.383 16.539 351 HG2 GLU 581 HG2 GLU 581 20.783 -13.591 16.776 352 HG3 GLU 581 HG3 GLU 581 22.111 -14.214 15.812 353 H TRP 582 H TRP 582 24.757 -11.032 17.793 354 HA TRP 582 HA TRP 582 24.588 -8.054 17.450 355 HB2 TRP 582 HB2 TRP 582 26.748 -9.732 18.781 356 HB3 TRP 582 HB3 TRP 582 26.892 -8.028 18.384 357 HD1 TRP 582 HD1 TRP 582 24.720 -10.325 20.619 358 HE1 TRP 582 HE1 TRP 582 23.890 -8.996 22.641 359 HE3 TRP 582 HE3 TRP 582 26.630 -5.747 19.403 360 HZ2 TRP 582 HZ2 TRP 582 23.981 -6.268 23.584 361 HZ3 TRP 582 HZ3 TRP 582 26.263 -3.787 20.900 362 HH2 TRP 582 HH2 TRP 582 24.923 -4.040 22.977 363 H VAL 583 H VAL 583 25.793 -7.135 15.819 364 HA VAL 583 HA VAL 583 27.134 -8.941 13.864 365 HB VAL 583 HB VAL 583 25.982 -7.693 12.041 366 HG11 VAL 583 HG11 VAL 583 24.158 -9.323 13.853 367 HG12 VAL 583 HG12 VAL 583 23.945 -9.043 12.117 368 HG13 VAL 583 HG13 VAL 583 25.328 -9.984 12.693 369 HG21 VAL 583 HG21 VAL 583 23.874 -6.588 12.383 370 HG22 VAL 583 HG22 VAL 583 23.972 -6.819 14.132 371 HG23 VAL 583 HG23 VAL 583 25.124 -5.737 13.311 372 H TRP 584 H TRP 584 28.754 -8.210 12.730 373 HA TRP 584 HA TRP 584 29.933 -5.517 13.220 374 HB2 TRP 584 HB2 TRP 584 30.876 -8.203 12.269 375 HB3 TRP 584 HB3 TRP 584 31.627 -6.817 11.520 376 HD1 TRP 584 HD1 TRP 584 32.098 -4.946 13.945 377 HE1 TRP 584 HE1 TRP 584 33.694 -5.573 15.872 378 HE3 TRP 584 HE3 TRP 584 32.536 -9.962 13.054 379 HZ2 TRP 584 HZ2 TRP 584 35.233 -7.865 16.676 380 HZ3 TRP 584 HZ3 TRP 584 34.156 -11.318 14.341 381 HH2 TRP 584 HH2 TRP 584 35.506 -10.288 16.160 382 H LYS 585 H LYS 585 28.744 -4.098 12.023 383 HA LYS 585 HA LYS 585 27.735 -4.685 9.333 384 HB2 LYS 585 HB2 LYS 585 27.858 -2.091 10.902 385 HB3 LYS 585 HB3 LYS 585 27.047 -2.321 9.340 386 HG2 LYS 585 HG2 LYS 585 25.656 -4.134 10.369 387 HG3 LYS 585 HG3 LYS 585 26.316 -3.710 11.955 388 HD2 LYS 585 HD2 LYS 585 24.755 -1.836 10.132 389 HD3 LYS 585 HD3 LYS 585 24.087 -2.700 11.521 390 HE2 LYS 585 HE2 LYS 585 25.692 -1.508 13.021 391 HE3 LYS 585 HE3 LYS 585 26.329 -0.629 11.635 392 HZ1 LYS 585 HZ1 LYS 585 24.102 0.337 11.321 393 HZ2 LYS 585 HZ2 LYS 585 24.652 0.678 12.806 394 HZ3 LYS 585 HZ3 LYS 585 23.518 -0.484 12.606 395 H ASN 586 H ASN 586 28.319 -3.566 7.416 396 HA ASN 586 HA ASN 586 29.784 -3.097 5.777 397 HB2 ASN 586 HB2 ASN 586 29.695 -0.945 7.044 398 HB3 ASN 586 HB3 ASN 586 31.180 -1.394 7.874 399 HD21 ASN 586 HD21 ASN 586 31.473 -2.350 4.531 400 HD22 ASN 586 HD22 ASN 586 32.308 -0.868 4.077 401 H THR 587 H THR 587 30.251 -5.571 7.128 402 HA THR 587 HA THR 587 33.233 -5.891 6.987 403 HB THR 587 HB THR 587 31.452 -7.132 9.100 404 HG1 THR 587 HG1 THR 587 31.847 -4.867 9.396 405 HG21 THR 587 HG21 THR 587 34.486 -7.098 8.858 406 HG22 THR 587 HG22 THR 587 33.440 -8.527 8.651 407 HG23 THR 587 HG23 THR 587 33.549 -7.722 10.218 408 H ILE 588 H ILE 588 34.045 -7.812 6.346 409 HA ILE 588 HA ILE 588 32.263 -9.954 5.388 410 HB ILE 588 HB ILE 588 32.628 -8.566 3.459 411 HG12 ILE 588 HG12 ILE 588 34.551 -10.902 3.168 412 HG13 ILE 588 HG13 ILE 588 32.794 -11.135 3.279 413 HG21 ILE 588 HG21 ILE 588 34.818 -8.014 2.539 414 HG22 ILE 588 HG22 ILE 588 34.804 -7.459 4.212 415 HG23 ILE 588 HG23 ILE 588 35.628 -8.978 3.782 416 HD11 ILE 588 HD11 ILE 588 33.474 -11.187 0.958 417 HD12 ILE 588 HD12 ILE 588 32.515 -9.714 1.241 418 HD13 ILE 588 HD13 ILE 588 34.291 -9.629 1.097 419 H GLU 589 H GLU 589 33.109 -11.991 5.474 420 HA GLU 589 HA GLU 589 35.833 -12.399 6.636 421 HB2 GLU 589 HB2 GLU 589 33.868 -13.279 7.957 422 HB3 GLU 589 HB3 GLU 589 33.497 -14.331 6.589 423 HG2 GLU 589 HG2 GLU 589 35.891 -15.247 6.814 424 HG3 GLU 589 HG3 GLU 589 36.009 -14.334 8.310 425 H VAL 590 H VAL 590 37.317 -13.466 5.389 426 HA VAL 590 HA VAL 590 36.484 -15.294 3.242 427 HB VAL 590 HB VAL 590 36.516 -13.213 2.021 428 HG11 VAL 590 HG11 VAL 590 38.489 -11.863 1.680 429 HG12 VAL 590 HG12 VAL 590 38.097 -11.889 3.406 430 HG13 VAL 590 HG13 VAL 590 39.444 -12.871 2.786 431 HG21 VAL 590 HG21 VAL 590 38.979 -14.868 1.341 432 HG22 VAL 590 HG22 VAL 590 37.296 -15.286 0.920 433 HG23 VAL 590 HG23 VAL 590 38.049 -13.829 0.254 434 H ASN 591 H ASN 591 37.515 -17.029 3.342 435 HA ASN 591 HA ASN 591 38.987 -18.618 3.970 436 HB2 ASN 591 HB2 ASN 591 40.928 -16.574 2.831 437 HB3 ASN 591 HB3 ASN 591 41.207 -18.307 3.002 438 HD21 ASN 591 HD21 ASN 591 41.263 -16.747 0.530 439 HD22 ASN 591 HD22 ASN 591 40.045 -17.496 -0.497 440 H GLY 592 H GLY 592 38.267 -17.147 6.213 441 HA2 GLY 592 HA2 GLY 592 38.833 -17.425 8.478 442 HA3 GLY 592 HA3 GLY 592 40.510 -17.745 8.027 443 H LYS 593 H LYS 593 40.016 -15.008 6.364 444 HA LYS 593 HA LYS 593 41.014 -13.216 8.533 445 HB2 LYS 593 HB2 LYS 593 41.081 -13.059 5.501 446 HB3 LYS 593 HB3 LYS 593 41.569 -11.731 6.553 447 HG2 LYS 593 HG2 LYS 593 43.305 -13.160 7.589 448 HG3 LYS 593 HG3 LYS 593 42.831 -14.508 6.530 449 HD2 LYS 593 HD2 LYS 593 43.466 -13.184 4.535 450 HD3 LYS 593 HD3 LYS 593 43.812 -11.790 5.552 451 HE2 LYS 593 HE2 LYS 593 45.903 -12.808 4.977 452 HE3 LYS 593 HE3 LYS 593 45.622 -13.064 6.692 453 HZ1 LYS 593 HZ1 LYS 593 46.413 -15.077 5.562 454 HZ2 LYS 593 HZ2 LYS 593 45.131 -15.079 4.562 455 HZ3 LYS 593 HZ3 LYS 593 44.926 -15.342 6.164 456 H TYR 594 H TYR 594 40.229 -11.137 8.755 457 HA TYR 594 HA TYR 594 37.423 -10.650 7.830 458 HB2 TYR 594 HB2 TYR 594 38.738 -9.924 10.456 459 HB3 TYR 594 HB3 TYR 594 37.245 -9.192 9.881 460 HD1 TYR 594 HD1 TYR 594 35.253 -10.628 9.331 461 HD2 TYR 594 HD2 TYR 594 38.655 -12.097 11.533 462 HE1 TYR 594 HE1 TYR 594 33.888 -12.521 10.149 463 HE2 TYR 594 HE2 TYR 594 37.282 -14.010 12.365 464 HH TYR 594 HH TYR 594 34.002 -14.638 11.202 465 H PHE 595 H PHE 595 36.875 -8.771 7.052 466 HA PHE 595 HA PHE 595 38.801 -6.531 6.650 467 HB2 PHE 595 HB2 PHE 595 37.425 -8.251 4.557 468 HB3 PHE 595 HB3 PHE 595 38.094 -6.705 4.153 469 HD1 PHE 595 HD1 PHE 595 38.588 -9.579 3.061 470 HD2 PHE 595 HD2 PHE 595 40.801 -7.032 5.739 471 HE1 PHE 595 HE1 PHE 595 40.697 -10.695 2.375 472 HE2 PHE 595 HE2 PHE 595 42.909 -8.175 5.054 473 HZ PHE 595 HZ PHE 595 42.856 -9.992 3.374 474 H HIS 596 H HIS 596 37.736 -4.615 5.757 475 HA HIS 596 HA HIS 596 34.882 -4.275 6.462 476 HB2 HIS 596 HB2 HIS 596 36.968 -2.580 5.105 477 HB3 HIS 596 HB3 HIS 596 35.287 -2.152 4.923 478 HD2 HIS 596 HD2 HIS 596 34.115 -1.962 7.767 479 HE1 HIS 596 HE1 HIS 596 37.543 0.378 8.689 480 HE2 HIS 596 HE2 HIS 596 35.174 -0.199 9.384 481 H SER 597 H SER 597 33.218 -4.421 4.930 482 HA SER 597 HA SER 597 33.578 -6.071 2.614 483 HB2 SER 597 HB2 SER 597 31.233 -5.475 2.142 484 HB3 SER 597 HB3 SER 597 31.489 -5.981 3.820 485 HG SER 597 HG SER 597 30.239 -3.946 3.231 486 H THR 598 H THR 598 33.243 -2.525 2.919 487 HA THR 598 HA THR 598 33.446 -1.971 0.099 488 HB THR 598 HB THR 598 33.929 0.399 0.959 489 HG1 THR 598 HG1 THR 598 34.640 0.128 2.978 490 HG21 THR 598 HG21 THR 598 31.401 -0.948 1.995 491 HG22 THR 598 HG22 THR 598 31.649 -0.342 0.340 492 HG23 THR 598 HG23 THR 598 31.643 0.786 1.704 493 H CYS 599 H CYS 599 35.947 -2.195 2.650 494 HA CYS 599 HA CYS 599 38.124 -1.218 1.023 495 HB2 CYS 599 HB2 CYS 599 38.033 -3.034 3.452 496 HB3 CYS 599 HB3 CYS 599 39.505 -2.466 2.715 497 H TYR 600 H TYR 600 37.021 -4.555 1.823 498 HA TYR 600 HA TYR 600 38.810 -5.946 0.117 499 HB2 TYR 600 HB2 TYR 600 37.630 -7.099 1.819 500 HB3 TYR 600 HB3 TYR 600 36.071 -6.579 1.217 501 HD1 TYR 600 HD1 TYR 600 38.988 -8.805 0.587 502 HD2 TYR 600 HD2 TYR 600 35.007 -7.730 -0.668 503 HE1 TYR 600 HE1 TYR 600 38.887 -10.848 -0.833 504 HE2 TYR 600 HE2 TYR 600 34.898 -9.784 -2.082 505 HH TYR 600 HH TYR 600 37.639 -12.053 -2.339 506 H HIS 601 H HIS 601 35.550 -4.627 -0.594 507 HA HIS 601 HA HIS 601 35.238 -5.461 -3.256 508 HB2 HIS 601 HB2 HIS 601 33.460 -4.504 -1.986 509 HB3 HIS 601 HB3 HIS 601 34.345 -3.006 -1.730 510 HD2 HIS 601 HD2 HIS 601 33.458 -1.068 -3.074 511 HE1 HIS 601 HE1 HIS 601 31.752 -3.134 -6.375 512 HE2 HIS 601 HE2 HIS 601 32.052 -0.863 -5.286 513 H GLU 602 H GLU 602 36.885 -2.393 -2.190 514 HA GLU 602 HA GLU 602 37.671 -1.840 -4.954 515 HB2 GLU 602 HB2 GLU 602 38.756 0.080 -4.165 516 HB3 GLU 602 HB3 GLU 602 37.194 -0.040 -3.360 517 HG2 GLU 602 HG2 GLU 602 38.256 -0.720 -1.284 518 HG3 GLU 602 HG3 GLU 602 39.825 -0.882 -2.074 519 H THR 603 H THR 603 39.143 -3.633 -2.345 520 HA THR 603 HA THR 603 41.861 -3.612 -3.398 521 HB THR 603 HB THR 603 40.519 -5.363 -1.306 522 HG1 THR 603 HG1 THR 603 40.698 -3.257 -0.698 523 HG21 THR 603 HG21 THR 603 43.474 -5.106 -2.001 524 HG22 THR 603 HG22 THR 603 42.485 -6.589 -2.025 525 HG23 THR 603 HG23 THR 603 42.843 -5.798 -0.488 526 H SER 604 H SER 604 39.056 -5.695 -3.888 527 HA SER 604 HA SER 604 40.226 -8.058 -4.709 528 HB2 SER 604 HB2 SER 604 37.833 -7.755 -4.284 529 HB3 SER 604 HB3 SER 604 37.671 -6.815 -5.776 530 HG SER 604 HG SER 604 37.120 -8.988 -6.118 531 H GLN 605 H GLN 605 41.687 -8.438 -6.122 532 HA GLN 605 HA GLN 605 41.541 -7.734 -8.963 533 HB2 GLN 605 HB2 GLN 605 42.510 -5.673 -8.031 534 HB3 GLN 605 HB3 GLN 605 43.695 -6.604 -7.126 535 HG2 GLN 605 HG2 GLN 605 44.733 -5.552 -9.055 536 HG3 GLN 605 HG3 GLN 605 44.815 -7.295 -9.196 537 HE21 GLN 605 HE21 GLN 605 45.235 -6.843 -11.525 538 HE22 GLN 605 HE22 GLN 605 43.865 -6.494 -12.574 539 H ASN 606 H ASN 606 43.471 -9.068 -6.287 540 HA ASN 606 HA ASN 606 45.024 -10.931 -7.841 541 HB2 ASN 606 HB2 ASN 606 45.716 -11.729 -5.645 542 HB3 ASN 606 HB3 ASN 606 45.719 -9.968 -5.659 543 HD21 ASN 606 HD21 ASN 606 44.844 -12.597 -3.799 544 HD22 ASN 606 HD22 ASN 606 43.612 -11.805 -2.823 545 H SER 607 H SER 607 41.718 -11.035 -7.024 546 HA SER 607 HA SER 607 41.271 -13.692 -6.234 547 HB2 SER 607 HB2 SER 607 39.441 -11.883 -7.853 548 HB3 SER 607 HB3 SER 607 38.948 -13.276 -6.875 549 HG SER 607 HG SER 607 38.852 -11.050 -5.910 550 H SER 608 H SER 608 40.819 -15.585 -7.243 551 HA SER 608 HA SER 608 41.856 -16.186 -9.823 552 HB2 SER 608 HB2 SER 608 39.939 -17.821 -8.122 553 HB3 SER 608 HB3 SER 608 40.918 -18.415 -9.471 554 HG SER 608 HG SER 608 41.940 -18.762 -7.427 Start of MODEL 5 1 H1 GLY 533 H1 GLY 533 14.898 12.244 -19.598 2 H2 GLY 533 H2 GLY 533 14.293 10.851 -20.215 3 H3 GLY 533 H3 GLY 533 15.345 11.751 -21.100 4 HA2 GLY 533 HA2 GLY 533 16.482 9.828 -20.211 5 HA3 GLY 533 HA3 GLY 533 17.120 11.333 -19.525 6 H GLY 534 H GLY 534 17.890 9.846 -17.805 7 HA2 GLY 534 HA2 GLY 534 17.814 9.282 -15.579 8 HA3 GLY 534 HA3 GLY 534 16.226 10.038 -15.465 9 H SER 535 H SER 535 16.722 7.382 -17.728 10 HA SER 535 HA SER 535 14.608 5.801 -16.581 11 HB2 SER 535 HB2 SER 535 15.219 4.193 -18.365 12 HB3 SER 535 HB3 SER 535 15.004 5.842 -18.968 13 HG SER 535 HG SER 535 16.904 4.821 -19.782 14 H GLU 536 H GLU 536 17.980 5.876 -15.853 15 HA GLU 536 HA GLU 536 17.583 3.710 -13.881 16 HB2 GLU 536 HB2 GLU 536 18.635 2.558 -15.746 17 HB3 GLU 536 HB3 GLU 536 19.875 3.800 -15.883 18 HG2 GLU 536 HG2 GLU 536 20.698 1.736 -14.793 19 HG3 GLU 536 HG3 GLU 536 20.870 3.169 -13.794 20 H PHE 537 H PHE 537 17.836 4.747 -12.010 21 HA PHE 537 HA PHE 537 18.998 7.370 -11.912 22 HB2 PHE 537 HB2 PHE 537 18.248 7.316 -9.556 23 HB3 PHE 537 HB3 PHE 537 17.008 6.937 -10.726 24 HD1 PHE 537 HD1 PHE 537 19.186 5.496 -8.073 25 HD2 PHE 537 HD2 PHE 537 15.872 4.800 -10.744 26 HE1 PHE 537 HE1 PHE 537 18.619 3.423 -6.840 27 HE2 PHE 537 HE2 PHE 537 15.320 2.717 -9.514 28 HZ PHE 537 HZ PHE 537 16.695 2.026 -7.558 29 H SER 538 H SER 538 20.419 4.272 -11.142 30 HA SER 538 HA SER 538 22.723 5.622 -9.779 31 HB2 SER 538 HB2 SER 538 21.839 2.719 -9.765 32 HB3 SER 538 HB3 SER 538 23.295 3.349 -8.976 33 HG SER 538 HG SER 538 21.536 3.234 -7.536 34 H ASP 539 H ASP 539 21.998 4.538 -12.867 35 HA ASP 539 HA ASP 539 23.136 3.723 -14.650 36 HB2 ASP 539 HB2 ASP 539 24.556 5.783 -13.925 37 HB3 ASP 539 HB3 ASP 539 25.756 4.596 -13.427 38 H ARG 540 H ARG 540 25.518 2.262 -15.017 39 HA ARG 540 HA ARG 540 24.946 -0.281 -13.829 40 HB2 ARG 540 HB2 ARG 540 26.661 -1.172 -15.060 41 HB3 ARG 540 HB3 ARG 540 26.119 0.162 -16.047 42 HG2 ARG 540 HG2 ARG 540 28.628 0.069 -14.306 43 HG3 ARG 540 HG3 ARG 540 28.566 -0.117 -16.047 44 HD2 ARG 540 HD2 ARG 540 27.879 2.424 -14.517 45 HD3 ARG 540 HD3 ARG 540 29.381 2.115 -15.364 46 HE ARG 540 HE ARG 540 26.807 2.878 -16.530 47 HH11 ARG 540 HH11 ARG 540 29.922 1.502 -17.399 48 HH12 ARG 540 HH12 ARG 540 29.721 1.963 -19.074 49 HH21 ARG 540 HH21 ARG 540 26.617 3.394 -18.578 50 HH22 ARG 540 HH22 ARG 540 27.873 3.013 -19.735 51 H SER 541 H SER 541 26.643 2.323 -12.457 52 HA SER 541 HA SER 541 28.556 0.984 -10.822 53 HB2 SER 541 HB2 SER 541 27.145 3.630 -10.326 54 HB3 SER 541 HB3 SER 541 28.667 3.087 -9.594 55 HG SER 541 HG SER 541 28.994 4.455 -11.416 56 H ASN 542 H ASN 542 28.397 -0.073 -8.944 57 HA ASN 542 HA ASN 542 26.004 0.170 -7.204 58 HB2 ASN 542 HB2 ASN 542 27.035 -2.383 -8.496 59 HB3 ASN 542 HB3 ASN 542 26.107 -2.394 -7.006 60 HD21 ASN 542 HD21 ASN 542 25.879 -1.782 -10.505 61 HD22 ASN 542 HD22 ASN 542 24.125 -1.750 -10.490 62 H GLU 543 H GLU 543 26.665 0.621 -5.249 63 HA GLU 543 HA GLU 543 28.911 -0.805 -3.973 64 HB2 GLU 543 HB2 GLU 543 30.154 1.143 -3.353 65 HB3 GLU 543 HB3 GLU 543 30.020 1.070 -5.109 66 HG2 GLU 543 HG2 GLU 543 28.086 2.715 -4.927 67 HG3 GLU 543 HG3 GLU 543 28.481 2.894 -3.220 68 H LEU 544 H LEU 544 26.155 1.437 -3.639 69 HA LEU 544 HA LEU 544 26.236 1.609 -0.783 70 HB2 LEU 544 HB2 LEU 544 23.860 1.867 -2.662 71 HB3 LEU 544 HB3 LEU 544 23.913 2.418 -0.993 72 HG LEU 544 HG LEU 544 25.614 3.529 -3.272 73 HD11 LEU 544 HD11 LEU 544 23.224 4.109 -3.438 74 HD12 LEU 544 HD12 LEU 544 24.215 5.523 -3.037 75 HD13 LEU 544 HD13 LEU 544 23.256 4.728 -1.770 76 HD21 LEU 544 HD21 LEU 544 25.351 4.443 -0.371 77 HD22 LEU 544 HD22 LEU 544 26.202 5.321 -1.660 78 HD23 LEU 544 HD23 LEU 544 26.805 3.748 -1.125 79 H GLU 545 H GLU 545 24.841 -0.823 -2.913 80 HA GLU 545 HA GLU 545 23.260 -2.228 -0.987 81 HB2 GLU 545 HB2 GLU 545 23.121 -2.444 -3.484 82 HB3 GLU 545 HB3 GLU 545 24.704 -3.191 -3.487 83 HG2 GLU 545 HG2 GLU 545 23.228 -4.939 -3.765 84 HG3 GLU 545 HG3 GLU 545 23.741 -5.092 -2.101 85 H ILE 546 H ILE 546 26.726 -2.288 -1.623 86 HA ILE 546 HA ILE 546 27.407 -4.786 -0.415 87 HB ILE 546 HB ILE 546 29.051 -2.245 -0.606 88 HG12 ILE 546 HG12 ILE 546 28.191 -2.933 -2.863 89 HG13 ILE 546 HG13 ILE 546 29.938 -2.925 -2.694 90 HG21 ILE 546 HG21 ILE 546 30.992 -3.877 -0.678 91 HG22 ILE 546 HG22 ILE 546 30.152 -3.757 0.879 92 HG23 ILE 546 HG23 ILE 546 29.850 -5.137 -0.188 93 HD11 ILE 546 HD11 ILE 546 28.244 -5.451 -2.507 94 HD12 ILE 546 HD12 ILE 546 29.071 -4.872 -3.977 95 HD13 ILE 546 HD13 ILE 546 30.026 -5.336 -2.562 96 H ARG 547 H ARG 547 26.890 -1.568 0.964 97 HA ARG 547 HA ARG 547 27.993 -2.001 3.564 98 HB2 ARG 547 HB2 ARG 547 27.366 0.191 2.444 99 HB3 ARG 547 HB3 ARG 547 25.676 -0.170 2.800 100 HG2 ARG 547 HG2 ARG 547 26.218 -0.190 5.243 101 HG3 ARG 547 HG3 ARG 547 27.912 0.158 4.855 102 HD2 ARG 547 HD2 ARG 547 27.231 2.298 3.812 103 HD3 ARG 547 HD3 ARG 547 25.534 1.915 4.116 104 HE ARG 547 HE ARG 547 27.422 2.038 6.423 105 HH11 ARG 547 HH11 ARG 547 24.731 3.596 4.787 106 HH12 ARG 547 HH12 ARG 547 24.377 4.607 6.170 107 HH21 ARG 547 HH21 ARG 547 26.912 3.357 8.129 108 HH22 ARG 547 HH22 ARG 547 25.579 4.473 8.002 109 H GLY 548 H GLY 548 25.034 -3.194 2.203 110 HA2 GLY 548 HA2 GLY 548 23.590 -3.706 4.657 111 HA3 GLY 548 HA3 GLY 548 23.281 -4.410 3.064 112 H LYS 549 H LYS 549 26.363 -5.314 3.322 113 HA LYS 549 HA LYS 549 25.838 -7.992 4.356 114 HB2 LYS 549 HB2 LYS 549 28.437 -6.586 3.597 115 HB3 LYS 549 HB3 LYS 549 28.319 -8.285 4.007 116 HG2 LYS 549 HG2 LYS 549 26.927 -6.968 1.633 117 HG3 LYS 549 HG3 LYS 549 28.429 -7.887 1.568 118 HD2 LYS 549 HD2 LYS 549 27.199 -9.896 2.442 119 HD3 LYS 549 HD3 LYS 549 25.689 -8.959 2.344 120 HE2 LYS 549 HE2 LYS 549 26.057 -8.614 -0.078 121 HE3 LYS 549 HE3 LYS 549 27.557 -9.528 0.008 122 HZ1 LYS 549 HZ1 LYS 549 24.856 -10.618 0.569 123 HZ2 LYS 549 HZ2 LYS 549 26.241 -11.475 0.699 124 HZ3 LYS 549 HZ3 LYS 549 25.749 -10.928 -0.756 125 H TYR 550 H TYR 550 26.555 -8.986 6.191 126 HA TYR 550 HA TYR 550 28.286 -7.679 8.084 127 HB2 TYR 550 HB2 TYR 550 26.743 -7.827 10.024 128 HB3 TYR 550 HB3 TYR 550 26.223 -6.631 8.876 129 HD1 TYR 550 HD1 TYR 550 24.123 -6.897 7.639 130 HD2 TYR 550 HD2 TYR 550 25.497 -9.974 10.332 131 HE1 TYR 550 HE1 TYR 550 21.878 -7.970 7.568 132 HE2 TYR 550 HE2 TYR 550 23.252 -11.016 10.290 133 HH TYR 550 HH TYR 550 21.118 -10.907 9.443 134 H VAL 551 H VAL 551 28.743 -9.049 9.960 135 HA VAL 551 HA VAL 551 28.058 -11.934 9.654 136 HB VAL 551 HB VAL 551 30.383 -12.412 10.613 137 HG11 VAL 551 HG11 VAL 551 30.118 -11.499 7.710 138 HG12 VAL 551 HG12 VAL 551 31.313 -12.654 8.340 139 HG13 VAL 551 HG13 VAL 551 29.598 -13.075 8.348 140 HG21 VAL 551 HG21 VAL 551 31.051 -9.771 9.284 141 HG22 VAL 551 HG22 VAL 551 31.171 -10.149 11.020 142 HG23 VAL 551 HG23 VAL 551 32.213 -10.986 9.855 143 H VAL 552 H VAL 552 27.389 -12.913 11.489 144 HA VAL 552 HA VAL 552 26.724 -11.263 13.778 145 HB VAL 552 HB VAL 552 26.530 -14.237 13.266 146 HG11 VAL 552 HG11 VAL 552 25.478 -12.722 15.696 147 HG12 VAL 552 HG12 VAL 552 25.045 -14.378 15.241 148 HG13 VAL 552 HG13 VAL 552 26.705 -14.013 15.689 149 HG21 VAL 552 HG21 VAL 552 24.987 -12.766 11.958 150 HG22 VAL 552 HG22 VAL 552 24.110 -13.760 13.123 151 HG23 VAL 552 HG23 VAL 552 24.403 -12.048 13.476 152 H VAL 553 H VAL 553 27.755 -11.009 15.714 153 HA VAL 553 HA VAL 553 30.554 -11.854 15.850 154 HB VAL 553 HB VAL 553 29.033 -10.221 17.928 155 HG11 VAL 553 HG11 VAL 553 31.060 -11.271 18.817 156 HG12 VAL 553 HG12 VAL 553 31.973 -10.764 17.370 157 HG13 VAL 553 HG13 VAL 553 31.372 -9.560 18.519 158 HG21 VAL 553 HG21 VAL 553 30.393 -8.320 16.906 159 HG22 VAL 553 HG22 VAL 553 30.682 -9.378 15.517 160 HG23 VAL 553 HG23 VAL 553 29.024 -8.892 15.923 161 HA PRO 554 HA PRO 554 29.274 -15.367 18.445 162 HB2 PRO 554 HB2 PRO 554 31.564 -16.799 18.480 163 HB3 PRO 554 HB3 PRO 554 30.612 -16.613 16.978 164 HG2 PRO 554 HG2 PRO 554 33.022 -15.016 17.826 165 HG3 PRO 554 HG3 PRO 554 32.744 -15.838 16.258 166 HD2 PRO 554 HD2 PRO 554 32.204 -13.173 16.661 167 HD3 PRO 554 HD3 PRO 554 31.242 -14.177 15.545 168 H GLU 555 H GLU 555 29.669 -16.074 20.630 169 HA GLU 555 HA GLU 555 30.696 -14.065 22.434 170 HB2 GLU 555 HB2 GLU 555 29.936 -16.979 22.916 171 HB3 GLU 555 HB3 GLU 555 30.297 -15.792 24.176 172 HG2 GLU 555 HG2 GLU 555 28.421 -14.358 23.291 173 HG3 GLU 555 HG3 GLU 555 27.999 -15.649 22.168 174 H THR 556 H THR 556 32.314 -16.627 20.739 175 HA THR 556 HA THR 556 34.613 -16.872 22.506 176 HB THR 556 HB THR 556 35.637 -18.042 20.563 177 HG1 THR 556 HG1 THR 556 34.385 -18.324 18.742 178 HG21 THR 556 HG21 THR 556 32.785 -18.991 21.079 179 HG22 THR 556 HG22 THR 556 34.172 -19.271 22.164 180 HG23 THR 556 HG23 THR 556 34.169 -19.960 20.532 181 H SER 557 H SER 557 33.699 -14.557 20.022 182 HA SER 557 HA SER 557 36.427 -13.538 19.613 183 HB2 SER 557 HB2 SER 557 33.684 -12.656 18.688 184 HB3 SER 557 HB3 SER 557 35.143 -11.674 18.438 185 HG SER 557 HG SER 557 36.045 -13.361 17.279 186 H GLN 558 H GLN 558 37.425 -12.467 21.182 187 HA GLN 558 HA GLN 558 36.161 -11.464 23.473 188 HB2 GLN 558 HB2 GLN 558 38.302 -10.638 24.162 189 HB3 GLN 558 HB3 GLN 558 38.422 -12.248 23.463 190 HG2 GLN 558 HG2 GLN 558 39.267 -11.319 21.363 191 HG3 GLN 558 HG3 GLN 558 39.069 -9.665 21.987 192 HE21 GLN 558 HE21 GLN 558 40.539 -12.643 23.500 193 HE22 GLN 558 HE22 GLN 558 42.083 -11.861 23.793 194 H ASP 559 H ASP 559 35.491 -9.594 24.231 195 HA ASP 559 HA ASP 559 34.477 -7.576 24.269 196 HB2 ASP 559 HB2 ASP 559 37.001 -6.672 22.887 197 HB3 ASP 559 HB3 ASP 559 35.926 -5.673 23.852 198 H MET 560 H MET 560 34.029 -9.121 21.601 199 HA MET 560 HA MET 560 33.173 -8.877 19.580 200 HB2 MET 560 HB2 MET 560 31.718 -6.474 20.772 201 HB3 MET 560 HB3 MET 560 31.290 -7.347 19.295 202 HG2 MET 560 HG2 MET 560 31.158 -9.452 20.766 203 HG3 MET 560 HG3 MET 560 31.162 -8.348 22.142 204 HE1 MET 560 HE1 MET 560 27.493 -9.939 21.286 205 HE2 MET 560 HE2 MET 560 28.982 -10.592 20.576 206 HE3 MET 560 HE3 MET 560 28.932 -10.156 22.300 207 H ALA 561 H ALA 561 35.779 -7.660 19.827 208 HA ALA 561 HA ALA 561 35.562 -5.534 17.727 209 HB1 ALA 561 HB1 ALA 561 36.101 -4.630 19.927 210 HB2 ALA 561 HB2 ALA 561 37.506 -5.708 20.043 211 HB3 ALA 561 HB3 ALA 561 37.456 -4.441 18.793 212 H PHE 562 H PHE 562 36.937 -5.472 16.066 213 HA PHE 562 HA PHE 562 39.342 -7.075 15.877 214 HB2 PHE 562 HB2 PHE 562 37.271 -8.563 15.164 215 HB3 PHE 562 HB3 PHE 562 37.317 -7.616 13.699 216 HD1 PHE 562 HD1 PHE 562 39.167 -9.988 15.871 217 HD2 PHE 562 HD2 PHE 562 39.124 -7.989 12.064 218 HE1 PHE 562 HE1 PHE 562 40.977 -11.493 15.068 219 HE2 PHE 562 HE2 PHE 562 40.980 -9.436 11.278 220 HZ PHE 562 HZ PHE 562 41.889 -11.216 12.767 221 H LYS 563 H LYS 563 40.163 -6.687 13.342 222 HA LYS 563 HA LYS 563 39.707 -3.799 12.731 223 HB2 LYS 563 HB2 LYS 563 41.746 -4.368 14.218 224 HB3 LYS 563 HB3 LYS 563 42.465 -5.060 12.765 225 HG2 LYS 563 HG2 LYS 563 42.221 -2.813 11.645 226 HG3 LYS 563 HG3 LYS 563 41.542 -2.175 13.149 227 HD2 LYS 563 HD2 LYS 563 44.333 -3.272 12.702 228 HD3 LYS 563 HD3 LYS 563 43.905 -1.579 12.896 229 HE2 LYS 563 HE2 LYS 563 43.556 -3.708 15.065 230 HE3 LYS 563 HE3 LYS 563 44.950 -2.653 14.911 231 HZ1 LYS 563 HZ1 LYS 563 43.364 -1.756 16.489 232 HZ2 LYS 563 HZ2 LYS 563 42.172 -1.697 15.397 233 HZ3 LYS 563 HZ3 LYS 563 43.483 -0.746 15.222 234 H CYS 564 H CYS 564 40.120 -3.071 10.683 235 HA CYS 564 HA CYS 564 40.131 -4.974 8.414 236 HB2 CYS 564 HB2 CYS 564 38.489 -2.950 8.730 237 HB3 CYS 564 HB3 CYS 564 39.847 -1.937 8.450 238 HA PRO 565 HA PRO 565 44.593 -3.777 8.280 239 HB2 PRO 565 HB2 PRO 565 44.511 -5.885 6.120 240 HB3 PRO 565 HB3 PRO 565 45.779 -5.583 7.350 241 HG2 PRO 565 HG2 PRO 565 44.005 -7.601 7.703 242 HG3 PRO 565 HG3 PRO 565 44.427 -6.535 9.082 243 HD2 PRO 565 HD2 PRO 565 41.962 -6.451 7.328 244 HD3 PRO 565 HD3 PRO 565 42.120 -6.267 9.095 245 H ILE 566 H ILE 566 42.200 -3.740 5.710 246 HA ILE 566 HA ILE 566 43.850 -2.645 3.608 247 HB ILE 566 HB ILE 566 40.846 -2.590 3.996 248 HG12 ILE 566 HG12 ILE 566 42.525 -4.403 2.204 249 HG13 ILE 566 HG13 ILE 566 41.952 -4.877 3.799 250 HG21 ILE 566 HG21 ILE 566 41.480 -0.812 2.422 251 HG22 ILE 566 HG22 ILE 566 42.494 -1.946 1.505 252 HG23 ILE 566 HG23 ILE 566 40.732 -2.119 1.524 253 HD11 ILE 566 HD11 ILE 566 39.601 -4.626 3.054 254 HD12 ILE 566 HD12 ILE 566 40.172 -4.238 1.409 255 HD13 ILE 566 HD13 ILE 566 40.503 -5.823 2.105 256 H CYS 567 H CYS 567 41.459 -1.074 5.789 257 HA CYS 567 HA CYS 567 42.702 1.556 5.176 258 HB2 CYS 567 HB2 CYS 567 40.634 2.540 5.648 259 HB3 CYS 567 HB3 CYS 567 40.327 1.203 4.534 260 H LYS 568 H LYS 568 42.880 -0.731 7.495 261 HA LYS 568 HA LYS 568 43.611 -0.902 9.630 262 HB2 LYS 568 HB2 LYS 568 44.758 1.861 9.217 263 HB3 LYS 568 HB3 LYS 568 45.149 0.748 10.532 264 HG2 LYS 568 HG2 LYS 568 45.913 -0.941 8.846 265 HG3 LYS 568 HG3 LYS 568 45.637 0.247 7.562 266 HD2 LYS 568 HD2 LYS 568 47.278 1.772 8.624 267 HD3 LYS 568 HD3 LYS 568 47.546 0.585 9.915 268 HE2 LYS 568 HE2 LYS 568 48.297 -1.070 8.216 269 HE3 LYS 568 HE3 LYS 568 48.018 0.114 6.946 270 HZ1 LYS 568 HZ1 LYS 568 49.997 0.394 9.137 271 HZ2 LYS 568 HZ2 LYS 568 49.726 1.527 7.989 272 HZ3 LYS 568 HZ3 LYS 568 50.353 0.078 7.581 273 H GLU 569 H GLU 569 40.959 -0.541 9.505 274 HA GLU 569 HA GLU 569 40.358 1.386 11.749 275 HB2 GLU 569 HB2 GLU 569 38.675 0.487 9.411 276 HB3 GLU 569 HB3 GLU 569 37.969 1.149 10.897 277 HG2 GLU 569 HG2 GLU 569 39.433 3.145 10.669 278 HG3 GLU 569 HG3 GLU 569 39.905 2.603 9.064 279 H THR 570 H THR 570 39.322 0.755 13.557 280 HA THR 570 HA THR 570 39.055 -2.145 14.017 281 HB THR 570 HB THR 570 38.625 0.191 15.903 282 HG1 THR 570 HG1 THR 570 40.697 0.174 15.409 283 HG21 THR 570 HG21 THR 570 39.044 -2.776 16.493 284 HG22 THR 570 HG22 THR 570 37.528 -1.874 16.742 285 HG23 THR 570 HG23 THR 570 38.961 -1.481 17.697 286 H VAL 571 H VAL 571 37.211 -3.210 13.771 287 HA VAL 571 HA VAL 571 34.578 -1.839 13.632 288 HB VAL 571 HB VAL 571 33.703 -4.142 13.076 289 HG11 VAL 571 HG11 VAL 571 33.913 -2.380 11.434 290 HG12 VAL 571 HG12 VAL 571 35.604 -2.857 11.101 291 HG13 VAL 571 HG13 VAL 571 34.255 -3.963 10.728 292 HG21 VAL 571 HG21 VAL 571 36.611 -4.762 12.443 293 HG22 VAL 571 HG22 VAL 571 35.662 -5.498 13.768 294 HG23 VAL 571 HG23 VAL 571 35.195 -5.774 12.086 295 H THR 572 H THR 572 32.938 -2.277 15.079 296 HA THR 572 HA THR 572 33.496 -4.101 17.353 297 HB THR 572 HB THR 572 32.392 -2.594 18.906 298 HG1 THR 572 HG1 THR 572 32.655 -0.635 16.887 299 HG21 THR 572 HG21 THR 572 34.855 -2.605 18.771 300 HG22 THR 572 HG22 THR 572 34.214 -1.014 19.235 301 HG23 THR 572 HG23 THR 572 34.806 -1.281 17.585 302 H GLY 573 H GLY 573 31.768 -5.249 18.109 303 HA2 GLY 573 HA2 GLY 573 29.650 -5.786 16.288 304 HA3 GLY 573 HA3 GLY 573 29.808 -6.455 17.907 305 H VAL 574 H VAL 574 27.526 -5.244 16.267 306 HA VAL 574 HA VAL 574 26.410 -3.592 18.470 307 HB VAL 574 HB VAL 574 25.266 -2.177 16.859 308 HG11 VAL 574 HG11 VAL 574 28.231 -2.200 16.192 309 HG12 VAL 574 HG12 VAL 574 27.115 -0.838 16.075 310 HG13 VAL 574 HG13 VAL 574 27.512 -1.501 17.668 311 HG21 VAL 574 HG21 VAL 574 25.002 -3.612 14.902 312 HG22 VAL 574 HG22 VAL 574 25.819 -2.099 14.470 313 HG23 VAL 574 HG23 VAL 574 26.765 -3.581 14.625 314 H TYR 575 H TYR 575 24.271 -3.903 19.065 315 HA TYR 575 HA TYR 575 23.129 -6.432 18.211 316 HB2 TYR 575 HB2 TYR 575 23.009 -5.644 20.527 317 HB3 TYR 575 HB3 TYR 575 22.009 -4.282 20.028 318 HD1 TYR 575 HD1 TYR 575 19.641 -4.535 19.848 319 HD2 TYR 575 HD2 TYR 575 22.162 -8.022 20.079 320 HE1 TYR 575 HE1 TYR 575 17.624 -5.957 20.159 321 HE2 TYR 575 HE2 TYR 575 20.134 -9.456 20.352 322 HH TYR 575 HH TYR 575 16.847 -8.073 20.510 323 H ASP 576 H ASP 576 22.063 -6.706 16.348 324 HA ASP 576 HA ASP 576 20.535 -4.550 15.066 325 HB2 ASP 576 HB2 ASP 576 21.931 -6.163 13.779 326 HB3 ASP 576 HB3 ASP 576 20.828 -7.457 14.239 327 H GLU 577 H GLU 577 18.490 -4.154 15.686 328 HA GLU 577 HA GLU 577 17.116 -5.797 17.591 329 HB2 GLU 577 HB2 GLU 577 15.968 -3.475 15.984 330 HB3 GLU 577 HB3 GLU 577 15.402 -4.129 17.507 331 HG2 GLU 577 HG2 GLU 577 16.532 -2.444 18.423 332 HG3 GLU 577 HG3 GLU 577 17.908 -3.520 18.287 333 H GLU 578 H GLU 578 16.860 -5.627 14.077 334 HA GLU 578 HA GLU 578 14.225 -6.917 13.976 335 HB2 GLU 578 HB2 GLU 578 14.948 -5.178 12.349 336 HB3 GLU 578 HB3 GLU 578 16.212 -6.246 11.773 337 HG2 GLU 578 HG2 GLU 578 14.305 -6.303 10.247 338 HG3 GLU 578 HG3 GLU 578 14.566 -7.868 10.983 339 H SER 579 H SER 579 17.606 -7.851 13.296 340 HA SER 579 HA SER 579 17.037 -10.649 12.753 341 HB2 SER 579 HB2 SER 579 19.026 -9.422 11.885 342 HB3 SER 579 HB3 SER 579 19.611 -9.230 13.546 343 HG SER 579 HG SER 579 19.345 -11.621 12.070 344 H GLY 580 H GLY 580 17.983 -8.766 15.639 345 HA2 GLY 580 HA2 GLY 580 17.708 -9.273 17.875 346 HA3 GLY 580 HA3 GLY 580 17.163 -10.918 17.481 347 H GLU 581 H GLU 581 20.200 -9.335 16.441 348 HA GLU 581 HA GLU 581 21.860 -11.183 18.069 349 HB2 GLU 581 HB2 GLU 581 21.824 -11.089 15.026 350 HB3 GLU 581 HB3 GLU 581 23.122 -11.817 15.949 351 HG2 GLU 581 HG2 GLU 581 20.226 -12.750 15.936 352 HG3 GLU 581 HG3 GLU 581 21.547 -13.469 15.040 353 H TRP 582 H TRP 582 24.027 -10.601 18.245 354 HA TRP 582 HA TRP 582 24.668 -7.795 17.664 355 HB2 TRP 582 HB2 TRP 582 26.354 -9.984 18.916 356 HB3 TRP 582 HB3 TRP 582 26.812 -8.293 18.722 357 HD1 TRP 582 HD1 TRP 582 24.423 -10.459 20.778 358 HE1 TRP 582 HE1 TRP 582 23.649 -9.136 22.832 359 HE3 TRP 582 HE3 TRP 582 26.661 -5.972 19.747 360 HZ2 TRP 582 HZ2 TRP 582 23.914 -6.458 23.876 361 HZ3 TRP 582 HZ3 TRP 582 26.376 -4.049 21.300 362 HH2 TRP 582 HH2 TRP 582 24.995 -4.283 23.344 363 H VAL 583 H VAL 583 25.886 -7.086 16.008 364 HA VAL 583 HA VAL 583 27.053 -9.027 14.055 365 HB VAL 583 HB VAL 583 26.025 -7.551 12.287 366 HG11 VAL 583 HG11 VAL 583 24.058 -9.074 14.066 367 HG12 VAL 583 HG12 VAL 583 23.818 -8.656 12.364 368 HG13 VAL 583 HG13 VAL 583 25.104 -9.794 12.815 369 HG21 VAL 583 HG21 VAL 583 25.388 -5.622 13.735 370 HG22 VAL 583 HG22 VAL 583 24.117 -6.242 12.662 371 HG23 VAL 583 HG23 VAL 583 24.080 -6.631 14.393 372 H TRP 584 H TRP 584 28.660 -8.395 12.792 373 HA TRP 584 HA TRP 584 30.010 -5.764 13.234 374 HB2 TRP 584 HB2 TRP 584 30.829 -8.493 12.269 375 HB3 TRP 584 HB3 TRP 584 31.681 -7.108 11.632 376 HD1 TRP 584 HD1 TRP 584 32.044 -5.400 14.267 377 HE1 TRP 584 HE1 TRP 584 33.590 -6.210 16.163 378 HE3 TRP 584 HE3 TRP 584 32.402 -10.356 13.000 379 HZ2 TRP 584 HZ2 TRP 584 35.002 -8.596 16.867 380 HZ3 TRP 584 HZ3 TRP 584 33.897 -11.858 14.285 381 HH2 TRP 584 HH2 TRP 584 35.175 -11.002 16.216 382 H LYS 585 H LYS 585 28.782 -4.389 12.099 383 HA LYS 585 HA LYS 585 27.529 -5.067 9.565 384 HB2 LYS 585 HB2 LYS 585 27.665 -2.531 11.222 385 HB3 LYS 585 HB3 LYS 585 26.894 -2.567 9.638 386 HG2 LYS 585 HG2 LYS 585 25.458 -4.484 10.414 387 HG3 LYS 585 HG3 LYS 585 26.135 -4.272 12.036 388 HD2 LYS 585 HD2 LYS 585 25.286 -1.953 12.096 389 HD3 LYS 585 HD3 LYS 585 24.614 -2.122 10.468 390 HE2 LYS 585 HE2 LYS 585 23.814 -3.914 12.802 391 HE3 LYS 585 HE3 LYS 585 23.006 -2.390 12.452 392 HZ1 LYS 585 HZ1 LYS 585 23.160 -4.666 10.547 393 HZ2 LYS 585 HZ2 LYS 585 22.391 -3.240 10.285 394 HZ3 LYS 585 HZ3 LYS 585 21.854 -4.251 11.421 395 H ASN 586 H ASN 586 27.891 -4.338 7.539 396 HA ASN 586 HA ASN 586 29.136 -4.180 5.717 397 HB2 ASN 586 HB2 ASN 586 28.957 -1.772 6.291 398 HB3 ASN 586 HB3 ASN 586 30.521 -1.871 7.104 399 HD21 ASN 586 HD21 ASN 586 31.388 -0.275 5.656 400 HD22 ASN 586 HD22 ASN 586 31.805 -0.732 4.008 401 H THR 587 H THR 587 30.014 -6.215 7.475 402 HA THR 587 HA THR 587 32.982 -6.262 7.018 403 HB THR 587 HB THR 587 31.457 -7.518 9.299 404 HG1 THR 587 HG1 THR 587 31.750 -5.240 9.408 405 HG21 THR 587 HG21 THR 587 34.453 -7.420 8.780 406 HG22 THR 587 HG22 THR 587 33.434 -8.876 8.796 407 HG23 THR 587 HG23 THR 587 33.671 -7.962 10.286 408 H ILE 588 H ILE 588 33.961 -8.090 6.369 409 HA ILE 588 HA ILE 588 32.408 -10.434 5.459 410 HB ILE 588 HB ILE 588 32.526 -9.001 3.543 411 HG12 ILE 588 HG12 ILE 588 34.760 -11.037 3.161 412 HG13 ILE 588 HG13 ILE 588 33.052 -11.499 3.283 413 HG21 ILE 588 HG21 ILE 588 34.651 -8.177 2.562 414 HG22 ILE 588 HG22 ILE 588 34.441 -7.541 4.191 415 HG23 ILE 588 HG23 ILE 588 35.549 -8.906 3.894 416 HD11 ILE 588 HD11 ILE 588 34.334 -9.793 1.108 417 HD12 ILE 588 HD12 ILE 588 33.669 -11.417 0.954 418 HD13 ILE 588 HD13 ILE 588 32.579 -10.055 1.271 419 H GLU 589 H GLU 589 33.554 -12.369 5.449 420 HA GLU 589 HA GLU 589 36.324 -12.364 6.581 421 HB2 GLU 589 HB2 GLU 589 34.550 -13.547 7.907 422 HB3 GLU 589 HB3 GLU 589 34.333 -14.637 6.532 423 HG2 GLU 589 HG2 GLU 589 36.733 -15.301 6.707 424 HG3 GLU 589 HG3 GLU 589 36.934 -14.213 8.074 425 H VAL 590 H VAL 590 37.919 -12.903 5.209 426 HA VAL 590 HA VAL 590 37.618 -14.874 3.104 427 HB VAL 590 HB VAL 590 36.638 -12.971 1.951 428 HG11 VAL 590 HG11 VAL 590 37.710 -11.112 3.185 429 HG12 VAL 590 HG12 VAL 590 39.255 -11.486 2.377 430 HG13 VAL 590 HG13 VAL 590 37.845 -10.948 1.435 431 HG21 VAL 590 HG21 VAL 590 39.426 -13.428 0.823 432 HG22 VAL 590 HG22 VAL 590 38.060 -14.568 0.671 433 HG23 VAL 590 HG23 VAL 590 37.957 -12.958 -0.045 434 H ASN 591 H ASN 591 39.619 -15.646 2.347 435 HA ASN 591 HA ASN 591 41.746 -16.353 2.694 436 HB2 ASN 591 HB2 ASN 591 41.959 -14.234 1.347 437 HB3 ASN 591 HB3 ASN 591 42.346 -13.383 2.841 438 HD21 ASN 591 HD21 ASN 591 44.319 -12.831 1.576 439 HD22 ASN 591 HD22 ASN 591 45.640 -13.991 1.571 440 H GLY 592 H GLY 592 40.258 -16.501 5.003 441 HA2 GLY 592 HA2 GLY 592 40.420 -16.975 7.223 442 HA3 GLY 592 HA3 GLY 592 42.183 -16.946 7.037 443 H LYS 593 H LYS 593 40.571 -13.964 6.302 444 HA LYS 593 HA LYS 593 41.038 -12.791 9.009 445 HB2 LYS 593 HB2 LYS 593 42.055 -11.796 6.315 446 HB3 LYS 593 HB3 LYS 593 42.022 -10.804 7.777 447 HG2 LYS 593 HG2 LYS 593 43.522 -12.319 8.940 448 HG3 LYS 593 HG3 LYS 593 43.551 -13.434 7.574 449 HD2 LYS 593 HD2 LYS 593 44.539 -10.556 7.483 450 HD3 LYS 593 HD3 LYS 593 45.570 -11.954 7.730 451 HE2 LYS 593 HE2 LYS 593 43.875 -11.461 5.240 452 HE3 LYS 593 HE3 LYS 593 45.587 -11.101 5.394 453 HZ1 LYS 593 HZ1 LYS 593 44.380 -13.803 5.493 454 HZ2 LYS 593 HZ2 LYS 593 45.953 -13.503 5.826 455 HZ3 LYS 593 HZ3 LYS 593 45.350 -13.206 4.338 456 H TYR 594 H TYR 594 39.974 -10.749 9.328 457 HA TYR 594 HA TYR 594 37.437 -10.493 7.793 458 HB2 TYR 594 HB2 TYR 594 38.338 -9.262 10.400 459 HB3 TYR 594 HB3 TYR 594 36.848 -8.833 9.564 460 HD1 TYR 594 HD1 TYR 594 35.211 -10.727 8.933 461 HD2 TYR 594 HD2 TYR 594 38.283 -11.132 11.929 462 HE1 TYR 594 HE1 TYR 594 34.022 -12.674 9.880 463 HE2 TYR 594 HE2 TYR 594 37.073 -13.070 12.907 464 HH TYR 594 HH TYR 594 34.030 -14.312 11.497 465 H PHE 595 H PHE 595 36.787 -8.668 6.876 466 HA PHE 595 HA PHE 595 38.519 -6.292 6.505 467 HB2 PHE 595 HB2 PHE 595 37.491 -8.156 4.325 468 HB3 PHE 595 HB3 PHE 595 37.869 -6.505 3.974 469 HD1 PHE 595 HD1 PHE 595 40.526 -6.486 5.774 470 HD2 PHE 595 HD2 PHE 595 38.947 -9.014 2.676 471 HE1 PHE 595 HE1 PHE 595 42.832 -7.182 5.159 472 HE2 PHE 595 HE2 PHE 595 41.252 -9.701 2.056 473 HZ PHE 595 HZ PHE 595 43.193 -8.793 3.310 474 H HIS 596 H HIS 596 37.237 -4.531 5.407 475 HA HIS 596 HA HIS 596 34.363 -4.568 6.148 476 HB2 HIS 596 HB2 HIS 596 36.168 -2.578 4.796 477 HB3 HIS 596 HB3 HIS 596 34.446 -2.339 4.777 478 HD2 HIS 596 HD2 HIS 596 33.510 -2.432 7.724 479 HE1 HIS 596 HE1 HIS 596 36.887 0.002 8.629 480 HE2 HIS 596 HE2 HIS 596 34.614 -0.772 9.437 481 H SER 597 H SER 597 32.698 -4.767 4.599 482 HA SER 597 HA SER 597 33.355 -6.389 2.311 483 HB2 SER 597 HB2 SER 597 31.238 -6.499 3.674 484 HB3 SER 597 HB3 SER 597 30.702 -5.031 2.844 485 HG SER 597 HG SER 597 31.302 -7.577 1.736 486 H THR 598 H THR 598 32.385 -2.927 2.552 487 HA THR 598 HA THR 598 32.542 -2.378 -0.259 488 HB THR 598 HB THR 598 32.914 0.009 0.510 489 HG1 THR 598 HG1 THR 598 33.808 -0.130 2.451 490 HG21 THR 598 HG21 THR 598 30.684 0.277 1.539 491 HG22 THR 598 HG22 THR 598 30.547 -1.488 1.697 492 HG23 THR 598 HG23 THR 598 30.656 -0.729 0.087 493 H CYS 599 H CYS 599 35.085 -2.165 2.300 494 HA CYS 599 HA CYS 599 37.191 -1.147 0.707 495 HB2 CYS 599 HB2 CYS 599 37.148 -3.023 3.098 496 HB3 CYS 599 HB3 CYS 599 38.629 -2.422 2.434 497 H TYR 600 H TYR 600 36.472 -4.591 1.479 498 HA TYR 600 HA TYR 600 38.414 -5.729 -0.256 499 HB2 TYR 600 HB2 TYR 600 37.484 -7.015 1.506 500 HB3 TYR 600 HB3 TYR 600 35.843 -6.786 0.925 501 HD1 TYR 600 HD1 TYR 600 39.131 -8.374 0.090 502 HD2 TYR 600 HD2 TYR 600 34.905 -8.242 -0.762 503 HE1 TYR 600 HE1 TYR 600 39.357 -10.388 -1.353 504 HE2 TYR 600 HE2 TYR 600 35.132 -10.265 -2.196 505 HH TYR 600 HH TYR 600 38.280 -11.858 -2.751 506 H HIS 601 H HIS 601 34.918 -5.080 -0.911 507 HA HIS 601 HA HIS 601 34.797 -6.251 -3.457 508 HB2 HIS 601 HB2 HIS 601 32.801 -5.671 -2.253 509 HB3 HIS 601 HB3 HIS 601 33.248 -3.970 -2.192 510 HD2 HIS 601 HD2 HIS 601 32.017 -6.619 -4.755 511 HE1 HIS 601 HE1 HIS 601 31.141 -2.769 -6.361 512 HE2 HIS 601 HE2 HIS 601 30.853 -5.275 -6.700 513 H GLU 602 H GLU 602 35.538 -2.791 -2.746 514 HA GLU 602 HA GLU 602 35.923 -2.210 -5.566 515 HB2 GLU 602 HB2 GLU 602 35.092 -0.565 -3.905 516 HB3 GLU 602 HB3 GLU 602 36.643 -0.613 -3.082 517 HG2 GLU 602 HG2 GLU 602 36.409 1.382 -4.476 518 HG3 GLU 602 HG3 GLU 602 37.762 0.392 -4.982 519 H THR 603 H THR 603 38.104 -3.214 -2.968 520 HA THR 603 HA THR 603 40.538 -2.427 -4.401 521 HB THR 603 HB THR 603 40.152 -4.080 -1.882 522 HG1 THR 603 HG1 THR 603 39.541 -2.016 -1.566 523 HG21 THR 603 HG21 THR 603 42.372 -4.589 -2.754 524 HG22 THR 603 HG22 THR 603 42.520 -3.483 -1.383 525 HG23 THR 603 HG23 THR 603 42.694 -2.860 -3.041 526 H SER 604 H SER 604 38.713 -5.457 -4.019 527 HA SER 604 HA SER 604 40.763 -7.254 -4.744 528 HB2 SER 604 HB2 SER 604 38.685 -7.926 -3.626 529 HB3 SER 604 HB3 SER 604 37.761 -7.538 -5.085 530 HG SER 604 HG SER 604 39.656 -9.599 -4.684 531 H GLN 605 H GLN 605 41.666 -7.876 -6.578 532 HA GLN 605 HA GLN 605 40.421 -7.254 -9.223 533 HB2 GLN 605 HB2 GLN 605 42.435 -5.924 -8.867 534 HB3 GLN 605 HB3 GLN 605 43.362 -7.376 -8.476 535 HG2 GLN 605 HG2 GLN 605 43.115 -8.221 -10.754 536 HG3 GLN 605 HG3 GLN 605 41.979 -6.925 -11.156 537 HE21 GLN 605 HE21 GLN 605 45.237 -6.825 -9.512 538 HE22 GLN 605 HE22 GLN 605 45.908 -5.706 -10.692 539 H ASN 606 H ASN 606 40.174 -8.944 -10.625 540 HA ASN 606 HA ASN 606 41.095 -11.661 -9.849 541 HB2 ASN 606 HB2 ASN 606 38.199 -10.861 -10.355 542 HB3 ASN 606 HB3 ASN 606 38.778 -12.506 -10.116 543 HD21 ASN 606 HD21 ASN 606 37.892 -9.524 -8.502 544 HD22 ASN 606 HD22 ASN 606 38.278 -10.071 -6.878 545 H SER 607 H SER 607 40.951 -13.242 -11.485 546 HA SER 607 HA SER 607 41.676 -12.288 -14.119 547 HB2 SER 607 HB2 SER 607 42.658 -14.294 -12.974 548 HB3 SER 607 HB3 SER 607 41.113 -15.122 -13.186 549 HG SER 607 HG SER 607 42.982 -14.300 -15.134 550 H SER 608 H SER 608 40.667 -12.755 -16.114 551 HA SER 608 HA SER 608 37.899 -12.146 -16.287 552 HB2 SER 608 HB2 SER 608 39.749 -13.272 -18.420 553 HB3 SER 608 HB3 SER 608 38.194 -12.481 -18.701 554 HG SER 608 HG SER 608 39.969 -11.009 -18.890 Start of MODEL 6 1 H1 GLY 533 H1 GLY 533 22.563 15.177 -13.483 2 H2 GLY 533 H2 GLY 533 20.950 15.390 -13.721 3 H3 GLY 533 H3 GLY 533 21.502 14.700 -12.333 4 HA2 GLY 533 HA2 GLY 533 22.573 16.732 -11.653 5 HA3 GLY 533 HA3 GLY 533 22.005 17.487 -13.154 6 H GLY 534 H GLY 534 21.323 16.973 -9.910 7 HA2 GLY 534 HA2 GLY 534 19.646 18.318 -8.825 8 HA3 GLY 534 HA3 GLY 534 18.554 18.084 -10.182 9 H SER 535 H SER 535 20.224 15.239 -9.071 10 HA SER 535 HA SER 535 17.966 14.380 -7.313 11 HB2 SER 535 HB2 SER 535 17.522 13.682 -9.663 12 HB3 SER 535 HB3 SER 535 19.049 12.798 -9.666 13 HG SER 535 HG SER 535 16.732 12.287 -8.118 14 H GLU 536 H GLU 536 21.334 14.378 -7.966 15 HA GLU 536 HA GLU 536 22.177 11.963 -6.813 16 HB2 GLU 536 HB2 GLU 536 23.705 14.560 -7.290 17 HB3 GLU 536 HB3 GLU 536 24.417 12.996 -6.933 18 HG2 GLU 536 HG2 GLU 536 24.640 12.876 -9.141 19 HG3 GLU 536 HG3 GLU 536 23.041 12.173 -9.039 20 H PHE 537 H PHE 537 20.688 14.152 -4.919 21 HA PHE 537 HA PHE 537 22.419 14.151 -2.568 22 HB2 PHE 537 HB2 PHE 537 20.426 14.890 -1.381 23 HB3 PHE 537 HB3 PHE 537 20.704 15.839 -2.824 24 HD1 PHE 537 HD1 PHE 537 19.091 15.875 -4.650 25 HD2 PHE 537 HD2 PHE 537 18.515 13.266 -1.264 26 HE1 PHE 537 HE1 PHE 537 16.755 15.448 -5.369 27 HE2 PHE 537 HE2 PHE 537 16.183 12.840 -1.995 28 HZ PHE 537 HZ PHE 537 15.302 13.924 -4.050 29 H SER 538 H SER 538 20.425 11.766 -4.088 30 HA SER 538 HA SER 538 21.356 9.762 -2.199 31 HB2 SER 538 HB2 SER 538 19.199 8.733 -1.781 32 HB3 SER 538 HB3 SER 538 19.212 10.381 -1.148 33 HG SER 538 HG SER 538 18.043 11.036 -2.966 34 H ASP 539 H ASP 539 21.119 7.568 -3.076 35 HA ASP 539 HA ASP 539 20.577 7.375 -5.989 36 HB2 ASP 539 HB2 ASP 539 23.221 6.614 -4.701 37 HB3 ASP 539 HB3 ASP 539 22.750 6.228 -6.345 38 H ARG 540 H ARG 540 20.341 5.308 -6.804 39 HA ARG 540 HA ARG 540 19.639 3.139 -4.894 40 HB2 ARG 540 HB2 ARG 540 19.284 3.183 -7.910 41 HB3 ARG 540 HB3 ARG 540 18.559 2.064 -6.763 42 HG2 ARG 540 HG2 ARG 540 17.896 5.012 -7.123 43 HG3 ARG 540 HG3 ARG 540 16.893 3.623 -7.532 44 HD2 ARG 540 HD2 ARG 540 16.715 3.035 -5.130 45 HD3 ARG 540 HD3 ARG 540 17.714 4.442 -4.717 46 HE ARG 540 HE ARG 540 15.458 5.244 -6.312 47 HH11 ARG 540 HH11 ARG 540 16.205 4.311 -3.013 48 HH12 ARG 540 HH12 ARG 540 14.867 5.230 -2.358 49 HH21 ARG 540 HH21 ARG 540 13.779 6.394 -5.411 50 HH22 ARG 540 HH22 ARG 540 13.542 6.375 -3.683 51 H SER 541 H SER 541 22.423 3.980 -5.352 52 HA SER 541 HA SER 541 23.757 2.105 -7.113 53 HB2 SER 541 HB2 SER 541 25.779 3.231 -6.356 54 HB3 SER 541 HB3 SER 541 24.530 4.427 -6.716 55 HG SER 541 HG SER 541 25.550 4.856 -4.719 56 H ASN 542 H ASN 542 25.814 1.027 -6.214 57 HA ASN 542 HA ASN 542 25.069 -1.145 -4.537 58 HB2 ASN 542 HB2 ASN 542 27.863 -0.216 -5.336 59 HB3 ASN 542 HB3 ASN 542 27.423 -1.815 -4.741 60 HD21 ASN 542 HD21 ASN 542 25.725 -3.050 -6.124 61 HD22 ASN 542 HD22 ASN 542 25.875 -2.802 -7.852 62 H GLU 543 H GLU 543 25.980 2.015 -3.497 63 HA GLU 543 HA GLU 543 27.526 1.525 -1.194 64 HB2 GLU 543 HB2 GLU 543 27.082 3.771 -2.015 65 HB3 GLU 543 HB3 GLU 543 25.358 3.589 -1.735 66 HG2 GLU 543 HG2 GLU 543 26.417 4.995 -0.022 67 HG3 GLU 543 HG3 GLU 543 25.635 3.584 0.656 68 H LEU 544 H LEU 544 23.924 1.608 -1.372 69 HA LEU 544 HA LEU 544 23.519 0.836 1.370 70 HB2 LEU 544 HB2 LEU 544 21.688 0.501 -1.044 71 HB3 LEU 544 HB3 LEU 544 21.200 0.400 0.643 72 HG LEU 544 HG LEU 544 22.248 2.907 -0.756 73 HD11 LEU 544 HD11 LEU 544 19.941 3.704 -0.531 74 HD12 LEU 544 HD12 LEU 544 19.456 2.161 0.211 75 HD13 LEU 544 HD13 LEU 544 19.990 2.213 -1.482 76 HD21 LEU 544 HD21 LEU 544 21.157 2.530 2.070 77 HD22 LEU 544 HD22 LEU 544 21.491 4.093 1.288 78 HD23 LEU 544 HD23 LEU 544 22.820 2.984 1.630 79 H GLU 545 H GLU 545 23.994 -1.067 -1.566 80 HA GLU 545 HA GLU 545 23.050 -3.561 -0.432 81 HB2 GLU 545 HB2 GLU 545 22.949 -3.038 -2.847 82 HB3 GLU 545 HB3 GLU 545 24.712 -2.962 -2.922 83 HG2 GLU 545 HG2 GLU 545 24.877 -5.346 -2.406 84 HG3 GLU 545 HG3 GLU 545 23.138 -5.437 -2.130 85 H ILE 546 H ILE 546 26.285 -2.178 -0.948 86 HA ILE 546 HA ILE 546 27.711 -4.405 0.270 87 HB ILE 546 HB ILE 546 28.536 -1.533 -0.303 88 HG12 ILE 546 HG12 ILE 546 27.985 -2.839 -2.359 89 HG13 ILE 546 HG13 ILE 546 29.662 -2.346 -2.249 90 HG21 ILE 546 HG21 ILE 546 30.868 -2.388 -0.100 91 HG22 ILE 546 HG22 ILE 546 29.983 -2.409 1.431 92 HG23 ILE 546 HG23 ILE 546 30.226 -3.919 0.532 93 HD11 ILE 546 HD11 ILE 546 30.336 -4.646 -1.658 94 HD12 ILE 546 HD12 ILE 546 28.624 -5.155 -1.668 95 HD13 ILE 546 HD13 ILE 546 29.406 -4.607 -3.159 96 H ARG 547 H ARG 547 26.187 -1.461 1.484 97 HA ARG 547 HA ARG 547 27.311 -1.555 4.156 98 HB2 ARG 547 HB2 ARG 547 26.258 0.458 3.013 99 HB3 ARG 547 HB3 ARG 547 24.692 -0.307 3.214 100 HG2 ARG 547 HG2 ARG 547 24.973 1.352 4.921 101 HG3 ARG 547 HG3 ARG 547 24.985 -0.225 5.696 102 HD2 ARG 547 HD2 ARG 547 26.669 1.289 6.651 103 HD3 ARG 547 HD3 ARG 547 27.438 -0.120 5.906 104 HE ARG 547 HE ARG 547 27.355 1.890 3.923 105 HH11 ARG 547 HH11 ARG 547 28.939 1.655 7.057 106 HH12 ARG 547 HH12 ARG 547 30.229 2.723 6.542 107 HH21 ARG 547 HH21 ARG 547 28.918 3.196 3.401 108 HH22 ARG 547 HH22 ARG 547 30.239 3.571 4.487 109 H GLY 548 H GLY 548 24.436 -2.954 2.656 110 HA2 GLY 548 HA2 GLY 548 23.232 -4.061 4.998 111 HA3 GLY 548 HA3 GLY 548 22.916 -4.512 3.323 112 H LYS 549 H LYS 549 26.146 -5.120 3.509 113 HA LYS 549 HA LYS 549 25.839 -7.985 4.125 114 HB2 LYS 549 HB2 LYS 549 28.381 -6.408 3.568 115 HB3 LYS 549 HB3 LYS 549 28.190 -8.156 3.548 116 HG2 LYS 549 HG2 LYS 549 26.984 -6.150 1.592 117 HG3 LYS 549 HG3 LYS 549 28.287 -7.292 1.284 118 HD2 LYS 549 HD2 LYS 549 26.706 -9.183 1.576 119 HD3 LYS 549 HD3 LYS 549 25.385 -8.022 1.879 120 HE2 LYS 549 HE2 LYS 549 25.766 -6.987 -0.330 121 HE3 LYS 549 HE3 LYS 549 27.055 -8.140 -0.650 122 HZ1 LYS 549 HZ1 LYS 549 24.205 -8.848 -0.222 123 HZ2 LYS 549 HZ2 LYS 549 25.398 -9.936 -0.462 124 HZ3 LYS 549 HZ3 LYS 549 24.989 -8.901 -1.652 125 H TYR 550 H TYR 550 26.065 -8.885 6.080 126 HA TYR 550 HA TYR 550 27.958 -7.781 8.015 127 HB2 TYR 550 HB2 TYR 550 26.365 -7.635 9.865 128 HB3 TYR 550 HB3 TYR 550 25.962 -6.490 8.611 129 HD1 TYR 550 HD1 TYR 550 23.819 -6.608 7.483 130 HD2 TYR 550 HD2 TYR 550 24.993 -9.703 10.247 131 HE1 TYR 550 HE1 TYR 550 21.490 -7.481 7.489 132 HE2 TYR 550 HE2 TYR 550 22.653 -10.566 10.265 133 HH TYR 550 HH TYR 550 20.059 -9.085 8.312 134 H VAL 551 H VAL 551 28.246 -9.031 9.898 135 HA VAL 551 HA VAL 551 27.548 -11.905 9.723 136 HB VAL 551 HB VAL 551 30.044 -12.224 10.571 137 HG11 VAL 551 HG11 VAL 551 28.983 -13.299 8.592 138 HG12 VAL 551 HG12 VAL 551 29.310 -11.840 7.634 139 HG13 VAL 551 HG13 VAL 551 30.653 -12.829 8.255 140 HG21 VAL 551 HG21 VAL 551 30.765 -9.867 10.434 141 HG22 VAL 551 HG22 VAL 551 31.691 -10.927 9.376 142 HG23 VAL 551 HG23 VAL 551 30.449 -9.879 8.681 143 H VAL 552 H VAL 552 27.234 -12.929 11.650 144 HA VAL 552 HA VAL 552 26.538 -11.214 13.876 145 HB VAL 552 HB VAL 552 26.552 -14.233 13.557 146 HG11 VAL 552 HG11 VAL 552 25.062 -14.292 15.527 147 HG12 VAL 552 HG12 VAL 552 26.687 -13.757 15.960 148 HG13 VAL 552 HG13 VAL 552 25.358 -12.574 15.822 149 HG21 VAL 552 HG21 VAL 552 24.925 -13.008 12.117 150 HG22 VAL 552 HG22 VAL 552 24.122 -13.973 13.359 151 HG23 VAL 552 HG23 VAL 552 24.264 -12.214 13.568 152 H VAL 553 H VAL 553 27.549 -10.802 15.758 153 HA VAL 553 HA VAL 553 30.377 -11.287 16.099 154 HB VAL 553 HB VAL 553 28.264 -10.209 17.985 155 HG11 VAL 553 HG11 VAL 553 29.974 -11.208 19.390 156 HG12 VAL 553 HG12 VAL 553 31.276 -10.510 18.387 157 HG13 VAL 553 HG13 VAL 553 30.229 -9.462 19.355 158 HG21 VAL 553 HG21 VAL 553 29.456 -8.107 17.712 159 HG22 VAL 553 HG22 VAL 553 30.614 -8.853 16.602 160 HG23 VAL 553 HG23 VAL 553 28.904 -8.682 16.110 161 HA PRO 554 HA PRO 554 29.485 -15.426 17.592 162 HB2 PRO 554 HB2 PRO 554 31.976 -16.481 17.581 163 HB3 PRO 554 HB3 PRO 554 31.262 -15.851 16.072 164 HG2 PRO 554 HG2 PRO 554 33.141 -14.389 17.939 165 HG3 PRO 554 HG3 PRO 554 33.312 -14.617 16.169 166 HD2 PRO 554 HD2 PRO 554 32.160 -12.369 17.259 167 HD3 PRO 554 HD3 PRO 554 31.587 -13.082 15.710 168 H GLU 555 H GLU 555 31.043 -13.153 19.514 169 HA GLU 555 HA GLU 555 31.743 -12.890 21.634 170 HB2 GLU 555 HB2 GLU 555 30.235 -15.418 22.349 171 HB3 GLU 555 HB3 GLU 555 30.912 -14.227 23.459 172 HG2 GLU 555 HG2 GLU 555 29.418 -12.483 22.536 173 HG3 GLU 555 HG3 GLU 555 28.759 -13.632 21.382 174 H THR 556 H THR 556 32.557 -16.010 20.191 175 HA THR 556 HA THR 556 34.858 -16.621 21.817 176 HB THR 556 HB THR 556 35.617 -17.945 19.919 177 HG1 THR 556 HG1 THR 556 34.440 -17.893 17.999 178 HG21 THR 556 HG21 THR 556 33.811 -18.878 21.353 179 HG22 THR 556 HG22 THR 556 33.706 -19.470 19.683 180 HG23 THR 556 HG23 THR 556 32.584 -18.221 20.255 181 H SER 557 H SER 557 34.295 -14.163 19.450 182 HA SER 557 HA SER 557 36.991 -13.328 18.855 183 HB2 SER 557 HB2 SER 557 35.794 -11.185 18.257 184 HB3 SER 557 HB3 SER 557 35.131 -12.649 17.511 185 HG SER 557 HG SER 557 34.080 -11.238 19.746 186 H GLN 558 H GLN 558 35.335 -13.271 21.829 187 HA GLN 558 HA GLN 558 35.856 -12.648 23.865 188 HB2 GLN 558 HB2 GLN 558 37.930 -13.674 23.308 189 HB3 GLN 558 HB3 GLN 558 38.612 -12.194 22.682 190 HG2 GLN 558 HG2 GLN 558 37.687 -12.494 25.580 191 HG3 GLN 558 HG3 GLN 558 39.282 -12.998 25.036 192 HE21 GLN 558 HE21 GLN 558 39.972 -10.829 23.249 193 HE22 GLN 558 HE22 GLN 558 40.153 -9.414 24.273 194 H ASP 559 H ASP 559 36.734 -10.007 21.664 195 HA ASP 559 HA ASP 559 35.655 -8.097 23.704 196 HB2 ASP 559 HB2 ASP 559 38.176 -8.066 23.268 197 HB3 ASP 559 HB3 ASP 559 37.804 -7.449 21.672 198 H MET 560 H MET 560 34.480 -9.522 21.242 199 HA MET 560 HA MET 560 33.053 -9.168 19.502 200 HB2 MET 560 HB2 MET 560 32.310 -6.661 21.058 201 HB3 MET 560 HB3 MET 560 31.307 -7.475 19.856 202 HG2 MET 560 HG2 MET 560 31.257 -9.514 21.289 203 HG3 MET 560 HG3 MET 560 32.292 -8.707 22.443 204 HE1 MET 560 HE1 MET 560 28.743 -9.233 21.095 205 HE2 MET 560 HE2 MET 560 27.827 -7.860 21.750 206 HE3 MET 560 HE3 MET 560 29.003 -7.595 20.441 207 H ALA 561 H ALA 561 35.751 -7.987 19.145 208 HA ALA 561 HA ALA 561 35.180 -5.964 17.033 209 HB1 ALA 561 HB1 ALA 561 35.918 -4.925 19.145 210 HB2 ALA 561 HB2 ALA 561 37.384 -5.922 19.127 211 HB3 ALA 561 HB3 ALA 561 37.112 -4.714 17.849 212 H PHE 562 H PHE 562 36.717 -5.872 15.314 213 HA PHE 562 HA PHE 562 39.023 -7.650 15.214 214 HB2 PHE 562 HB2 PHE 562 36.647 -8.081 13.378 215 HB3 PHE 562 HB3 PHE 562 38.268 -8.358 12.785 216 HD1 PHE 562 HD1 PHE 562 39.782 -9.715 14.767 217 HD2 PHE 562 HD2 PHE 562 35.616 -10.151 13.747 218 HE1 PHE 562 HE1 PHE 562 39.811 -12.048 15.614 219 HE2 PHE 562 HE2 PHE 562 35.672 -12.510 14.535 220 HZ PHE 562 HZ PHE 562 37.768 -13.450 15.490 221 H LYS 563 H LYS 563 40.488 -7.164 13.438 222 HA LYS 563 HA LYS 563 40.517 -4.279 12.850 223 HB2 LYS 563 HB2 LYS 563 42.441 -5.668 13.778 224 HB3 LYS 563 HB3 LYS 563 42.595 -6.403 12.184 225 HG2 LYS 563 HG2 LYS 563 43.058 -4.135 11.223 226 HG3 LYS 563 HG3 LYS 563 42.896 -3.452 12.862 227 HD2 LYS 563 HD2 LYS 563 44.797 -4.943 13.599 228 HD3 LYS 563 HD3 LYS 563 44.937 -5.503 11.928 229 HE2 LYS 563 HE2 LYS 563 46.611 -3.856 12.200 230 HE3 LYS 563 HE3 LYS 563 45.347 -3.125 11.220 231 HZ1 LYS 563 HZ1 LYS 563 44.548 -1.988 13.239 232 HZ2 LYS 563 HZ2 LYS 563 46.123 -1.630 12.989 233 HZ3 LYS 563 HZ3 LYS 563 45.702 -2.698 14.144 234 H CYS 564 H CYS 564 40.725 -3.346 10.846 235 HA CYS 564 HA CYS 564 40.226 -4.930 8.363 236 HB2 CYS 564 HB2 CYS 564 38.822 -2.781 8.956 237 HB3 CYS 564 HB3 CYS 564 40.269 -1.906 8.622 238 HA PRO 565 HA PRO 565 44.797 -4.179 8.195 239 HB2 PRO 565 HB2 PRO 565 44.471 -6.097 5.901 240 HB3 PRO 565 HB3 PRO 565 45.755 -6.030 7.142 241 HG2 PRO 565 HG2 PRO 565 43.766 -7.870 7.342 242 HG3 PRO 565 HG3 PRO 565 44.305 -6.966 8.801 243 HD2 PRO 565 HD2 PRO 565 41.881 -6.441 7.064 244 HD3 PRO 565 HD3 PRO 565 42.031 -6.454 8.843 245 H ILE 566 H ILE 566 42.370 -3.732 5.693 246 HA ILE 566 HA ILE 566 44.120 -2.586 3.690 247 HB ILE 566 HB ILE 566 41.118 -2.535 4.019 248 HG12 ILE 566 HG12 ILE 566 42.826 -4.066 1.983 249 HG13 ILE 566 HG13 ILE 566 42.322 -4.764 3.516 250 HG21 ILE 566 HG21 ILE 566 41.067 -1.769 1.599 251 HG22 ILE 566 HG22 ILE 566 41.726 -0.564 2.692 252 HG23 ILE 566 HG23 ILE 566 42.818 -1.541 1.683 253 HD11 ILE 566 HD11 ILE 566 40.480 -3.899 1.250 254 HD12 ILE 566 HD12 ILE 566 40.833 -5.535 1.813 255 HD13 ILE 566 HD13 ILE 566 39.924 -4.425 2.862 256 H CYS 567 H CYS 567 41.636 -1.007 5.802 257 HA CYS 567 HA CYS 567 43.006 1.577 5.365 258 HB2 CYS 567 HB2 CYS 567 41.024 2.641 5.996 259 HB3 CYS 567 HB3 CYS 567 40.590 1.382 4.843 260 H LYS 568 H LYS 568 43.292 -0.830 7.514 261 HA LYS 568 HA LYS 568 44.105 -1.176 9.570 262 HB2 LYS 568 HB2 LYS 568 45.885 0.133 10.448 263 HB3 LYS 568 HB3 LYS 568 46.079 -0.204 8.741 264 HG2 LYS 568 HG2 LYS 568 45.561 2.093 8.134 265 HG3 LYS 568 HG3 LYS 568 45.096 2.480 9.800 266 HD2 LYS 568 HD2 LYS 568 47.261 3.397 9.348 267 HD3 LYS 568 HD3 LYS 568 47.431 2.089 10.529 268 HE2 LYS 568 HE2 LYS 568 48.183 0.554 8.742 269 HE3 LYS 568 HE3 LYS 568 47.943 1.809 7.534 270 HZ1 LYS 568 HZ1 LYS 568 49.687 3.114 8.627 271 HZ2 LYS 568 HZ2 LYS 568 50.268 1.650 8.218 272 HZ3 LYS 568 HZ3 LYS 568 49.892 1.960 9.768 273 H GLU 569 H GLU 569 41.546 -0.640 9.642 274 HA GLU 569 HA GLU 569 41.169 1.051 12.104 275 HB2 GLU 569 HB2 GLU 569 39.298 0.491 9.791 276 HB3 GLU 569 HB3 GLU 569 38.724 1.115 11.313 277 HG2 GLU 569 HG2 GLU 569 40.759 2.507 9.543 278 HG3 GLU 569 HG3 GLU 569 39.057 2.921 9.685 279 H THR 570 H THR 570 38.906 0.248 13.151 280 HA THR 570 HA THR 570 39.011 -2.722 13.479 281 HB THR 570 HB THR 570 39.005 -0.693 15.722 282 HG1 THR 570 HG1 THR 570 41.028 -1.201 14.879 283 HG21 THR 570 HG21 THR 570 39.073 -2.679 17.234 284 HG22 THR 570 HG22 THR 570 38.725 -3.727 15.846 285 HG23 THR 570 HG23 THR 570 37.530 -2.522 16.386 286 H VAL 571 H VAL 571 37.097 -3.577 13.125 287 HA VAL 571 HA VAL 571 34.565 -2.051 13.383 288 HB VAL 571 HB VAL 571 33.596 -4.408 12.832 289 HG11 VAL 571 HG11 VAL 571 33.364 -2.451 11.455 290 HG12 VAL 571 HG12 VAL 571 34.987 -2.742 10.740 291 HG13 VAL 571 HG13 VAL 571 33.650 -3.892 10.481 292 HG21 VAL 571 HG21 VAL 571 36.331 -4.769 11.575 293 HG22 VAL 571 HG22 VAL 571 35.694 -5.689 12.975 294 HG23 VAL 571 HG23 VAL 571 34.909 -5.810 11.393 295 H THR 572 H THR 572 32.954 -2.621 14.843 296 HA THR 572 HA THR 572 33.353 -4.860 16.645 297 HB THR 572 HB THR 572 34.590 -3.431 17.963 298 HG1 THR 572 HG1 THR 572 33.362 -3.243 19.793 299 HG21 THR 572 HG21 THR 572 32.422 -1.336 17.621 300 HG22 THR 572 HG22 THR 572 34.107 -1.267 17.041 301 HG23 THR 572 HG23 THR 572 33.794 -1.222 18.777 302 H GLY 573 H GLY 573 31.560 -5.326 17.981 303 HA2 GLY 573 HA2 GLY 573 29.345 -5.815 16.356 304 HA3 GLY 573 HA3 GLY 573 29.405 -6.071 18.101 305 H VAL 574 H VAL 574 27.259 -5.180 16.205 306 HA VAL 574 HA VAL 574 26.174 -3.130 18.037 307 HB VAL 574 HB VAL 574 25.804 -3.203 14.992 308 HG11 VAL 574 HG11 VAL 574 24.709 -1.239 17.045 309 HG12 VAL 574 HG12 VAL 574 24.600 -1.048 15.282 310 HG13 VAL 574 HG13 VAL 574 23.758 -2.387 16.066 311 HG21 VAL 574 HG21 VAL 574 27.297 -1.197 16.731 312 HG22 VAL 574 HG22 VAL 574 28.005 -2.271 15.509 313 HG23 VAL 574 HG23 VAL 574 26.928 -0.961 15.012 314 H TYR 575 H TYR 575 24.118 -3.544 18.806 315 HA TYR 575 HA TYR 575 23.096 -6.199 18.354 316 HB2 TYR 575 HB2 TYR 575 23.064 -4.999 20.526 317 HB3 TYR 575 HB3 TYR 575 21.829 -3.921 19.896 318 HD1 TYR 575 HD1 TYR 575 22.602 -7.534 20.507 319 HD2 TYR 575 HD2 TYR 575 19.525 -4.558 20.049 320 HE1 TYR 575 HE1 TYR 575 20.894 -9.200 21.224 321 HE2 TYR 575 HE2 TYR 575 17.812 -6.226 20.780 322 HH TYR 575 HH TYR 575 18.681 -9.554 21.704 323 H ASP 576 H ASP 576 21.650 -6.962 16.995 324 HA ASP 576 HA ASP 576 19.759 -5.182 15.524 325 HB2 ASP 576 HB2 ASP 576 21.120 -6.679 14.138 326 HB3 ASP 576 HB3 ASP 576 20.593 -8.068 15.080 327 H GLU 577 H GLU 577 17.715 -5.066 16.321 328 HA GLU 577 HA GLU 577 16.745 -6.791 18.441 329 HB2 GLU 577 HB2 GLU 577 15.299 -4.734 16.728 330 HB3 GLU 577 HB3 GLU 577 14.666 -5.499 18.195 331 HG2 GLU 577 HG2 GLU 577 16.635 -4.573 19.458 332 HG3 GLU 577 HG3 GLU 577 17.055 -3.631 18.035 333 H GLU 578 H GLU 578 16.485 -6.992 14.913 334 HA GLU 578 HA GLU 578 14.025 -8.551 14.959 335 HB2 GLU 578 HB2 GLU 578 14.564 -7.083 13.111 336 HB3 GLU 578 HB3 GLU 578 15.989 -8.046 12.693 337 HG2 GLU 578 HG2 GLU 578 14.597 -9.989 12.178 338 HG3 GLU 578 HG3 GLU 578 13.157 -9.175 12.778 339 H SER 579 H SER 579 17.444 -9.465 14.170 340 HA SER 579 HA SER 579 16.873 -12.317 14.510 341 HB2 SER 579 HB2 SER 579 19.274 -12.637 14.337 342 HB3 SER 579 HB3 SER 579 18.685 -11.588 13.043 343 HG SER 579 HG SER 579 19.562 -9.867 14.002 344 H GLY 580 H GLY 580 17.846 -9.681 16.633 345 HA2 GLY 580 HA2 GLY 580 17.724 -9.584 18.942 346 HA3 GLY 580 HA3 GLY 580 17.377 -11.311 19.032 347 H GLU 581 H GLU 581 20.152 -9.896 17.312 348 HA GLU 581 HA GLU 581 22.109 -10.906 19.299 349 HB2 GLU 581 HB2 GLU 581 21.955 -11.905 16.424 350 HB3 GLU 581 HB3 GLU 581 23.308 -12.164 17.520 351 HG2 GLU 581 HG2 GLU 581 21.695 -13.291 19.119 352 HG3 GLU 581 HG3 GLU 581 20.490 -13.255 17.833 353 H TRP 582 H TRP 582 24.328 -10.297 18.838 354 HA TRP 582 HA TRP 582 24.525 -7.577 17.750 355 HB2 TRP 582 HB2 TRP 582 26.529 -9.430 19.071 356 HB3 TRP 582 HB3 TRP 582 26.870 -7.771 18.589 357 HD1 TRP 582 HD1 TRP 582 24.863 -9.803 21.159 358 HE1 TRP 582 HE1 TRP 582 24.232 -8.319 23.140 359 HE3 TRP 582 HE3 TRP 582 26.628 -5.337 19.413 360 HZ2 TRP 582 HZ2 TRP 582 24.435 -5.522 23.874 361 HZ3 TRP 582 HZ3 TRP 582 26.421 -3.272 20.788 362 HH2 TRP 582 HH2 TRP 582 25.312 -3.360 23.009 363 H VAL 583 H VAL 583 25.426 -6.957 15.866 364 HA VAL 583 HA VAL 583 26.728 -8.958 14.079 365 HB VAL 583 HB VAL 583 25.651 -7.796 12.181 366 HG11 VAL 583 HG11 VAL 583 23.463 -8.882 12.408 367 HG12 VAL 583 HG12 VAL 583 24.751 -9.917 13.039 368 HG13 VAL 583 HG13 VAL 583 23.684 -9.027 14.162 369 HG21 VAL 583 HG21 VAL 583 23.714 -6.402 12.409 370 HG22 VAL 583 HG22 VAL 583 23.752 -6.520 14.180 371 HG23 VAL 583 HG23 VAL 583 25.034 -5.643 13.314 372 H TRP 584 H TRP 584 28.215 -8.275 12.624 373 HA TRP 584 HA TRP 584 29.568 -5.651 13.034 374 HB2 TRP 584 HB2 TRP 584 30.318 -8.313 11.822 375 HB3 TRP 584 HB3 TRP 584 31.252 -6.876 11.476 376 HD1 TRP 584 HD1 TRP 584 31.640 -5.541 14.172 377 HE1 TRP 584 HE1 TRP 584 32.942 -6.674 16.103 378 HE3 TRP 584 HE3 TRP 584 31.391 -10.418 12.631 379 HZ2 TRP 584 HZ2 TRP 584 34.039 -9.255 16.688 380 HZ3 TRP 584 HZ3 TRP 584 32.629 -12.184 13.861 381 HH2 TRP 584 HH2 TRP 584 33.935 -11.607 15.896 382 H LYS 585 H LYS 585 28.579 -4.135 11.817 383 HA LYS 585 HA LYS 585 27.261 -4.641 9.256 384 HB2 LYS 585 HB2 LYS 585 28.027 -2.038 10.621 385 HB3 LYS 585 HB3 LYS 585 27.010 -2.194 9.186 386 HG2 LYS 585 HG2 LYS 585 25.406 -3.620 10.528 387 HG3 LYS 585 HG3 LYS 585 26.375 -3.267 11.969 388 HD2 LYS 585 HD2 LYS 585 25.992 -0.830 11.614 389 HD3 LYS 585 HD3 LYS 585 24.982 -1.216 10.204 390 HE2 LYS 585 HE2 LYS 585 23.444 -2.503 11.660 391 HE3 LYS 585 HE3 LYS 585 24.439 -2.131 13.062 392 HZ1 LYS 585 HZ1 LYS 585 23.965 0.244 12.681 393 HZ2 LYS 585 HZ2 LYS 585 22.579 -0.587 12.895 394 HZ3 LYS 585 HZ3 LYS 585 23.017 -0.116 11.399 395 H ASN 586 H ASN 586 27.886 -4.022 7.197 396 HA ASN 586 HA ASN 586 29.319 -3.906 5.428 397 HB2 ASN 586 HB2 ASN 586 29.179 -1.533 6.091 398 HB3 ASN 586 HB3 ASN 586 30.560 -1.737 7.169 399 HD21 ASN 586 HD21 ASN 586 31.660 -0.014 6.038 400 HD22 ASN 586 HD22 ASN 586 32.359 -0.332 4.455 401 H THR 587 H THR 587 29.952 -6.158 6.822 402 HA THR 587 HA THR 587 32.943 -6.211 6.924 403 HB THR 587 HB THR 587 31.097 -7.403 9.007 404 HG1 THR 587 HG1 THR 587 31.506 -5.123 9.118 405 HG21 THR 587 HG21 THR 587 34.142 -7.412 8.814 406 HG22 THR 587 HG22 THR 587 33.077 -8.839 8.791 407 HG23 THR 587 HG23 THR 587 33.212 -7.855 10.254 408 H ILE 588 H ILE 588 33.998 -7.988 6.422 409 HA ILE 588 HA ILE 588 32.679 -10.451 5.463 410 HB ILE 588 HB ILE 588 32.729 -9.123 3.493 411 HG12 ILE 588 HG12 ILE 588 35.256 -10.810 3.365 412 HG13 ILE 588 HG13 ILE 588 33.604 -11.472 3.281 413 HG21 ILE 588 HG21 ILE 588 34.752 -7.955 2.617 414 HG22 ILE 588 HG22 ILE 588 34.252 -7.319 4.174 415 HG23 ILE 588 HG23 ILE 588 35.630 -8.441 4.084 416 HD11 ILE 588 HD11 ILE 588 33.254 -10.056 1.208 417 HD12 ILE 588 HD12 ILE 588 35.006 -9.702 1.253 418 HD13 ILE 588 HD13 ILE 588 34.442 -11.363 1.063 419 H GLU 589 H GLU 589 34.101 -12.278 5.360 420 HA GLU 589 HA GLU 589 36.801 -11.945 6.542 421 HB2 GLU 589 HB2 GLU 589 35.371 -13.019 8.207 422 HB3 GLU 589 HB3 GLU 589 34.859 -14.234 7.031 423 HG2 GLU 589 HG2 GLU 589 37.231 -15.004 6.833 424 HG3 GLU 589 HG3 GLU 589 37.700 -13.771 8.005 425 H VAL 590 H VAL 590 38.366 -12.626 5.267 426 HA VAL 590 HA VAL 590 38.016 -14.578 3.061 427 HB VAL 590 HB VAL 590 38.502 -11.613 2.723 428 HG11 VAL 590 HG11 VAL 590 39.621 -13.752 0.862 429 HG12 VAL 590 HG12 VAL 590 39.472 -12.030 0.468 430 HG13 VAL 590 HG13 VAL 590 40.565 -12.534 1.756 431 HG21 VAL 590 HG21 VAL 590 36.303 -12.588 2.148 432 HG22 VAL 590 HG22 VAL 590 37.125 -11.937 0.727 433 HG23 VAL 590 HG23 VAL 590 37.097 -13.690 1.001 434 H ASN 591 H ASN 591 39.583 -15.829 2.771 435 HA ASN 591 HA ASN 591 41.463 -16.999 3.255 436 HB2 ASN 591 HB2 ASN 591 42.744 -14.259 2.927 437 HB3 ASN 591 HB3 ASN 591 43.512 -15.838 2.717 438 HD21 ASN 591 HD21 ASN 591 41.582 -17.217 1.146 439 HD22 ASN 591 HD22 ASN 591 41.507 -16.374 -0.397 440 H GLY 592 H GLY 592 40.098 -16.379 5.607 441 HA2 GLY 592 HA2 GLY 592 40.416 -16.817 7.847 442 HA3 GLY 592 HA3 GLY 592 42.161 -16.891 7.588 443 H LYS 593 H LYS 593 40.877 -13.927 6.460 444 HA LYS 593 HA LYS 593 41.471 -12.468 8.999 445 HB2 LYS 593 HB2 LYS 593 42.269 -11.761 6.158 446 HB3 LYS 593 HB3 LYS 593 42.479 -10.690 7.542 447 HG2 LYS 593 HG2 LYS 593 44.029 -12.241 8.614 448 HG3 LYS 593 HG3 LYS 593 43.793 -13.449 7.353 449 HD2 LYS 593 HD2 LYS 593 44.963 -10.683 6.867 450 HD3 LYS 593 HD3 LYS 593 45.907 -12.152 7.142 451 HE2 LYS 593 HE2 LYS 593 44.781 -13.218 5.178 452 HE3 LYS 593 HE3 LYS 593 43.958 -11.694 4.841 453 HZ1 LYS 593 HZ1 LYS 593 46.157 -10.660 4.547 454 HZ2 LYS 593 HZ2 LYS 593 45.998 -11.914 3.518 455 HZ3 LYS 593 HZ3 LYS 593 46.906 -12.075 4.859 456 H TYR 594 H TYR 594 40.381 -10.540 9.334 457 HA TYR 594 HA TYR 594 37.725 -10.342 7.999 458 HB2 TYR 594 HB2 TYR 594 38.840 -9.372 10.616 459 HB3 TYR 594 HB3 TYR 594 37.455 -8.565 9.911 460 HD1 TYR 594 HD1 TYR 594 35.299 -9.345 10.256 461 HD2 TYR 594 HD2 TYR 594 38.602 -12.069 10.788 462 HE1 TYR 594 HE1 TYR 594 33.725 -11.104 11.051 463 HE2 TYR 594 HE2 TYR 594 37.029 -13.830 11.539 464 HH TYR 594 HH TYR 594 34.822 -14.401 11.863 465 H PHE 595 H PHE 595 36.927 -8.487 7.095 466 HA PHE 595 HA PHE 595 38.592 -6.090 6.710 467 HB2 PHE 595 HB2 PHE 595 37.566 -7.812 4.413 468 HB3 PHE 595 HB3 PHE 595 38.279 -6.237 4.229 469 HD1 PHE 595 HD1 PHE 595 38.857 -9.814 4.560 470 HD2 PHE 595 HD2 PHE 595 40.765 -5.950 4.752 471 HE1 PHE 595 HE1 PHE 595 41.057 -10.884 4.189 472 HE2 PHE 595 HE2 PHE 595 42.976 -7.034 4.363 473 HZ PHE 595 HZ PHE 595 43.125 -9.491 4.103 474 H HIS 596 H HIS 596 37.390 -4.371 5.610 475 HA HIS 596 HA HIS 596 34.498 -4.290 6.239 476 HB2 HIS 596 HB2 HIS 596 36.484 -2.394 5.001 477 HB3 HIS 596 HB3 HIS 596 34.793 -2.026 4.895 478 HD2 HIS 596 HD2 HIS 596 33.729 -2.147 7.813 479 HE1 HIS 596 HE1 HIS 596 37.170 0.142 8.883 480 HE2 HIS 596 HE2 HIS 596 34.840 -0.566 9.612 481 H SER 597 H SER 597 32.880 -4.472 4.651 482 HA SER 597 HA SER 597 33.538 -5.878 2.237 483 HB2 SER 597 HB2 SER 597 30.935 -4.448 2.875 484 HB3 SER 597 HB3 SER 597 31.181 -5.707 1.663 485 HG SER 597 HG SER 597 31.471 -7.197 3.231 486 H THR 598 H THR 598 32.754 -2.404 2.782 487 HA THR 598 HA THR 598 32.991 -1.570 0.067 488 HB THR 598 HB THR 598 33.611 0.683 1.079 489 HG1 THR 598 HG1 THR 598 34.482 0.296 2.985 490 HG21 THR 598 HG21 THR 598 31.431 1.125 2.052 491 HG22 THR 598 HG22 THR 598 31.115 -0.612 2.235 492 HG23 THR 598 HG23 THR 598 31.261 0.109 0.616 493 H CYS 599 H CYS 599 35.543 -1.759 2.605 494 HA CYS 599 HA CYS 599 37.683 -0.757 1.043 495 HB2 CYS 599 HB2 CYS 599 37.606 -2.711 3.370 496 HB3 CYS 599 HB3 CYS 599 39.079 -2.024 2.748 497 H TYR 600 H TYR 600 36.756 -4.181 1.658 498 HA TYR 600 HA TYR 600 38.731 -5.324 -0.049 499 HB2 TYR 600 HB2 TYR 600 37.656 -6.564 1.727 500 HB3 TYR 600 HB3 TYR 600 36.080 -6.397 0.984 501 HD1 TYR 600 HD1 TYR 600 39.443 -7.964 0.669 502 HD2 TYR 600 HD2 TYR 600 35.424 -7.862 -0.882 503 HE1 TYR 600 HE1 TYR 600 39.914 -9.993 -0.690 504 HE2 TYR 600 HE2 TYR 600 35.888 -9.906 -2.222 505 HH TYR 600 HH TYR 600 37.500 -11.405 -2.896 506 H HIS 601 H HIS 601 35.304 -4.440 -0.757 507 HA HIS 601 HA HIS 601 35.229 -5.371 -3.436 508 HB2 HIS 601 HB2 HIS 601 33.237 -4.734 -2.161 509 HB3 HIS 601 HB3 HIS 601 33.794 -3.067 -2.059 510 HD2 HIS 601 HD2 HIS 601 33.717 -5.139 -5.370 511 HE1 HIS 601 HE1 HIS 601 30.817 -2.045 -5.716 512 HE2 HIS 601 HE2 HIS 601 31.981 -3.945 -6.939 513 H GLU 602 H GLU 602 36.194 -2.123 -2.198 514 HA GLU 602 HA GLU 602 36.764 -1.064 -4.818 515 HB2 GLU 602 HB2 GLU 602 36.151 0.299 -2.887 516 HB3 GLU 602 HB3 GLU 602 37.645 -0.141 -2.053 517 HG2 GLU 602 HG2 GLU 602 38.992 1.038 -3.670 518 HG3 GLU 602 HG3 GLU 602 37.629 1.230 -4.768 519 H THR 603 H THR 603 38.782 -2.764 -2.453 520 HA THR 603 HA THR 603 41.286 -2.064 -3.822 521 HB THR 603 HB THR 603 40.760 -3.795 -1.389 522 HG1 THR 603 HG1 THR 603 40.239 -1.695 -1.029 523 HG21 THR 603 HG21 THR 603 43.373 -2.635 -2.446 524 HG22 THR 603 HG22 THR 603 42.971 -4.364 -2.280 525 HG23 THR 603 HG23 THR 603 43.144 -3.361 -0.839 526 H SER 604 H SER 604 39.380 -5.098 -3.415 527 HA SER 604 HA SER 604 41.570 -6.669 -4.508 528 HB2 SER 604 HB2 SER 604 40.121 -7.401 -2.606 529 HB3 SER 604 HB3 SER 604 38.807 -7.643 -3.770 530 HG SER 604 HG SER 604 41.282 -8.980 -3.538 531 H GLN 605 H GLN 605 41.567 -5.451 -6.597 532 HA GLN 605 HA GLN 605 39.638 -6.117 -8.625 533 HB2 GLN 605 HB2 GLN 605 41.297 -4.229 -8.659 534 HB3 GLN 605 HB3 GLN 605 42.576 -5.390 -8.990 535 HG2 GLN 605 HG2 GLN 605 40.234 -5.567 -10.842 536 HG3 GLN 605 HG3 GLN 605 41.042 -4.011 -10.858 537 HE21 GLN 605 HE21 GLN 605 41.617 -7.508 -11.385 538 HE22 GLN 605 HE22 GLN 605 43.025 -7.257 -12.417 539 H ASN 606 H ASN 606 42.195 -7.990 -7.177 540 HA ASN 606 HA ASN 606 42.576 -9.929 -9.278 541 HB2 ASN 606 HB2 ASN 606 42.953 -10.157 -6.264 542 HB3 ASN 606 HB3 ASN 606 43.586 -11.287 -7.451 543 HD21 ASN 606 HD21 ASN 606 44.793 -9.181 -5.438 544 HD22 ASN 606 HD22 ASN 606 46.026 -8.435 -6.446 545 H SER 607 H SER 607 40.038 -9.547 -6.877 546 HA SER 607 HA SER 607 39.071 -12.269 -6.907 547 HB2 SER 607 HB2 SER 607 38.783 -10.617 -5.060 548 HB3 SER 607 HB3 SER 607 37.650 -9.714 -6.072 549 HG SER 607 HG SER 607 36.311 -11.559 -6.078 550 H SER 608 H SER 608 38.668 -9.669 -9.147 551 HA SER 608 HA SER 608 36.063 -10.047 -10.166 552 HB2 SER 608 HB2 SER 608 38.565 -9.080 -11.593 553 HB3 SER 608 HB3 SER 608 36.899 -8.856 -12.147 554 HG SER 608 HG SER 608 37.649 -7.036 -10.957 Start of MODEL 7 1 H1 GLY 533 H1 GLY 533 13.284 22.593 -6.177 2 H2 GLY 533 H2 GLY 533 11.838 22.960 -6.863 3 H3 GLY 533 H3 GLY 533 13.234 23.354 -7.632 4 HA2 GLY 533 HA2 GLY 533 12.224 21.428 -8.673 5 HA3 GLY 533 HA3 GLY 533 13.803 21.050 -7.964 6 H GLY 534 H GLY 534 11.220 19.456 -8.480 7 HA2 GLY 534 HA2 GLY 534 10.186 18.630 -5.901 8 HA3 GLY 534 HA3 GLY 534 9.924 17.835 -7.446 9 H SER 535 H SER 535 10.320 16.516 -4.977 10 HA SER 535 HA SER 535 12.951 15.523 -4.554 11 HB2 SER 535 HB2 SER 535 10.307 14.156 -3.932 12 HB3 SER 535 HB3 SER 535 11.883 13.780 -3.219 13 HG SER 535 HG SER 535 10.649 15.163 -1.889 14 H GLU 536 H GLU 536 14.038 13.708 -5.215 15 HA GLU 536 HA GLU 536 13.258 12.434 -7.736 16 HB2 GLU 536 HB2 GLU 536 15.647 11.969 -5.918 17 HB3 GLU 536 HB3 GLU 536 15.411 11.267 -7.527 18 HG2 GLU 536 HG2 GLU 536 15.271 13.602 -8.464 19 HG3 GLU 536 HG3 GLU 536 15.724 14.228 -6.881 20 H PHE 537 H PHE 537 12.935 10.228 -8.105 21 HA PHE 537 HA PHE 537 11.619 8.723 -5.956 22 HB2 PHE 537 HB2 PHE 537 11.097 7.129 -7.786 23 HB3 PHE 537 HB3 PHE 537 10.495 8.753 -8.027 24 HD1 PHE 537 HD1 PHE 537 11.198 10.115 -9.903 25 HD2 PHE 537 HD2 PHE 537 13.052 6.292 -9.150 26 HE1 PHE 537 HE1 PHE 537 12.275 10.189 -12.137 27 HE2 PHE 537 HE2 PHE 537 14.124 6.374 -11.385 28 HZ PHE 537 HZ PHE 537 13.740 8.323 -12.879 29 H SER 538 H SER 538 12.086 6.479 -5.537 30 HA SER 538 HA SER 538 14.841 6.046 -4.821 31 HB2 SER 538 HB2 SER 538 12.853 5.333 -3.484 32 HB3 SER 538 HB3 SER 538 12.486 4.129 -4.725 33 HG SER 538 HG SER 538 14.659 4.242 -2.929 34 H ASP 539 H ASP 539 16.199 4.249 -5.352 35 HA ASP 539 HA ASP 539 15.672 2.720 -7.813 36 HB2 ASP 539 HB2 ASP 539 17.926 3.158 -8.698 37 HB3 ASP 539 HB3 ASP 539 16.846 4.535 -8.730 38 H ARG 540 H ARG 540 17.195 0.928 -8.131 39 HA ARG 540 HA ARG 540 17.529 -0.462 -5.514 40 HB2 ARG 540 HB2 ARG 540 17.146 -1.696 -8.256 41 HB3 ARG 540 HB3 ARG 540 17.047 -2.505 -6.698 42 HG2 ARG 540 HG2 ARG 540 15.096 -0.472 -7.842 43 HG3 ARG 540 HG3 ARG 540 14.816 -2.182 -7.564 44 HD2 ARG 540 HD2 ARG 540 15.249 -0.079 -5.403 45 HD3 ARG 540 HD3 ARG 540 13.699 -0.759 -5.895 46 HE ARG 540 HE ARG 540 15.211 -2.982 -5.202 47 HH11 ARG 540 HH11 ARG 540 14.167 -0.110 -3.478 48 HH12 ARG 540 HH12 ARG 540 14.115 -0.941 -1.938 49 HH21 ARG 540 HH21 ARG 540 15.145 -3.974 -3.216 50 HH22 ARG 540 HH22 ARG 540 14.668 -3.071 -1.802 51 H SER 541 H SER 541 19.654 1.191 -6.741 52 HA SER 541 HA SER 541 21.637 -0.275 -8.037 53 HB2 SER 541 HB2 SER 541 22.029 2.090 -6.175 54 HB3 SER 541 HB3 SER 541 23.139 1.556 -7.457 55 HG SER 541 HG SER 541 21.775 3.248 -8.161 56 H ASN 542 H ASN 542 23.603 -1.191 -7.493 57 HA ASN 542 HA ASN 542 23.677 -2.891 -5.248 58 HB2 ASN 542 HB2 ASN 542 24.744 -3.332 -7.416 59 HB3 ASN 542 HB3 ASN 542 25.887 -2.001 -7.152 60 HD21 ASN 542 HD21 ASN 542 24.826 -5.166 -5.777 61 HD22 ASN 542 HD22 ASN 542 26.429 -5.551 -5.157 62 H GLU 543 H GLU 543 24.753 0.429 -5.393 63 HA GLU 543 HA GLU 543 26.573 0.481 -3.201 64 HB2 GLU 543 HB2 GLU 543 24.527 2.568 -4.071 65 HB3 GLU 543 HB3 GLU 543 25.873 2.834 -2.954 66 HG2 GLU 543 HG2 GLU 543 27.476 2.232 -4.759 67 HG3 GLU 543 HG3 GLU 543 26.130 2.019 -5.879 68 H LEU 544 H LEU 544 23.107 -0.014 -3.160 69 HA LEU 544 HA LEU 544 22.823 0.405 -0.255 70 HB2 LEU 544 HB2 LEU 544 20.920 -0.824 -2.284 71 HB3 LEU 544 HB3 LEU 544 20.525 -0.359 -0.638 72 HG LEU 544 HG LEU 544 21.326 1.564 -2.874 73 HD11 LEU 544 HD11 LEU 544 18.645 1.044 -1.529 74 HD12 LEU 544 HD12 LEU 544 19.106 0.534 -3.170 75 HD13 LEU 544 HD13 LEU 544 18.975 2.255 -2.790 76 HD21 LEU 544 HD21 LEU 544 21.998 2.487 -0.700 77 HD22 LEU 544 HD22 LEU 544 20.406 2.091 -0.011 78 HD23 LEU 544 HD23 LEU 544 20.556 3.331 -1.278 79 H GLU 545 H GLU 545 23.843 -2.178 -2.309 80 HA GLU 545 HA GLU 545 23.009 -4.303 -0.434 81 HB2 GLU 545 HB2 GLU 545 22.654 -4.553 -2.888 82 HB3 GLU 545 HB3 GLU 545 24.382 -4.426 -3.152 83 HG2 GLU 545 HG2 GLU 545 23.670 -6.755 -3.249 84 HG3 GLU 545 HG3 GLU 545 24.784 -6.507 -1.927 85 H ILE 546 H ILE 546 26.065 -2.838 -1.594 86 HA ILE 546 HA ILE 546 27.826 -4.595 -0.196 87 HB ILE 546 HB ILE 546 28.244 -1.639 -0.752 88 HG12 ILE 546 HG12 ILE 546 27.723 -2.823 -2.860 89 HG13 ILE 546 HG13 ILE 546 29.358 -2.187 -2.797 90 HG21 ILE 546 HG21 ILE 546 30.671 -2.266 -0.756 91 HG22 ILE 546 HG22 ILE 546 29.895 -2.420 0.827 92 HG23 ILE 546 HG23 ILE 546 30.223 -3.871 -0.133 93 HD11 ILE 546 HD11 ILE 546 29.238 -4.420 -3.842 94 HD12 ILE 546 HD12 ILE 546 30.283 -4.409 -2.415 95 HD13 ILE 546 HD13 ILE 546 28.648 -5.110 -2.312 96 H ARG 547 H ARG 547 26.046 -1.743 0.934 97 HA ARG 547 HA ARG 547 27.354 -1.690 3.554 98 HB2 ARG 547 HB2 ARG 547 25.946 0.150 4.086 99 HB3 ARG 547 HB3 ARG 547 26.497 0.354 2.428 100 HG2 ARG 547 HG2 ARG 547 24.274 -0.543 1.633 101 HG3 ARG 547 HG3 ARG 547 23.745 -0.614 3.323 102 HD2 ARG 547 HD2 ARG 547 22.867 1.408 2.453 103 HD3 ARG 547 HD3 ARG 547 24.229 1.866 3.490 104 HE ARG 547 HE ARG 547 24.905 1.480 0.658 105 HH11 ARG 547 HH11 ARG 547 23.770 3.943 2.888 106 HH12 ARG 547 HH12 ARG 547 24.302 5.236 1.835 107 HH21 ARG 547 HH21 ARG 547 25.559 3.105 -0.569 108 HH22 ARG 547 HH22 ARG 547 25.302 4.772 -0.085 109 H GLY 548 H GLY 548 24.784 -3.543 2.277 110 HA2 GLY 548 HA2 GLY 548 23.330 -3.989 4.770 111 HA3 GLY 548 HA3 GLY 548 23.092 -4.804 3.226 112 H LYS 549 H LYS 549 26.276 -5.277 3.557 113 HA LYS 549 HA LYS 549 26.002 -8.005 4.494 114 HB2 LYS 549 HB2 LYS 549 28.517 -6.411 3.897 115 HB3 LYS 549 HB3 LYS 549 28.401 -8.162 4.030 116 HG2 LYS 549 HG2 LYS 549 27.289 -6.373 1.838 117 HG3 LYS 549 HG3 LYS 549 28.555 -7.599 1.723 118 HD2 LYS 549 HD2 LYS 549 26.781 -9.352 2.234 119 HD3 LYS 549 HD3 LYS 549 25.571 -8.047 2.114 120 HE2 LYS 549 HE2 LYS 549 26.475 -7.530 -0.183 121 HE3 LYS 549 HE3 LYS 549 27.513 -8.947 -0.037 122 HZ1 LYS 549 HZ1 LYS 549 24.559 -8.901 -0.120 123 HZ2 LYS 549 HZ2 LYS 549 25.395 -10.255 0.294 124 HZ3 LYS 549 HZ3 LYS 549 25.540 -9.597 -1.195 125 H TYR 550 H TYR 550 26.746 -8.978 6.327 126 HA TYR 550 HA TYR 550 28.420 -7.672 8.290 127 HB2 TYR 550 HB2 TYR 550 26.849 -7.822 10.188 128 HB3 TYR 550 HB3 TYR 550 26.367 -6.632 9.015 129 HD1 TYR 550 HD1 TYR 550 24.262 -6.793 7.844 130 HD2 TYR 550 HD2 TYR 550 25.584 -10.034 10.364 131 HE1 TYR 550 HE1 TYR 550 22.004 -7.823 7.705 132 HE2 TYR 550 HE2 TYR 550 23.328 -11.069 10.213 133 HH TYR 550 HH TYR 550 21.202 -10.890 9.360 134 H VAL 551 H VAL 551 28.816 -9.030 10.165 135 HA VAL 551 HA VAL 551 28.184 -11.907 9.912 136 HB VAL 551 HB VAL 551 30.564 -12.372 10.791 137 HG11 VAL 551 HG11 VAL 551 31.389 -12.666 8.502 138 HG12 VAL 551 HG12 VAL 551 29.667 -13.072 8.581 139 HG13 VAL 551 HG13 VAL 551 30.195 -11.513 7.885 140 HG21 VAL 551 HG21 VAL 551 31.400 -10.121 11.130 141 HG22 VAL 551 HG22 VAL 551 32.358 -10.983 9.929 142 HG23 VAL 551 HG23 VAL 551 31.186 -9.762 9.393 143 H VAL 552 H VAL 552 27.923 -12.990 11.898 144 HA VAL 552 HA VAL 552 26.992 -11.142 13.919 145 HB VAL 552 HB VAL 552 25.725 -13.112 13.204 146 HG11 VAL 552 HG11 VAL 552 26.200 -15.337 14.070 147 HG12 VAL 552 HG12 VAL 552 27.569 -14.797 13.102 148 HG13 VAL 552 HG13 VAL 552 27.662 -14.766 14.883 149 HG21 VAL 552 HG21 VAL 552 24.853 -13.745 15.388 150 HG22 VAL 552 HG22 VAL 552 26.291 -13.103 16.190 151 HG23 VAL 552 HG23 VAL 552 25.182 -12.010 15.314 152 H VAL 553 H VAL 553 27.666 -10.720 15.967 153 HA VAL 553 HA VAL 553 30.416 -11.377 16.745 154 HB VAL 553 HB VAL 553 28.239 -9.765 18.128 155 HG11 VAL 553 HG11 VAL 553 30.053 -9.078 19.680 156 HG12 VAL 553 HG12 VAL 553 29.651 -10.780 19.860 157 HG13 VAL 553 HG13 VAL 553 31.122 -10.315 18.964 158 HG21 VAL 553 HG21 VAL 553 29.768 -7.879 17.747 159 HG22 VAL 553 HG22 VAL 553 30.899 -8.945 16.908 160 HG23 VAL 553 HG23 VAL 553 29.295 -8.618 16.188 161 HA PRO 554 HA PRO 554 28.794 -14.897 19.129 162 HB2 PRO 554 HB2 PRO 554 31.115 -16.024 19.941 163 HB3 PRO 554 HB3 PRO 554 30.595 -16.064 18.222 164 HG2 PRO 554 HG2 PRO 554 32.571 -14.193 19.531 165 HG3 PRO 554 HG3 PRO 554 32.728 -15.078 17.984 166 HD2 PRO 554 HD2 PRO 554 31.866 -12.430 18.198 167 HD3 PRO 554 HD3 PRO 554 31.421 -13.514 16.846 168 H GLU 555 H GLU 555 28.235 -15.082 21.314 169 HA GLU 555 HA GLU 555 28.885 -13.026 23.214 170 HB2 GLU 555 HB2 GLU 555 27.661 -15.792 23.473 171 HB3 GLU 555 HB3 GLU 555 27.830 -14.715 24.855 172 HG2 GLU 555 HG2 GLU 555 26.346 -13.798 22.360 173 HG3 GLU 555 HG3 GLU 555 25.585 -14.827 23.543 174 H THR 556 H THR 556 30.611 -15.886 22.306 175 HA THR 556 HA THR 556 32.327 -16.263 24.558 176 HB THR 556 HB THR 556 32.985 -16.637 21.648 177 HG1 THR 556 HG1 THR 556 31.658 -18.419 23.397 178 HG21 THR 556 HG21 THR 556 34.265 -18.633 22.470 179 HG22 THR 556 HG22 THR 556 33.947 -18.116 24.135 180 HG23 THR 556 HG23 THR 556 34.927 -17.099 23.042 181 H SER 557 H SER 557 32.317 -13.738 22.063 182 HA SER 557 HA SER 557 35.114 -13.013 22.380 183 HB2 SER 557 HB2 SER 557 33.837 -12.480 20.331 184 HB3 SER 557 HB3 SER 557 32.818 -11.367 21.269 185 HG SER 557 HG SER 557 35.567 -11.195 20.626 186 H GLN 558 H GLN 558 36.056 -11.887 23.953 187 HA GLN 558 HA GLN 558 34.538 -10.707 26.130 188 HB2 GLN 558 HB2 GLN 558 36.636 -11.903 26.445 189 HB3 GLN 558 HB3 GLN 558 37.506 -10.731 25.451 190 HG2 GLN 558 HG2 GLN 558 37.168 -8.967 27.071 191 HG3 GLN 558 HG3 GLN 558 36.037 -9.948 28.004 192 HE21 GLN 558 HE21 GLN 558 38.814 -8.644 28.592 193 HE22 GLN 558 HE22 GLN 558 39.679 -9.965 29.360 194 H ASP 559 H ASP 559 35.960 -9.450 23.166 195 HA ASP 559 HA ASP 559 35.522 -6.644 24.089 196 HB2 ASP 559 HB2 ASP 559 37.891 -7.547 23.676 197 HB3 ASP 559 HB3 ASP 559 37.478 -7.548 21.967 198 H MET 560 H MET 560 34.386 -8.911 21.790 199 HA MET 560 HA MET 560 33.007 -8.823 20.026 200 HB2 MET 560 HB2 MET 560 32.105 -6.183 21.217 201 HB3 MET 560 HB3 MET 560 31.208 -7.152 20.049 202 HG2 MET 560 HG2 MET 560 31.042 -9.010 21.667 203 HG3 MET 560 HG3 MET 560 32.040 -8.121 22.799 204 HE1 MET 560 HE1 MET 560 27.588 -7.315 21.941 205 HE2 MET 560 HE2 MET 560 28.762 -7.177 20.609 206 HE3 MET 560 HE3 MET 560 28.507 -8.740 21.423 207 H ALA 561 H ALA 561 35.631 -7.962 19.428 208 HA ALA 561 HA ALA 561 35.172 -6.046 17.194 209 HB1 ALA 561 HB1 ALA 561 37.131 -4.773 17.913 210 HB2 ALA 561 HB2 ALA 561 35.903 -4.821 19.196 211 HB3 ALA 561 HB3 ALA 561 37.343 -5.851 19.313 212 H PHE 562 H PHE 562 36.639 -5.920 15.596 213 HA PHE 562 HA PHE 562 38.992 -7.604 15.313 214 HB2 PHE 562 HB2 PHE 562 36.535 -7.982 13.561 215 HB3 PHE 562 HB3 PHE 562 38.140 -8.261 12.923 216 HD1 PHE 562 HD1 PHE 562 35.438 -9.981 14.216 217 HD2 PHE 562 HD2 PHE 562 39.729 -9.737 14.583 218 HE1 PHE 562 HE1 PHE 562 35.507 -12.323 15.034 219 HE2 PHE 562 HE2 PHE 562 39.785 -12.075 15.431 220 HZ PHE 562 HZ PHE 562 37.671 -13.359 15.669 221 H LYS 563 H LYS 563 39.990 -6.957 12.994 222 HA LYS 563 HA LYS 563 39.538 -4.040 12.528 223 HB2 LYS 563 HB2 LYS 563 41.276 -4.243 14.187 224 HB3 LYS 563 HB3 LYS 563 42.189 -5.365 13.169 225 HG2 LYS 563 HG2 LYS 563 42.687 -3.636 11.560 226 HG3 LYS 563 HG3 LYS 563 41.515 -2.536 12.290 227 HD2 LYS 563 HD2 LYS 563 43.734 -1.823 12.838 228 HD3 LYS 563 HD3 LYS 563 42.894 -2.300 14.297 229 HE2 LYS 563 HE2 LYS 563 44.684 -4.283 12.877 230 HE3 LYS 563 HE3 LYS 563 45.410 -2.981 13.812 231 HZ1 LYS 563 HZ1 LYS 563 44.204 -3.733 15.768 232 HZ2 LYS 563 HZ2 LYS 563 45.119 -4.947 15.188 233 HZ3 LYS 563 HZ3 LYS 563 43.517 -4.965 14.940 234 H CYS 564 H CYS 564 39.831 -3.247 10.601 235 HA CYS 564 HA CYS 564 40.054 -4.928 8.224 236 HB2 CYS 564 HB2 CYS 564 38.474 -2.906 8.620 237 HB3 CYS 564 HB3 CYS 564 39.875 -1.899 8.526 238 HA PRO 565 HA PRO 565 44.575 -3.958 8.148 239 HB2 PRO 565 HB2 PRO 565 44.355 -5.597 5.624 240 HB3 PRO 565 HB3 PRO 565 45.587 -5.672 6.917 241 HG2 PRO 565 HG2 PRO 565 43.631 -7.541 6.794 242 HG3 PRO 565 HG3 PRO 565 44.100 -6.831 8.375 243 HD2 PRO 565 HD2 PRO 565 41.720 -6.112 6.647 244 HD3 PRO 565 HD3 PRO 565 41.821 -6.387 8.401 245 H ILE 566 H ILE 566 42.206 -3.442 5.569 246 HA ILE 566 HA ILE 566 43.950 -2.110 3.710 247 HB ILE 566 HB ILE 566 40.939 -2.161 3.966 248 HG12 ILE 566 HG12 ILE 566 42.761 -3.553 1.941 249 HG13 ILE 566 HG13 ILE 566 42.232 -4.325 3.424 250 HG21 ILE 566 HG21 ILE 566 40.920 -1.315 1.581 251 HG22 ILE 566 HG22 ILE 566 41.525 -0.125 2.719 252 HG23 ILE 566 HG23 ILE 566 42.667 -1.037 1.711 253 HD11 ILE 566 HD11 ILE 566 40.812 -5.094 1.650 254 HD12 ILE 566 HD12 ILE 566 39.844 -4.056 2.707 255 HD13 ILE 566 HD13 ILE 566 40.428 -3.447 1.138 256 H CYS 567 H CYS 567 41.413 -0.746 5.859 257 HA CYS 567 HA CYS 567 42.697 1.920 5.633 258 HB2 CYS 567 HB2 CYS 567 40.615 2.845 6.159 259 HB3 CYS 567 HB3 CYS 567 40.315 1.635 4.904 260 H LYS 568 H LYS 568 42.890 -0.615 7.662 261 HA LYS 568 HA LYS 568 43.668 -1.000 9.776 262 HB2 LYS 568 HB2 LYS 568 44.677 1.853 9.673 263 HB3 LYS 568 HB3 LYS 568 45.142 0.615 10.838 264 HG2 LYS 568 HG2 LYS 568 46.070 -0.790 9.001 265 HG3 LYS 568 HG3 LYS 568 45.574 0.424 7.822 266 HD2 LYS 568 HD2 LYS 568 47.911 0.728 8.227 267 HD3 LYS 568 HD3 LYS 568 47.025 2.105 8.872 268 HE2 LYS 568 HE2 LYS 568 48.733 1.587 10.447 269 HE3 LYS 568 HE3 LYS 568 47.220 1.076 11.179 270 HZ1 LYS 568 HZ1 LYS 568 48.974 -0.598 11.426 271 HZ2 LYS 568 HZ2 LYS 568 49.149 -0.730 9.814 272 HZ3 LYS 568 HZ3 LYS 568 47.761 -1.214 10.524 273 H GLU 569 H GLU 569 40.952 -0.649 9.667 274 HA GLU 569 HA GLU 569 40.338 1.066 12.080 275 HB2 GLU 569 HB2 GLU 569 38.676 0.436 9.659 276 HB3 GLU 569 HB3 GLU 569 37.979 0.993 11.194 277 HG2 GLU 569 HG2 GLU 569 39.300 3.002 11.148 278 HG3 GLU 569 HG3 GLU 569 40.066 2.538 9.621 279 H THR 570 H THR 570 39.405 0.285 13.791 280 HA THR 570 HA THR 570 38.860 -2.600 14.004 281 HB THR 570 HB THR 570 38.733 -0.404 16.085 282 HG1 THR 570 HG1 THR 570 40.694 -1.239 16.679 283 HG21 THR 570 HG21 THR 570 37.338 -2.339 16.769 284 HG22 THR 570 HG22 THR 570 38.822 -2.259 17.716 285 HG23 THR 570 HG23 THR 570 38.688 -3.441 16.396 286 H VAL 571 H VAL 571 36.931 -3.460 13.619 287 HA VAL 571 HA VAL 571 34.426 -1.884 13.674 288 HB VAL 571 HB VAL 571 33.359 -4.108 13.082 289 HG11 VAL 571 HG11 VAL 571 33.625 -2.323 11.500 290 HG12 VAL 571 HG12 VAL 571 35.283 -2.882 11.091 291 HG13 VAL 571 HG13 VAL 571 33.858 -3.905 10.746 292 HG21 VAL 571 HG21 VAL 571 36.178 -4.920 12.321 293 HG22 VAL 571 HG22 VAL 571 35.251 -5.608 13.683 294 HG23 VAL 571 HG23 VAL 571 34.674 -5.810 12.013 295 H THR 572 H THR 572 32.734 -2.358 15.078 296 HA THR 572 HA THR 572 33.242 -4.197 17.349 297 HB THR 572 HB THR 572 32.264 -2.583 18.915 298 HG1 THR 572 HG1 THR 572 32.047 -0.446 18.259 299 HG21 THR 572 HG21 THR 572 34.655 -1.376 17.456 300 HG22 THR 572 HG22 THR 572 34.745 -2.687 18.661 301 HG23 THR 572 HG23 THR 572 34.171 -1.086 19.145 302 H GLY 573 H GLY 573 31.347 -4.946 18.429 303 HA2 GLY 573 HA2 GLY 573 29.259 -5.760 16.700 304 HA3 GLY 573 HA3 GLY 573 29.265 -5.919 18.457 305 H VAL 574 H VAL 574 27.253 -5.116 16.268 306 HA VAL 574 HA VAL 574 25.967 -2.963 17.867 307 HB VAL 574 HB VAL 574 25.983 -3.278 14.824 308 HG11 VAL 574 HG11 VAL 574 24.619 -1.169 16.546 309 HG12 VAL 574 HG12 VAL 574 24.736 -1.138 14.770 310 HG13 VAL 574 HG13 VAL 574 23.801 -2.405 15.548 311 HG21 VAL 574 HG21 VAL 574 28.074 -2.295 15.583 312 HG22 VAL 574 HG22 VAL 574 27.090 -1.040 14.836 313 HG23 VAL 574 HG23 VAL 574 27.196 -1.134 16.616 314 H TYR 575 H TYR 575 23.856 -3.377 18.469 315 HA TYR 575 HA TYR 575 22.914 -6.063 18.087 316 HB2 TYR 575 HB2 TYR 575 22.650 -4.787 20.168 317 HB3 TYR 575 HB3 TYR 575 21.556 -3.678 19.366 318 HD1 TYR 575 HD1 TYR 575 19.215 -4.160 19.344 319 HD2 TYR 575 HD2 TYR 575 22.022 -7.323 20.159 320 HE1 TYR 575 HE1 TYR 575 17.333 -5.660 20.024 321 HE2 TYR 575 HE2 TYR 575 20.144 -8.823 20.800 322 HH TYR 575 HH TYR 575 17.880 -8.931 21.288 323 H ASP 576 H ASP 576 21.726 -6.934 16.565 324 HA ASP 576 HA ASP 576 19.949 -5.343 14.795 325 HB2 ASP 576 HB2 ASP 576 21.538 -6.930 13.804 326 HB3 ASP 576 HB3 ASP 576 20.836 -8.243 14.718 327 H GLU 577 H GLU 577 17.948 -5.029 15.535 328 HA GLU 577 HA GLU 577 16.818 -6.405 17.785 329 HB2 GLU 577 HB2 GLU 577 15.541 -4.519 15.767 330 HB3 GLU 577 HB3 GLU 577 14.821 -5.013 17.303 331 HG2 GLU 577 HG2 GLU 577 16.613 -3.902 18.538 332 HG3 GLU 577 HG3 GLU 577 17.455 -3.506 17.049 333 H GLU 578 H GLU 578 16.554 -7.069 14.342 334 HA GLU 578 HA GLU 578 14.065 -8.674 14.660 335 HB2 GLU 578 HB2 GLU 578 15.738 -7.922 12.237 336 HB3 GLU 578 HB3 GLU 578 14.356 -8.990 12.151 337 HG2 GLU 578 HG2 GLU 578 14.225 -6.106 13.141 338 HG3 GLU 578 HG3 GLU 578 13.931 -6.601 11.483 339 H SER 579 H SER 579 17.535 -9.110 13.891 340 HA SER 579 HA SER 579 17.380 -12.021 13.795 341 HB2 SER 579 HB2 SER 579 19.208 -10.717 12.723 342 HB3 SER 579 HB3 SER 579 19.757 -10.200 14.323 343 HG SER 579 HG SER 579 19.737 -12.805 13.235 344 H GLY 580 H GLY 580 18.026 -9.591 16.304 345 HA2 GLY 580 HA2 GLY 580 17.727 -9.722 18.583 346 HA3 GLY 580 HA3 GLY 580 17.464 -11.466 18.510 347 H GLU 581 H GLU 581 20.240 -9.797 17.026 348 HA GLU 581 HA GLU 581 22.142 -10.959 18.996 349 HB2 GLU 581 HB2 GLU 581 22.149 -11.565 16.015 350 HB3 GLU 581 HB3 GLU 581 23.447 -11.973 17.124 351 HG2 GLU 581 HG2 GLU 581 20.628 -13.123 17.165 352 HG3 GLU 581 HG3 GLU 581 22.071 -13.905 16.565 353 H TRP 582 H TRP 582 24.256 -10.111 18.885 354 HA TRP 582 HA TRP 582 24.513 -7.410 17.761 355 HB2 TRP 582 HB2 TRP 582 26.420 -9.152 19.354 356 HB3 TRP 582 HB3 TRP 582 26.730 -7.485 18.857 357 HD1 TRP 582 HD1 TRP 582 24.565 -9.540 21.251 358 HE1 TRP 582 HE1 TRP 582 23.615 -8.038 23.085 359 HE3 TRP 582 HE3 TRP 582 26.207 -5.013 19.515 360 HZ2 TRP 582 HZ2 TRP 582 23.535 -5.203 23.702 361 HZ3 TRP 582 HZ3 TRP 582 25.686 -2.929 20.771 362 HH2 TRP 582 HH2 TRP 582 24.351 -3.020 22.849 363 H VAL 583 H VAL 583 25.644 -6.855 15.956 364 HA VAL 583 HA VAL 583 27.111 -8.944 14.402 365 HB VAL 583 HB VAL 583 26.149 -8.017 12.356 366 HG11 VAL 583 HG11 VAL 583 25.185 -10.071 13.276 367 HG12 VAL 583 HG12 VAL 583 24.060 -9.108 14.267 368 HG13 VAL 583 HG13 VAL 583 23.939 -9.081 12.498 369 HG21 VAL 583 HG21 VAL 583 24.185 -6.663 12.275 370 HG22 VAL 583 HG22 VAL 583 24.063 -6.615 14.050 371 HG23 VAL 583 HG23 VAL 583 25.407 -5.791 13.217 372 H TRP 584 H TRP 584 28.686 -8.333 13.022 373 HA TRP 584 HA TRP 584 30.027 -5.712 13.378 374 HB2 TRP 584 HB2 TRP 584 30.738 -8.411 12.213 375 HB3 TRP 584 HB3 TRP 584 31.700 -7.017 11.825 376 HD1 TRP 584 HD1 TRP 584 32.151 -5.587 14.422 377 HE1 TRP 584 HE1 TRP 584 33.337 -6.619 16.475 378 HE3 TRP 584 HE3 TRP 584 31.462 -10.536 13.369 379 HZ2 TRP 584 HZ2 TRP 584 34.185 -9.255 17.336 380 HZ3 TRP 584 HZ3 TRP 584 32.431 -12.282 14.824 381 HH2 TRP 584 HH2 TRP 584 33.782 -11.654 16.815 382 H LYS 585 H LYS 585 28.939 -4.241 12.217 383 HA LYS 585 HA LYS 585 27.566 -4.770 9.704 384 HB2 LYS 585 HB2 LYS 585 28.316 -2.152 11.069 385 HB3 LYS 585 HB3 LYS 585 27.297 -2.272 9.643 386 HG2 LYS 585 HG2 LYS 585 26.649 -3.447 12.374 387 HG3 LYS 585 HG3 LYS 585 25.991 -1.957 11.690 388 HD2 LYS 585 HD2 LYS 585 25.058 -3.423 9.768 389 HD3 LYS 585 HD3 LYS 585 25.523 -4.812 10.754 390 HE2 LYS 585 HE2 LYS 585 23.239 -4.459 11.224 391 HE3 LYS 585 HE3 LYS 585 24.122 -3.862 12.630 392 HZ1 LYS 585 HZ1 LYS 585 22.372 -2.321 11.942 393 HZ2 LYS 585 HZ2 LYS 585 22.995 -2.185 10.449 394 HZ3 LYS 585 HZ3 LYS 585 23.812 -1.603 11.741 395 H ASN 586 H ASN 586 28.042 -4.156 7.637 396 HA ASN 586 HA ASN 586 29.286 -3.954 5.785 397 HB2 ASN 586 HB2 ASN 586 29.194 -1.592 6.565 398 HB3 ASN 586 HB3 ASN 586 30.738 -1.823 7.393 399 HD21 ASN 586 HD21 ASN 586 31.799 -0.182 6.152 400 HD22 ASN 586 HD22 ASN 586 32.141 -0.439 4.441 401 H THR 587 H THR 587 30.101 -6.106 7.441 402 HA THR 587 HA THR 587 33.077 -6.172 7.078 403 HB THR 587 HB THR 587 31.428 -7.525 9.214 404 HG1 THR 587 HG1 THR 587 31.802 -5.257 9.410 405 HG21 THR 587 HG21 THR 587 33.641 -8.058 10.224 406 HG22 THR 587 HG22 THR 587 34.446 -7.457 8.760 407 HG23 THR 587 HG23 THR 587 33.406 -8.898 8.681 408 H ILE 588 H ILE 588 34.062 -7.884 6.249 409 HA ILE 588 HA ILE 588 32.579 -10.252 5.270 410 HB ILE 588 HB ILE 588 32.625 -8.775 3.411 411 HG12 ILE 588 HG12 ILE 588 34.979 -10.673 2.998 412 HG13 ILE 588 HG13 ILE 588 33.285 -11.195 3.015 413 HG21 ILE 588 HG21 ILE 588 34.419 -7.212 4.146 414 HG22 ILE 588 HG22 ILE 588 35.626 -8.462 3.753 415 HG23 ILE 588 HG23 ILE 588 34.647 -7.715 2.474 416 HD11 ILE 588 HD11 ILE 588 32.868 -9.665 1.049 417 HD12 ILE 588 HD12 ILE 588 34.624 -9.348 0.993 418 HD13 ILE 588 HD13 ILE 588 34.016 -10.982 0.728 419 H GLU 589 H GLU 589 33.750 -12.139 5.207 420 HA GLU 589 HA GLU 589 36.541 -12.101 6.279 421 HB2 GLU 589 HB2 GLU 589 34.821 -13.159 7.769 422 HB3 GLU 589 HB3 GLU 589 34.501 -14.330 6.482 423 HG2 GLU 589 HG2 GLU 589 36.953 -14.984 6.574 424 HG3 GLU 589 HG3 GLU 589 37.140 -13.883 7.935 425 H VAL 590 H VAL 590 38.106 -13.031 5.038 426 HA VAL 590 HA VAL 590 37.434 -15.046 3.033 427 HB VAL 590 HB VAL 590 37.187 -13.012 1.717 428 HG11 VAL 590 HG11 VAL 590 39.045 -11.529 1.188 429 HG12 VAL 590 HG12 VAL 590 38.725 -11.501 2.926 430 HG13 VAL 590 HG13 VAL 590 40.120 -12.403 2.292 431 HG21 VAL 590 HG21 VAL 590 39.724 -14.490 0.916 432 HG22 VAL 590 HG22 VAL 590 38.059 -15.055 0.632 433 HG23 VAL 590 HG23 VAL 590 38.638 -13.572 -0.137 434 H ASN 591 H ASN 591 38.989 -16.549 2.794 435 HA ASN 591 HA ASN 591 40.748 -17.832 3.409 436 HB2 ASN 591 HB2 ASN 591 41.563 -16.336 1.557 437 HB3 ASN 591 HB3 ASN 591 42.309 -15.310 2.786 438 HD21 ASN 591 HD21 ASN 591 44.399 -15.687 1.942 439 HD22 ASN 591 HD22 ASN 591 45.188 -17.259 2.095 440 H GLY 592 H GLY 592 39.486 -16.864 5.684 441 HA2 GLY 592 HA2 GLY 592 39.787 -17.081 7.965 442 HA3 GLY 592 HA3 GLY 592 41.521 -17.297 7.710 443 H LYS 593 H LYS 593 40.500 -14.384 6.277 444 HA LYS 593 HA LYS 593 41.291 -12.749 8.661 445 HB2 LYS 593 HB2 LYS 593 42.003 -12.364 5.731 446 HB3 LYS 593 HB3 LYS 593 42.347 -11.194 7.008 447 HG2 LYS 593 HG2 LYS 593 43.772 -12.877 8.164 448 HG3 LYS 593 HG3 LYS 593 43.460 -14.033 6.855 449 HD2 LYS 593 HD2 LYS 593 44.475 -12.471 5.221 450 HD3 LYS 593 HD3 LYS 593 44.802 -11.311 6.530 451 HE2 LYS 593 HE2 LYS 593 46.204 -13.000 7.671 452 HE3 LYS 593 HE3 LYS 593 45.857 -14.165 6.396 453 HZ1 LYS 593 HZ1 LYS 593 46.966 -12.681 4.819 454 HZ2 LYS 593 HZ2 LYS 593 47.989 -13.059 6.023 455 HZ3 LYS 593 HZ3 LYS 593 47.291 -11.592 5.993 456 H TYR 594 H TYR 594 40.430 -10.714 8.871 457 HA TYR 594 HA TYR 594 37.730 -10.386 7.659 458 HB2 TYR 594 HB2 TYR 594 38.934 -9.286 10.210 459 HB3 TYR 594 HB3 TYR 594 37.380 -8.785 9.559 460 HD1 TYR 594 HD1 TYR 594 35.584 -10.510 9.076 461 HD2 TYR 594 HD2 TYR 594 39.041 -11.335 11.527 462 HE1 TYR 594 HE1 TYR 594 34.421 -12.469 10.059 463 HE2 TYR 594 HE2 TYR 594 37.888 -13.301 12.497 464 HH TYR 594 HH TYR 594 35.978 -14.605 12.466 465 H PHE 595 H PHE 595 36.999 -8.549 6.808 466 HA PHE 595 HA PHE 595 38.675 -6.144 6.425 467 HB2 PHE 595 HB2 PHE 595 37.612 -7.897 4.166 468 HB3 PHE 595 HB3 PHE 595 38.241 -6.287 3.931 469 HD1 PHE 595 HD1 PHE 595 39.039 -9.818 4.433 470 HD2 PHE 595 HD2 PHE 595 40.708 -5.853 4.300 471 HE1 PHE 595 HE1 PHE 595 41.294 -10.784 4.059 472 HE2 PHE 595 HE2 PHE 595 42.971 -6.821 3.934 473 HZ PHE 595 HZ PHE 595 43.268 -9.294 3.825 474 H HIS 596 H HIS 596 37.360 -4.433 5.239 475 HA HIS 596 HA HIS 596 34.485 -4.492 6.013 476 HB2 HIS 596 HB2 HIS 596 36.322 -2.417 4.845 477 HB3 HIS 596 HB3 HIS 596 34.607 -2.164 4.789 478 HD2 HIS 596 HD2 HIS 596 33.623 -2.540 7.742 479 HE1 HIS 596 HE1 HIS 596 36.859 0.002 8.817 480 HE2 HIS 596 HE2 HIS 596 34.634 -0.944 9.559 481 H SER 597 H SER 597 32.811 -4.548 4.483 482 HA SER 597 HA SER 597 33.301 -5.859 1.995 483 HB2 SER 597 HB2 SER 597 30.802 -4.348 2.813 484 HB3 SER 597 HB3 SER 597 30.924 -5.627 1.600 485 HG SER 597 HG SER 597 31.301 -7.100 3.168 486 H THR 598 H THR 598 32.532 -2.397 2.679 487 HA THR 598 HA THR 598 32.650 -1.532 -0.053 488 HB THR 598 HB THR 598 33.128 0.743 0.978 489 HG1 THR 598 HG1 THR 598 34.083 0.283 2.870 490 HG21 THR 598 HG21 THR 598 30.938 1.027 1.992 491 HG22 THR 598 HG22 THR 598 30.742 -0.731 2.150 492 HG23 THR 598 HG23 THR 598 30.821 0.012 0.537 493 H CYS 599 H CYS 599 35.237 -1.859 2.409 494 HA CYS 599 HA CYS 599 37.299 -0.635 0.849 495 HB2 CYS 599 HB2 CYS 599 37.367 -2.641 3.129 496 HB3 CYS 599 HB3 CYS 599 38.786 -1.872 2.483 497 H TYR 600 H TYR 600 36.628 -4.124 1.461 498 HA TYR 600 HA TYR 600 38.610 -5.154 -0.244 499 HB2 TYR 600 HB2 TYR 600 37.480 -6.364 1.567 500 HB3 TYR 600 HB3 TYR 600 35.992 -6.403 0.637 501 HD1 TYR 600 HD1 TYR 600 39.550 -7.543 0.704 502 HD2 TYR 600 HD2 TYR 600 35.653 -8.103 -1.065 503 HE1 TYR 600 HE1 TYR 600 40.365 -9.596 -0.425 504 HE2 TYR 600 HE2 TYR 600 36.466 -10.174 -2.178 505 HH TYR 600 HH TYR 600 39.843 -11.304 -1.875 506 H HIS 601 H HIS 601 35.218 -4.355 -1.030 507 HA HIS 601 HA HIS 601 34.923 -5.711 -3.427 508 HB2 HIS 601 HB2 HIS 601 33.057 -4.722 -2.255 509 HB3 HIS 601 HB3 HIS 601 33.711 -3.101 -2.448 510 HD2 HIS 601 HD2 HIS 601 32.598 -1.740 -4.304 511 HE1 HIS 601 HE1 HIS 601 31.147 -4.881 -6.789 512 HE2 HIS 601 HE2 HIS 601 31.206 -2.362 -6.453 513 H GLU 602 H GLU 602 35.831 -2.224 -3.292 514 HA GLU 602 HA GLU 602 36.475 -2.405 -6.187 515 HB2 GLU 602 HB2 GLU 602 34.868 -0.739 -5.282 516 HB3 GLU 602 HB3 GLU 602 36.200 0.063 -4.444 517 HG2 GLU 602 HG2 GLU 602 37.179 0.773 -6.489 518 HG3 GLU 602 HG3 GLU 602 36.340 -0.460 -7.424 519 H THR 603 H THR 603 38.238 -2.568 -3.297 520 HA THR 603 HA THR 603 40.649 -1.174 -4.319 521 HB THR 603 HB THR 603 40.284 -2.832 -1.805 522 HG1 THR 603 HG1 THR 603 39.187 -0.975 -1.642 523 HG21 THR 603 HG21 THR 603 42.364 -1.695 -1.036 524 HG22 THR 603 HG22 THR 603 42.611 -1.083 -2.691 525 HG23 THR 603 HG23 THR 603 42.652 -2.832 -2.357 526 H SER 604 H SER 604 39.508 -4.537 -4.073 527 HA SER 604 HA SER 604 42.029 -5.753 -4.754 528 HB2 SER 604 HB2 SER 604 40.189 -6.931 -3.592 529 HB3 SER 604 HB3 SER 604 39.217 -6.847 -5.070 530 HG SER 604 HG SER 604 40.392 -8.835 -4.843 531 H GLN 605 H GLN 605 42.682 -6.748 -6.694 532 HA GLN 605 HA GLN 605 41.894 -5.425 -9.196 533 HB2 GLN 605 HB2 GLN 605 44.251 -5.941 -8.685 534 HB3 GLN 605 HB3 GLN 605 43.880 -7.669 -8.691 535 HG2 GLN 605 HG2 GLN 605 43.164 -7.480 -11.088 536 HG3 GLN 605 HG3 GLN 605 43.531 -5.757 -11.046 537 HE21 GLN 605 HE21 GLN 605 44.773 -7.000 -13.028 538 HE22 GLN 605 HE22 GLN 605 46.460 -7.322 -12.636 539 H ASN 606 H ASN 606 39.689 -6.011 -9.231 540 HA ASN 606 HA ASN 606 38.746 -8.727 -9.354 541 HB2 ASN 606 HB2 ASN 606 37.470 -6.141 -10.318 542 HB3 ASN 606 HB3 ASN 606 36.629 -7.673 -10.116 543 HD21 ASN 606 HD21 ASN 606 36.493 -4.882 -8.716 544 HD22 ASN 606 HD22 ASN 606 36.471 -5.340 -7.019 545 H SER 607 H SER 607 37.640 -9.713 -11.219 546 HA SER 607 HA SER 607 38.901 -9.197 -13.864 547 HB2 SER 607 HB2 SER 607 40.311 -10.810 -12.599 548 HB3 SER 607 HB3 SER 607 38.919 -11.893 -12.471 549 HG SER 607 HG SER 607 40.289 -12.396 -14.243 550 H SER 608 H SER 608 37.909 -10.329 -15.619 551 HA SER 608 HA SER 608 35.099 -9.930 -15.735 552 HB2 SER 608 HB2 SER 608 36.889 -11.435 -17.676 553 HB3 SER 608 HB3 SER 608 35.286 -10.783 -18.028 554 HG SER 608 HG SER 608 36.106 -8.694 -17.656 Start of MODEL 8 1 H1 GLY 533 H1 GLY 533 12.065 11.834 -0.745 2 H2 GLY 533 H2 GLY 533 12.157 12.838 0.550 3 H3 GLY 533 H3 GLY 533 13.070 11.476 0.504 4 HA2 GLY 533 HA2 GLY 533 14.434 13.409 0.039 5 HA3 GLY 533 HA3 GLY 533 14.360 12.297 -1.339 6 H GLY 534 H GLY 534 14.604 15.391 -0.892 7 HA2 GLY 534 HA2 GLY 534 12.307 16.539 -2.251 8 HA3 GLY 534 HA3 GLY 534 13.793 17.356 -1.782 9 H SER 535 H SER 535 15.018 14.912 -3.553 10 HA SER 535 HA SER 535 14.435 15.857 -6.267 11 HB2 SER 535 HB2 SER 535 16.154 17.465 -5.299 12 HB3 SER 535 HB3 SER 535 17.263 16.093 -5.188 13 HG SER 535 HG SER 535 16.174 17.352 -7.466 14 H GLU 536 H GLU 536 15.861 14.640 -7.879 15 HA GLU 536 HA GLU 536 15.524 11.797 -7.411 16 HB2 GLU 536 HB2 GLU 536 16.177 11.523 -9.694 17 HB3 GLU 536 HB3 GLU 536 15.061 12.882 -9.570 18 HG2 GLU 536 HG2 GLU 536 17.083 14.427 -9.594 19 HG3 GLU 536 HG3 GLU 536 18.082 13.022 -9.952 20 H PHE 537 H PHE 537 17.118 10.134 -7.655 21 HA PHE 537 HA PHE 537 19.601 10.594 -6.231 22 HB2 PHE 537 HB2 PHE 537 18.609 8.162 -7.757 23 HB3 PHE 537 HB3 PHE 537 20.012 8.201 -6.706 24 HD1 PHE 537 HD1 PHE 537 19.739 8.637 -4.229 25 HD2 PHE 537 HD2 PHE 537 16.388 7.882 -6.838 26 HE1 PHE 537 HE1 PHE 537 18.329 8.077 -2.263 27 HE2 PHE 537 HE2 PHE 537 14.984 7.332 -4.867 28 HZ PHE 537 HZ PHE 537 15.952 7.425 -2.581 29 H SER 538 H SER 538 21.721 10.384 -6.965 30 HA SER 538 HA SER 538 22.288 11.212 -9.720 31 HB2 SER 538 HB2 SER 538 24.567 11.360 -9.051 32 HB3 SER 538 HB3 SER 538 23.573 12.084 -7.788 33 HG SER 538 HG SER 538 23.856 10.185 -6.566 34 H ASP 539 H ASP 539 23.995 10.076 -10.998 35 HA ASP 539 HA ASP 539 23.187 7.343 -11.495 36 HB2 ASP 539 HB2 ASP 539 23.641 9.177 -13.190 37 HB3 ASP 539 HB3 ASP 539 25.355 8.967 -12.866 38 H ARG 540 H ARG 540 24.847 7.947 -9.003 39 HA ARG 540 HA ARG 540 27.426 6.636 -9.301 40 HB2 ARG 540 HB2 ARG 540 25.738 7.443 -6.899 41 HB3 ARG 540 HB3 ARG 540 27.308 6.654 -6.745 42 HG2 ARG 540 HG2 ARG 540 28.415 8.475 -7.950 43 HG3 ARG 540 HG3 ARG 540 26.866 9.300 -8.196 44 HD2 ARG 540 HD2 ARG 540 26.584 9.534 -5.748 45 HD3 ARG 540 HD3 ARG 540 28.053 8.601 -5.478 46 HE ARG 540 HE ARG 540 29.378 10.423 -5.998 47 HH11 ARG 540 HH11 ARG 540 26.094 11.281 -6.908 48 HH12 ARG 540 HH12 ARG 540 26.489 12.981 -7.039 49 HH21 ARG 540 HH21 ARG 540 29.811 12.574 -6.217 50 HH22 ARG 540 HH22 ARG 540 28.550 13.683 -6.687 51 H SER 541 H SER 541 28.120 4.694 -8.373 52 HA SER 541 HA SER 541 26.369 2.392 -8.641 53 HB2 SER 541 HB2 SER 541 28.345 1.122 -7.918 54 HB3 SER 541 HB3 SER 541 28.713 2.231 -9.240 55 HG SER 541 HG SER 541 30.284 2.300 -7.569 56 H ASN 542 H ASN 542 25.954 0.811 -6.954 57 HA ASN 542 HA ASN 542 24.827 2.050 -4.606 58 HB2 ASN 542 HB2 ASN 542 23.885 0.126 -5.960 59 HB3 ASN 542 HB3 ASN 542 25.111 -0.918 -5.234 60 HD21 ASN 542 HD21 ASN 542 21.980 -0.497 -5.062 61 HD22 ASN 542 HD22 ASN 542 21.728 -0.687 -3.334 62 H GLU 543 H GLU 543 25.740 2.417 -2.691 63 HA GLU 543 HA GLU 543 28.043 0.759 -1.736 64 HB2 GLU 543 HB2 GLU 543 28.888 2.536 -0.592 65 HB3 GLU 543 HB3 GLU 543 28.518 3.169 -2.192 66 HG2 GLU 543 HG2 GLU 543 26.778 3.516 0.274 67 HG3 GLU 543 HG3 GLU 543 28.016 4.656 -0.216 68 H LEU 544 H LEU 544 24.774 1.841 -0.979 69 HA LEU 544 HA LEU 544 24.801 1.332 1.798 70 HB2 LEU 544 HB2 LEU 544 23.082 2.661 0.673 71 HB3 LEU 544 HB3 LEU 544 22.559 1.260 -0.258 72 HG LEU 544 HG LEU 544 21.731 0.165 1.807 73 HD11 LEU 544 HD11 LEU 544 22.574 2.748 3.198 74 HD12 LEU 544 HD12 LEU 544 23.268 1.129 3.480 75 HD13 LEU 544 HD13 LEU 544 21.585 1.454 3.912 76 HD21 LEU 544 HD21 LEU 544 19.855 1.682 2.226 77 HD22 LEU 544 HD22 LEU 544 20.243 1.621 0.496 78 HD23 LEU 544 HD23 LEU 544 20.738 3.022 1.463 79 H GLU 545 H GLU 545 24.060 -0.900 -0.913 80 HA GLU 545 HA GLU 545 23.421 -3.092 0.891 81 HB2 GLU 545 HB2 GLU 545 23.983 -3.041 -2.104 82 HB3 GLU 545 HB3 GLU 545 23.487 -4.478 -1.190 83 HG2 GLU 545 HG2 GLU 545 21.409 -3.336 -0.481 84 HG3 GLU 545 HG3 GLU 545 21.875 -1.911 -1.403 85 H ILE 546 H ILE 546 26.415 -1.803 -0.230 86 HA ILE 546 HA ILE 546 27.984 -4.219 0.393 87 HB ILE 546 HB ILE 546 28.952 -1.346 0.184 88 HG12 ILE 546 HG12 ILE 546 27.869 -2.024 -1.972 89 HG13 ILE 546 HG13 ILE 546 29.579 -1.662 -2.070 90 HG21 ILE 546 HG21 ILE 546 30.380 -4.024 0.139 91 HG22 ILE 546 HG22 ILE 546 31.120 -2.483 -0.326 92 HG23 ILE 546 HG23 ILE 546 30.532 -2.722 1.331 93 HD11 ILE 546 HD11 ILE 546 28.465 -4.490 -1.962 94 HD12 ILE 546 HD12 ILE 546 28.953 -3.625 -3.435 95 HD13 ILE 546 HD13 ILE 546 30.165 -4.015 -2.205 96 H ARG 547 H ARG 547 27.005 -1.163 1.977 97 HA ARG 547 HA ARG 547 28.439 -1.608 4.446 98 HB2 ARG 547 HB2 ARG 547 27.602 0.578 3.495 99 HB3 ARG 547 HB3 ARG 547 25.970 0.149 3.992 100 HG2 ARG 547 HG2 ARG 547 28.300 0.203 5.950 101 HG3 ARG 547 HG3 ARG 547 27.484 1.683 5.483 102 HD2 ARG 547 HD2 ARG 547 26.029 -0.675 6.770 103 HD3 ARG 547 HD3 ARG 547 26.704 0.669 7.656 104 HE ARG 547 HE ARG 547 24.326 0.693 5.904 105 HH11 ARG 547 HH11 ARG 547 26.516 2.679 7.816 106 HH12 ARG 547 HH12 ARG 547 25.372 4.000 7.895 107 HH21 ARG 547 HH21 ARG 547 22.932 2.410 6.057 108 HH22 ARG 547 HH22 ARG 547 23.419 3.862 6.889 109 H GLY 548 H GLY 548 25.183 -2.406 3.384 110 HA2 GLY 548 HA2 GLY 548 24.155 -3.488 5.796 111 HA3 GLY 548 HA3 GLY 548 23.601 -3.848 4.152 112 H LYS 549 H LYS 549 26.722 -4.890 3.969 113 HA LYS 549 HA LYS 549 26.088 -7.697 4.515 114 HB2 LYS 549 HB2 LYS 549 28.783 -6.406 3.946 115 HB3 LYS 549 HB3 LYS 549 28.425 -8.121 3.915 116 HG2 LYS 549 HG2 LYS 549 27.360 -6.012 1.996 117 HG3 LYS 549 HG3 LYS 549 28.558 -7.246 1.648 118 HD2 LYS 549 HD2 LYS 549 26.823 -9.015 2.011 119 HD3 LYS 549 HD3 LYS 549 25.614 -7.744 2.308 120 HE2 LYS 549 HE2 LYS 549 26.049 -6.813 0.053 121 HE3 LYS 549 HE3 LYS 549 27.215 -8.101 -0.255 122 HZ1 LYS 549 HZ1 LYS 549 25.371 -9.701 0.006 123 HZ2 LYS 549 HZ2 LYS 549 25.046 -8.644 -1.185 124 HZ3 LYS 549 HZ3 LYS 549 24.313 -8.478 0.257 125 H TYR 550 H TYR 550 26.547 -8.919 6.313 126 HA TYR 550 HA TYR 550 28.342 -7.850 8.361 127 HB2 TYR 550 HB2 TYR 550 26.751 -7.884 10.181 128 HB3 TYR 550 HB3 TYR 550 26.174 -6.793 8.964 129 HD1 TYR 550 HD1 TYR 550 24.078 -7.223 7.776 130 HD2 TYR 550 HD2 TYR 550 25.643 -10.097 10.578 131 HE1 TYR 550 HE1 TYR 550 21.922 -8.457 7.712 132 HE2 TYR 550 HE2 TYR 550 23.482 -11.331 10.515 133 HH TYR 550 HH TYR 550 20.727 -10.260 8.513 134 H VAL 551 H VAL 551 28.611 -9.197 10.204 135 HA VAL 551 HA VAL 551 27.990 -12.084 9.948 136 HB VAL 551 HB VAL 551 30.407 -12.447 10.871 137 HG11 VAL 551 HG11 VAL 551 31.248 -12.808 8.595 138 HG12 VAL 551 HG12 VAL 551 29.570 -13.318 8.699 139 HG13 VAL 551 HG13 VAL 551 29.964 -11.767 7.929 140 HG21 VAL 551 HG21 VAL 551 32.146 -11.027 9.960 141 HG22 VAL 551 HG22 VAL 551 30.940 -9.884 9.335 142 HG23 VAL 551 HG23 VAL 551 31.124 -10.122 11.090 143 H VAL 552 H VAL 552 27.584 -13.092 11.936 144 HA VAL 552 HA VAL 552 26.769 -11.267 14.024 145 HB VAL 552 HB VAL 552 26.783 -14.294 13.938 146 HG11 VAL 552 HG11 VAL 552 25.209 -14.249 15.821 147 HG12 VAL 552 HG12 VAL 552 26.786 -13.626 16.306 148 HG13 VAL 552 HG13 VAL 552 25.437 -12.498 15.993 149 HG21 VAL 552 HG21 VAL 552 24.383 -14.081 13.573 150 HG22 VAL 552 HG22 VAL 552 24.467 -12.313 13.672 151 HG23 VAL 552 HG23 VAL 552 25.230 -13.162 12.321 152 H VAL 553 H VAL 553 27.670 -10.711 15.897 153 HA VAL 553 HA VAL 553 30.493 -11.187 16.434 154 HB VAL 553 HB VAL 553 28.328 -9.737 18.000 155 HG11 VAL 553 HG11 VAL 553 30.179 -8.754 19.303 156 HG12 VAL 553 HG12 VAL 553 30.060 -10.481 19.579 157 HG13 VAL 553 HG13 VAL 553 31.332 -9.840 18.497 158 HG21 VAL 553 HG21 VAL 553 29.342 -7.707 17.308 159 HG22 VAL 553 HG22 VAL 553 30.707 -8.546 16.547 160 HG23 VAL 553 HG23 VAL 553 29.078 -8.650 15.823 161 HA PRO 554 HA PRO 554 29.407 -14.788 19.015 162 HB2 PRO 554 HB2 PRO 554 31.871 -15.698 19.635 163 HB3 PRO 554 HB3 PRO 554 31.215 -15.803 17.973 164 HG2 PRO 554 HG2 PRO 554 33.118 -13.727 19.075 165 HG3 PRO 554 HG3 PRO 554 33.244 -14.646 17.550 166 HD2 PRO 554 HD2 PRO 554 32.174 -12.097 17.721 167 HD3 PRO 554 HD3 PRO 554 31.656 -13.285 16.490 168 H GLU 555 H GLU 555 29.299 -15.240 21.248 169 HA GLU 555 HA GLU 555 29.663 -13.135 23.153 170 HB2 GLU 555 HB2 GLU 555 29.376 -16.132 23.587 171 HB3 GLU 555 HB3 GLU 555 29.246 -14.900 24.842 172 HG2 GLU 555 HG2 GLU 555 27.360 -13.851 23.513 173 HG3 GLU 555 HG3 GLU 555 27.381 -15.271 22.465 174 H THR 556 H THR 556 31.972 -15.473 21.950 175 HA THR 556 HA THR 556 33.878 -15.238 24.139 176 HB THR 556 HB THR 556 35.375 -16.508 22.639 177 HG1 THR 556 HG1 THR 556 34.853 -15.915 20.644 178 HG21 THR 556 HG21 THR 556 32.570 -17.694 22.717 179 HG22 THR 556 HG22 THR 556 33.747 -17.736 24.052 180 HG23 THR 556 HG23 THR 556 34.098 -18.576 22.534 181 H SER 557 H SER 557 33.101 -13.139 21.526 182 HA SER 557 HA SER 557 35.724 -12.152 20.899 183 HB2 SER 557 HB2 SER 557 34.656 -10.216 19.943 184 HB3 SER 557 HB3 SER 557 33.795 -11.668 19.457 185 HG SER 557 HG SER 557 32.193 -11.187 20.909 186 H GLN 558 H GLN 558 36.942 -10.441 21.643 187 HA GLN 558 HA GLN 558 36.366 -9.372 24.351 188 HB2 GLN 558 HB2 GLN 558 38.723 -8.921 22.495 189 HB3 GLN 558 HB3 GLN 558 38.531 -8.279 24.134 190 HG2 GLN 558 HG2 GLN 558 38.306 -10.712 24.939 191 HG3 GLN 558 HG3 GLN 558 38.805 -11.206 23.334 192 HE21 GLN 558 HE21 GLN 558 40.903 -12.018 23.681 193 HE22 GLN 558 HE22 GLN 558 42.152 -11.108 24.525 194 H ASP 559 H ASP 559 35.146 -7.684 24.598 195 HA ASP 559 HA ASP 559 33.888 -5.854 24.254 196 HB2 ASP 559 HB2 ASP 559 36.403 -4.789 22.956 197 HB3 ASP 559 HB3 ASP 559 35.106 -3.832 23.654 198 H MET 560 H MET 560 33.639 -7.798 22.019 199 HA MET 560 HA MET 560 32.749 -8.025 19.960 200 HB2 MET 560 HB2 MET 560 31.355 -5.375 20.557 201 HB3 MET 560 HB3 MET 560 30.854 -6.610 19.396 202 HG2 MET 560 HG2 MET 560 30.769 -8.233 21.379 203 HG3 MET 560 HG3 MET 560 30.916 -6.828 22.431 204 HE1 MET 560 HE1 MET 560 28.432 -9.262 21.084 205 HE2 MET 560 HE2 MET 560 28.721 -8.841 22.793 206 HE3 MET 560 HE3 MET 560 27.144 -8.520 22.061 207 H ALA 561 H ALA 561 35.353 -6.952 19.896 208 HA ALA 561 HA ALA 561 35.235 -5.172 17.508 209 HB1 ALA 561 HB1 ALA 561 37.183 -5.122 19.831 210 HB2 ALA 561 HB2 ALA 561 37.227 -4.072 18.395 211 HB3 ALA 561 HB3 ALA 561 35.863 -3.976 19.527 212 H PHE 562 H PHE 562 36.706 -5.354 15.871 213 HA PHE 562 HA PHE 562 38.993 -7.123 15.983 214 HB2 PHE 562 HB2 PHE 562 36.870 -8.556 15.337 215 HB3 PHE 562 HB3 PHE 562 37.053 -7.793 13.763 216 HD1 PHE 562 HD1 PHE 562 38.648 -9.962 16.316 217 HD2 PHE 562 HD2 PHE 562 38.934 -8.433 12.302 218 HE1 PHE 562 HE1 PHE 562 40.475 -11.573 15.833 219 HE2 PHE 562 HE2 PHE 562 40.804 -10.005 11.835 220 HZ PHE 562 HZ PHE 562 41.562 -11.586 13.592 221 H LYS 563 H LYS 563 40.228 -7.005 13.784 222 HA LYS 563 HA LYS 563 40.151 -4.139 12.947 223 HB2 LYS 563 HB2 LYS 563 42.050 -5.035 14.323 224 HB3 LYS 563 HB3 LYS 563 42.505 -6.045 12.953 225 HG2 LYS 563 HG2 LYS 563 42.842 -3.980 11.568 226 HG3 LYS 563 HG3 LYS 563 42.379 -2.985 12.955 227 HD2 LYS 563 HD2 LYS 563 44.765 -4.884 12.823 228 HD3 LYS 563 HD3 LYS 563 44.824 -3.133 12.576 229 HE2 LYS 563 HE2 LYS 563 43.981 -2.768 14.884 230 HE3 LYS 563 HE3 LYS 563 43.932 -4.508 15.151 231 HZ1 LYS 563 HZ1 LYS 563 45.969 -3.571 16.042 232 HZ2 LYS 563 HZ2 LYS 563 46.385 -2.940 14.605 233 HZ3 LYS 563 HZ3 LYS 563 46.348 -4.559 14.801 234 H CYS 564 H CYS 564 40.449 -3.442 10.913 235 HA CYS 564 HA CYS 564 40.194 -5.228 8.568 236 HB2 CYS 564 HB2 CYS 564 38.826 -3.040 8.912 237 HB3 CYS 564 HB3 CYS 564 40.310 -2.186 8.741 238 HA PRO 565 HA PRO 565 44.759 -4.681 8.468 239 HB2 PRO 565 HB2 PRO 565 44.441 -6.521 6.098 240 HB3 PRO 565 HB3 PRO 565 45.642 -6.584 7.421 241 HG2 PRO 565 HG2 PRO 565 43.530 -8.275 7.408 242 HG3 PRO 565 HG3 PRO 565 44.038 -7.480 8.935 243 HD2 PRO 565 HD2 PRO 565 41.777 -6.688 7.071 244 HD3 PRO 565 HD3 PRO 565 41.793 -6.812 8.848 245 H ILE 566 H ILE 566 42.474 -4.046 5.866 246 HA ILE 566 HA ILE 566 44.366 -3.011 3.921 247 HB ILE 566 HB ILE 566 41.371 -2.700 4.213 248 HG12 ILE 566 HG12 ILE 566 42.980 -4.341 2.191 249 HG13 ILE 566 HG13 ILE 566 42.390 -4.998 3.710 250 HG21 ILE 566 HG21 ILE 566 41.383 -1.899 1.819 251 HG22 ILE 566 HG22 ILE 566 42.181 -0.779 2.910 252 HG23 ILE 566 HG23 ILE 566 43.155 -1.847 1.879 253 HD11 ILE 566 HD11 ILE 566 40.035 -4.493 3.021 254 HD12 ILE 566 HD12 ILE 566 40.657 -3.987 1.429 255 HD13 ILE 566 HD13 ILE 566 40.869 -5.654 1.976 256 H CYS 567 H CYS 567 42.011 -1.347 6.082 257 HA CYS 567 HA CYS 567 43.551 1.163 5.730 258 HB2 CYS 567 HB2 CYS 567 41.577 2.313 6.226 259 HB3 CYS 567 HB3 CYS 567 41.174 1.085 5.017 260 H LYS 568 H LYS 568 43.474 -1.266 7.878 261 HA LYS 568 HA LYS 568 44.065 -1.676 10.011 262 HB2 LYS 568 HB2 LYS 568 45.813 -0.525 11.085 263 HB3 LYS 568 HB3 LYS 568 46.187 -0.882 9.417 264 HG2 LYS 568 HG2 LYS 568 45.940 1.441 8.763 265 HG3 LYS 568 HG3 LYS 568 45.350 1.886 10.380 266 HD2 LYS 568 HD2 LYS 568 47.531 1.160 11.343 267 HD3 LYS 568 HD3 LYS 568 48.122 0.807 9.718 268 HE2 LYS 568 HE2 LYS 568 47.212 3.542 10.723 269 HE3 LYS 568 HE3 LYS 568 48.886 3.006 10.647 270 HZ1 LYS 568 HZ1 LYS 568 48.623 2.766 8.225 271 HZ2 LYS 568 HZ2 LYS 568 48.373 4.302 8.705 272 HZ3 LYS 568 HZ3 LYS 568 47.103 3.359 8.309 273 H GLU 569 H GLU 569 41.535 -1.005 9.897 274 HA GLU 569 HA GLU 569 41.134 0.788 12.282 275 HB2 GLU 569 HB2 GLU 569 39.465 0.538 9.783 276 HB3 GLU 569 HB3 GLU 569 38.841 1.249 11.247 277 HG2 GLU 569 HG2 GLU 569 41.257 2.289 9.723 278 HG3 GLU 569 HG3 GLU 569 39.630 2.940 9.617 279 H THR 570 H THR 570 39.521 0.378 13.727 280 HA THR 570 HA THR 570 38.923 -2.486 14.014 281 HB THR 570 HB THR 570 38.621 -0.167 15.946 282 HG1 THR 570 HG1 THR 570 40.481 -1.051 16.814 283 HG21 THR 570 HG21 THR 570 38.423 -3.178 16.413 284 HG22 THR 570 HG22 THR 570 37.118 -1.977 16.615 285 HG23 THR 570 HG23 THR 570 38.510 -1.941 17.690 286 H VAL 571 H VAL 571 37.030 -3.354 13.507 287 HA VAL 571 HA VAL 571 34.540 -1.777 13.218 288 HB VAL 571 HB VAL 571 33.476 -4.049 12.874 289 HG11 VAL 571 HG11 VAL 571 35.508 -3.109 10.845 290 HG12 VAL 571 HG12 VAL 571 34.074 -4.125 10.553 291 HG13 VAL 571 HG13 VAL 571 33.863 -2.453 11.091 292 HG21 VAL 571 HG21 VAL 571 36.308 -4.976 12.317 293 HG22 VAL 571 HG22 VAL 571 35.340 -5.454 13.748 294 HG23 VAL 571 HG23 VAL 571 34.800 -5.895 12.123 295 H THR 572 H THR 572 32.768 -1.979 14.598 296 HA THR 572 HA THR 572 33.136 -3.551 17.105 297 HB THR 572 HB THR 572 31.982 -1.805 18.355 298 HG1 THR 572 HG1 THR 572 31.754 0.223 17.429 299 HG21 THR 572 HG21 THR 572 33.829 -0.261 18.567 300 HG22 THR 572 HG22 THR 572 34.451 -0.675 16.959 301 HG23 THR 572 HG23 THR 572 34.490 -1.881 18.264 302 H GLY 573 H GLY 573 31.357 -4.501 17.971 303 HA2 GLY 573 HA2 GLY 573 29.332 -5.372 16.190 304 HA3 GLY 573 HA3 GLY 573 29.369 -5.664 17.926 305 H VAL 574 H VAL 574 27.161 -4.982 16.029 306 HA VAL 574 HA VAL 574 25.871 -2.930 17.748 307 HB VAL 574 HB VAL 574 25.605 -3.215 14.709 308 HG11 VAL 574 HG11 VAL 574 23.449 -2.556 15.604 309 HG12 VAL 574 HG12 VAL 574 24.205 -1.283 16.602 310 HG13 VAL 574 HG13 VAL 574 24.199 -1.167 14.834 311 HG21 VAL 574 HG21 VAL 574 26.780 -0.930 16.353 312 HG22 VAL 574 HG22 VAL 574 27.683 -2.046 15.318 313 HG23 VAL 574 HG23 VAL 574 26.528 -0.915 14.601 314 H TYR 575 H TYR 575 23.806 -3.387 18.449 315 HA TYR 575 HA TYR 575 22.957 -6.131 18.303 316 HB2 TYR 575 HB2 TYR 575 22.727 -4.707 20.291 317 HB3 TYR 575 HB3 TYR 575 21.629 -3.641 19.432 318 HD1 TYR 575 HD1 TYR 575 19.307 -3.992 19.784 319 HD2 TYR 575 HD2 TYR 575 22.054 -7.272 20.331 320 HE1 TYR 575 HE1 TYR 575 17.451 -5.405 20.648 321 HE2 TYR 575 HE2 TYR 575 20.191 -8.681 21.201 322 HH TYR 575 HH TYR 575 16.861 -7.411 21.535 323 H ASP 576 H ASP 576 21.825 -7.097 16.703 324 HA ASP 576 HA ASP 576 19.982 -5.580 14.968 325 HB2 ASP 576 HB2 ASP 576 21.431 -7.415 14.070 326 HB3 ASP 576 HB3 ASP 576 20.547 -8.557 15.062 327 H GLU 577 H GLU 577 18.124 -5.031 15.863 328 HA GLU 577 HA GLU 577 17.003 -6.174 18.217 329 HB2 GLU 577 HB2 GLU 577 15.755 -4.358 16.119 330 HB3 GLU 577 HB3 GLU 577 15.092 -4.656 17.731 331 HG2 GLU 577 HG2 GLU 577 17.091 -3.685 18.767 332 HG3 GLU 577 HG3 GLU 577 17.800 -3.373 17.184 333 H GLU 578 H GLU 578 16.483 -7.058 14.846 334 HA GLU 578 HA GLU 578 13.866 -8.275 15.344 335 HB2 GLU 578 HB2 GLU 578 14.430 -7.187 13.189 336 HB3 GLU 578 HB3 GLU 578 15.680 -8.388 12.901 337 HG2 GLU 578 HG2 GLU 578 13.665 -8.902 11.626 338 HG3 GLU 578 HG3 GLU 578 14.035 -10.180 12.760 339 H SER 579 H SER 579 17.157 -9.555 14.645 340 HA SER 579 HA SER 579 16.351 -12.329 15.215 341 HB2 SER 579 HB2 SER 579 18.686 -12.858 14.851 342 HB3 SER 579 HB3 SER 579 18.082 -11.834 13.545 343 HG SER 579 HG SER 579 20.033 -11.023 14.193 344 H GLY 580 H GLY 580 17.868 -9.643 16.944 345 HA2 GLY 580 HA2 GLY 580 17.989 -9.305 19.235 346 HA3 GLY 580 HA3 GLY 580 17.535 -10.986 19.559 347 H GLU 581 H GLU 581 20.170 -9.898 17.351 348 HA GLU 581 HA GLU 581 22.217 -11.021 19.197 349 HB2 GLU 581 HB2 GLU 581 21.911 -11.801 16.276 350 HB3 GLU 581 HB3 GLU 581 23.236 -12.262 17.349 351 HG2 GLU 581 HG2 GLU 581 21.566 -13.390 18.851 352 HG3 GLU 581 HG3 GLU 581 20.330 -13.109 17.622 353 H TRP 582 H TRP 582 24.301 -10.193 18.943 354 HA TRP 582 HA TRP 582 24.436 -7.552 17.692 355 HB2 TRP 582 HB2 TRP 582 26.467 -9.133 19.298 356 HB3 TRP 582 HB3 TRP 582 26.702 -7.501 18.691 357 HD1 TRP 582 HD1 TRP 582 24.426 -9.401 21.179 358 HE1 TRP 582 HE1 TRP 582 23.632 -7.782 22.996 359 HE3 TRP 582 HE3 TRP 582 26.431 -5.080 19.343 360 HZ2 TRP 582 HZ2 TRP 582 23.819 -4.959 23.577 361 HZ3 TRP 582 HZ3 TRP 582 26.088 -2.922 20.519 362 HH2 TRP 582 HH2 TRP 582 24.789 -2.850 22.649 363 H VAL 583 H VAL 583 25.629 -6.946 15.965 364 HA VAL 583 HA VAL 583 26.945 -9.025 14.277 365 HB VAL 583 HB VAL 583 25.880 -8.002 12.308 366 HG11 VAL 583 HG11 VAL 583 23.686 -9.124 12.578 367 HG12 VAL 583 HG12 VAL 583 25.031 -10.111 13.189 368 HG13 VAL 583 HG13 VAL 583 23.971 -9.248 14.325 369 HG21 VAL 583 HG21 VAL 583 23.852 -6.748 14.200 370 HG22 VAL 583 HG22 VAL 583 25.098 -5.830 13.348 371 HG23 VAL 583 HG23 VAL 583 23.864 -6.708 12.423 372 H TRP 584 H TRP 584 28.556 -8.436 12.982 373 HA TRP 584 HA TRP 584 29.813 -5.755 13.286 374 HB2 TRP 584 HB2 TRP 584 30.674 -8.499 12.405 375 HB3 TRP 584 HB3 TRP 584 31.540 -7.111 11.777 376 HD1 TRP 584 HD1 TRP 584 31.945 -5.311 14.177 377 HE1 TRP 584 HE1 TRP 584 33.339 -6.008 16.234 378 HE3 TRP 584 HE3 TRP 584 31.848 -10.385 13.565 379 HZ2 TRP 584 HZ2 TRP 584 34.490 -8.429 17.301 380 HZ3 TRP 584 HZ3 TRP 584 33.136 -11.862 15.089 381 HH2 TRP 584 HH2 TRP 584 34.430 -10.892 16.978 382 H LYS 585 H LYS 585 28.511 -4.475 12.073 383 HA LYS 585 HA LYS 585 27.563 -5.111 9.374 384 HB2 LYS 585 HB2 LYS 585 27.695 -2.500 10.931 385 HB3 LYS 585 HB3 LYS 585 26.929 -2.713 9.342 386 HG2 LYS 585 HG2 LYS 585 25.419 -4.446 10.314 387 HG3 LYS 585 HG3 LYS 585 26.125 -4.155 11.915 388 HD2 LYS 585 HD2 LYS 585 25.450 -1.782 11.794 389 HD3 LYS 585 HD3 LYS 585 24.714 -2.051 10.221 390 HE2 LYS 585 HE2 LYS 585 23.909 -3.511 12.778 391 HE3 LYS 585 HE3 LYS 585 23.137 -2.034 12.209 392 HZ1 LYS 585 HZ1 LYS 585 22.489 -3.220 10.181 393 HZ2 LYS 585 HZ2 LYS 585 21.884 -3.958 11.494 394 HZ3 LYS 585 HZ3 LYS 585 23.166 -4.602 10.717 395 H ASN 586 H ASN 586 28.189 -3.894 7.448 396 HA ASN 586 HA ASN 586 29.698 -3.425 5.848 397 HB2 ASN 586 HB2 ASN 586 29.624 -1.311 7.213 398 HB3 ASN 586 HB3 ASN 586 31.083 -1.839 8.044 399 HD21 ASN 586 HD21 ASN 586 31.303 -2.576 4.624 400 HD22 ASN 586 HD22 ASN 586 32.195 -1.095 4.257 401 H THR 587 H THR 587 30.158 -5.963 7.189 402 HA THR 587 HA THR 587 33.149 -6.204 7.115 403 HB THR 587 HB THR 587 31.312 -7.629 9.060 404 HG1 THR 587 HG1 THR 587 31.663 -5.393 9.488 405 HG21 THR 587 HG21 THR 587 34.351 -7.553 8.849 406 HG22 THR 587 HG22 THR 587 33.312 -8.989 8.648 407 HG23 THR 587 HG23 THR 587 33.430 -8.195 10.220 408 H ILE 588 H ILE 588 34.099 -8.015 6.365 409 HA ILE 588 HA ILE 588 32.532 -10.259 5.281 410 HB ILE 588 HB ILE 588 32.678 -8.681 3.419 411 HG12 ILE 588 HG12 ILE 588 34.695 -10.909 2.967 412 HG13 ILE 588 HG13 ILE 588 32.944 -11.175 3.024 413 HG21 ILE 588 HG21 ILE 588 34.757 -7.884 2.447 414 HG22 ILE 588 HG22 ILE 588 34.779 -7.459 4.154 415 HG23 ILE 588 HG23 ILE 588 35.716 -8.851 3.576 416 HD11 ILE 588 HD11 ILE 588 34.510 -9.605 0.957 417 HD12 ILE 588 HD12 ILE 588 33.586 -11.089 0.724 418 HD13 ILE 588 HD13 ILE 588 32.730 -9.570 1.058 419 H GLU 589 H GLU 589 33.731 -12.209 5.097 420 HA GLU 589 HA GLU 589 36.517 -12.189 6.181 421 HB2 GLU 589 HB2 GLU 589 34.939 -13.448 7.578 422 HB3 GLU 589 HB3 GLU 589 34.495 -14.448 6.186 423 HG2 GLU 589 HG2 GLU 589 36.887 -15.172 5.995 424 HG3 GLU 589 HG3 GLU 589 37.254 -14.238 7.439 425 H VAL 590 H VAL 590 38.057 -12.550 4.732 426 HA VAL 590 HA VAL 590 37.634 -14.132 2.264 427 HB VAL 590 HB VAL 590 37.981 -11.160 2.390 428 HG11 VAL 590 HG11 VAL 590 40.145 -11.695 1.392 429 HG12 VAL 590 HG12 VAL 590 39.362 -12.769 0.204 430 HG13 VAL 590 HG13 VAL 590 39.060 -11.020 0.196 431 HG21 VAL 590 HG21 VAL 590 36.679 -11.251 0.336 432 HG22 VAL 590 HG22 VAL 590 36.846 -13.018 0.261 433 HG23 VAL 590 HG23 VAL 590 35.905 -12.263 1.563 434 H ASN 591 H ASN 591 39.471 -15.111 1.506 435 HA ASN 591 HA ASN 591 41.449 -16.167 1.666 436 HB2 ASN 591 HB2 ASN 591 41.896 -13.826 0.691 437 HB3 ASN 591 HB3 ASN 591 42.647 -13.443 2.234 438 HD21 ASN 591 HD21 ASN 591 44.346 -13.083 0.328 439 HD22 ASN 591 HD22 ASN 591 45.418 -14.456 0.096 440 H GLY 592 H GLY 592 40.020 -16.100 4.211 441 HA2 GLY 592 HA2 GLY 592 40.424 -17.193 6.227 442 HA3 GLY 592 HA3 GLY 592 42.162 -16.983 6.023 443 H LYS 593 H LYS 593 40.798 -13.914 5.624 444 HA LYS 593 HA LYS 593 40.988 -13.243 8.533 445 HB2 LYS 593 HB2 LYS 593 42.139 -11.657 6.206 446 HB3 LYS 593 HB3 LYS 593 42.149 -11.166 7.896 447 HG2 LYS 593 HG2 LYS 593 44.171 -12.066 7.970 448 HG3 LYS 593 HG3 LYS 593 43.335 -13.603 8.145 449 HD2 LYS 593 HD2 LYS 593 43.348 -13.678 5.529 450 HD3 LYS 593 HD3 LYS 593 44.551 -12.391 5.626 451 HE2 LYS 593 HE2 LYS 593 46.058 -13.815 6.904 452 HE3 LYS 593 HE3 LYS 593 44.814 -15.060 7.064 453 HZ1 LYS 593 HZ1 LYS 593 46.324 -15.647 5.298 454 HZ2 LYS 593 HZ2 LYS 593 46.069 -14.241 4.508 455 HZ3 LYS 593 HZ3 LYS 593 44.859 -15.329 4.654 456 H TYR 594 H TYR 594 40.125 -11.206 9.133 457 HA TYR 594 HA TYR 594 37.502 -10.630 7.872 458 HB2 TYR 594 HB2 TYR 594 38.831 -9.895 10.456 459 HB3 TYR 594 HB3 TYR 594 37.581 -8.847 9.824 460 HD1 TYR 594 HD1 TYR 594 37.736 -12.638 9.800 461 HD2 TYR 594 HD2 TYR 594 35.674 -9.070 11.092 462 HE1 TYR 594 HE1 TYR 594 35.842 -14.017 10.569 463 HE2 TYR 594 HE2 TYR 594 33.790 -10.464 11.894 464 HH TYR 594 HH TYR 594 33.784 -14.028 11.578 465 H PHE 595 H PHE 595 36.900 -8.728 7.059 466 HA PHE 595 HA PHE 595 38.760 -6.486 6.623 467 HB2 PHE 595 HB2 PHE 595 37.556 -8.284 4.481 468 HB3 PHE 595 HB3 PHE 595 38.134 -6.688 4.096 469 HD1 PHE 595 HD1 PHE 595 39.020 -10.131 4.281 470 HD2 PHE 595 HD2 PHE 595 40.651 -6.183 4.813 471 HE1 PHE 595 HE1 PHE 595 41.305 -11.011 3.871 472 HE2 PHE 595 HE2 PHE 595 42.947 -7.085 4.420 473 HZ PHE 595 HZ PHE 595 43.267 -9.496 3.960 474 H HIS 596 H HIS 596 37.626 -4.615 5.621 475 HA HIS 596 HA HIS 596 34.765 -4.401 6.355 476 HB2 HIS 596 HB2 HIS 596 36.767 -2.562 5.074 477 HB3 HIS 596 HB3 HIS 596 35.070 -2.161 4.982 478 HD2 HIS 596 HD2 HIS 596 34.063 -2.290 7.944 479 HE1 HIS 596 HE1 HIS 596 37.557 -0.071 8.952 480 HE2 HIS 596 HE2 HIS 596 35.216 -0.745 9.714 481 H SER 597 H SER 597 33.090 -4.594 4.877 482 HA SER 597 HA SER 597 33.456 -6.041 2.427 483 HB2 SER 597 HB2 SER 597 31.054 -5.486 2.060 484 HB3 SER 597 HB3 SER 597 31.385 -6.198 3.645 485 HG SER 597 HG SER 597 30.048 -4.151 3.395 486 H THR 598 H THR 598 33.115 -2.535 3.051 487 HA THR 598 HA THR 598 33.075 -1.744 0.266 488 HB THR 598 HB THR 598 33.793 0.523 1.313 489 HG1 THR 598 HG1 THR 598 33.797 0.651 3.435 490 HG21 THR 598 HG21 THR 598 31.193 -0.747 2.273 491 HG22 THR 598 HG22 THR 598 31.447 0.048 0.709 492 HG23 THR 598 HG23 THR 598 31.555 0.991 2.207 493 H CYS 599 H CYS 599 35.742 -1.635 2.728 494 HA CYS 599 HA CYS 599 37.827 -0.816 1.089 495 HB2 CYS 599 HB2 CYS 599 37.793 -2.824 3.377 496 HB3 CYS 599 HB3 CYS 599 39.254 -2.190 2.679 497 H TYR 600 H TYR 600 36.789 -4.209 1.650 498 HA TYR 600 HA TYR 600 38.564 -5.444 -0.186 499 HB2 TYR 600 HB2 TYR 600 37.483 -6.797 1.432 500 HB3 TYR 600 HB3 TYR 600 35.889 -6.231 0.984 501 HD1 TYR 600 HD1 TYR 600 38.828 -8.166 -0.334 502 HD2 TYR 600 HD2 TYR 600 34.611 -7.346 -0.699 503 HE1 TYR 600 HE1 TYR 600 38.615 -9.986 -2.021 504 HE2 TYR 600 HE2 TYR 600 34.390 -9.177 -2.355 505 HH TYR 600 HH TYR 600 35.483 -10.809 -3.540 506 H HIS 601 H HIS 601 35.121 -4.433 -0.724 507 HA HIS 601 HA HIS 601 34.967 -5.274 -3.421 508 HB2 HIS 601 HB2 HIS 601 33.025 -4.812 -2.028 509 HB3 HIS 601 HB3 HIS 601 33.460 -3.101 -1.924 510 HD2 HIS 601 HD2 HIS 601 31.914 -5.691 -4.298 511 HE1 HIS 601 HE1 HIS 601 31.288 -1.882 -6.093 512 HE2 HIS 601 HE2 HIS 601 30.715 -4.356 -6.217 513 H GLU 602 H GLU 602 35.964 -2.082 -2.157 514 HA GLU 602 HA GLU 602 36.326 -0.881 -4.753 515 HB2 GLU 602 HB2 GLU 602 37.363 -0.175 -1.985 516 HB3 GLU 602 HB3 GLU 602 37.674 0.806 -3.431 517 HG2 GLU 602 HG2 GLU 602 35.255 1.055 -3.816 518 HG3 GLU 602 HG3 GLU 602 34.905 0.132 -2.363 519 H THR 603 H THR 603 38.288 -3.145 -3.027 520 HA THR 603 HA THR 603 40.751 -2.413 -4.548 521 HB THR 603 HB THR 603 40.432 -4.261 -2.164 522 HG1 THR 603 HG1 THR 603 40.188 -2.185 -1.552 523 HG21 THR 603 HG21 THR 603 42.386 -4.922 -3.527 524 HG22 THR 603 HG22 THR 603 42.917 -4.102 -2.058 525 HG23 THR 603 HG23 THR 603 42.916 -3.226 -3.606 526 H SER 604 H SER 604 39.122 -5.437 -3.590 527 HA SER 604 HA SER 604 39.076 -7.527 -4.330 528 HB2 SER 604 HB2 SER 604 38.813 -6.182 -7.029 529 HB3 SER 604 HB3 SER 604 38.430 -7.876 -6.679 530 HG SER 604 HG SER 604 37.205 -5.588 -5.540 531 H GLN 605 H GLN 605 41.429 -5.896 -6.464 532 HA GLN 605 HA GLN 605 42.712 -8.359 -7.284 533 HB2 GLN 605 HB2 GLN 605 43.551 -5.451 -7.623 534 HB3 GLN 605 HB3 GLN 605 44.246 -6.809 -8.488 535 HG2 GLN 605 HG2 GLN 605 41.354 -5.844 -8.724 536 HG3 GLN 605 HG3 GLN 605 42.647 -5.510 -9.856 537 HE21 GLN 605 HE21 GLN 605 40.298 -6.698 -10.768 538 HE22 GLN 605 HE22 GLN 605 40.666 -8.357 -11.232 539 H ASN 606 H ASN 606 44.891 -8.909 -7.024 540 HA ASN 606 HA ASN 606 46.771 -9.429 -5.879 541 HB2 ASN 606 HB2 ASN 606 47.205 -7.317 -7.140 542 HB3 ASN 606 HB3 ASN 606 46.915 -6.406 -5.658 543 HD21 ASN 606 HD21 ASN 606 49.037 -5.558 -5.533 544 HD22 ASN 606 HD22 ASN 606 50.428 -6.596 -5.228 545 H SER 607 H SER 607 45.184 -10.283 -4.138 546 HA SER 607 HA SER 607 44.871 -8.981 -1.650 547 HB2 SER 607 HB2 SER 607 43.535 -10.909 -2.424 548 HB3 SER 607 HB3 SER 607 44.947 -11.960 -2.245 549 HG SER 607 HG SER 607 43.527 -10.588 -0.210 550 H SER 608 H SER 608 47.582 -10.996 -2.749 551 HA SER 608 HA SER 608 49.296 -9.937 -0.637 552 HB2 SER 608 HB2 SER 608 48.257 -11.885 0.482 553 HB3 SER 608 HB3 SER 608 48.879 -12.940 -0.797 554 HG SER 608 HG SER 608 50.310 -12.832 1.020 Start of MODEL 9 1 H1 GLY 533 H1 GLY 533 19.237 16.094 -3.667 2 H2 GLY 533 H2 GLY 533 18.115 16.833 -4.609 3 H3 GLY 533 H3 GLY 533 19.292 17.720 -3.885 4 HA2 GLY 533 HA2 GLY 533 19.781 17.450 -6.230 5 HA3 GLY 533 HA3 GLY 533 21.005 16.691 -5.199 6 H GLY 534 H GLY 534 20.070 16.108 -8.007 7 HA2 GLY 534 HA2 GLY 534 20.317 13.262 -7.993 8 HA3 GLY 534 HA3 GLY 534 18.614 13.680 -8.177 9 H SER 535 H SER 535 21.842 14.116 -9.583 10 HA SER 535 HA SER 535 21.044 15.458 -11.987 11 HB2 SER 535 HB2 SER 535 23.327 15.489 -11.053 12 HB3 SER 535 HB3 SER 535 23.494 13.762 -11.386 13 HG SER 535 HG SER 535 23.263 15.890 -13.240 14 H GLU 536 H GLU 536 21.361 12.014 -11.203 15 HA GLU 536 HA GLU 536 19.629 11.295 -13.434 16 HB2 GLU 536 HB2 GLU 536 21.892 11.207 -14.464 17 HB3 GLU 536 HB3 GLU 536 22.424 10.109 -13.197 18 HG2 GLU 536 HG2 GLU 536 21.961 8.888 -15.242 19 HG3 GLU 536 HG3 GLU 536 20.843 8.394 -13.986 20 H PHE 537 H PHE 537 18.540 9.334 -13.084 21 HA PHE 537 HA PHE 537 18.366 8.638 -10.228 22 HB2 PHE 537 HB2 PHE 537 16.498 8.046 -12.540 23 HB3 PHE 537 HB3 PHE 537 16.155 7.768 -10.841 24 HD1 PHE 537 HD1 PHE 537 16.055 9.750 -9.237 25 HD2 PHE 537 HD2 PHE 537 16.128 10.219 -13.523 26 HE1 PHE 537 HE1 PHE 537 15.219 12.076 -8.999 27 HE2 PHE 537 HE2 PHE 537 15.292 12.543 -13.279 28 HZ PHE 537 HZ PHE 537 14.849 13.477 -11.019 29 H SER 538 H SER 538 20.028 7.207 -12.740 30 HA SER 538 HA SER 538 20.176 4.634 -11.332 31 HB2 SER 538 HB2 SER 538 18.255 4.346 -12.875 32 HB3 SER 538 HB3 SER 538 19.304 4.763 -14.240 33 HG SER 538 HG SER 538 19.096 2.496 -13.908 34 H ASP 539 H ASP 539 22.040 3.500 -11.708 35 HA ASP 539 HA ASP 539 23.838 4.040 -13.899 36 HB2 ASP 539 HB2 ASP 539 25.779 4.711 -12.680 37 HB3 ASP 539 HB3 ASP 539 24.508 5.855 -12.314 38 H ARG 540 H ARG 540 25.799 2.549 -13.729 39 HA ARG 540 HA ARG 540 24.796 -0.089 -12.788 40 HB2 ARG 540 HB2 ARG 540 25.240 0.697 -15.330 41 HB3 ARG 540 HB3 ARG 540 26.863 0.156 -14.954 42 HG2 ARG 540 HG2 ARG 540 25.661 -1.635 -16.007 43 HG3 ARG 540 HG3 ARG 540 25.879 -2.102 -14.321 44 HD2 ARG 540 HD2 ARG 540 23.553 -1.451 -13.814 45 HD3 ARG 540 HD3 ARG 540 23.334 -0.831 -15.443 46 HE ARG 540 HE ARG 540 23.431 -3.659 -14.561 47 HH11 ARG 540 HH11 ARG 540 23.253 -1.544 -17.357 48 HH12 ARG 540 HH12 ARG 540 22.657 -2.825 -18.392 49 HH21 ARG 540 HH21 ARG 540 22.688 -5.232 -15.934 50 HH22 ARG 540 HH22 ARG 540 22.360 -4.850 -17.604 51 H SER 541 H SER 541 26.753 1.851 -11.296 52 HA SER 541 HA SER 541 29.181 0.264 -11.023 53 HB2 SER 541 HB2 SER 541 29.212 2.658 -10.558 54 HB3 SER 541 HB3 SER 541 28.061 2.435 -9.221 55 HG SER 541 HG SER 541 30.303 2.469 -8.585 56 H ASN 542 H ASN 542 29.551 -1.463 -9.779 57 HA ASN 542 HA ASN 542 27.440 -2.626 -8.133 58 HB2 ASN 542 HB2 ASN 542 30.339 -3.466 -8.520 59 HB3 ASN 542 HB3 ASN 542 29.081 -4.419 -7.742 60 HD21 ASN 542 HD21 ASN 542 30.729 -4.216 -10.582 61 HD22 ASN 542 HD22 ASN 542 29.483 -4.830 -11.656 62 H GLU 543 H GLU 543 30.017 -0.393 -7.440 63 HA GLU 543 HA GLU 543 30.664 -1.134 -4.767 64 HB2 GLU 543 HB2 GLU 543 31.986 0.386 -6.174 65 HB3 GLU 543 HB3 GLU 543 30.711 1.611 -6.062 66 HG2 GLU 543 HG2 GLU 543 31.061 1.844 -3.665 67 HG3 GLU 543 HG3 GLU 543 32.146 0.455 -3.645 68 H LEU 544 H LEU 544 27.886 0.628 -6.002 69 HA LEU 544 HA LEU 544 26.931 1.796 -3.594 70 HB2 LEU 544 HB2 LEU 544 26.112 2.333 -5.851 71 HB3 LEU 544 HB3 LEU 544 25.461 0.703 -6.025 72 HG LEU 544 HG LEU 544 23.827 1.127 -4.221 73 HD11 LEU 544 HD11 LEU 544 25.027 3.937 -4.183 74 HD12 LEU 544 HD12 LEU 544 25.016 2.774 -2.837 75 HD13 LEU 544 HD13 LEU 544 23.499 3.467 -3.407 76 HD21 LEU 544 HD21 LEU 544 23.874 3.291 -6.367 77 HD22 LEU 544 HD22 LEU 544 22.449 2.765 -5.441 78 HD23 LEU 544 HD23 LEU 544 23.239 1.638 -6.555 79 H GLU 545 H GLU 545 26.557 -1.513 -4.870 80 HA GLU 545 HA GLU 545 24.511 -2.313 -2.970 81 HB2 GLU 545 HB2 GLU 545 26.297 -4.004 -4.779 82 HB3 GLU 545 HB3 GLU 545 24.797 -4.519 -4.020 83 HG2 GLU 545 HG2 GLU 545 25.146 -2.493 -6.255 84 HG3 GLU 545 HG3 GLU 545 24.411 -4.077 -6.367 85 H ILE 546 H ILE 546 27.943 -2.231 -2.766 86 HA ILE 546 HA ILE 546 28.505 -4.577 -1.322 87 HB ILE 546 HB ILE 546 29.939 -1.892 -1.308 88 HG12 ILE 546 HG12 ILE 546 29.651 -2.818 -3.594 89 HG13 ILE 546 HG13 ILE 546 31.318 -2.674 -3.077 90 HG21 ILE 546 HG21 ILE 546 31.982 -3.320 -0.859 91 HG22 ILE 546 HG22 ILE 546 30.846 -3.189 0.497 92 HG23 ILE 546 HG23 ILE 546 30.880 -4.659 -0.498 93 HD11 ILE 546 HD11 ILE 546 30.869 -4.736 -4.374 94 HD12 ILE 546 HD12 ILE 546 31.498 -5.087 -2.755 95 HD13 ILE 546 HD13 ILE 546 29.760 -5.292 -3.109 96 H ARG 547 H ARG 547 27.461 -1.447 -0.114 97 HA ARG 547 HA ARG 547 28.299 -1.801 2.615 98 HB2 ARG 547 HB2 ARG 547 27.231 0.336 2.996 99 HB3 ARG 547 HB3 ARG 547 28.104 0.346 1.475 100 HG2 ARG 547 HG2 ARG 547 25.685 -0.280 0.453 101 HG3 ARG 547 HG3 ARG 547 25.119 0.379 1.984 102 HD2 ARG 547 HD2 ARG 547 25.094 2.141 0.351 103 HD3 ARG 547 HD3 ARG 547 26.380 2.481 1.506 104 HE ARG 547 HE ARG 547 26.872 1.136 -1.138 105 HH11 ARG 547 HH11 ARG 547 27.640 3.884 0.907 106 HH12 ARG 547 HH12 ARG 547 29.103 4.240 0.018 107 HH21 ARG 547 HH21 ARG 547 28.874 1.535 -2.083 108 HH22 ARG 547 HH22 ARG 547 29.723 2.997 -1.675 109 H GLY 548 H GLY 548 25.610 -3.196 1.129 110 HA2 GLY 548 HA2 GLY 548 23.799 -3.220 3.420 111 HA3 GLY 548 HA3 GLY 548 23.680 -4.186 1.954 112 H LYS 549 H LYS 549 26.644 -5.075 2.700 113 HA LYS 549 HA LYS 549 25.834 -7.610 3.834 114 HB2 LYS 549 HB2 LYS 549 28.620 -6.461 3.331 115 HB3 LYS 549 HB3 LYS 549 28.266 -8.140 3.699 116 HG2 LYS 549 HG2 LYS 549 27.380 -6.641 1.202 117 HG3 LYS 549 HG3 LYS 549 28.689 -7.813 1.321 118 HD2 LYS 549 HD2 LYS 549 27.012 -9.570 1.964 119 HD3 LYS 549 HD3 LYS 549 25.716 -8.383 1.713 120 HE2 LYS 549 HE2 LYS 549 26.464 -8.053 -0.630 121 HE3 LYS 549 HE3 LYS 549 27.749 -9.229 -0.397 122 HZ1 LYS 549 HZ1 LYS 549 25.802 -10.232 -1.446 123 HZ2 LYS 549 HZ2 LYS 549 24.845 -9.819 -0.199 124 HZ3 LYS 549 HZ3 LYS 549 26.034 -10.921 0.012 125 H TYR 550 H TYR 550 26.302 -8.602 5.733 126 HA TYR 550 HA TYR 550 28.003 -7.422 7.745 127 HB2 TYR 550 HB2 TYR 550 26.365 -7.452 9.579 128 HB3 TYR 550 HB3 TYR 550 25.979 -6.232 8.396 129 HD1 TYR 550 HD1 TYR 550 23.962 -6.403 6.992 130 HD2 TYR 550 HD2 TYR 550 24.927 -9.436 9.906 131 HE1 TYR 550 HE1 TYR 550 21.659 -7.338 6.792 132 HE2 TYR 550 HE2 TYR 550 22.629 -10.349 9.725 133 HH TYR 550 HH TYR 550 20.593 -10.176 8.680 134 H VAL 551 H VAL 551 28.334 -8.823 9.568 135 HA VAL 551 HA VAL 551 27.598 -11.684 9.238 136 HB VAL 551 HB VAL 551 30.045 -12.136 10.064 137 HG11 VAL 551 HG11 VAL 551 29.527 -11.355 7.166 138 HG12 VAL 551 HG12 VAL 551 30.789 -12.468 7.762 139 HG13 VAL 551 HG13 VAL 551 29.084 -12.910 7.907 140 HG21 VAL 551 HG21 VAL 551 30.557 -9.544 8.576 141 HG22 VAL 551 HG22 VAL 551 30.811 -9.845 10.316 142 HG23 VAL 551 HG23 VAL 551 31.767 -10.724 9.119 143 H VAL 552 H VAL 552 27.190 -12.776 11.115 144 HA VAL 552 HA VAL 552 26.620 -11.188 13.468 145 HB VAL 552 HB VAL 552 26.476 -14.144 12.891 146 HG11 VAL 552 HG11 VAL 552 26.941 -14.054 15.286 147 HG12 VAL 552 HG12 VAL 552 25.722 -12.776 15.511 148 HG13 VAL 552 HG13 VAL 552 25.237 -14.414 15.030 149 HG21 VAL 552 HG21 VAL 552 24.068 -13.778 13.023 150 HG22 VAL 552 HG22 VAL 552 24.323 -12.084 13.501 151 HG23 VAL 552 HG23 VAL 552 24.765 -12.621 11.871 152 H VAL 553 H VAL 553 27.738 -10.852 15.258 153 HA VAL 553 HA VAL 553 30.547 -11.667 15.514 154 HB VAL 553 HB VAL 553 28.833 -10.253 17.608 155 HG11 VAL 553 HG11 VAL 553 31.842 -10.488 17.173 156 HG12 VAL 553 HG12 VAL 553 31.060 -9.531 18.444 157 HG13 VAL 553 HG13 VAL 553 30.914 -11.288 18.462 158 HG21 VAL 553 HG21 VAL 553 30.064 -8.180 16.887 159 HG22 VAL 553 HG22 VAL 553 30.538 -9.045 15.420 160 HG23 VAL 553 HG23 VAL 553 28.818 -8.758 15.735 161 HA PRO 554 HA PRO 554 29.160 -15.419 17.665 162 HB2 PRO 554 HB2 PRO 554 31.574 -16.531 18.288 163 HB3 PRO 554 HB3 PRO 554 30.946 -16.454 16.607 164 HG2 PRO 554 HG2 PRO 554 32.890 -14.544 17.928 165 HG3 PRO 554 HG3 PRO 554 33.066 -15.382 16.355 166 HD2 PRO 554 HD2 PRO 554 32.130 -12.843 16.548 167 HD3 PRO 554 HD3 PRO 554 31.477 -13.983 15.324 168 H GLU 555 H GLU 555 28.778 -15.963 19.838 169 HA GLU 555 HA GLU 555 29.314 -14.065 21.927 170 HB2 GLU 555 HB2 GLU 555 28.444 -16.977 22.068 171 HB3 GLU 555 HB3 GLU 555 28.496 -15.869 23.446 172 HG2 GLU 555 HG2 GLU 555 26.962 -14.321 22.111 173 HG3 GLU 555 HG3 GLU 555 26.699 -15.682 21.015 174 H THR 556 H THR 556 31.266 -16.662 20.693 175 HA THR 556 HA THR 556 33.150 -17.045 22.787 176 HB THR 556 HB THR 556 33.688 -16.893 19.837 177 HG1 THR 556 HG1 THR 556 33.184 -19.105 19.846 178 HG21 THR 556 HG21 THR 556 35.388 -18.661 20.319 179 HG22 THR 556 HG22 THR 556 35.036 -18.511 22.055 180 HG23 THR 556 HG23 THR 556 35.761 -17.155 21.165 181 H SER 557 H SER 557 32.711 -14.314 20.546 182 HA SER 557 HA SER 557 35.187 -12.978 21.440 183 HB2 SER 557 HB2 SER 557 34.401 -12.751 19.070 184 HB3 SER 557 HB3 SER 557 32.981 -11.891 19.663 185 HG SER 557 HG SER 557 35.703 -11.134 19.816 186 H GLN 558 H GLN 558 35.022 -12.461 23.570 187 HA GLN 558 HA GLN 558 32.659 -11.292 24.793 188 HB2 GLN 558 HB2 GLN 558 35.564 -11.364 25.698 189 HB3 GLN 558 HB3 GLN 558 34.209 -10.814 26.682 190 HG2 GLN 558 HG2 GLN 558 33.148 -13.056 26.456 191 HG3 GLN 558 HG3 GLN 558 34.550 -13.637 25.558 192 HE21 GLN 558 HE21 GLN 558 33.473 -14.618 28.160 193 HE22 GLN 558 HE22 GLN 558 34.820 -14.454 29.276 194 H ASP 559 H ASP 559 35.475 -9.971 23.143 195 HA ASP 559 HA ASP 559 34.882 -7.206 23.996 196 HB2 ASP 559 HB2 ASP 559 37.053 -8.335 22.212 197 HB3 ASP 559 HB3 ASP 559 36.927 -6.659 22.730 198 H MET 560 H MET 560 34.114 -9.210 21.227 199 HA MET 560 HA MET 560 33.170 -8.853 19.263 200 HB2 MET 560 HB2 MET 560 31.812 -6.494 20.608 201 HB3 MET 560 HB3 MET 560 31.263 -7.378 19.176 202 HG2 MET 560 HG2 MET 560 31.352 -9.492 20.642 203 HG3 MET 560 HG3 MET 560 31.459 -8.408 22.019 204 HE1 MET 560 HE1 MET 560 29.355 -10.670 21.680 205 HE2 MET 560 HE2 MET 560 27.756 -10.189 21.070 206 HE3 MET 560 HE3 MET 560 29.072 -10.481 19.932 207 H ALA 561 H ALA 561 35.775 -7.761 19.352 208 HA ALA 561 HA ALA 561 35.533 -5.652 17.264 209 HB1 ALA 561 HB1 ALA 561 37.416 -5.608 19.643 210 HB2 ALA 561 HB2 ALA 561 37.392 -4.424 18.306 211 HB3 ALA 561 HB3 ALA 561 35.999 -4.571 19.387 212 H PHE 562 H PHE 562 36.815 -5.777 15.557 213 HA PHE 562 HA PHE 562 39.266 -7.401 15.487 214 HB2 PHE 562 HB2 PHE 562 36.740 -8.164 14.108 215 HB3 PHE 562 HB3 PHE 562 38.143 -8.098 13.071 216 HD1 PHE 562 HD1 PHE 562 36.603 -9.861 15.913 217 HD2 PHE 562 HD2 PHE 562 40.087 -9.578 13.389 218 HE1 PHE 562 HE1 PHE 562 37.314 -12.124 16.640 219 HE2 PHE 562 HE2 PHE 562 40.802 -11.834 14.131 220 HZ PHE 562 HZ PHE 562 39.399 -13.121 15.747 221 H LYS 563 H LYS 563 40.536 -6.979 13.500 222 HA LYS 563 HA LYS 563 40.435 -4.076 12.968 223 HB2 LYS 563 HB2 LYS 563 42.465 -5.598 13.864 224 HB3 LYS 563 HB3 LYS 563 42.715 -5.881 12.147 225 HG2 LYS 563 HG2 LYS 563 44.135 -4.082 12.714 226 HG3 LYS 563 HG3 LYS 563 42.788 -3.322 11.876 227 HD2 LYS 563 HD2 LYS 563 41.774 -2.950 14.263 228 HD3 LYS 563 HD3 LYS 563 43.368 -3.386 14.876 229 HE2 LYS 563 HE2 LYS 563 44.388 -1.538 13.596 230 HE3 LYS 563 HE3 LYS 563 42.835 -1.174 12.850 231 HZ1 LYS 563 HZ1 LYS 563 43.465 -0.897 15.735 232 HZ2 LYS 563 HZ2 LYS 563 41.978 -0.689 15.113 233 HZ3 LYS 563 HZ3 LYS 563 43.183 0.323 14.682 234 H CYS 564 H CYS 564 40.869 -3.156 10.968 235 HA CYS 564 HA CYS 564 40.407 -4.769 8.497 236 HB2 CYS 564 HB2 CYS 564 38.840 -2.707 9.000 237 HB3 CYS 564 HB3 CYS 564 40.249 -1.736 8.729 238 HA PRO 565 HA PRO 565 44.929 -3.806 8.619 239 HB2 PRO 565 HB2 PRO 565 44.876 -5.887 6.437 240 HB3 PRO 565 HB3 PRO 565 46.048 -5.673 7.761 241 HG2 PRO 565 HG2 PRO 565 44.112 -7.575 7.894 242 HG3 PRO 565 HG3 PRO 565 44.589 -6.634 9.347 243 HD2 PRO 565 HD2 PRO 565 42.110 -6.328 7.657 244 HD3 PRO 565 HD3 PRO 565 42.366 -6.114 9.402 245 H ILE 566 H ILE 566 42.628 -3.575 6.008 246 HA ILE 566 HA ILE 566 44.388 -2.446 3.998 247 HB ILE 566 HB ILE 566 41.374 -2.449 4.276 248 HG12 ILE 566 HG12 ILE 566 43.128 -4.027 2.329 249 HG13 ILE 566 HG13 ILE 566 42.673 -4.659 3.897 250 HG21 ILE 566 HG21 ILE 566 41.914 -0.544 2.867 251 HG22 ILE 566 HG22 ILE 566 43.130 -1.482 1.970 252 HG23 ILE 566 HG23 ILE 566 41.401 -1.838 1.792 253 HD11 ILE 566 HD11 ILE 566 41.171 -5.576 2.270 254 HD12 ILE 566 HD12 ILE 566 40.257 -4.451 3.300 255 HD13 ILE 566 HD13 ILE 566 40.744 -3.973 1.653 256 H CYS 567 H CYS 567 41.827 -0.887 6.026 257 HA CYS 567 HA CYS 567 43.155 1.722 5.561 258 HB2 CYS 567 HB2 CYS 567 41.095 2.746 5.962 259 HB3 CYS 567 HB3 CYS 567 40.784 1.402 4.864 260 H LYS 568 H LYS 568 43.301 -0.588 7.828 261 HA LYS 568 HA LYS 568 44.113 -0.836 9.908 262 HB2 LYS 568 HB2 LYS 568 45.090 2.015 9.652 263 HB3 LYS 568 HB3 LYS 568 45.592 0.846 10.886 264 HG2 LYS 568 HG2 LYS 568 46.483 -0.659 9.151 265 HG3 LYS 568 HG3 LYS 568 46.023 0.491 7.884 266 HD2 LYS 568 HD2 LYS 568 47.981 1.072 10.139 267 HD3 LYS 568 HD3 LYS 568 48.439 0.566 8.507 268 HE2 LYS 568 HE2 LYS 568 47.298 2.583 7.579 269 HE3 LYS 568 HE3 LYS 568 46.929 3.119 9.217 270 HZ1 LYS 568 HZ1 LYS 568 48.943 4.173 8.404 271 HZ2 LYS 568 HZ2 LYS 568 49.659 2.734 8.129 272 HZ3 LYS 568 HZ3 LYS 568 49.329 3.204 9.655 273 H GLU 569 H GLU 569 41.408 -0.431 9.729 274 HA GLU 569 HA GLU 569 40.735 1.325 12.080 275 HB2 GLU 569 HB2 GLU 569 39.127 0.401 9.700 276 HB3 GLU 569 HB3 GLU 569 38.317 0.911 11.158 277 HG2 GLU 569 HG2 GLU 569 40.273 2.628 9.590 278 HG3 GLU 569 HG3 GLU 569 38.518 2.738 9.514 279 H THR 570 H THR 570 38.777 0.512 13.353 280 HA THR 570 HA THR 570 38.946 -2.442 13.818 281 HB THR 570 HB THR 570 38.545 -0.225 15.847 282 HG1 THR 570 HG1 THR 570 40.429 -2.266 15.973 283 HG21 THR 570 HG21 THR 570 38.426 -3.245 16.237 284 HG22 THR 570 HG22 THR 570 37.105 -2.082 16.507 285 HG23 THR 570 HG23 THR 570 38.529 -2.043 17.545 286 H VAL 571 H VAL 571 37.141 -3.481 13.334 287 HA VAL 571 HA VAL 571 34.514 -2.116 13.151 288 HB VAL 571 HB VAL 571 33.716 -4.472 12.551 289 HG11 VAL 571 HG11 VAL 571 34.327 -4.104 10.195 290 HG12 VAL 571 HG12 VAL 571 33.744 -2.650 11.014 291 HG13 VAL 571 HG13 VAL 571 35.492 -2.855 10.702 292 HG21 VAL 571 HG21 VAL 571 36.636 -4.880 11.805 293 HG22 VAL 571 HG22 VAL 571 35.808 -5.722 13.134 294 HG23 VAL 571 HG23 VAL 571 35.272 -5.963 11.462 295 H THR 572 H THR 572 33.291 -1.968 14.862 296 HA THR 572 HA THR 572 33.535 -3.945 17.081 297 HB THR 572 HB THR 572 32.332 -2.261 18.451 298 HG1 THR 572 HG1 THR 572 31.354 -1.048 16.849 299 HG21 THR 572 HG21 THR 572 34.219 -0.753 18.769 300 HG22 THR 572 HG22 THR 572 34.882 -1.189 17.175 301 HG23 THR 572 HG23 THR 572 34.810 -2.398 18.477 302 H GLY 573 H GLY 573 31.821 -5.104 17.776 303 HA2 GLY 573 HA2 GLY 573 29.690 -5.709 16.008 304 HA3 GLY 573 HA3 GLY 573 29.801 -6.221 17.700 305 H VAL 574 H VAL 574 27.524 -5.305 16.032 306 HA VAL 574 HA VAL 574 26.421 -3.334 17.941 307 HB VAL 574 HB VAL 574 25.961 -3.457 14.906 308 HG11 VAL 574 HG11 VAL 574 24.787 -1.535 16.963 309 HG12 VAL 574 HG12 VAL 574 24.647 -1.378 15.196 310 HG13 VAL 574 HG13 VAL 574 23.886 -2.733 15.997 311 HG21 VAL 574 HG21 VAL 574 26.981 -1.174 14.886 312 HG22 VAL 574 HG22 VAL 574 27.354 -1.354 16.613 313 HG23 VAL 574 HG23 VAL 574 28.118 -2.420 15.415 314 H TYR 575 H TYR 575 24.511 -3.840 18.896 315 HA TYR 575 HA TYR 575 23.537 -6.527 18.514 316 HB2 TYR 575 HB2 TYR 575 23.677 -5.409 20.703 317 HB3 TYR 575 HB3 TYR 575 22.427 -4.274 20.206 318 HD1 TYR 575 HD1 TYR 575 20.321 -4.749 21.147 319 HD2 TYR 575 HD2 TYR 575 22.956 -8.016 20.164 320 HE1 TYR 575 HE1 TYR 575 18.668 -6.365 22.064 321 HE2 TYR 575 HE2 TYR 575 21.298 -9.634 21.078 322 HH TYR 575 HH TYR 575 18.232 -8.554 22.556 323 H ASP 576 H ASP 576 22.026 -7.279 17.188 324 HA ASP 576 HA ASP 576 20.001 -5.505 15.967 325 HB2 ASP 576 HB2 ASP 576 21.273 -7.142 14.574 326 HB3 ASP 576 HB3 ASP 576 20.562 -8.450 15.499 327 H GLU 577 H GLU 577 18.377 -5.110 17.368 328 HA GLU 577 HA GLU 577 17.603 -6.797 19.556 329 HB2 GLU 577 HB2 GLU 577 16.138 -4.484 18.204 330 HB3 GLU 577 HB3 GLU 577 15.648 -5.240 19.728 331 HG2 GLU 577 HG2 GLU 577 17.712 -4.564 20.809 332 HG3 GLU 577 HG3 GLU 577 18.340 -3.918 19.301 333 H GLU 578 H GLU 578 16.550 -6.814 16.209 334 HA GLU 578 HA GLU 578 14.041 -8.231 16.765 335 HB2 GLU 578 HB2 GLU 578 14.229 -6.568 14.932 336 HB3 GLU 578 HB3 GLU 578 15.436 -7.577 14.152 337 HG2 GLU 578 HG2 GLU 578 13.522 -8.018 12.958 338 HG3 GLU 578 HG3 GLU 578 13.637 -9.418 14.003 339 H SER 579 H SER 579 17.230 -9.053 15.296 340 HA SER 579 HA SER 579 16.598 -11.907 15.121 341 HB2 SER 579 HB2 SER 579 19.282 -10.486 14.915 342 HB3 SER 579 HB3 SER 579 18.952 -12.179 14.531 343 HG SER 579 HG SER 579 18.381 -9.902 13.096 344 H GLY 580 H GLY 580 18.075 -9.813 17.518 345 HA2 GLY 580 HA2 GLY 580 18.491 -10.199 19.763 346 HA3 GLY 580 HA3 GLY 580 18.061 -11.900 19.585 347 H GLU 581 H GLU 581 20.466 -10.186 17.605 348 HA GLU 581 HA GLU 581 22.741 -11.674 18.822 349 HB2 GLU 581 HB2 GLU 581 21.972 -11.787 15.880 350 HB3 GLU 581 HB3 GLU 581 23.480 -12.382 16.541 351 HG2 GLU 581 HG2 GLU 581 20.705 -13.473 17.144 352 HG3 GLU 581 HG3 GLU 581 21.893 -14.192 16.083 353 H TRP 582 H TRP 582 24.797 -10.782 18.350 354 HA TRP 582 HA TRP 582 24.752 -7.928 17.534 355 HB2 TRP 582 HB2 TRP 582 26.922 -9.701 18.667 356 HB3 TRP 582 HB3 TRP 582 27.142 -8.002 18.228 357 HD1 TRP 582 HD1 TRP 582 25.129 -10.159 20.707 358 HE1 TRP 582 HE1 TRP 582 24.640 -8.816 22.824 359 HE3 TRP 582 HE3 TRP 582 27.112 -5.668 19.275 360 HZ2 TRP 582 HZ2 TRP 582 25.057 -6.129 23.778 361 HZ3 TRP 582 HZ3 TRP 582 27.052 -3.722 20.814 362 HH2 TRP 582 HH2 TRP 582 26.004 -3.932 23.057 363 H VAL 583 H VAL 583 25.775 -7.126 15.749 364 HA VAL 583 HA VAL 583 26.987 -8.999 13.754 365 HB VAL 583 HB VAL 583 25.875 -7.779 11.946 366 HG11 VAL 583 HG11 VAL 583 23.895 -8.992 13.912 367 HG12 VAL 583 HG12 VAL 583 23.651 -8.751 12.174 368 HG13 VAL 583 HG13 VAL 583 24.900 -9.872 12.738 369 HG21 VAL 583 HG21 VAL 583 25.369 -5.632 13.185 370 HG22 VAL 583 HG22 VAL 583 24.006 -6.320 12.279 371 HG23 VAL 583 HG23 VAL 583 24.084 -6.505 14.042 372 H TRP 584 H TRP 584 28.402 -8.206 12.256 373 HA TRP 584 HA TRP 584 29.786 -5.614 12.816 374 HB2 TRP 584 HB2 TRP 584 30.627 -8.325 11.782 375 HB3 TRP 584 HB3 TRP 584 31.516 -6.926 11.268 376 HD1 TRP 584 HD1 TRP 584 31.929 -5.348 13.917 377 HE1 TRP 584 HE1 TRP 584 33.398 -6.278 15.810 378 HE3 TRP 584 HE3 TRP 584 31.865 -10.310 12.632 379 HZ2 TRP 584 HZ2 TRP 584 34.513 -8.803 16.582 380 HZ3 TRP 584 HZ3 TRP 584 33.141 -11.953 13.979 381 HH2 TRP 584 HH2 TRP 584 34.480 -11.223 15.936 382 H LYS 585 H LYS 585 28.893 -4.134 11.504 383 HA LYS 585 HA LYS 585 27.596 -4.871 8.960 384 HB2 LYS 585 HB2 LYS 585 27.698 -2.280 10.533 385 HB3 LYS 585 HB3 LYS 585 26.818 -2.504 9.008 386 HG2 LYS 585 HG2 LYS 585 25.541 -4.397 10.077 387 HG3 LYS 585 HG3 LYS 585 26.314 -4.001 11.619 388 HD2 LYS 585 HD2 LYS 585 25.333 -1.727 11.536 389 HD3 LYS 585 HD3 LYS 585 24.586 -2.106 9.966 390 HE2 LYS 585 HE2 LYS 585 23.300 -3.942 11.023 391 HE3 LYS 585 HE3 LYS 585 24.021 -3.557 12.586 392 HZ1 LYS 585 HZ1 LYS 585 22.983 -1.354 12.429 393 HZ2 LYS 585 HZ2 LYS 585 21.836 -2.513 12.339 394 HZ3 LYS 585 HZ3 LYS 585 22.309 -1.741 10.985 395 H ASN 586 H ASN 586 27.987 -3.955 6.938 396 HA ASN 586 HA ASN 586 29.311 -3.775 5.167 397 HB2 ASN 586 HB2 ASN 586 29.179 -1.385 5.824 398 HB3 ASN 586 HB3 ASN 586 30.698 -1.561 6.706 399 HD21 ASN 586 HD21 ASN 586 31.906 -0.112 5.429 400 HD22 ASN 586 HD22 ASN 586 32.296 -0.466 3.748 401 H THR 587 H THR 587 30.060 -5.846 6.948 402 HA THR 587 HA THR 587 33.053 -5.930 6.752 403 HB THR 587 HB THR 587 31.221 -7.252 8.768 404 HG1 THR 587 HG1 THR 587 31.630 -4.979 8.989 405 HG21 THR 587 HG21 THR 587 34.263 -7.255 8.570 406 HG22 THR 587 HG22 THR 587 33.195 -8.667 8.403 407 HG23 THR 587 HG23 THR 587 33.323 -7.836 9.955 408 H ILE 588 H ILE 588 34.082 -7.717 6.065 409 HA ILE 588 HA ILE 588 32.547 -10.017 4.996 410 HB ILE 588 HB ILE 588 33.017 -8.737 3.087 411 HG12 ILE 588 HG12 ILE 588 35.266 -10.785 3.194 412 HG13 ILE 588 HG13 ILE 588 33.559 -11.263 3.086 413 HG21 ILE 588 HG21 ILE 588 35.271 -7.973 2.410 414 HG22 ILE 588 HG22 ILE 588 34.839 -7.250 3.958 415 HG23 ILE 588 HG23 ILE 588 35.951 -8.638 3.899 416 HD11 ILE 588 HD11 ILE 588 33.379 -9.979 0.933 417 HD12 ILE 588 HD12 ILE 588 35.133 -9.699 1.012 418 HD13 ILE 588 HD13 ILE 588 34.507 -11.350 0.888 419 H GLU 589 H GLU 589 33.333 -11.966 5.405 420 HA GLU 589 HA GLU 589 35.832 -12.292 6.992 421 HB2 GLU 589 HB2 GLU 589 33.711 -13.265 7.884 422 HB3 GLU 589 HB3 GLU 589 33.555 -14.217 6.410 423 HG2 GLU 589 HG2 GLU 589 35.910 -15.185 7.037 424 HG3 GLU 589 HG3 GLU 589 35.644 -14.444 8.602 425 H VAL 590 H VAL 590 37.613 -13.129 6.023 426 HA VAL 590 HA VAL 590 37.457 -15.052 3.811 427 HB VAL 590 HB VAL 590 37.358 -12.939 2.579 428 HG11 VAL 590 HG11 VAL 590 39.218 -11.387 2.501 429 HG12 VAL 590 HG12 VAL 590 38.576 -11.465 4.151 430 HG13 VAL 590 HG13 VAL 590 40.099 -12.277 3.755 431 HG21 VAL 590 HG21 VAL 590 40.072 -14.265 2.232 432 HG22 VAL 590 HG22 VAL 590 38.534 -14.921 1.617 433 HG23 VAL 590 HG23 VAL 590 39.142 -13.377 1.015 434 H ASN 591 H ASN 591 38.891 -16.537 3.890 435 HA ASN 591 HA ASN 591 40.525 -17.840 4.733 436 HB2 ASN 591 HB2 ASN 591 42.047 -15.261 4.211 437 HB3 ASN 591 HB3 ASN 591 42.774 -16.854 4.405 438 HD21 ASN 591 HD21 ASN 591 43.183 -15.294 2.089 439 HD22 ASN 591 HD22 ASN 591 42.418 -16.160 0.759 440 H GLY 592 H GLY 592 39.017 -17.004 6.850 441 HA2 GLY 592 HA2 GLY 592 39.032 -17.250 9.147 442 HA3 GLY 592 HA3 GLY 592 40.786 -17.449 9.111 443 H LYS 593 H LYS 593 39.772 -14.546 7.605 444 HA LYS 593 HA LYS 593 40.365 -12.853 9.995 445 HB2 LYS 593 HB2 LYS 593 41.520 -12.566 7.183 446 HB3 LYS 593 HB3 LYS 593 41.882 -11.533 8.566 447 HG2 LYS 593 HG2 LYS 593 42.958 -13.420 9.732 448 HG3 LYS 593 HG3 LYS 593 42.529 -14.505 8.402 449 HD2 LYS 593 HD2 LYS 593 43.870 -12.959 6.854 450 HD3 LYS 593 HD3 LYS 593 44.490 -12.197 8.325 451 HE2 LYS 593 HE2 LYS 593 46.097 -13.843 7.778 452 HE3 LYS 593 HE3 LYS 593 45.177 -14.511 9.124 453 HZ1 LYS 593 HZ1 LYS 593 43.884 -15.793 7.419 454 HZ2 LYS 593 HZ2 LYS 593 45.476 -16.168 7.404 455 HZ3 LYS 593 HZ3 LYS 593 44.848 -15.202 6.254 456 H TYR 594 H TYR 594 40.004 -10.472 9.387 457 HA TYR 594 HA TYR 594 37.402 -10.212 7.938 458 HB2 TYR 594 HB2 TYR 594 38.241 -8.995 10.570 459 HB3 TYR 594 HB3 TYR 594 36.836 -8.473 9.661 460 HD1 TYR 594 HD1 TYR 594 38.081 -10.990 11.963 461 HD2 TYR 594 HD2 TYR 594 34.996 -10.129 9.068 462 HE1 TYR 594 HE1 TYR 594 36.692 -12.826 12.901 463 HE2 TYR 594 HE2 TYR 594 33.609 -11.962 10.007 464 HH TYR 594 HH TYR 594 34.761 -14.041 12.672 465 H PHE 595 H PHE 595 36.860 -8.346 7.026 466 HA PHE 595 HA PHE 595 38.681 -6.044 6.774 467 HB2 PHE 595 HB2 PHE 595 37.802 -7.854 4.499 468 HB3 PHE 595 HB3 PHE 595 38.290 -6.212 4.195 469 HD1 PHE 595 HD1 PHE 595 39.333 -9.299 3.634 470 HD2 PHE 595 HD2 PHE 595 40.749 -5.800 5.691 471 HE1 PHE 595 HE1 PHE 595 41.673 -10.072 3.313 472 HE2 PHE 595 HE2 PHE 595 43.093 -6.557 5.347 473 HZ PHE 595 HZ PHE 595 43.560 -8.704 4.186 474 H HIS 596 H HIS 596 37.544 -4.262 5.570 475 HA HIS 596 HA HIS 596 34.601 -4.190 5.978 476 HB2 HIS 596 HB2 HIS 596 36.660 -2.292 4.863 477 HB3 HIS 596 HB3 HIS 596 34.975 -1.959 4.617 478 HD2 HIS 596 HD2 HIS 596 33.705 -2.035 7.488 479 HE1 HIS 596 HE1 HIS 596 37.090 0.226 8.757 480 HE2 HIS 596 HE2 HIS 596 34.700 -0.469 9.342 481 H SER 597 H SER 597 33.151 -4.468 4.251 482 HA SER 597 HA SER 597 34.099 -6.010 2.029 483 HB2 SER 597 HB2 SER 597 31.821 -6.105 3.151 484 HB3 SER 597 HB3 SER 597 31.381 -4.677 2.201 485 HG SER 597 HG SER 597 30.860 -6.704 1.178 486 H THR 598 H THR 598 33.204 -2.547 2.260 487 HA THR 598 HA THR 598 33.657 -1.893 -0.499 488 HB THR 598 HB THR 598 33.943 0.456 0.460 489 HG1 THR 598 HG1 THR 598 34.571 0.113 2.511 490 HG21 THR 598 HG21 THR 598 31.432 -1.043 1.299 491 HG22 THR 598 HG22 THR 598 31.759 -0.360 -0.316 492 HG23 THR 598 HG23 THR 598 31.604 0.708 1.096 493 H CYS 599 H CYS 599 35.909 -1.991 2.301 494 HA CYS 599 HA CYS 599 38.183 -0.887 0.922 495 HB2 CYS 599 HB2 CYS 599 37.879 -2.744 3.313 496 HB3 CYS 599 HB3 CYS 599 39.413 -2.123 2.792 497 H TYR 600 H TYR 600 37.244 -4.280 1.600 498 HA TYR 600 HA TYR 600 39.283 -5.590 0.154 499 HB2 TYR 600 HB2 TYR 600 37.956 -6.667 1.820 500 HB3 TYR 600 HB3 TYR 600 36.470 -6.395 0.930 501 HD1 TYR 600 HD1 TYR 600 39.612 -8.339 1.088 502 HD2 TYR 600 HD2 TYR 600 35.875 -7.827 -0.981 503 HE1 TYR 600 HE1 TYR 600 39.959 -10.516 -0.069 504 HE2 TYR 600 HE2 TYR 600 36.212 -10.015 -2.134 505 HH TYR 600 HH TYR 600 37.615 -11.809 -2.424 506 H HIS 601 H HIS 601 36.088 -4.445 -1.013 507 HA HIS 601 HA HIS 601 36.186 -5.538 -3.621 508 HB2 HIS 601 HB2 HIS 601 34.178 -4.546 -2.560 509 HB3 HIS 601 HB3 HIS 601 34.924 -2.952 -2.615 510 HD2 HIS 601 HD2 HIS 601 34.627 -5.583 -5.505 511 HE1 HIS 601 HE1 HIS 601 32.461 -2.118 -6.691 512 HE2 HIS 601 HE2 HIS 601 33.264 -4.417 -7.427 513 H GLU 602 H GLU 602 37.705 -2.547 -2.407 514 HA GLU 602 HA GLU 602 38.610 -1.726 -5.078 515 HB2 GLU 602 HB2 GLU 602 39.149 -0.729 -2.266 516 HB3 GLU 602 HB3 GLU 602 39.952 -0.048 -3.681 517 HG2 GLU 602 HG2 GLU 602 36.921 -0.174 -3.509 518 HG3 GLU 602 HG3 GLU 602 37.842 1.128 -2.781 519 H THR 603 H THR 603 40.057 -3.549 -2.366 520 HA THR 603 HA THR 603 42.743 -3.371 -3.568 521 HB THR 603 HB THR 603 43.481 -4.661 -1.619 522 HG1 THR 603 HG1 THR 603 41.742 -5.895 -1.130 523 HG21 THR 603 HG21 THR 603 43.067 -3.007 0.085 524 HG22 THR 603 HG22 THR 603 41.678 -2.352 -0.802 525 HG23 THR 603 HG23 THR 603 43.320 -2.188 -1.469 526 H SER 604 H SER 604 40.182 -5.801 -3.498 527 HA SER 604 HA SER 604 41.747 -8.099 -3.932 528 HB2 SER 604 HB2 SER 604 39.382 -8.144 -3.277 529 HB3 SER 604 HB3 SER 604 38.921 -7.533 -4.876 530 HG SER 604 HG SER 604 39.987 -10.042 -4.150 531 H GLN 605 H GLN 605 42.942 -8.766 -5.549 532 HA GLN 605 HA GLN 605 42.446 -8.149 -8.390 533 HB2 GLN 605 HB2 GLN 605 44.980 -7.346 -6.885 534 HB3 GLN 605 HB3 GLN 605 44.860 -7.439 -8.640 535 HG2 GLN 605 HG2 GLN 605 43.069 -5.716 -8.628 536 HG3 GLN 605 HG3 GLN 605 43.263 -5.547 -6.877 537 HE21 GLN 605 HE21 GLN 605 45.375 -4.781 -6.046 538 HE22 GLN 605 HE22 GLN 605 46.356 -3.759 -7.094 539 H ASN 606 H ASN 606 43.953 -9.382 -9.802 540 HA ASN 606 HA ASN 606 44.708 -11.375 -10.563 541 HB2 ASN 606 HB2 ASN 606 46.293 -11.406 -7.976 542 HB3 ASN 606 HB3 ASN 606 46.674 -12.296 -9.449 543 HD21 ASN 606 HD21 ASN 606 47.267 -11.020 -11.404 544 HD22 ASN 606 HD22 ASN 606 47.965 -9.423 -11.160 545 H SER 607 H SER 607 42.215 -11.652 -9.611 546 HA SER 607 HA SER 607 41.746 -13.592 -7.640 547 HB2 SER 607 HB2 SER 607 39.930 -12.871 -9.964 548 HB3 SER 607 HB3 SER 607 39.446 -13.489 -8.378 549 HG SER 607 HG SER 607 39.217 -11.223 -8.518 550 H SER 608 H SER 608 42.891 -14.270 -10.769 551 HA SER 608 HA SER 608 41.500 -16.560 -11.616 552 HB2 SER 608 HB2 SER 608 44.437 -15.902 -12.040 553 HB3 SER 608 HB3 SER 608 43.460 -17.019 -13.000 554 HG SER 608 HG SER 608 43.539 -14.933 -13.961 Start of MODEL 10 1 H1 GLY 533 H1 GLY 533 8.591 1.843 -9.528 2 H2 GLY 533 H2 GLY 533 7.368 2.214 -8.498 3 H3 GLY 533 H3 GLY 533 8.239 0.841 -8.275 4 HA2 GLY 533 HA2 GLY 533 8.899 2.524 -6.672 5 HA3 GLY 533 HA3 GLY 533 10.225 2.081 -7.762 6 H GLY 534 H GLY 534 9.096 4.661 -6.275 7 HA2 GLY 534 HA2 GLY 534 8.837 6.602 -8.478 8 HA3 GLY 534 HA3 GLY 534 8.725 6.914 -6.749 9 H SER 535 H SER 535 11.409 5.566 -6.255 10 HA SER 535 HA SER 535 13.348 7.369 -7.569 11 HB2 SER 535 HB2 SER 535 14.001 8.518 -5.518 12 HB3 SER 535 HB3 SER 535 12.305 8.816 -5.890 13 HG SER 535 HG SER 535 13.414 7.209 -3.858 14 H GLU 536 H GLU 536 12.816 4.360 -6.261 15 HA GLU 536 HA GLU 536 15.202 3.827 -4.802 16 HB2 GLU 536 HB2 GLU 536 13.282 1.981 -6.296 17 HB3 GLU 536 HB3 GLU 536 14.564 1.446 -5.224 18 HG2 GLU 536 HG2 GLU 536 12.647 1.347 -3.921 19 HG3 GLU 536 HG3 GLU 536 13.532 2.749 -3.352 20 H PHE 537 H PHE 537 14.729 4.056 -8.219 21 HA PHE 537 HA PHE 537 17.462 3.010 -8.756 22 HB2 PHE 537 HB2 PHE 537 15.014 2.418 -10.448 23 HB3 PHE 537 HB3 PHE 537 16.665 1.917 -10.781 24 HD1 PHE 537 HD1 PHE 537 13.612 1.157 -8.923 25 HD2 PHE 537 HD2 PHE 537 17.819 0.270 -9.241 26 HE1 PHE 537 HE1 PHE 537 13.290 -0.882 -7.543 27 HE2 PHE 537 HE2 PHE 537 17.490 -1.771 -7.868 28 HZ PHE 537 HZ PHE 537 15.230 -2.343 -7.008 29 H SER 538 H SER 538 18.643 4.086 -10.211 30 HA SER 538 HA SER 538 17.697 6.231 -11.940 31 HB2 SER 538 HB2 SER 538 18.734 8.059 -10.716 32 HB3 SER 538 HB3 SER 538 17.565 7.276 -9.656 33 HG SER 538 HG SER 538 19.536 7.646 -8.594 34 H ASP 539 H ASP 539 20.120 7.641 -12.116 35 HA ASP 539 HA ASP 539 21.974 5.822 -13.418 36 HB2 ASP 539 HB2 ASP 539 22.283 8.736 -12.628 37 HB3 ASP 539 HB3 ASP 539 23.349 7.848 -13.706 38 H ARG 540 H ARG 540 21.456 6.141 -10.165 39 HA ARG 540 HA ARG 540 23.983 6.385 -8.929 40 HB2 ARG 540 HB2 ARG 540 23.052 5.388 -7.033 41 HB3 ARG 540 HB3 ARG 540 21.846 6.438 -7.756 42 HG2 ARG 540 HG2 ARG 540 20.641 4.475 -8.676 43 HG3 ARG 540 HG3 ARG 540 21.917 3.390 -8.075 44 HD2 ARG 540 HD2 ARG 540 21.519 4.227 -5.777 45 HD3 ARG 540 HD3 ARG 540 20.189 5.210 -6.382 46 HE ARG 540 HE ARG 540 18.822 3.323 -6.442 47 HH11 ARG 540 HH11 ARG 540 22.132 2.038 -6.186 48 HH12 ARG 540 HH12 ARG 540 21.480 0.473 -5.735 49 HH21 ARG 540 HH21 ARG 540 18.214 1.307 -6.018 50 HH22 ARG 540 HH22 ARG 540 19.414 0.055 -5.694 51 H SER 541 H SER 541 25.377 4.877 -7.970 52 HA SER 541 HA SER 541 25.931 2.402 -9.475 53 HB2 SER 541 HB2 SER 541 27.932 2.295 -8.108 54 HB3 SER 541 HB3 SER 541 27.754 3.922 -8.774 55 HG SER 541 HG SER 541 28.200 4.173 -6.635 56 H ASN 542 H ASN 542 26.439 0.425 -8.170 57 HA ASN 542 HA ASN 542 24.362 -0.186 -6.151 58 HB2 ASN 542 HB2 ASN 542 26.464 -1.933 -7.486 59 HB3 ASN 542 HB3 ASN 542 25.228 -2.504 -6.374 60 HD21 ASN 542 HD21 ASN 542 25.538 -3.541 -8.973 61 HD22 ASN 542 HD22 ASN 542 24.099 -3.098 -9.886 62 H GLU 543 H GLU 543 27.394 1.236 -5.964 63 HA GLU 543 HA GLU 543 28.752 -0.268 -3.970 64 HB2 GLU 543 HB2 GLU 543 28.855 2.708 -4.583 65 HB3 GLU 543 HB3 GLU 543 30.010 1.835 -3.570 66 HG2 GLU 543 HG2 GLU 543 30.728 0.467 -5.460 67 HG3 GLU 543 HG3 GLU 543 29.498 1.174 -6.500 68 H LEU 544 H LEU 544 26.154 2.057 -3.636 69 HA LEU 544 HA LEU 544 26.345 2.629 -0.836 70 HB2 LEU 544 HB2 LEU 544 23.875 2.439 -2.614 71 HB3 LEU 544 HB3 LEU 544 23.969 3.268 -1.068 72 HG LEU 544 HG LEU 544 25.486 4.083 -3.594 73 HD11 LEU 544 HD11 LEU 544 23.071 5.342 -2.231 74 HD12 LEU 544 HD12 LEU 544 23.049 4.434 -3.760 75 HD13 LEU 544 HD13 LEU 544 23.931 5.968 -3.659 76 HD21 LEU 544 HD21 LEU 544 25.220 5.475 -0.892 77 HD22 LEU 544 HD22 LEU 544 25.961 6.172 -2.349 78 HD23 LEU 544 HD23 LEU 544 26.706 4.770 -1.571 79 H GLU 545 H GLU 545 25.113 -0.195 -2.555 80 HA GLU 545 HA GLU 545 23.589 -1.250 -0.284 81 HB2 GLU 545 HB2 GLU 545 24.308 -2.476 -2.969 82 HB3 GLU 545 HB3 GLU 545 23.177 -3.147 -1.789 83 HG2 GLU 545 HG2 GLU 545 21.674 -1.251 -2.047 84 HG3 GLU 545 HG3 GLU 545 22.823 -0.402 -3.067 85 H ILE 546 H ILE 546 26.896 -1.448 -1.343 86 HA ILE 546 HA ILE 546 27.605 -3.973 -0.141 87 HB ILE 546 HB ILE 546 29.315 -1.529 -0.701 88 HG12 ILE 546 HG12 ILE 546 28.172 -2.457 -2.772 89 HG13 ILE 546 HG13 ILE 546 29.925 -2.401 -2.797 90 HG21 ILE 546 HG21 ILE 546 31.199 -3.219 -0.785 91 HG22 ILE 546 HG22 ILE 546 30.506 -2.976 0.821 92 HG23 ILE 546 HG23 ILE 546 30.075 -4.416 -0.111 93 HD11 ILE 546 HD11 ILE 546 28.378 -4.942 -2.133 94 HD12 ILE 546 HD12 ILE 546 28.952 -4.501 -3.760 95 HD13 ILE 546 HD13 ILE 546 30.122 -4.760 -2.455 96 H ARG 547 H ARG 547 27.310 -0.681 1.124 97 HA ARG 547 HA ARG 547 28.476 -1.036 3.728 98 HB2 ARG 547 HB2 ARG 547 26.082 0.664 2.882 99 HB3 ARG 547 HB3 ARG 547 26.990 0.844 4.375 100 HG2 ARG 547 HG2 ARG 547 28.102 1.318 1.580 101 HG3 ARG 547 HG3 ARG 547 27.555 2.555 2.711 102 HD2 ARG 547 HD2 ARG 547 29.293 1.794 4.345 103 HD3 ARG 547 HD3 ARG 547 29.911 0.672 3.120 104 HE ARG 547 HE ARG 547 29.761 3.255 1.954 105 HH11 ARG 547 HH11 ARG 547 31.693 1.686 4.440 106 HH12 ARG 547 HH12 ARG 547 33.050 2.744 4.159 107 HH21 ARG 547 HH21 ARG 547 31.540 4.573 1.683 108 HH22 ARG 547 HH22 ARG 547 32.964 4.313 2.653 109 H GLY 548 H GLY 548 25.477 -2.220 2.397 110 HA2 GLY 548 HA2 GLY 548 24.130 -2.766 4.914 111 HA3 GLY 548 HA3 GLY 548 23.632 -3.252 3.299 112 H LYS 549 H LYS 549 26.702 -4.461 3.345 113 HA LYS 549 HA LYS 549 25.898 -7.179 4.053 114 HB2 LYS 549 HB2 LYS 549 28.704 -6.052 3.703 115 HB3 LYS 549 HB3 LYS 549 28.257 -7.746 3.759 116 HG2 LYS 549 HG2 LYS 549 27.756 -5.768 1.516 117 HG3 LYS 549 HG3 LYS 549 28.750 -7.203 1.517 118 HD2 LYS 549 HD2 LYS 549 27.028 -8.147 0.428 119 HD3 LYS 549 HD3 LYS 549 26.334 -8.364 2.048 120 HE2 LYS 549 HE2 LYS 549 25.214 -6.097 1.738 121 HE3 LYS 549 HE3 LYS 549 25.824 -6.074 0.088 122 HZ1 LYS 549 HZ1 LYS 549 24.549 -8.091 -0.359 123 HZ2 LYS 549 HZ2 LYS 549 23.557 -6.923 0.183 124 HZ3 LYS 549 HZ3 LYS 549 23.993 -8.143 1.172 125 H TYR 550 H TYR 550 26.470 -8.412 5.855 126 HA TYR 550 HA TYR 550 28.177 -7.287 7.918 127 HB2 TYR 550 HB2 TYR 550 26.594 -7.553 9.789 128 HB3 TYR 550 HB3 TYR 550 26.109 -6.291 8.709 129 HD1 TYR 550 HD1 TYR 550 24.067 -6.536 7.328 130 HD2 TYR 550 HD2 TYR 550 25.328 -9.650 10.019 131 HE1 TYR 550 HE1 TYR 550 21.804 -7.574 7.182 132 HE2 TYR 550 HE2 TYR 550 23.068 -10.687 9.880 133 HH TYR 550 HH TYR 550 20.945 -10.524 9.013 134 H VAL 551 H VAL 551 28.649 -8.730 9.647 135 HA VAL 551 HA VAL 551 28.085 -11.619 9.213 136 HB VAL 551 HB VAL 551 30.496 -12.001 10.073 137 HG11 VAL 551 HG11 VAL 551 31.319 -12.154 7.741 138 HG12 VAL 551 HG12 VAL 551 29.627 -12.680 7.831 139 HG13 VAL 551 HG13 VAL 551 30.017 -11.064 7.206 140 HG21 VAL 551 HG21 VAL 551 32.212 -10.513 9.243 141 HG22 VAL 551 HG22 VAL 551 30.988 -9.312 8.752 142 HG23 VAL 551 HG23 VAL 551 31.205 -9.731 10.475 143 H VAL 552 H VAL 552 27.595 -12.727 11.014 144 HA VAL 552 HA VAL 552 26.820 -11.171 13.306 145 HB VAL 552 HB VAL 552 25.584 -13.134 12.447 146 HG11 VAL 552 HG11 VAL 552 26.182 -15.395 13.134 147 HG12 VAL 552 HG12 VAL 552 27.494 -14.727 12.158 148 HG13 VAL 552 HG13 VAL 552 27.657 -14.818 13.924 149 HG21 VAL 552 HG21 VAL 552 25.045 -12.237 14.644 150 HG22 VAL 552 HG22 VAL 552 24.867 -14.001 14.630 151 HG23 VAL 552 HG23 VAL 552 26.285 -13.268 15.395 152 H VAL 553 H VAL 553 27.605 -10.960 15.301 153 HA VAL 553 HA VAL 553 30.375 -11.815 15.924 154 HB VAL 553 HB VAL 553 28.511 -9.951 17.461 155 HG11 VAL 553 HG11 VAL 553 30.087 -11.103 18.974 156 HG12 VAL 553 HG12 VAL 553 31.442 -10.726 17.875 157 HG13 VAL 553 HG13 VAL 553 30.583 -9.429 18.708 158 HG21 VAL 553 HG21 VAL 553 31.019 -9.358 15.870 159 HG22 VAL 553 HG22 VAL 553 29.374 -8.883 15.384 160 HG23 VAL 553 HG23 VAL 553 30.106 -8.196 16.861 161 HA PRO 554 HA PRO 554 28.182 -15.084 18.269 162 HB2 PRO 554 HB2 PRO 554 30.248 -16.820 18.609 163 HB3 PRO 554 HB3 PRO 554 29.483 -16.559 17.007 164 HG2 PRO 554 HG2 PRO 554 32.018 -15.311 18.091 165 HG3 PRO 554 HG3 PRO 554 31.773 -16.125 16.516 166 HD2 PRO 554 HD2 PRO 554 31.614 -13.401 16.835 167 HD3 PRO 554 HD3 PRO 554 30.645 -14.280 15.619 168 H GLU 555 H GLU 555 28.174 -15.729 20.493 169 HA GLU 555 HA GLU 555 29.131 -13.898 22.432 170 HB2 GLU 555 HB2 GLU 555 27.228 -15.386 22.754 171 HB3 GLU 555 HB3 GLU 555 28.278 -16.810 22.703 172 HG2 GLU 555 HG2 GLU 555 29.370 -16.147 24.772 173 HG3 GLU 555 HG3 GLU 555 28.562 -14.588 24.760 174 H THR 556 H THR 556 30.569 -16.851 21.156 175 HA THR 556 HA THR 556 32.775 -17.224 22.864 176 HB THR 556 HB THR 556 32.719 -17.685 19.899 177 HG1 THR 556 HG1 THR 556 31.803 -19.357 21.989 178 HG21 THR 556 HG21 THR 556 34.099 -19.709 20.455 179 HG22 THR 556 HG22 THR 556 34.253 -19.098 22.122 180 HG23 THR 556 HG23 THR 556 34.922 -18.176 20.758 181 H SER 557 H SER 557 32.333 -14.717 20.414 182 HA SER 557 HA SER 557 35.135 -14.058 20.069 183 HB2 SER 557 HB2 SER 557 33.276 -13.480 18.459 184 HB3 SER 557 HB3 SER 557 32.712 -12.266 19.617 185 HG SER 557 HG SER 557 34.904 -11.375 19.433 186 H GLN 558 H GLN 558 32.794 -13.309 22.511 187 HA GLN 558 HA GLN 558 32.718 -12.176 24.403 188 HB2 GLN 558 HB2 GLN 558 35.701 -12.549 24.284 189 HB3 GLN 558 HB3 GLN 558 34.827 -12.027 25.722 190 HG2 GLN 558 HG2 GLN 558 33.793 -14.090 26.061 191 HG3 GLN 558 HG3 GLN 558 33.918 -14.586 24.383 192 HE21 GLN 558 HE21 GLN 558 35.782 -15.682 23.659 193 HE22 GLN 558 HE22 GLN 558 37.086 -16.110 24.765 194 H ASP 559 H ASP 559 35.512 -10.586 22.814 195 HA ASP 559 HA ASP 559 34.868 -8.000 24.040 196 HB2 ASP 559 HB2 ASP 559 37.018 -8.803 22.054 197 HB3 ASP 559 HB3 ASP 559 36.928 -7.258 22.895 198 H MET 560 H MET 560 33.925 -9.542 21.152 199 HA MET 560 HA MET 560 32.896 -8.940 19.246 200 HB2 MET 560 HB2 MET 560 31.904 -6.501 20.775 201 HB3 MET 560 HB3 MET 560 31.193 -7.245 19.350 202 HG2 MET 560 HG2 MET 560 31.017 -9.399 20.793 203 HG3 MET 560 HG3 MET 560 31.313 -8.352 22.166 204 HE1 MET 560 HE1 MET 560 27.403 -9.479 21.751 205 HE2 MET 560 HE2 MET 560 28.613 -10.232 20.696 206 HE3 MET 560 HE3 MET 560 28.963 -10.001 22.425 207 H ALA 561 H ALA 561 35.666 -7.910 19.457 208 HA ALA 561 HA ALA 561 35.495 -5.642 17.528 209 HB1 ALA 561 HB1 ALA 561 37.362 -5.865 19.920 210 HB2 ALA 561 HB2 ALA 561 37.355 -4.560 18.714 211 HB3 ALA 561 HB3 ALA 561 35.949 -4.793 19.780 212 H PHE 562 H PHE 562 36.993 -5.458 15.958 213 HA PHE 562 HA PHE 562 39.408 -7.076 15.813 214 HB2 PHE 562 HB2 PHE 562 37.332 -8.448 14.841 215 HB3 PHE 562 HB3 PHE 562 37.578 -7.420 13.443 216 HD1 PHE 562 HD1 PHE 562 39.592 -7.770 12.005 217 HD2 PHE 562 HD2 PHE 562 39.051 -10.012 15.645 218 HE1 PHE 562 HE1 PHE 562 41.445 -9.283 11.352 219 HE2 PHE 562 HE2 PHE 562 40.899 -11.529 14.979 220 HZ PHE 562 HZ PHE 562 42.103 -11.160 12.845 221 H LYS 563 H LYS 563 40.382 -6.518 13.383 222 HA LYS 563 HA LYS 563 39.873 -3.650 12.739 223 HB2 LYS 563 HB2 LYS 563 41.607 -3.641 14.385 224 HB3 LYS 563 HB3 LYS 563 42.497 -4.910 13.596 225 HG2 LYS 563 HG2 LYS 563 42.035 -2.350 12.060 226 HG3 LYS 563 HG3 LYS 563 43.137 -2.294 13.408 227 HD2 LYS 563 HD2 LYS 563 43.405 -4.167 11.014 228 HD3 LYS 563 HD3 LYS 563 44.302 -2.677 11.255 229 HE2 LYS 563 HE2 LYS 563 44.465 -5.159 13.019 230 HE3 LYS 563 HE3 LYS 563 45.611 -4.706 11.769 231 HZ1 LYS 563 HZ1 LYS 563 46.114 -2.686 13.038 232 HZ2 LYS 563 HZ2 LYS 563 46.409 -4.018 13.927 233 HZ3 LYS 563 HZ3 LYS 563 45.084 -3.129 14.230 234 H CYS 564 H CYS 564 39.900 -3.129 10.710 235 HA CYS 564 HA CYS 564 40.112 -4.987 8.525 236 HB2 CYS 564 HB2 CYS 564 38.694 -2.834 8.721 237 HB3 CYS 564 HB3 CYS 564 40.160 -1.945 8.502 238 HA PRO 565 HA PRO 565 44.663 -4.402 8.248 239 HB2 PRO 565 HB2 PRO 565 44.271 -6.191 5.858 240 HB3 PRO 565 HB3 PRO 565 45.494 -6.305 7.150 241 HG2 PRO 565 HG2 PRO 565 43.366 -7.975 7.145 242 HG3 PRO 565 HG3 PRO 565 43.887 -7.212 8.687 243 HD2 PRO 565 HD2 PRO 565 41.633 -6.355 6.849 244 HD3 PRO 565 HD3 PRO 565 41.641 -6.563 8.612 245 H ILE 566 H ILE 566 42.297 -3.876 5.679 246 HA ILE 566 HA ILE 566 44.113 -2.829 3.683 247 HB ILE 566 HB ILE 566 41.102 -2.748 3.974 248 HG12 ILE 566 HG12 ILE 566 42.850 -4.251 1.974 249 HG13 ILE 566 HG13 ILE 566 42.368 -4.954 3.514 250 HG21 ILE 566 HG21 ILE 566 41.110 -2.020 1.520 251 HG22 ILE 566 HG22 ILE 566 41.658 -0.790 2.646 252 HG23 ILE 566 HG23 ILE 566 42.845 -1.712 1.695 253 HD11 ILE 566 HD11 ILE 566 40.486 -4.162 1.260 254 HD12 ILE 566 HD12 ILE 566 40.893 -5.787 1.813 255 HD13 ILE 566 HD13 ILE 566 39.963 -4.712 2.870 256 H CYS 567 H CYS 567 41.652 -1.118 5.705 257 HA CYS 567 HA CYS 567 43.108 1.410 5.208 258 HB2 CYS 567 HB2 CYS 567 41.127 2.534 5.802 259 HB3 CYS 567 HB3 CYS 567 40.714 1.297 4.610 260 H LYS 568 H LYS 568 43.204 -0.937 7.464 261 HA LYS 568 HA LYS 568 43.998 -1.190 9.583 262 HB2 LYS 568 HB2 LYS 568 45.284 1.519 9.173 263 HB3 LYS 568 HB3 LYS 568 45.654 0.367 10.449 264 HG2 LYS 568 HG2 LYS 568 46.304 -1.326 8.720 265 HG3 LYS 568 HG3 LYS 568 46.015 -0.109 7.458 266 HD2 LYS 568 HD2 LYS 568 47.732 1.362 8.472 267 HD3 LYS 568 HD3 LYS 568 48.032 0.133 9.722 268 HE2 LYS 568 HE2 LYS 568 48.675 -1.504 7.978 269 HE3 LYS 568 HE3 LYS 568 48.364 -0.302 6.728 270 HZ1 LYS 568 HZ1 LYS 568 50.134 1.068 7.716 271 HZ2 LYS 568 HZ2 LYS 568 50.719 -0.393 7.271 272 HZ3 LYS 568 HZ3 LYS 568 50.434 -0.068 8.840 273 H GLU 569 H GLU 569 41.359 -0.692 9.564 274 HA GLU 569 HA GLU 569 40.989 1.174 11.902 275 HB2 GLU 569 HB2 GLU 569 39.241 0.826 9.460 276 HB3 GLU 569 HB3 GLU 569 38.671 1.564 10.929 277 HG2 GLU 569 HG2 GLU 569 40.974 2.561 9.226 278 HG3 GLU 569 HG3 GLU 569 39.353 3.244 9.279 279 H THR 570 H THR 570 39.769 0.682 13.561 280 HA THR 570 HA THR 570 39.126 -2.056 14.085 281 HB THR 570 HB THR 570 38.267 0.416 15.613 282 HG1 THR 570 HG1 THR 570 40.575 -1.174 15.945 283 HG21 THR 570 HG21 THR 570 37.121 -1.572 16.474 284 HG22 THR 570 HG22 THR 570 38.378 -1.062 17.604 285 HG23 THR 570 HG23 THR 570 38.659 -2.460 16.543 286 H VAL 571 H VAL 571 37.273 -3.170 14.127 287 HA VAL 571 HA VAL 571 34.649 -1.864 13.538 288 HB VAL 571 HB VAL 571 33.923 -4.254 12.956 289 HG11 VAL 571 HG11 VAL 571 34.460 -3.933 10.602 290 HG12 VAL 571 HG12 VAL 571 33.899 -2.451 11.370 291 HG13 VAL 571 HG13 VAL 571 35.650 -2.678 11.040 292 HG21 VAL 571 HG21 VAL 571 35.529 -5.706 11.906 293 HG22 VAL 571 HG22 VAL 571 36.858 -4.589 12.289 294 HG23 VAL 571 HG23 VAL 571 35.987 -5.442 13.600 295 H THR 572 H THR 572 33.029 -2.222 14.956 296 HA THR 572 HA THR 572 33.459 -4.086 17.238 297 HB THR 572 HB THR 572 32.350 -2.456 18.713 298 HG1 THR 572 HG1 THR 572 31.396 -1.090 17.182 299 HG21 THR 572 HG21 THR 572 34.281 -1.064 19.122 300 HG22 THR 572 HG22 THR 572 34.897 -1.341 17.474 301 HG23 THR 572 HG23 THR 572 34.826 -2.674 18.660 302 H GLY 573 H GLY 573 31.678 -5.167 17.968 303 HA2 GLY 573 HA2 GLY 573 29.571 -5.664 16.169 304 HA3 GLY 573 HA3 GLY 573 29.635 -6.206 17.849 305 H VAL 574 H VAL 574 27.442 -5.117 16.076 306 HA VAL 574 HA VAL 574 26.266 -3.313 18.122 307 HB VAL 574 HB VAL 574 25.078 -2.067 16.443 308 HG11 VAL 574 HG11 VAL 574 27.358 -1.292 17.027 309 HG12 VAL 574 HG12 VAL 574 27.996 -2.115 15.583 310 HG13 VAL 574 HG13 VAL 574 26.829 -0.788 15.428 311 HG21 VAL 574 HG21 VAL 574 24.742 -3.755 14.691 312 HG22 VAL 574 HG22 VAL 574 25.413 -2.256 14.052 313 HG23 VAL 574 HG23 VAL 574 26.479 -3.667 14.277 314 H TYR 575 H TYR 575 23.971 -3.505 18.496 315 HA TYR 575 HA TYR 575 23.182 -6.278 18.326 316 HB2 TYR 575 HB2 TYR 575 22.762 -4.904 20.302 317 HB3 TYR 575 HB3 TYR 575 21.676 -3.872 19.377 318 HD1 TYR 575 HD1 TYR 575 19.359 -4.317 19.523 319 HD2 TYR 575 HD2 TYR 575 22.177 -7.512 20.194 320 HE1 TYR 575 HE1 TYR 575 17.502 -5.819 20.179 321 HE2 TYR 575 HE2 TYR 575 20.309 -9.028 20.834 322 HH TYR 575 HH TYR 575 16.907 -7.912 20.955 323 H ASP 576 H ASP 576 21.641 -7.296 17.171 324 HA ASP 576 HA ASP 576 20.009 -5.816 15.161 325 HB2 ASP 576 HB2 ASP 576 21.664 -7.343 14.131 326 HB3 ASP 576 HB3 ASP 576 21.070 -8.671 15.104 327 H GLU 577 H GLU 577 17.956 -5.727 15.681 328 HA GLU 577 HA GLU 577 16.823 -7.239 17.868 329 HB2 GLU 577 HB2 GLU 577 15.266 -5.501 15.917 330 HB3 GLU 577 HB3 GLU 577 14.896 -5.925 17.572 331 HG2 GLU 577 HG2 GLU 577 15.616 -3.799 17.895 332 HG3 GLU 577 HG3 GLU 577 17.111 -4.691 18.175 333 H GLU 578 H GLU 578 16.806 -7.679 14.385 334 HA GLU 578 HA GLU 578 14.468 -9.372 14.290 335 HB2 GLU 578 HB2 GLU 578 15.277 -8.033 12.358 336 HB3 GLU 578 HB3 GLU 578 16.727 -9.008 12.280 337 HG2 GLU 578 HG2 GLU 578 15.146 -9.680 10.569 338 HG3 GLU 578 HG3 GLU 578 15.452 -10.993 11.687 339 H SER 579 H SER 579 18.014 -10.115 14.122 340 HA SER 579 HA SER 579 17.562 -12.993 14.440 341 HB2 SER 579 HB2 SER 579 20.143 -11.428 14.872 342 HB3 SER 579 HB3 SER 579 19.946 -13.179 14.660 343 HG SER 579 HG SER 579 19.615 -11.097 12.817 344 H GLY 580 H GLY 580 18.238 -10.242 16.608 345 HA2 GLY 580 HA2 GLY 580 18.100 -10.097 18.910 346 HA3 GLY 580 HA3 GLY 580 17.735 -11.828 19.039 347 H GLU 581 H GLU 581 20.442 -10.363 17.277 348 HA GLU 581 HA GLU 581 22.464 -11.565 19.102 349 HB2 GLU 581 HB2 GLU 581 22.338 -11.929 16.088 350 HB3 GLU 581 HB3 GLU 581 23.684 -12.427 17.090 351 HG2 GLU 581 HG2 GLU 581 20.865 -13.574 17.134 352 HG3 GLU 581 HG3 GLU 581 22.292 -14.323 16.464 353 H TRP 582 H TRP 582 24.738 -10.882 18.207 354 HA TRP 582 HA TRP 582 24.653 -7.957 17.578 355 HB2 TRP 582 HB2 TRP 582 26.751 -9.601 18.997 356 HB3 TRP 582 HB3 TRP 582 26.969 -7.932 18.496 357 HD1 TRP 582 HD1 TRP 582 24.658 -10.001 20.793 358 HE1 TRP 582 HE1 TRP 582 23.785 -8.533 22.694 359 HE3 TRP 582 HE3 TRP 582 26.782 -5.561 19.418 360 HZ2 TRP 582 HZ2 TRP 582 23.916 -5.769 23.482 361 HZ3 TRP 582 HZ3 TRP 582 26.371 -3.501 20.748 362 HH2 TRP 582 HH2 TRP 582 24.921 -3.595 22.779 363 H VAL 583 H VAL 583 25.957 -7.129 15.943 364 HA VAL 583 HA VAL 583 27.103 -9.008 13.938 365 HB VAL 583 HB VAL 583 25.948 -7.660 12.158 366 HG11 VAL 583 HG11 VAL 583 24.101 -9.232 13.999 367 HG12 VAL 583 HG12 VAL 583 23.797 -8.831 12.297 368 HG13 VAL 583 HG13 VAL 583 25.144 -9.902 12.715 369 HG21 VAL 583 HG21 VAL 583 25.274 -5.698 13.467 370 HG22 VAL 583 HG22 VAL 583 23.957 -6.429 12.559 371 HG23 VAL 583 HG23 VAL 583 24.063 -6.703 14.311 372 H TRP 584 H TRP 584 28.586 -8.236 12.531 373 HA TRP 584 HA TRP 584 29.838 -5.577 13.053 374 HB2 TRP 584 HB2 TRP 584 30.771 -8.217 11.895 375 HB3 TRP 584 HB3 TRP 584 31.599 -6.743 11.462 376 HD1 TRP 584 HD1 TRP 584 31.988 -5.303 14.143 377 HE1 TRP 584 HE1 TRP 584 33.509 -6.251 15.990 378 HE3 TRP 584 HE3 TRP 584 31.992 -10.227 12.738 379 HZ2 TRP 584 HZ2 TRP 584 34.702 -8.795 16.662 380 HZ3 TRP 584 HZ3 TRP 584 33.322 -11.884 14.010 381 HH2 TRP 584 HH2 TRP 584 34.649 -11.194 15.968 382 H LYS 585 H LYS 585 28.885 -4.098 11.810 383 HA LYS 585 HA LYS 585 27.607 -4.777 9.228 384 HB2 LYS 585 HB2 LYS 585 27.739 -2.154 10.780 385 HB3 LYS 585 HB3 LYS 585 26.872 -2.403 9.266 386 HG2 LYS 585 HG2 LYS 585 25.642 -4.341 10.468 387 HG3 LYS 585 HG3 LYS 585 26.270 -3.634 11.957 388 HD2 LYS 585 HD2 LYS 585 24.414 -2.367 9.909 389 HD3 LYS 585 HD3 LYS 585 24.035 -2.832 11.572 390 HE2 LYS 585 HE2 LYS 585 25.661 -1.077 12.379 391 HE3 LYS 585 HE3 LYS 585 25.929 -0.594 10.704 392 HZ1 LYS 585 HZ1 LYS 585 23.572 -0.030 10.544 393 HZ2 LYS 585 HZ2 LYS 585 24.264 0.814 11.757 394 HZ3 LYS 585 HZ3 LYS 585 23.313 -0.458 12.101 395 H ASN 586 H ASN 586 28.075 -3.776 7.246 396 HA ASN 586 HA ASN 586 29.433 -3.326 5.517 397 HB2 ASN 586 HB2 ASN 586 29.252 -1.084 6.610 398 HB3 ASN 586 HB3 ASN 586 30.771 -1.388 7.457 399 HD21 ASN 586 HD21 ASN 586 31.058 -2.501 4.154 400 HD22 ASN 586 HD22 ASN 586 31.851 -1.022 3.630 401 H THR 587 H THR 587 30.084 -5.639 7.038 402 HA THR 587 HA THR 587 33.065 -5.842 6.819 403 HB THR 587 HB THR 587 31.355 -6.976 9.059 404 HG1 THR 587 HG1 THR 587 31.708 -4.704 9.187 405 HG21 THR 587 HG21 THR 587 33.356 -8.385 8.714 406 HG22 THR 587 HG22 THR 587 33.494 -7.432 10.190 407 HG23 THR 587 HG23 THR 587 34.383 -6.928 8.750 408 H ILE 588 H ILE 588 33.939 -7.816 6.386 409 HA ILE 588 HA ILE 588 32.292 -10.113 5.538 410 HB ILE 588 HB ILE 588 32.519 -8.890 3.525 411 HG12 ILE 588 HG12 ILE 588 34.773 -10.929 3.433 412 HG13 ILE 588 HG13 ILE 588 33.051 -11.386 3.467 413 HG21 ILE 588 HG21 ILE 588 34.629 -8.080 2.563 414 HG22 ILE 588 HG22 ILE 588 34.414 -7.367 4.158 415 HG23 ILE 588 HG23 ILE 588 35.517 -8.745 3.953 416 HD11 ILE 588 HD11 ILE 588 33.815 -11.495 1.200 417 HD12 ILE 588 HD12 ILE 588 32.729 -10.091 1.337 418 HD13 ILE 588 HD13 ILE 588 34.491 -9.862 1.265 419 H GLU 589 H GLU 589 33.334 -12.092 5.736 420 HA GLU 589 HA GLU 589 36.108 -12.143 6.863 421 HB2 GLU 589 HB2 GLU 589 34.314 -12.920 8.435 422 HB3 GLU 589 HB3 GLU 589 33.886 -14.170 7.263 423 HG2 GLU 589 HG2 GLU 589 36.242 -15.060 7.414 424 HG3 GLU 589 HG3 GLU 589 36.584 -13.838 8.633 425 H VAL 590 H VAL 590 37.614 -13.230 5.701 426 HA VAL 590 HA VAL 590 36.938 -15.450 3.960 427 HB VAL 590 HB VAL 590 36.394 -13.630 2.459 428 HG11 VAL 590 HG11 VAL 590 39.275 -12.663 2.693 429 HG12 VAL 590 HG12 VAL 590 37.995 -12.040 1.624 430 HG13 VAL 590 HG13 VAL 590 37.838 -11.852 3.368 431 HG21 VAL 590 HG21 VAL 590 38.995 -14.906 1.542 432 HG22 VAL 590 HG22 VAL 590 37.388 -15.688 1.516 433 HG23 VAL 590 HG23 VAL 590 37.692 -14.251 0.540 434 H ASN 591 H ASN 591 38.697 -16.781 3.512 435 HA ASN 591 HA ASN 591 40.622 -17.836 4.024 436 HB2 ASN 591 HB2 ASN 591 41.157 -16.196 2.172 437 HB3 ASN 591 HB3 ASN 591 41.877 -15.144 3.396 438 HD21 ASN 591 HD21 ASN 591 42.032 -18.644 2.432 439 HD22 ASN 591 HD22 ASN 591 43.789 -18.700 2.515 440 H GLY 592 H GLY 592 39.340 -16.928 6.373 441 HA2 GLY 592 HA2 GLY 592 39.741 -17.060 8.642 442 HA3 GLY 592 HA3 GLY 592 41.473 -17.243 8.316 443 H LYS 593 H LYS 593 40.241 -14.422 6.851 444 HA LYS 593 HA LYS 593 41.077 -12.659 9.122 445 HB2 LYS 593 HB2 LYS 593 41.544 -12.369 6.138 446 HB3 LYS 593 HB3 LYS 593 41.878 -11.099 7.322 447 HG2 LYS 593 HG2 LYS 593 43.537 -12.552 8.435 448 HG3 LYS 593 HG3 LYS 593 43.228 -13.831 7.244 449 HD2 LYS 593 HD2 LYS 593 43.950 -12.329 5.419 450 HD3 LYS 593 HD3 LYS 593 44.277 -11.042 6.599 451 HE2 LYS 593 HE2 LYS 593 45.943 -12.506 7.718 452 HE3 LYS 593 HE3 LYS 593 45.596 -13.792 6.570 453 HZ1 LYS 593 HZ1 LYS 593 46.722 -11.141 5.836 454 HZ2 LYS 593 HZ2 LYS 593 46.426 -12.362 4.794 455 HZ3 LYS 593 HZ3 LYS 593 47.574 -12.527 5.933 456 H TYR 594 H TYR 594 40.075 -10.667 9.289 457 HA TYR 594 HA TYR 594 37.398 -10.398 7.986 458 HB2 TYR 594 HB2 TYR 594 38.538 -9.146 10.486 459 HB3 TYR 594 HB3 TYR 594 37.032 -8.623 9.739 460 HD1 TYR 594 HD1 TYR 594 35.129 -10.205 9.440 461 HD2 TYR 594 HD2 TYR 594 38.543 -11.148 11.902 462 HE1 TYR 594 HE1 TYR 594 33.826 -11.996 10.559 463 HE2 TYR 594 HE2 TYR 594 37.234 -12.941 13.031 464 HH TYR 594 HH TYR 594 35.269 -14.136 13.029 465 H PHE 595 H PHE 595 36.763 -8.535 7.066 466 HA PHE 595 HA PHE 595 38.604 -6.280 6.565 467 HB2 PHE 595 HB2 PHE 595 37.434 -8.081 4.403 468 HB3 PHE 595 HB3 PHE 595 38.157 -6.541 4.079 469 HD1 PHE 595 HD1 PHE 595 38.700 -10.069 4.541 470 HD2 PHE 595 HD2 PHE 595 40.687 -6.249 4.619 471 HE1 PHE 595 HE1 PHE 595 40.873 -11.198 4.168 472 HE2 PHE 595 HE2 PHE 595 42.868 -7.380 4.239 473 HZ PHE 595 HZ PHE 595 42.968 -9.853 4.018 474 H HIS 596 H HIS 596 37.434 -4.469 5.491 475 HA HIS 596 HA HIS 596 34.556 -4.345 6.154 476 HB2 HIS 596 HB2 HIS 596 36.490 -2.491 4.801 477 HB3 HIS 596 HB3 HIS 596 34.786 -2.140 4.749 478 HD2 HIS 596 HD2 HIS 596 33.860 -2.237 7.741 479 HE1 HIS 596 HE1 HIS 596 37.395 -0.055 8.686 480 HE2 HIS 596 HE2 HIS 596 35.081 -0.741 9.509 481 H SER 597 H SER 597 32.890 -4.451 4.593 482 HA SER 597 HA SER 597 33.311 -6.157 2.331 483 HB2 SER 597 HB2 SER 597 30.935 -5.612 1.817 484 HB3 SER 597 HB3 SER 597 31.203 -6.153 3.477 485 HG SER 597 HG SER 597 29.893 -4.112 2.926 486 H THR 598 H THR 598 32.851 -2.607 2.538 487 HA THR 598 HA THR 598 33.046 -2.123 -0.293 488 HB THR 598 HB THR 598 33.678 0.254 0.575 489 HG1 THR 598 HG1 THR 598 34.178 -0.006 2.647 490 HG21 THR 598 HG21 THR 598 31.402 -0.420 -0.214 491 HG22 THR 598 HG22 THR 598 31.402 0.808 1.051 492 HG23 THR 598 HG23 THR 598 31.005 -0.878 1.466 493 H CYS 599 H CYS 599 35.534 -2.063 2.321 494 HA CYS 599 HA CYS 599 37.723 -1.209 0.739 495 HB2 CYS 599 HB2 CYS 599 37.537 -2.999 3.196 496 HB3 CYS 599 HB3 CYS 599 39.046 -2.450 2.544 497 H TYR 600 H TYR 600 36.789 -4.565 1.632 498 HA TYR 600 HA TYR 600 38.737 -5.919 0.086 499 HB2 TYR 600 HB2 TYR 600 37.509 -6.915 1.926 500 HB3 TYR 600 HB3 TYR 600 35.995 -6.786 1.050 501 HD1 TYR 600 HD1 TYR 600 39.267 -8.507 1.254 502 HD2 TYR 600 HD2 TYR 600 35.462 -8.371 -0.781 503 HE1 TYR 600 HE1 TYR 600 39.774 -10.684 0.147 504 HE2 TYR 600 HE2 TYR 600 35.959 -10.552 -1.861 505 HH TYR 600 HH TYR 600 37.520 -12.198 -2.174 506 H HIS 601 H HIS 601 35.378 -5.029 -0.816 507 HA HIS 601 HA HIS 601 35.275 -6.303 -3.330 508 HB2 HIS 601 HB2 HIS 601 33.313 -5.415 -2.202 509 HB3 HIS 601 HB3 HIS 601 33.952 -3.773 -2.260 510 HD2 HIS 601 HD2 HIS 601 33.307 -2.305 -4.289 511 HE1 HIS 601 HE1 HIS 601 31.477 -5.279 -6.732 512 HE2 HIS 601 HE2 HIS 601 31.940 -2.790 -6.488 513 H GLU 602 H GLU 602 36.577 -3.062 -2.600 514 HA GLU 602 HA GLU 602 37.182 -2.581 -5.445 515 HB2 GLU 602 HB2 GLU 602 36.223 -0.838 -3.988 516 HB3 GLU 602 HB3 GLU 602 37.617 -0.939 -2.928 517 HG2 GLU 602 HG2 GLU 602 37.692 1.036 -4.380 518 HG3 GLU 602 HG3 GLU 602 39.078 -0.006 -4.610 519 H THR 603 H THR 603 38.924 -3.703 -2.625 520 HA THR 603 HA THR 603 41.550 -2.956 -3.853 521 HB THR 603 HB THR 603 40.922 -3.656 -0.978 522 HG1 THR 603 HG1 THR 603 39.910 -1.793 -1.492 523 HG21 THR 603 HG21 THR 603 43.382 -2.441 -2.282 524 HG22 THR 603 HG22 THR 603 43.286 -3.923 -1.286 525 HG23 THR 603 HG23 THR 603 43.034 -2.342 -0.544 526 H SER 604 H SER 604 39.825 -5.891 -2.897 527 HA SER 604 HA SER 604 41.956 -7.475 -2.111 528 HB2 SER 604 HB2 SER 604 40.535 -9.421 -2.610 529 HB3 SER 604 HB3 SER 604 39.717 -8.139 -1.711 530 HG SER 604 HG SER 604 38.509 -7.668 -3.393 531 H GLN 605 H GLN 605 40.497 -8.081 -5.288 532 HA GLN 605 HA GLN 605 41.245 -9.141 -7.124 533 HB2 GLN 605 HB2 GLN 605 41.596 -6.729 -7.499 534 HB3 GLN 605 HB3 GLN 605 43.304 -6.926 -7.094 535 HG2 GLN 605 HG2 GLN 605 43.444 -8.662 -8.966 536 HG3 GLN 605 HG3 GLN 605 41.790 -8.256 -9.394 537 HE21 GLN 605 HE21 GLN 605 44.743 -7.799 -10.560 538 HE22 GLN 605 HE22 GLN 605 44.576 -6.160 -11.186 539 H ASN 606 H ASN 606 44.598 -8.314 -6.256 540 HA ASN 606 HA ASN 606 45.381 -11.106 -5.920 541 HB2 ASN 606 HB2 ASN 606 47.070 -10.977 -7.798 542 HB3 ASN 606 HB3 ASN 606 45.388 -11.132 -8.286 543 HD21 ASN 606 HD21 ASN 606 47.071 -8.046 -7.355 544 HD22 ASN 606 HD22 ASN 606 46.901 -7.362 -8.964 545 H SER 607 H SER 607 47.414 -11.381 -4.952 546 HA SER 607 HA SER 607 48.452 -9.122 -3.455 547 HB2 SER 607 HB2 SER 607 48.373 -11.420 -2.572 548 HB3 SER 607 HB3 SER 607 49.539 -11.940 -3.796 549 HG SER 607 HG SER 607 50.526 -11.461 -1.789 550 H SER 608 H SER 608 49.557 -10.853 -6.350 551 HA SER 608 HA SER 608 51.436 -8.719 -7.084 552 HB2 SER 608 HB2 SER 608 53.351 -10.266 -7.321 553 HB3 SER 608 HB3 SER 608 52.857 -10.023 -5.649 554 HG SER 608 HG SER 608 52.205 -12.265 -7.286 Start of MODEL 11 1 H1 GLY 533 H1 GLY 533 13.712 4.040 -10.906 2 H2 GLY 533 H2 GLY 533 12.461 4.177 -9.852 3 H3 GLY 533 H3 GLY 533 12.958 2.694 -10.349 4 HA2 GLY 533 HA2 GLY 533 14.542 4.567 -8.709 5 HA3 GLY 533 HA3 GLY 533 13.721 3.117 -8.101 6 H GLY 534 H GLY 534 16.621 3.915 -8.199 7 HA2 GLY 534 HA2 GLY 534 18.590 2.639 -8.287 8 HA3 GLY 534 HA3 GLY 534 17.780 1.394 -9.243 9 H SER 535 H SER 535 17.490 4.770 -10.122 10 HA SER 535 HA SER 535 19.399 4.580 -12.385 11 HB2 SER 535 HB2 SER 535 17.617 5.124 -13.999 12 HB3 SER 535 HB3 SER 535 17.358 3.561 -13.219 13 HG SER 535 HG SER 535 15.463 4.897 -13.330 14 H GLU 536 H GLU 536 18.335 6.411 -9.894 15 HA GLU 536 HA GLU 536 18.283 9.079 -10.907 16 HB2 GLU 536 HB2 GLU 536 19.154 8.064 -8.166 17 HB3 GLU 536 HB3 GLU 536 18.698 9.709 -8.584 18 HG2 GLU 536 HG2 GLU 536 16.701 9.139 -7.778 19 HG3 GLU 536 HG3 GLU 536 16.425 8.485 -9.378 20 H PHE 537 H PHE 537 19.989 10.726 -10.012 21 HA PHE 537 HA PHE 537 22.426 10.430 -11.452 22 HB2 PHE 537 HB2 PHE 537 23.004 12.554 -10.529 23 HB3 PHE 537 HB3 PHE 537 21.291 12.579 -10.879 24 HD1 PHE 537 HD1 PHE 537 19.619 12.630 -9.006 25 HD2 PHE 537 HD2 PHE 537 23.863 12.681 -8.243 26 HE1 PHE 537 HE1 PHE 537 19.195 13.282 -6.652 27 HE2 PHE 537 HE2 PHE 537 23.430 13.342 -5.893 28 HZ PHE 537 HZ PHE 537 21.095 13.633 -5.089 29 H SER 538 H SER 538 21.656 9.522 -8.143 30 HA SER 538 HA SER 538 24.416 9.297 -7.225 31 HB2 SER 538 HB2 SER 538 23.358 8.347 -5.197 32 HB3 SER 538 HB3 SER 538 22.721 9.931 -5.656 33 HG SER 538 HG SER 538 21.054 8.486 -5.123 34 H ASP 539 H ASP 539 25.349 7.308 -6.437 35 HA ASP 539 HA ASP 539 25.306 5.288 -8.505 36 HB2 ASP 539 HB2 ASP 539 26.972 5.473 -5.982 37 HB3 ASP 539 HB3 ASP 539 27.267 4.392 -7.340 38 H ARG 540 H ARG 540 22.900 4.917 -7.697 39 HA ARG 540 HA ARG 540 22.483 2.980 -5.582 40 HB2 ARG 540 HB2 ARG 540 20.618 3.845 -7.803 41 HB3 ARG 540 HB3 ARG 540 20.192 2.874 -6.385 42 HG2 ARG 540 HG2 ARG 540 21.190 4.871 -4.991 43 HG3 ARG 540 HG3 ARG 540 21.036 5.772 -6.507 44 HD2 ARG 540 HD2 ARG 540 19.051 6.197 -5.312 45 HD3 ARG 540 HD3 ARG 540 18.614 5.024 -6.576 46 HE ARG 540 HE ARG 540 19.303 3.608 -4.193 47 HH11 ARG 540 HH11 ARG 540 16.669 5.665 -5.305 48 HH12 ARG 540 HH12 ARG 540 15.540 4.957 -4.183 49 HH21 ARG 540 HH21 ARG 540 17.785 2.735 -2.823 50 HH22 ARG 540 HH22 ARG 540 16.151 3.344 -2.837 51 H SER 541 H SER 541 24.452 2.102 -7.476 52 HA SER 541 HA SER 541 23.420 -0.284 -8.872 53 HB2 SER 541 HB2 SER 541 25.355 1.056 -9.702 54 HB3 SER 541 HB3 SER 541 26.269 0.589 -8.260 55 HG SER 541 HG SER 541 26.626 -0.737 -10.151 56 H ASN 542 H ASN 542 25.046 -2.286 -8.222 57 HA ASN 542 HA ASN 542 24.090 -3.418 -5.787 58 HB2 ASN 542 HB2 ASN 542 26.549 -4.120 -7.450 59 HB3 ASN 542 HB3 ASN 542 25.832 -5.148 -6.214 60 HD21 ASN 542 HD21 ASN 542 25.954 -4.747 -9.503 61 HD22 ASN 542 HD22 ASN 542 24.403 -5.476 -9.898 62 H GLU 543 H GLU 543 26.800 -1.265 -6.284 63 HA GLU 543 HA GLU 543 28.346 -1.699 -3.945 64 HB2 GLU 543 HB2 GLU 543 27.694 0.906 -5.372 65 HB3 GLU 543 HB3 GLU 543 28.999 0.660 -4.198 66 HG2 GLU 543 HG2 GLU 543 29.938 -1.116 -5.718 67 HG3 GLU 543 HG3 GLU 543 28.749 -0.654 -6.933 68 H LEU 544 H LEU 544 25.139 -0.224 -4.228 69 HA LEU 544 HA LEU 544 25.121 1.041 -1.632 70 HB2 LEU 544 HB2 LEU 544 23.665 1.677 -3.524 71 HB3 LEU 544 HB3 LEU 544 22.874 0.104 -3.460 72 HG LEU 544 HG LEU 544 21.931 0.620 -1.243 73 HD11 LEU 544 HD11 LEU 544 22.079 2.939 -0.346 74 HD12 LEU 544 HD12 LEU 544 23.293 3.335 -1.584 75 HD13 LEU 544 HD13 LEU 544 23.648 2.135 -0.323 76 HD21 LEU 544 HD21 LEU 544 20.373 2.377 -1.959 77 HD22 LEU 544 HD22 LEU 544 20.693 1.239 -3.285 78 HD23 LEU 544 HD23 LEU 544 21.474 2.839 -3.279 79 H GLU 545 H GLU 545 24.453 -2.250 -2.742 80 HA GLU 545 HA GLU 545 23.166 -3.152 -0.271 81 HB2 GLU 545 HB2 GLU 545 24.379 -4.764 -2.546 82 HB3 GLU 545 HB3 GLU 545 23.320 -5.374 -1.287 83 HG2 GLU 545 HG2 GLU 545 22.577 -3.418 -3.498 84 HG3 GLU 545 HG3 GLU 545 22.087 -5.095 -3.359 85 H ILE 546 H ILE 546 26.481 -2.904 -1.405 86 HA ILE 546 HA ILE 546 27.768 -4.794 0.278 87 HB ILE 546 HB ILE 546 28.751 -2.068 -0.659 88 HG12 ILE 546 HG12 ILE 546 28.083 -3.595 -2.537 89 HG13 ILE 546 HG13 ILE 546 29.766 -3.094 -2.534 90 HG21 ILE 546 HG21 ILE 546 30.206 -2.799 1.118 91 HG22 ILE 546 HG22 ILE 546 30.322 -4.427 0.423 92 HG23 ILE 546 HG23 ILE 546 31.035 -3.046 -0.429 93 HD11 ILE 546 HD11 ILE 546 30.495 -5.268 -1.724 94 HD12 ILE 546 HD12 ILE 546 28.797 -5.803 -1.546 95 HD13 ILE 546 HD13 ILE 546 29.477 -5.463 -3.153 96 H ARG 547 H ARG 547 26.644 -1.511 0.994 97 HA ARG 547 HA ARG 547 27.858 -1.211 3.590 98 HB2 ARG 547 HB2 ARG 547 25.221 0.025 2.735 99 HB3 ARG 547 HB3 ARG 547 26.384 0.641 3.887 100 HG2 ARG 547 HG2 ARG 547 26.556 0.638 0.853 101 HG3 ARG 547 HG3 ARG 547 26.482 2.008 1.944 102 HD2 ARG 547 HD2 ARG 547 28.811 0.132 1.461 103 HD3 ARG 547 HD3 ARG 547 28.724 1.842 1.073 104 HE ARG 547 HE ARG 547 29.408 0.614 3.620 105 HH11 ARG 547 HH11 ARG 547 28.194 3.653 2.351 106 HH12 ARG 547 HH12 ARG 547 28.646 4.512 3.808 107 HH21 ARG 547 HH21 ARG 547 29.935 1.690 5.335 108 HH22 ARG 547 HH22 ARG 547 29.648 3.416 5.492 109 H GLY 548 H GLY 548 24.958 -2.854 2.542 110 HA2 GLY 548 HA2 GLY 548 23.773 -3.119 5.208 111 HA3 GLY 548 HA3 GLY 548 23.186 -3.808 3.698 112 H LYS 549 H LYS 549 26.303 -4.826 3.647 113 HA LYS 549 HA LYS 549 25.677 -7.504 4.556 114 HB2 LYS 549 HB2 LYS 549 28.268 -6.243 3.585 115 HB3 LYS 549 HB3 LYS 549 28.094 -7.945 4.064 116 HG2 LYS 549 HG2 LYS 549 26.236 -8.203 2.427 117 HG3 LYS 549 HG3 LYS 549 26.512 -6.547 1.871 118 HD2 LYS 549 HD2 LYS 549 28.760 -7.144 1.108 119 HD3 LYS 549 HD3 LYS 549 28.585 -8.789 1.772 120 HE2 LYS 549 HE2 LYS 549 26.599 -9.162 0.333 121 HE3 LYS 549 HE3 LYS 549 26.737 -7.537 -0.302 122 HZ1 LYS 549 HZ1 LYS 549 28.773 -9.686 -0.646 123 HZ2 LYS 549 HZ2 LYS 549 28.907 -8.186 -1.264 124 HZ3 LYS 549 HZ3 LYS 549 27.738 -9.193 -1.794 125 H TYR 550 H TYR 550 26.456 -8.650 6.291 126 HA TYR 550 HA TYR 550 28.240 -7.469 8.249 127 HB2 TYR 550 HB2 TYR 550 26.706 -7.696 10.161 128 HB3 TYR 550 HB3 TYR 550 26.170 -6.481 9.046 129 HD1 TYR 550 HD1 TYR 550 25.548 -9.956 10.256 130 HD2 TYR 550 HD2 TYR 550 24.013 -6.624 7.979 131 HE1 TYR 550 HE1 TYR 550 23.315 -11.033 10.185 132 HE2 TYR 550 HE2 TYR 550 21.771 -7.686 7.936 133 HH TYR 550 HH TYR 550 20.515 -9.495 8.573 134 H VAL 551 H VAL 551 28.701 -8.919 10.042 135 HA VAL 551 HA VAL 551 28.070 -11.792 9.644 136 HB VAL 551 HB VAL 551 30.454 -12.250 10.536 137 HG11 VAL 551 HG11 VAL 551 31.339 -12.378 8.246 138 HG12 VAL 551 HG12 VAL 551 29.638 -12.869 8.277 139 HG13 VAL 551 HG13 VAL 551 30.084 -11.261 7.671 140 HG21 VAL 551 HG21 VAL 551 31.186 -9.973 11.009 141 HG22 VAL 551 HG22 VAL 551 32.219 -10.771 9.820 142 HG23 VAL 551 HG23 VAL 551 31.042 -9.554 9.280 143 H VAL 552 H VAL 552 27.633 -12.914 11.536 144 HA VAL 552 HA VAL 552 26.850 -11.267 13.771 145 HB VAL 552 HB VAL 552 25.569 -13.206 13.022 146 HG11 VAL 552 HG11 VAL 552 27.708 -14.932 14.338 147 HG12 VAL 552 HG12 VAL 552 26.177 -15.475 13.632 148 HG13 VAL 552 HG13 VAL 552 27.429 -14.818 12.581 149 HG21 VAL 552 HG21 VAL 552 25.171 -12.334 15.254 150 HG22 VAL 552 HG22 VAL 552 24.960 -14.078 15.229 151 HG23 VAL 552 HG23 VAL 552 26.441 -13.386 15.928 152 H VAL 553 H VAL 553 27.714 -10.966 15.759 153 HA VAL 553 HA VAL 553 30.562 -11.466 16.141 154 HB VAL 553 HB VAL 553 28.528 -10.211 18.029 155 HG11 VAL 553 HG11 VAL 553 30.497 -11.000 19.257 156 HG12 VAL 553 HG12 VAL 553 31.580 -10.252 18.058 157 HG13 VAL 553 HG13 VAL 553 30.562 -9.240 19.097 158 HG21 VAL 553 HG21 VAL 553 28.833 -8.876 15.936 159 HG22 VAL 553 HG22 VAL 553 29.430 -8.073 17.406 160 HG23 VAL 553 HG23 VAL 553 30.578 -8.812 16.280 161 HA PRO 554 HA PRO 554 29.584 -15.297 18.414 162 HB2 PRO 554 HB2 PRO 554 32.090 -16.199 18.921 163 HB3 PRO 554 HB3 PRO 554 31.409 -16.191 17.265 164 HG2 PRO 554 HG2 PRO 554 33.263 -14.142 18.499 165 HG3 PRO 554 HG3 PRO 554 33.399 -14.957 16.908 166 HD2 PRO 554 HD2 PRO 554 32.266 -12.464 17.204 167 HD3 PRO 554 HD3 PRO 554 31.724 -13.622 15.957 168 H GLU 555 H GLU 555 29.490 -15.877 20.629 169 HA GLU 555 HA GLU 555 29.770 -13.777 22.565 170 HB2 GLU 555 HB2 GLU 555 29.394 -16.769 22.949 171 HB3 GLU 555 HB3 GLU 555 29.285 -15.556 24.228 172 HG2 GLU 555 HG2 GLU 555 27.433 -14.436 22.960 173 HG3 GLU 555 HG3 GLU 555 27.512 -15.715 21.756 174 H THR 556 H THR 556 32.144 -16.062 21.424 175 HA THR 556 HA THR 556 34.001 -15.835 23.641 176 HB THR 556 HB THR 556 35.669 -16.644 21.992 177 HG1 THR 556 HG1 THR 556 34.970 -17.110 19.917 178 HG21 THR 556 HG21 THR 556 34.698 -18.844 21.556 179 HG22 THR 556 HG22 THR 556 33.055 -18.224 21.865 180 HG23 THR 556 HG23 THR 556 34.258 -18.300 23.176 181 H SER 557 H SER 557 33.186 -13.705 20.977 182 HA SER 557 HA SER 557 35.556 -11.985 21.374 183 HB2 SER 557 HB2 SER 557 34.543 -12.207 19.126 184 HB3 SER 557 HB3 SER 557 33.082 -11.413 19.724 185 HG SER 557 HG SER 557 35.712 -10.387 19.474 186 H GLN 558 H GLN 558 35.182 -11.890 23.684 187 HA GLN 558 HA GLN 558 32.897 -10.880 24.943 188 HB2 GLN 558 HB2 GLN 558 34.689 -12.093 26.048 189 HB3 GLN 558 HB3 GLN 558 35.818 -10.762 25.769 190 HG2 GLN 558 HG2 GLN 558 34.535 -9.298 27.269 191 HG3 GLN 558 HG3 GLN 558 33.307 -10.543 27.473 192 HE21 GLN 558 HE21 GLN 558 34.397 -9.507 29.749 193 HE22 GLN 558 HE22 GLN 558 35.517 -10.661 30.470 194 H ASP 559 H ASP 559 35.590 -9.046 23.543 195 HA ASP 559 HA ASP 559 34.491 -6.444 24.393 196 HB2 ASP 559 HB2 ASP 559 36.890 -7.151 22.682 197 HB3 ASP 559 HB3 ASP 559 36.481 -5.541 23.245 198 H MET 560 H MET 560 33.719 -8.559 21.883 199 HA MET 560 HA MET 560 32.861 -8.452 19.828 200 HB2 MET 560 HB2 MET 560 31.527 -5.935 20.911 201 HB3 MET 560 HB3 MET 560 30.979 -6.930 19.561 202 HG2 MET 560 HG2 MET 560 30.920 -8.893 21.212 203 HG3 MET 560 HG3 MET 560 31.077 -7.711 22.497 204 HE1 MET 560 HE1 MET 560 28.901 -9.752 22.519 205 HE2 MET 560 HE2 MET 560 27.316 -9.330 21.840 206 HE3 MET 560 HE3 MET 560 28.606 -9.884 20.759 207 H ALA 561 H ALA 561 35.469 -7.468 19.698 208 HA ALA 561 HA ALA 561 35.227 -5.339 17.611 209 HB1 ALA 561 HB1 ALA 561 35.950 -4.394 19.758 210 HB2 ALA 561 HB2 ALA 561 37.340 -5.496 19.778 211 HB3 ALA 561 HB3 ALA 561 37.195 -4.261 18.511 212 H PHE 562 H PHE 562 36.483 -5.364 15.890 213 HA PHE 562 HA PHE 562 38.747 -7.201 15.577 214 HB2 PHE 562 HB2 PHE 562 36.165 -7.757 14.406 215 HB3 PHE 562 HB3 PHE 562 37.203 -7.271 13.105 216 HD1 PHE 562 HD1 PHE 562 39.876 -8.482 14.081 217 HD2 PHE 562 HD2 PHE 562 35.845 -10.030 13.987 218 HE1 PHE 562 HE1 PHE 562 40.761 -10.794 13.959 219 HE2 PHE 562 HE2 PHE 562 36.745 -12.339 13.850 220 HZ PHE 562 HZ PHE 562 39.197 -12.726 13.850 221 H LYS 563 H LYS 563 39.709 -6.646 13.179 222 HA LYS 563 HA LYS 563 39.244 -3.840 12.480 223 HB2 LYS 563 HB2 LYS 563 40.962 -2.835 13.272 224 HB3 LYS 563 HB3 LYS 563 41.167 -4.171 14.359 225 HG2 LYS 563 HG2 LYS 563 42.593 -4.091 11.666 226 HG3 LYS 563 HG3 LYS 563 43.136 -3.148 13.024 227 HD2 LYS 563 HD2 LYS 563 44.447 -5.110 12.996 228 HD3 LYS 563 HD3 LYS 563 43.400 -5.181 14.417 229 HE2 LYS 563 HE2 LYS 563 41.876 -6.723 13.217 230 HE3 LYS 563 HE3 LYS 563 42.896 -6.626 11.783 231 HZ1 LYS 563 HZ1 LYS 563 43.748 -7.713 14.413 232 HZ2 LYS 563 HZ2 LYS 563 44.711 -7.605 13.103 233 HZ3 LYS 563 HZ3 LYS 563 43.428 -8.603 13.078 234 H CYS 564 H CYS 564 39.835 -3.109 10.605 235 HA CYS 564 HA CYS 564 40.090 -4.967 8.390 236 HB2 CYS 564 HB2 CYS 564 38.725 -2.738 8.613 237 HB3 CYS 564 HB3 CYS 564 40.232 -1.925 8.441 238 HA PRO 565 HA PRO 565 44.660 -4.274 8.525 239 HB2 PRO 565 HB2 PRO 565 45.433 -6.135 6.694 240 HB3 PRO 565 HB3 PRO 565 44.893 -6.579 8.343 241 HG2 PRO 565 HG2 PRO 565 43.254 -6.563 5.788 242 HG3 PRO 565 HG3 PRO 565 43.413 -7.888 6.985 243 HD2 PRO 565 HD2 PRO 565 41.322 -6.144 7.052 244 HD3 PRO 565 HD3 PRO 565 42.062 -6.751 8.559 245 H ILE 566 H ILE 566 42.439 -3.937 5.826 246 HA ILE 566 HA ILE 566 44.324 -2.984 3.845 247 HB ILE 566 HB ILE 566 41.320 -2.710 4.078 248 HG12 ILE 566 HG12 ILE 566 42.959 -4.535 2.246 249 HG13 ILE 566 HG13 ILE 566 42.336 -5.061 3.799 250 HG21 ILE 566 HG21 ILE 566 42.167 -0.908 2.623 251 HG22 ILE 566 HG22 ILE 566 43.109 -2.089 1.685 252 HG23 ILE 566 HG23 ILE 566 41.335 -2.102 1.653 253 HD11 ILE 566 HD11 ILE 566 40.869 -5.839 2.042 254 HD12 ILE 566 HD12 ILE 566 40.008 -4.632 3.028 255 HD13 ILE 566 HD13 ILE 566 40.639 -4.206 1.420 256 H CYS 567 H CYS 567 41.878 -1.241 5.844 257 HA CYS 567 HA CYS 567 43.368 1.276 5.382 258 HB2 CYS 567 HB2 CYS 567 41.379 2.424 5.800 259 HB3 CYS 567 HB3 CYS 567 40.995 1.132 4.659 260 H LYS 568 H LYS 568 43.398 -1.024 7.658 261 HA LYS 568 HA LYS 568 43.954 -1.262 9.832 262 HB2 LYS 568 HB2 LYS 568 45.639 0.051 10.815 263 HB3 LYS 568 HB3 LYS 568 46.043 -0.368 9.159 264 HG2 LYS 568 HG2 LYS 568 45.733 1.849 8.371 265 HG3 LYS 568 HG3 LYS 568 44.928 2.370 9.850 266 HD2 LYS 568 HD2 LYS 568 47.849 1.551 9.607 267 HD3 LYS 568 HD3 LYS 568 47.250 3.198 9.689 268 HE2 LYS 568 HE2 LYS 568 47.122 1.108 11.895 269 HE3 LYS 568 HE3 LYS 568 48.143 2.534 11.840 270 HZ1 LYS 568 HZ1 LYS 568 46.214 2.936 13.233 271 HZ2 LYS 568 HZ2 LYS 568 45.182 2.547 12.033 272 HZ3 LYS 568 HZ3 LYS 568 46.099 3.897 11.926 273 H GLU 569 H GLU 569 41.373 -0.676 9.686 274 HA GLU 569 HA GLU 569 40.936 1.182 12.004 275 HB2 GLU 569 HB2 GLU 569 39.319 0.896 9.471 276 HB3 GLU 569 HB3 GLU 569 38.643 1.588 10.923 277 HG2 GLU 569 HG2 GLU 569 41.027 2.666 9.383 278 HG3 GLU 569 HG3 GLU 569 39.404 3.336 9.393 279 H THR 570 H THR 570 39.435 0.762 13.517 280 HA THR 570 HA THR 570 38.823 -2.065 13.940 281 HB THR 570 HB THR 570 38.276 0.418 15.603 282 HG1 THR 570 HG1 THR 570 40.440 -0.158 15.417 283 HG21 THR 570 HG21 THR 570 36.673 -1.295 16.351 284 HG22 THR 570 HG22 THR 570 37.973 -1.126 17.529 285 HG23 THR 570 HG23 THR 570 37.973 -2.511 16.414 286 H VAL 571 H VAL 571 36.894 -3.047 14.109 287 HA VAL 571 HA VAL 571 34.358 -1.585 13.551 288 HB VAL 571 HB VAL 571 33.654 -4.133 12.931 289 HG11 VAL 571 HG11 VAL 571 32.986 -2.190 11.735 290 HG12 VAL 571 HG12 VAL 571 34.625 -1.979 11.050 291 HG13 VAL 571 HG13 VAL 571 33.618 -3.381 10.595 292 HG21 VAL 571 HG21 VAL 571 36.375 -3.845 11.594 293 HG22 VAL 571 HG22 VAL 571 35.979 -5.003 12.888 294 HG23 VAL 571 HG23 VAL 571 35.163 -5.117 11.324 295 H THR 572 H THR 572 32.861 -1.736 15.067 296 HA THR 572 HA THR 572 33.245 -3.669 17.307 297 HB THR 572 HB THR 572 31.899 -2.051 18.645 298 HG1 THR 572 HG1 THR 572 30.917 -0.868 17.008 299 HG21 THR 572 HG21 THR 572 33.674 -0.466 19.030 300 HG22 THR 572 HG22 THR 572 34.419 -0.839 17.460 301 HG23 THR 572 HG23 THR 572 34.377 -2.069 18.754 302 H GLY 573 H GLY 573 31.520 -4.835 18.088 303 HA2 GLY 573 HA2 GLY 573 29.417 -5.609 16.315 304 HA3 GLY 573 HA3 GLY 573 29.603 -6.076 18.009 305 H VAL 574 H VAL 574 27.229 -5.294 16.366 306 HA VAL 574 HA VAL 574 26.049 -3.367 18.291 307 HB VAL 574 HB VAL 574 25.712 -3.312 15.252 308 HG11 VAL 574 HG11 VAL 574 24.523 -1.483 17.386 309 HG12 VAL 574 HG12 VAL 574 24.461 -1.197 15.634 310 HG13 VAL 574 HG13 VAL 574 23.634 -2.590 16.315 311 HG21 VAL 574 HG21 VAL 574 27.880 -2.342 15.844 312 HG22 VAL 574 HG22 VAL 574 26.772 -1.058 15.372 313 HG23 VAL 574 HG23 VAL 574 27.115 -1.329 17.093 314 H TYR 575 H TYR 575 24.042 -3.914 19.050 315 HA TYR 575 HA TYR 575 22.988 -6.503 18.371 316 HB2 TYR 575 HB2 TYR 575 22.845 -5.476 20.603 317 HB3 TYR 575 HB3 TYR 575 21.713 -4.270 19.991 318 HD1 TYR 575 HD1 TYR 575 19.388 -4.747 19.960 319 HD2 TYR 575 HD2 TYR 575 22.212 -7.980 20.344 320 HE1 TYR 575 HE1 TYR 575 17.510 -6.340 20.388 321 HE2 TYR 575 HE2 TYR 575 20.348 -9.558 20.802 322 HH TYR 575 HH TYR 575 16.955 -8.484 20.980 323 H ASP 576 H ASP 576 21.968 -6.972 16.493 324 HA ASP 576 HA ASP 576 20.225 -5.015 15.132 325 HB2 ASP 576 HB2 ASP 576 21.604 -6.532 13.759 326 HB3 ASP 576 HB3 ASP 576 20.865 -7.934 14.539 327 H GLU 577 H GLU 577 18.297 -4.677 16.013 328 HA GLU 577 HA GLU 577 16.942 -6.504 17.798 329 HB2 GLU 577 HB2 GLU 577 15.933 -4.029 16.334 330 HB3 GLU 577 HB3 GLU 577 15.086 -4.885 17.644 331 HG2 GLU 577 HG2 GLU 577 16.928 -4.373 19.196 332 HG3 GLU 577 HG3 GLU 577 17.807 -3.547 17.914 333 H GLU 578 H GLU 578 16.940 -6.324 14.305 334 HA GLU 578 HA GLU 578 14.320 -7.543 13.954 335 HB2 GLU 578 HB2 GLU 578 15.400 -6.013 12.298 336 HB3 GLU 578 HB3 GLU 578 16.603 -7.252 11.989 337 HG2 GLU 578 HG2 GLU 578 14.922 -7.284 10.248 338 HG3 GLU 578 HG3 GLU 578 14.886 -8.796 11.169 339 H SER 579 H SER 579 17.679 -8.775 13.499 340 HA SER 579 HA SER 579 16.850 -11.577 13.386 341 HB2 SER 579 HB2 SER 579 18.857 -10.701 12.228 342 HB3 SER 579 HB3 SER 579 19.587 -10.334 13.798 343 HG SER 579 HG SER 579 20.218 -12.364 12.869 344 H GLY 580 H GLY 580 18.014 -9.387 15.918 345 HA2 GLY 580 HA2 GLY 580 17.707 -9.577 18.212 346 HA3 GLY 580 HA3 GLY 580 17.258 -11.280 18.048 347 H GLU 581 H GLU 581 20.208 -9.771 16.701 348 HA GLU 581 HA GLU 581 21.963 -11.247 18.586 349 HB2 GLU 581 HB2 GLU 581 22.017 -11.605 15.562 350 HB3 GLU 581 HB3 GLU 581 23.235 -12.213 16.657 351 HG2 GLU 581 HG2 GLU 581 20.326 -13.099 16.569 352 HG3 GLU 581 HG3 GLU 581 21.698 -13.952 15.892 353 H TRP 582 H TRP 582 24.152 -10.533 18.605 354 HA TRP 582 HA TRP 582 24.572 -7.759 17.748 355 HB2 TRP 582 HB2 TRP 582 26.416 -9.734 19.108 356 HB3 TRP 582 HB3 TRP 582 26.778 -8.038 18.762 357 HD1 TRP 582 HD1 TRP 582 24.538 -10.192 21.002 358 HE1 TRP 582 HE1 TRP 582 23.769 -8.828 23.030 359 HE3 TRP 582 HE3 TRP 582 26.495 -5.663 19.697 360 HZ2 TRP 582 HZ2 TRP 582 23.905 -6.083 23.927 361 HZ3 TRP 582 HZ3 TRP 582 26.178 -3.683 21.169 362 HH2 TRP 582 HH2 TRP 582 24.867 -3.889 23.283 363 H VAL 583 H VAL 583 25.642 -7.064 16.017 364 HA VAL 583 HA VAL 583 26.991 -8.999 14.194 365 HB VAL 583 HB VAL 583 25.909 -7.810 12.305 366 HG11 VAL 583 HG11 VAL 583 25.072 -9.992 13.041 367 HG12 VAL 583 HG12 VAL 583 23.983 -9.191 14.210 368 HG13 VAL 583 HG13 VAL 583 23.760 -8.958 12.463 369 HG21 VAL 583 HG21 VAL 583 23.944 -6.678 14.306 370 HG22 VAL 583 HG22 VAL 583 25.210 -5.723 13.505 371 HG23 VAL 583 HG23 VAL 583 23.943 -6.492 12.542 372 H TRP 584 H TRP 584 28.596 -8.341 12.934 373 HA TRP 584 HA TRP 584 29.873 -5.688 13.368 374 HB2 TRP 584 HB2 TRP 584 30.746 -8.386 12.351 375 HB3 TRP 584 HB3 TRP 584 31.630 -6.981 11.830 376 HD1 TRP 584 HD1 TRP 584 31.945 -5.362 14.444 377 HE1 TRP 584 HE1 TRP 584 33.349 -6.223 16.418 378 HE3 TRP 584 HE3 TRP 584 31.973 -10.340 13.307 379 HZ2 TRP 584 HZ2 TRP 584 34.479 -8.744 17.297 380 HZ3 TRP 584 HZ3 TRP 584 33.257 -11.950 14.695 381 HH2 TRP 584 HH2 TRP 584 34.488 -11.163 16.706 382 H LYS 585 H LYS 585 28.765 -4.273 12.138 383 HA LYS 585 HA LYS 585 27.604 -4.903 9.529 384 HB2 LYS 585 HB2 LYS 585 27.970 -2.253 10.974 385 HB3 LYS 585 HB3 LYS 585 27.050 -2.500 9.486 386 HG2 LYS 585 HG2 LYS 585 25.588 -4.146 10.713 387 HG3 LYS 585 HG3 LYS 585 26.458 -3.738 12.212 388 HD2 LYS 585 HD2 LYS 585 25.773 -1.359 11.936 389 HD3 LYS 585 HD3 LYS 585 24.891 -1.798 10.465 390 HE2 LYS 585 HE2 LYS 585 23.489 -3.370 11.821 391 HE3 LYS 585 HE3 LYS 585 24.347 -2.858 13.277 392 HZ1 LYS 585 HZ1 LYS 585 22.712 -1.092 11.528 393 HZ2 LYS 585 HZ2 LYS 585 23.519 -0.591 12.853 394 HZ3 LYS 585 HZ3 LYS 585 22.271 -1.632 12.995 395 H ASN 586 H ASN 586 28.174 -4.023 7.503 396 HA ASN 586 HA ASN 586 29.570 -3.583 5.797 397 HB2 ASN 586 HB2 ASN 586 29.367 -1.366 7.076 398 HB3 ASN 586 HB3 ASN 586 31.011 -1.649 7.651 399 HD21 ASN 586 HD21 ASN 586 32.605 -2.087 5.736 400 HD22 ASN 586 HD22 ASN 586 32.443 -0.930 4.402 401 H THR 587 H THR 587 30.232 -5.921 7.219 402 HA THR 587 HA THR 587 33.227 -6.053 7.097 403 HB THR 587 HB THR 587 31.456 -7.319 9.213 404 HG1 THR 587 HG1 THR 587 31.831 -5.071 9.445 405 HG21 THR 587 HG21 THR 587 34.494 -7.319 8.971 406 HG22 THR 587 HG22 THR 587 33.427 -8.741 8.840 407 HG23 THR 587 HG23 THR 587 33.553 -7.879 10.368 408 H ILE 588 H ILE 588 34.150 -7.966 6.491 409 HA ILE 588 HA ILE 588 32.545 -10.261 5.558 410 HB ILE 588 HB ILE 588 32.597 -8.794 3.638 411 HG12 ILE 588 HG12 ILE 588 34.706 -10.945 3.183 412 HG13 ILE 588 HG13 ILE 588 32.980 -11.305 3.335 413 HG21 ILE 588 HG21 ILE 588 35.631 -8.918 3.606 414 HG22 ILE 588 HG22 ILE 588 34.589 -7.942 2.577 415 HG23 ILE 588 HG23 ILE 588 34.759 -7.525 4.289 416 HD11 ILE 588 HD11 ILE 588 33.582 -11.275 1.005 417 HD12 ILE 588 HD12 ILE 588 32.571 -9.846 1.326 418 HD13 ILE 588 HD13 ILE 588 34.337 -9.682 1.145 419 H GLU 589 H GLU 589 33.656 -12.231 5.535 420 HA GLU 589 HA GLU 589 36.535 -12.204 6.245 421 HB2 GLU 589 HB2 GLU 589 35.156 -13.326 7.867 422 HB3 GLU 589 HB3 GLU 589 34.402 -14.334 6.644 423 HG2 GLU 589 HG2 GLU 589 37.437 -14.329 6.926 424 HG3 GLU 589 HG3 GLU 589 36.478 -15.083 8.150 425 H VAL 590 H VAL 590 37.904 -13.405 5.085 426 HA VAL 590 HA VAL 590 37.231 -15.224 3.003 427 HB VAL 590 HB VAL 590 37.508 -12.471 2.133 428 HG11 VAL 590 HG11 VAL 590 39.924 -12.856 1.801 429 HG12 VAL 590 HG12 VAL 590 39.558 -14.306 0.828 430 HG13 VAL 590 HG13 VAL 590 39.064 -12.700 0.272 431 HG21 VAL 590 HG21 VAL 590 36.784 -13.380 0.000 432 HG22 VAL 590 HG22 VAL 590 37.194 -15.034 0.516 433 HG23 VAL 590 HG23 VAL 590 35.874 -14.152 1.303 434 H ASN 591 H ASN 591 38.978 -16.571 2.495 435 HA ASN 591 HA ASN 591 40.930 -17.657 2.869 436 HB2 ASN 591 HB2 ASN 591 41.489 -15.785 1.281 437 HB3 ASN 591 HB3 ASN 591 42.119 -14.869 2.653 438 HD21 ASN 591 HD21 ASN 591 42.501 -18.153 1.132 439 HD22 ASN 591 HD22 ASN 591 44.245 -18.153 1.362 440 H GLY 592 H GLY 592 39.552 -16.951 5.334 441 HA2 GLY 592 HA2 GLY 592 39.914 -17.398 7.566 442 HA3 GLY 592 HA3 GLY 592 41.645 -17.575 7.267 443 H LYS 593 H LYS 593 40.306 -14.604 6.129 444 HA LYS 593 HA LYS 593 41.388 -13.069 8.460 445 HB2 LYS 593 HB2 LYS 593 41.848 -12.560 5.503 446 HB3 LYS 593 HB3 LYS 593 42.435 -11.543 6.823 447 HG2 LYS 593 HG2 LYS 593 43.917 -13.302 7.612 448 HG3 LYS 593 HG3 LYS 593 43.230 -14.467 6.468 449 HD2 LYS 593 HD2 LYS 593 44.023 -12.983 4.571 450 HD3 LYS 593 HD3 LYS 593 44.860 -12.003 5.776 451 HE2 LYS 593 HE2 LYS 593 46.485 -13.529 4.924 452 HE3 LYS 593 HE3 LYS 593 46.074 -14.096 6.536 453 HZ1 LYS 593 HZ1 LYS 593 46.098 -15.949 4.985 454 HZ2 LYS 593 HZ2 LYS 593 45.061 -15.225 3.975 455 HZ3 LYS 593 HZ3 LYS 593 44.539 -15.720 5.421 456 H TYR 594 H TYR 594 40.512 -11.046 8.824 457 HA TYR 594 HA TYR 594 37.767 -10.666 7.704 458 HB2 TYR 594 HB2 TYR 594 38.987 -9.895 10.352 459 HB3 TYR 594 HB3 TYR 594 37.483 -9.211 9.768 460 HD1 TYR 594 HD1 TYR 594 39.067 -12.471 10.710 461 HD2 TYR 594 HD2 TYR 594 35.423 -10.368 9.756 462 HE1 TYR 594 HE1 TYR 594 37.736 -14.461 11.393 463 HE2 TYR 594 HE2 TYR 594 34.094 -12.343 10.454 464 HH TYR 594 HH TYR 594 34.165 -14.497 11.246 465 H PHE 595 H PHE 595 37.002 -8.747 7.083 466 HA PHE 595 HA PHE 595 38.795 -6.445 6.550 467 HB2 PHE 595 HB2 PHE 595 37.337 -8.155 4.494 468 HB3 PHE 595 HB3 PHE 595 38.179 -6.682 4.101 469 HD1 PHE 595 HD1 PHE 595 40.773 -6.672 4.538 470 HD2 PHE 595 HD2 PHE 595 38.370 -10.248 4.379 471 HE1 PHE 595 HE1 PHE 595 42.795 -8.015 3.975 472 HE2 PHE 595 HE2 PHE 595 40.382 -11.578 3.841 473 HZ PHE 595 HZ PHE 595 42.602 -10.470 3.640 474 H HIS 596 H HIS 596 37.559 -4.628 5.512 475 HA HIS 596 HA HIS 596 34.716 -4.435 6.339 476 HB2 HIS 596 HB2 HIS 596 36.670 -2.644 4.927 477 HB3 HIS 596 HB3 HIS 596 34.980 -2.252 4.845 478 HD2 HIS 596 HD2 HIS 596 34.061 -2.368 7.897 479 HE1 HIS 596 HE1 HIS 596 37.470 0.054 8.676 480 HE2 HIS 596 HE2 HIS 596 35.209 -0.701 9.555 481 H SER 597 H SER 597 32.971 -4.602 4.889 482 HA SER 597 HA SER 597 33.226 -6.244 2.572 483 HB2 SER 597 HB2 SER 597 30.868 -5.692 2.191 484 HB3 SER 597 HB3 SER 597 31.185 -6.148 3.862 485 HG SER 597 HG SER 597 29.894 -4.123 3.306 486 H THR 598 H THR 598 32.886 -2.707 2.871 487 HA THR 598 HA THR 598 32.999 -2.096 0.071 488 HB THR 598 HB THR 598 33.591 0.229 0.929 489 HG1 THR 598 HG1 THR 598 34.495 0.000 2.845 490 HG21 THR 598 HG21 THR 598 31.438 0.681 1.889 491 HG22 THR 598 HG22 THR 598 31.187 -1.027 2.314 492 HG23 THR 598 HG23 THR 598 31.224 -0.528 0.609 493 H CYS 599 H CYS 599 35.615 -2.058 2.573 494 HA CYS 599 HA CYS 599 37.668 -1.160 0.847 495 HB2 CYS 599 HB2 CYS 599 37.796 -2.950 3.309 496 HB3 CYS 599 HB3 CYS 599 39.178 -2.227 2.557 497 H TYR 600 H TYR 600 36.775 -4.544 1.717 498 HA TYR 600 HA TYR 600 38.712 -5.860 0.144 499 HB2 TYR 600 HB2 TYR 600 37.447 -7.011 1.844 500 HB3 TYR 600 HB3 TYR 600 35.928 -6.685 1.022 501 HD1 TYR 600 HD1 TYR 600 39.175 -8.515 0.730 502 HD2 TYR 600 HD2 TYR 600 35.148 -8.110 -0.767 503 HE1 TYR 600 HE1 TYR 600 39.483 -10.561 -0.646 504 HE2 TYR 600 HE2 TYR 600 35.451 -10.180 -2.124 505 HH TYR 600 HH TYR 600 38.538 -11.950 -2.248 506 H HIS 601 H HIS 601 35.376 -4.846 -0.783 507 HA HIS 601 HA HIS 601 35.469 -5.843 -3.447 508 HB2 HIS 601 HB2 HIS 601 33.420 -5.199 -2.214 509 HB3 HIS 601 HB3 HIS 601 33.905 -3.509 -2.262 510 HD2 HIS 601 HD2 HIS 601 34.336 -5.583 -5.487 511 HE1 HIS 601 HE1 HIS 601 30.815 -3.262 -6.028 512 HE2 HIS 601 HE2 HIS 601 32.474 -4.813 -7.166 513 H GLU 602 H GLU 602 36.249 -2.538 -2.229 514 HA GLU 602 HA GLU 602 36.890 -1.510 -4.839 515 HB2 GLU 602 HB2 GLU 602 36.124 -0.224 -2.855 516 HB3 GLU 602 HB3 GLU 602 37.696 -0.431 -2.108 517 HG2 GLU 602 HG2 GLU 602 37.267 0.841 -4.856 518 HG3 GLU 602 HG3 GLU 602 37.128 1.763 -3.377 519 H THR 603 H THR 603 38.869 -3.087 -2.363 520 HA THR 603 HA THR 603 41.436 -2.525 -3.625 521 HB THR 603 HB THR 603 40.633 -4.549 -1.504 522 HG1 THR 603 HG1 THR 603 40.391 -2.447 -0.859 523 HG21 THR 603 HG21 THR 603 43.404 -3.623 -2.371 524 HG22 THR 603 HG22 THR 603 42.757 -5.280 -2.446 525 HG23 THR 603 HG23 THR 603 43.047 -4.516 -0.877 526 H SER 604 H SER 604 39.151 -5.258 -3.732 527 HA SER 604 HA SER 604 40.819 -6.873 -5.508 528 HB2 SER 604 HB2 SER 604 37.894 -7.201 -4.752 529 HB3 SER 604 HB3 SER 604 38.917 -8.382 -5.590 530 HG SER 604 HG SER 604 39.038 -7.477 -2.936 531 H GLN 605 H GLN 605 40.958 -4.714 -6.819 532 HA GLN 605 HA GLN 605 38.756 -3.845 -8.391 533 HB2 GLN 605 HB2 GLN 605 40.435 -2.406 -9.507 534 HB3 GLN 605 HB3 GLN 605 40.369 -2.268 -7.758 535 HG2 GLN 605 HG2 GLN 605 42.452 -3.365 -7.456 536 HG3 GLN 605 HG3 GLN 605 42.465 -4.026 -9.092 537 HE21 GLN 605 HE21 GLN 605 42.042 -0.667 -7.737 538 HE22 GLN 605 HE22 GLN 605 43.275 0.021 -8.791 539 H ASN 606 H ASN 606 38.082 -5.905 -9.252 540 HA ASN 606 HA ASN 606 37.617 -7.288 -10.955 541 HB2 ASN 606 HB2 ASN 606 38.936 -5.222 -12.735 542 HB3 ASN 606 HB3 ASN 606 37.754 -6.429 -13.227 543 HD21 ASN 606 HD21 ASN 606 37.939 -3.238 -12.781 544 HD22 ASN 606 HD22 ASN 606 36.324 -2.931 -12.149 545 H SER 607 H SER 607 40.028 -7.888 -9.547 546 HA SER 607 HA SER 607 42.038 -8.939 -11.337 547 HB2 SER 607 HB2 SER 607 42.832 -10.119 -9.307 548 HB3 SER 607 HB3 SER 607 42.619 -8.381 -9.075 549 HG SER 607 HG SER 607 41.748 -9.690 -7.360 550 H SER 608 H SER 608 42.546 -11.145 -11.703 551 HA SER 608 HA SER 608 40.312 -12.754 -12.610 552 HB2 SER 608 HB2 SER 608 42.456 -12.511 -13.824 553 HB3 SER 608 HB3 SER 608 43.277 -13.410 -12.544 554 HG SER 608 HG SER 608 42.074 -15.218 -13.074 Start of MODEL 12 1 H1 GLY 533 H1 GLY 533 16.888 16.269 6.023 2 H2 GLY 533 H2 GLY 533 15.614 15.660 6.860 3 H3 GLY 533 H3 GLY 533 15.740 17.279 6.618 4 HA2 GLY 533 HA2 GLY 533 15.327 15.268 4.499 5 HA3 GLY 533 HA3 GLY 533 14.068 16.327 5.156 6 H GLY 534 H GLY 534 14.919 16.160 2.396 7 HA2 GLY 534 HA2 GLY 534 14.950 18.852 1.610 8 HA3 GLY 534 HA3 GLY 534 16.634 18.328 1.628 9 H SER 535 H SER 535 16.506 18.847 -0.672 10 HA SER 535 HA SER 535 15.123 17.106 -2.555 11 HB2 SER 535 HB2 SER 535 16.565 18.238 -4.208 12 HB3 SER 535 HB3 SER 535 15.696 19.372 -3.171 13 HG SER 535 HG SER 535 17.921 19.905 -3.447 14 H GLU 536 H GLU 536 16.607 15.997 -4.292 15 HA GLU 536 HA GLU 536 17.893 13.783 -3.022 16 HB2 GLU 536 HB2 GLU 536 17.964 14.568 -5.966 17 HB3 GLU 536 HB3 GLU 536 18.360 13.012 -5.263 18 HG2 GLU 536 HG2 GLU 536 16.271 12.487 -5.865 19 HG3 GLU 536 HG3 GLU 536 15.859 13.171 -4.307 20 H PHE 537 H PHE 537 19.972 13.286 -2.631 21 HA PHE 537 HA PHE 537 22.188 14.897 -3.805 22 HB2 PHE 537 HB2 PHE 537 21.917 14.108 -0.882 23 HB3 PHE 537 HB3 PHE 537 23.330 14.855 -1.604 24 HD1 PHE 537 HD1 PHE 537 22.961 17.143 -2.847 25 HD2 PHE 537 HD2 PHE 537 20.352 15.542 0.188 26 HE1 PHE 537 HE1 PHE 537 22.126 19.431 -2.354 27 HE2 PHE 537 HE2 PHE 537 19.522 17.828 0.681 28 HZ PHE 537 HZ PHE 537 20.404 19.774 -0.592 29 H SER 538 H SER 538 20.992 12.064 -4.224 30 HA SER 538 HA SER 538 23.539 10.581 -4.308 31 HB2 SER 538 HB2 SER 538 22.654 8.710 -3.000 32 HB3 SER 538 HB3 SER 538 22.728 10.185 -2.032 33 HG SER 538 HG SER 538 20.748 9.079 -1.760 34 H ASP 539 H ASP 539 23.341 8.478 -5.307 35 HA ASP 539 HA ASP 539 21.007 7.979 -7.073 36 HB2 ASP 539 HB2 ASP 539 23.916 7.758 -7.928 37 HB3 ASP 539 HB3 ASP 539 22.520 7.295 -8.881 38 H ARG 540 H ARG 540 20.639 5.732 -7.463 39 HA ARG 540 HA ARG 540 21.613 3.982 -5.342 40 HB2 ARG 540 HB2 ARG 540 19.206 4.146 -6.175 41 HB3 ARG 540 HB3 ARG 540 19.718 3.275 -7.611 42 HG2 ARG 540 HG2 ARG 540 18.678 1.735 -6.092 43 HG3 ARG 540 HG3 ARG 540 20.393 1.338 -6.129 44 HD2 ARG 540 HD2 ARG 540 20.700 2.622 -3.993 45 HD3 ARG 540 HD3 ARG 540 18.969 2.947 -3.956 46 HE ARG 540 HE ARG 540 20.372 0.420 -3.365 47 HH11 ARG 540 HH11 ARG 540 17.181 1.765 -3.941 48 HH12 ARG 540 HH12 ARG 540 16.404 0.417 -3.140 49 HH21 ARG 540 HH21 ARG 540 19.403 -1.132 -2.388 50 HH22 ARG 540 HH22 ARG 540 17.649 -1.253 -2.277 51 H SER 541 H SER 541 23.816 4.538 -6.534 52 HA SER 541 HA SER 541 24.712 2.672 -8.564 53 HB2 SER 541 HB2 SER 541 26.300 4.267 -6.514 54 HB3 SER 541 HB3 SER 541 26.973 3.411 -7.913 55 HG SER 541 HG SER 541 26.611 5.629 -8.346 56 H ASN 542 H ASN 542 25.579 0.652 -8.366 57 HA ASN 542 HA ASN 542 24.979 -0.945 -6.115 58 HB2 ASN 542 HB2 ASN 542 26.109 -2.708 -7.302 59 HB3 ASN 542 HB3 ASN 542 25.218 -1.744 -8.465 60 HD21 ASN 542 HD21 ASN 542 28.131 -3.288 -7.989 61 HD22 ASN 542 HD22 ASN 542 29.102 -2.326 -9.100 62 H GLU 543 H GLU 543 27.895 0.905 -6.773 63 HA GLU 543 HA GLU 543 29.737 -0.320 -4.983 64 HB2 GLU 543 HB2 GLU 543 29.432 2.596 -5.800 65 HB3 GLU 543 HB3 GLU 543 30.868 1.884 -5.049 66 HG2 GLU 543 HG2 GLU 543 31.065 0.320 -6.995 67 HG3 GLU 543 HG3 GLU 543 29.737 1.167 -7.784 68 H LEU 544 H LEU 544 27.065 1.905 -4.319 69 HA LEU 544 HA LEU 544 27.955 2.495 -1.577 70 HB2 LEU 544 HB2 LEU 544 25.322 3.117 -2.960 71 HB3 LEU 544 HB3 LEU 544 25.904 3.805 -1.450 72 HG LEU 544 HG LEU 544 27.109 4.257 -4.217 73 HD11 LEU 544 HD11 LEU 544 26.313 6.535 -3.952 74 HD12 LEU 544 HD12 LEU 544 25.651 6.155 -2.340 75 HD13 LEU 544 HD13 LEU 544 24.962 5.401 -3.798 76 HD21 LEU 544 HD21 LEU 544 28.910 4.350 -2.544 77 HD22 LEU 544 HD22 LEU 544 27.925 5.431 -1.523 78 HD23 LEU 544 HD23 LEU 544 28.515 5.977 -3.105 79 H GLU 545 H GLU 545 25.854 0.171 -3.161 80 HA GLU 545 HA GLU 545 24.245 -0.577 -0.926 81 HB2 GLU 545 HB2 GLU 545 23.965 -1.052 -3.476 82 HB3 GLU 545 HB3 GLU 545 25.057 -2.401 -3.213 83 HG2 GLU 545 HG2 GLU 545 22.809 -3.224 -3.135 84 HG3 GLU 545 HG3 GLU 545 23.466 -3.323 -1.513 85 H ILE 546 H ILE 546 27.512 -1.441 -1.810 86 HA ILE 546 HA ILE 546 27.947 -3.905 -0.576 87 HB ILE 546 HB ILE 546 29.827 -1.535 -0.759 88 HG12 ILE 546 HG12 ILE 546 28.856 -2.188 -2.993 89 HG13 ILE 546 HG13 ILE 546 30.599 -2.243 -2.861 90 HG21 ILE 546 HG21 ILE 546 31.630 -3.334 -0.864 91 HG22 ILE 546 HG22 ILE 546 30.836 -3.154 0.709 92 HG23 ILE 546 HG23 ILE 546 30.399 -4.496 -0.360 93 HD11 ILE 546 HD11 ILE 546 29.665 -4.155 -4.137 94 HD12 ILE 546 HD12 ILE 546 30.626 -4.649 -2.741 95 HD13 ILE 546 HD13 ILE 546 28.843 -4.719 -2.665 96 H ARG 547 H ARG 547 27.828 -0.723 0.983 97 HA ARG 547 HA ARG 547 28.879 -1.428 3.553 98 HB2 ARG 547 HB2 ARG 547 28.748 0.836 2.753 99 HB3 ARG 547 HB3 ARG 547 26.994 0.765 2.609 100 HG2 ARG 547 HG2 ARG 547 26.650 0.860 4.930 101 HG3 ARG 547 HG3 ARG 547 28.296 0.344 5.313 102 HD2 ARG 547 HD2 ARG 547 27.695 2.990 3.955 103 HD3 ARG 547 HD3 ARG 547 27.768 2.798 5.716 104 HE ARG 547 HE ARG 547 30.133 1.676 4.916 105 HH11 ARG 547 HH11 ARG 547 28.814 4.881 4.402 106 HH12 ARG 547 HH12 ARG 547 30.410 5.597 4.309 107 HH21 ARG 547 HH21 ARG 547 32.050 2.594 4.792 108 HH22 ARG 547 HH22 ARG 547 32.224 4.317 4.533 109 H GLY 548 H GLY 548 25.769 -2.195 2.185 110 HA2 GLY 548 HA2 GLY 548 24.315 -2.553 4.666 111 HA3 GLY 548 HA3 GLY 548 23.888 -3.181 3.077 112 H LYS 549 H LYS 549 26.811 -4.505 3.233 113 HA LYS 549 HA LYS 549 25.899 -7.119 4.145 114 HB2 LYS 549 HB2 LYS 549 28.684 -6.106 3.423 115 HB3 LYS 549 HB3 LYS 549 28.249 -7.798 3.654 116 HG2 LYS 549 HG2 LYS 549 27.172 -5.979 1.456 117 HG3 LYS 549 HG3 LYS 549 28.401 -7.227 1.277 118 HD2 LYS 549 HD2 LYS 549 26.718 -8.954 1.929 119 HD3 LYS 549 HD3 LYS 549 25.481 -7.677 2.019 120 HE2 LYS 549 HE2 LYS 549 25.906 -7.090 -0.346 121 HE3 LYS 549 HE3 LYS 549 27.112 -8.371 -0.456 122 HZ1 LYS 549 HZ1 LYS 549 25.349 -9.984 0.023 123 HZ2 LYS 549 HZ2 LYS 549 24.975 -9.125 -1.307 124 HZ3 LYS 549 HZ3 LYS 549 24.230 -8.795 0.102 125 H TYR 550 H TYR 550 26.564 -8.365 5.863 126 HA TYR 550 HA TYR 550 28.350 -7.294 7.896 127 HB2 TYR 550 HB2 TYR 550 26.733 -7.475 9.762 128 HB3 TYR 550 HB3 TYR 550 26.309 -6.212 8.639 129 HD1 TYR 550 HD1 TYR 550 24.236 -6.310 7.360 130 HD2 TYR 550 HD2 TYR 550 25.420 -9.606 9.874 131 HE1 TYR 550 HE1 TYR 550 21.952 -7.281 7.161 132 HE2 TYR 550 HE2 TYR 550 23.144 -10.580 9.672 133 HH TYR 550 HH TYR 550 21.030 -10.318 8.806 134 H VAL 551 H VAL 551 28.692 -8.712 9.702 135 HA VAL 551 HA VAL 551 28.084 -11.592 9.335 136 HB VAL 551 HB VAL 551 30.528 -11.978 10.188 137 HG11 VAL 551 HG11 VAL 551 30.009 -11.163 7.296 138 HG12 VAL 551 HG12 VAL 551 31.286 -12.249 7.865 139 HG13 VAL 551 HG13 VAL 551 29.588 -12.739 7.996 140 HG21 VAL 551 HG21 VAL 551 32.222 -10.514 9.257 141 HG22 VAL 551 HG22 VAL 551 30.996 -9.351 8.726 142 HG23 VAL 551 HG23 VAL 551 31.256 -9.664 10.461 143 H VAL 552 H VAL 552 27.761 -12.725 11.237 144 HA VAL 552 HA VAL 552 26.969 -11.121 13.522 145 HB VAL 552 HB VAL 552 27.049 -14.099 13.025 146 HG11 VAL 552 HG11 VAL 552 27.259 -13.854 15.459 147 HG12 VAL 552 HG12 VAL 552 25.905 -12.697 15.480 148 HG13 VAL 552 HG13 VAL 552 25.638 -14.392 15.031 149 HG21 VAL 552 HG21 VAL 552 24.713 -12.162 13.328 150 HG22 VAL 552 HG22 VAL 552 25.354 -12.744 11.777 151 HG23 VAL 552 HG23 VAL 552 24.618 -13.883 12.912 152 H VAL 553 H VAL 553 27.909 -10.684 15.402 153 HA VAL 553 HA VAL 553 30.728 -11.249 15.926 154 HB VAL 553 HB VAL 553 28.571 -10.013 17.688 155 HG11 VAL 553 HG11 VAL 553 30.491 -9.272 19.092 156 HG12 VAL 553 HG12 VAL 553 30.293 -11.020 19.117 157 HG13 VAL 553 HG13 VAL 553 31.581 -10.281 18.123 158 HG21 VAL 553 HG21 VAL 553 30.918 -8.673 16.302 159 HG22 VAL 553 HG22 VAL 553 29.205 -8.516 15.820 160 HG23 VAL 553 HG23 VAL 553 29.763 -7.922 17.406 161 HA PRO 554 HA PRO 554 29.531 -15.117 18.047 162 HB2 PRO 554 HB2 PRO 554 31.975 -16.155 18.524 163 HB3 PRO 554 HB3 PRO 554 31.294 -16.056 16.869 164 HG2 PRO 554 HG2 PRO 554 33.245 -14.150 18.170 165 HG3 PRO 554 HG3 PRO 554 33.364 -14.896 16.550 166 HD2 PRO 554 HD2 PRO 554 32.348 -12.376 16.997 167 HD3 PRO 554 HD3 PRO 554 31.778 -13.420 15.657 168 H GLU 555 H GLU 555 29.225 -15.636 20.176 169 HA GLU 555 HA GLU 555 29.575 -13.689 22.200 170 HB2 GLU 555 HB2 GLU 555 27.832 -15.441 22.092 171 HB3 GLU 555 HB3 GLU 555 29.049 -16.671 22.472 172 HG2 GLU 555 HG2 GLU 555 29.399 -15.703 24.682 173 HG3 GLU 555 HG3 GLU 555 28.416 -14.299 24.281 174 H THR 556 H THR 556 31.786 -16.220 21.183 175 HA THR 556 HA THR 556 33.445 -16.283 23.561 176 HB THR 556 HB THR 556 35.043 -17.459 22.063 177 HG1 THR 556 HG1 THR 556 34.748 -16.642 20.084 178 HG21 THR 556 HG21 THR 556 33.236 -18.738 23.178 179 HG22 THR 556 HG22 THR 556 33.655 -19.411 21.587 180 HG23 THR 556 HG23 THR 556 32.173 -18.465 21.782 181 H SER 557 H SER 557 33.351 -14.102 20.776 182 HA SER 557 HA SER 557 36.037 -12.998 21.339 183 HB2 SER 557 HB2 SER 557 33.859 -12.216 19.367 184 HB3 SER 557 HB3 SER 557 35.359 -11.298 19.617 185 HG SER 557 HG SER 557 35.215 -14.036 18.897 186 H GLN 558 H GLN 558 35.838 -12.408 23.475 187 HA GLN 558 HA GLN 558 33.856 -10.926 24.746 188 HB2 GLN 558 HB2 GLN 558 36.858 -10.866 25.234 189 HB3 GLN 558 HB3 GLN 558 35.619 -10.316 26.370 190 HG2 GLN 558 HG2 GLN 558 34.716 -12.645 26.471 191 HG3 GLN 558 HG3 GLN 558 35.991 -13.180 25.386 192 HE21 GLN 558 HE21 GLN 558 36.047 -14.595 27.587 193 HE22 GLN 558 HE22 GLN 558 37.276 -14.022 28.712 194 H ASP 559 H ASP 559 36.449 -9.631 22.710 195 HA ASP 559 HA ASP 559 36.029 -6.848 23.439 196 HB2 ASP 559 HB2 ASP 559 37.461 -8.098 21.067 197 HB3 ASP 559 HB3 ASP 559 37.547 -6.410 21.535 198 H MET 560 H MET 560 34.363 -8.964 21.263 199 HA MET 560 HA MET 560 33.039 -8.733 19.433 200 HB2 MET 560 HB2 MET 560 32.051 -6.259 20.895 201 HB3 MET 560 HB3 MET 560 31.162 -7.186 19.683 202 HG2 MET 560 HG2 MET 560 31.306 -9.207 21.188 203 HG3 MET 560 HG3 MET 560 32.132 -8.211 22.361 204 HE1 MET 560 HE1 MET 560 27.641 -8.383 21.500 205 HE2 MET 560 HE2 MET 560 28.727 -7.922 20.170 206 HE3 MET 560 HE3 MET 560 28.904 -9.505 20.940 207 H ALA 561 H ALA 561 35.622 -7.669 18.999 208 HA ALA 561 HA ALA 561 35.133 -5.734 16.817 209 HB1 ALA 561 HB1 ALA 561 36.847 -4.217 17.763 210 HB2 ALA 561 HB2 ALA 561 35.515 -4.439 18.914 211 HB3 ALA 561 HB3 ALA 561 37.049 -5.292 19.158 212 H PHE 562 H PHE 562 36.834 -5.491 15.329 213 HA PHE 562 HA PHE 562 39.293 -7.020 15.544 214 HB2 PHE 562 HB2 PHE 562 37.404 -8.601 14.556 215 HB3 PHE 562 HB3 PHE 562 37.653 -7.671 13.094 216 HD1 PHE 562 HD1 PHE 562 39.028 -10.171 15.399 217 HD2 PHE 562 HD2 PHE 562 39.881 -7.803 11.906 218 HE1 PHE 562 HE1 PHE 562 40.962 -11.639 14.865 219 HE2 PHE 562 HE2 PHE 562 41.813 -9.263 11.384 220 HZ PHE 562 HZ PHE 562 42.348 -11.195 12.850 221 H LYS 563 H LYS 563 40.811 -6.462 13.827 222 HA LYS 563 HA LYS 563 40.357 -3.670 12.833 223 HB2 LYS 563 HB2 LYS 563 41.946 -3.945 14.629 224 HB3 LYS 563 HB3 LYS 563 42.857 -5.139 13.743 225 HG2 LYS 563 HG2 LYS 563 42.475 -2.292 12.723 226 HG3 LYS 563 HG3 LYS 563 43.682 -2.679 13.935 227 HD2 LYS 563 HD2 LYS 563 43.601 -3.658 11.072 228 HD3 LYS 563 HD3 LYS 563 44.778 -2.587 11.817 229 HE2 LYS 563 HE2 LYS 563 44.423 -5.549 12.416 230 HE3 LYS 563 HE3 LYS 563 45.683 -4.837 11.431 231 HZ1 LYS 563 HZ1 LYS 563 46.492 -5.263 13.656 232 HZ2 LYS 563 HZ2 LYS 563 45.337 -4.352 14.344 233 HZ3 LYS 563 HZ3 LYS 563 46.479 -3.648 13.417 234 H CYS 564 H CYS 564 39.987 -3.462 10.773 235 HA CYS 564 HA CYS 564 40.302 -5.243 8.640 236 HB2 CYS 564 HB2 CYS 564 38.910 -3.092 8.776 237 HB3 CYS 564 HB3 CYS 564 40.381 -2.207 8.566 238 HA PRO 565 HA PRO 565 44.860 -4.880 8.427 239 HB2 PRO 565 HB2 PRO 565 44.421 -6.764 6.120 240 HB3 PRO 565 HB3 PRO 565 45.634 -6.847 7.433 241 HG2 PRO 565 HG2 PRO 565 43.436 -8.437 7.494 242 HG3 PRO 565 HG3 PRO 565 44.005 -7.629 8.989 243 HD2 PRO 565 HD2 PRO 565 41.731 -6.795 7.166 244 HD3 PRO 565 HD3 PRO 565 41.799 -6.851 8.933 245 H ILE 566 H ILE 566 42.567 -4.225 5.847 246 HA ILE 566 HA ILE 566 44.497 -3.314 3.873 247 HB ILE 566 HB ILE 566 41.503 -3.008 4.107 248 HG12 ILE 566 HG12 ILE 566 43.178 -4.747 2.219 249 HG13 ILE 566 HG13 ILE 566 42.498 -5.321 3.732 250 HG21 ILE 566 HG21 ILE 566 42.339 -1.121 2.757 251 HG22 ILE 566 HG22 ILE 566 43.323 -2.227 1.782 252 HG23 ILE 566 HG23 ILE 566 41.543 -2.278 1.717 253 HD11 ILE 566 HD11 ILE 566 40.194 -4.817 2.904 254 HD12 ILE 566 HD12 ILE 566 40.909 -4.405 1.316 255 HD13 ILE 566 HD13 ILE 566 41.065 -6.042 1.963 256 H CYS 567 H CYS 567 42.101 -1.495 5.876 257 HA CYS 567 HA CYS 567 43.661 0.978 5.372 258 HB2 CYS 567 HB2 CYS 567 41.671 2.149 5.810 259 HB3 CYS 567 HB3 CYS 567 41.300 0.878 4.644 260 H LYS 568 H LYS 568 43.517 -1.298 7.689 261 HA LYS 568 HA LYS 568 44.193 -1.551 9.842 262 HB2 LYS 568 HB2 LYS 568 45.484 1.183 9.646 263 HB3 LYS 568 HB3 LYS 568 45.844 -0.084 10.807 264 HG2 LYS 568 HG2 LYS 568 46.339 -0.234 7.804 265 HG3 LYS 568 HG3 LYS 568 47.539 0.084 9.047 266 HD2 LYS 568 HD2 LYS 568 47.195 -2.185 9.997 267 HD3 LYS 568 HD3 LYS 568 45.926 -2.496 8.804 268 HE2 LYS 568 HE2 LYS 568 47.884 -3.583 8.014 269 HE3 LYS 568 HE3 LYS 568 47.570 -2.210 6.971 270 HZ1 LYS 568 HZ1 LYS 568 49.572 -2.259 9.171 271 HZ2 LYS 568 HZ2 LYS 568 49.318 -0.990 8.173 272 HZ3 LYS 568 HZ3 LYS 568 49.928 -2.379 7.585 273 H GLU 569 H GLU 569 41.599 -1.025 9.625 274 HA GLU 569 HA GLU 569 41.028 0.923 11.872 275 HB2 GLU 569 HB2 GLU 569 39.437 0.353 9.375 276 HB3 GLU 569 HB3 GLU 569 38.762 1.128 10.808 277 HG2 GLU 569 HG2 GLU 569 40.384 2.934 10.684 278 HG3 GLU 569 HG3 GLU 569 41.152 2.207 9.271 279 H THR 570 H THR 570 39.831 0.372 13.548 280 HA THR 570 HA THR 570 39.051 -2.427 13.840 281 HB THR 570 HB THR 570 38.827 -0.130 15.796 282 HG1 THR 570 HG1 THR 570 40.709 -1.006 16.583 283 HG21 THR 570 HG21 THR 570 38.602 -3.150 16.178 284 HG22 THR 570 HG22 THR 570 37.324 -1.948 16.478 285 HG23 THR 570 HG23 THR 570 38.773 -1.971 17.494 286 H VAL 571 H VAL 571 37.168 -3.230 13.243 287 HA VAL 571 HA VAL 571 34.664 -1.624 13.234 288 HB VAL 571 HB VAL 571 33.713 -4.027 12.632 289 HG11 VAL 571 HG11 VAL 571 33.381 -2.086 11.343 290 HG12 VAL 571 HG12 VAL 571 35.067 -2.120 10.720 291 HG13 VAL 571 HG13 VAL 571 33.894 -3.385 10.272 292 HG21 VAL 571 HG21 VAL 571 35.106 -5.288 11.129 293 HG22 VAL 571 HG22 VAL 571 36.497 -4.235 11.440 294 HG23 VAL 571 HG23 VAL 571 35.833 -5.268 12.742 295 H THR 572 H THR 572 32.929 -2.106 14.535 296 HA THR 572 HA THR 572 33.350 -3.923 16.851 297 HB THR 572 HB THR 572 32.375 -2.276 18.352 298 HG1 THR 572 HG1 THR 572 32.100 -0.163 17.669 299 HG21 THR 572 HG21 THR 572 34.876 -2.321 18.057 300 HG22 THR 572 HG22 THR 572 34.246 -0.747 18.563 301 HG23 THR 572 HG23 THR 572 34.729 -1.011 16.871 302 H GLY 573 H GLY 573 31.479 -4.752 17.795 303 HA2 GLY 573 HA2 GLY 573 29.423 -5.424 15.967 304 HA3 GLY 573 HA3 GLY 573 29.440 -5.806 17.697 305 H VAL 574 H VAL 574 27.150 -5.143 16.051 306 HA VAL 574 HA VAL 574 26.020 -3.241 17.989 307 HB VAL 574 HB VAL 574 26.486 -2.018 15.827 308 HG11 VAL 574 HG11 VAL 574 24.231 -3.700 14.659 309 HG12 VAL 574 HG12 VAL 574 25.029 -2.310 13.903 310 HG13 VAL 574 HG13 VAL 574 25.958 -3.784 14.193 311 HG21 VAL 574 HG21 VAL 574 24.765 -1.269 17.433 312 HG22 VAL 574 HG22 VAL 574 24.373 -0.852 15.757 313 HG23 VAL 574 HG23 VAL 574 23.529 -2.190 16.554 314 H TYR 575 H TYR 575 23.884 -3.642 18.647 315 HA TYR 575 HA TYR 575 23.198 -6.412 18.486 316 HB2 TYR 575 HB2 TYR 575 22.939 -5.054 20.523 317 HB3 TYR 575 HB3 TYR 575 21.765 -4.038 19.723 318 HD1 TYR 575 HD1 TYR 575 19.964 -4.320 21.211 319 HD2 TYR 575 HD2 TYR 575 21.836 -7.815 19.520 320 HE1 TYR 575 HE1 TYR 575 18.116 -5.743 22.100 321 HE2 TYR 575 HE2 TYR 575 19.972 -9.208 20.337 322 HH TYR 575 HH TYR 575 17.299 -7.873 22.292 323 H ASP 576 H ASP 576 21.875 -7.499 17.162 324 HA ASP 576 HA ASP 576 19.791 -6.132 15.556 325 HB2 ASP 576 HB2 ASP 576 21.492 -7.698 14.472 326 HB3 ASP 576 HB3 ASP 576 20.737 -9.019 15.330 327 H GLU 577 H GLU 577 18.104 -5.837 16.928 328 HA GLU 577 HA GLU 577 17.278 -7.526 19.060 329 HB2 GLU 577 HB2 GLU 577 15.761 -5.472 17.385 330 HB3 GLU 577 HB3 GLU 577 15.122 -6.206 18.848 331 HG2 GLU 577 HG2 GLU 577 16.890 -5.252 20.190 332 HG3 GLU 577 HG3 GLU 577 17.685 -4.581 18.763 333 H GLU 578 H GLU 578 16.588 -7.807 15.603 334 HA GLU 578 HA GLU 578 14.162 -9.425 15.942 335 HB2 GLU 578 HB2 GLU 578 15.840 -8.882 13.467 336 HB3 GLU 578 HB3 GLU 578 14.276 -9.661 13.489 337 HG2 GLU 578 HG2 GLU 578 14.896 -6.778 14.228 338 HG3 GLU 578 HG3 GLU 578 14.058 -7.345 12.790 339 H SER 579 H SER 579 17.553 -10.092 14.941 340 HA SER 579 HA SER 579 17.145 -12.998 14.971 341 HB2 SER 579 HB2 SER 579 19.654 -11.282 14.846 342 HB3 SER 579 HB3 SER 579 19.628 -13.047 14.691 343 HG SER 579 HG SER 579 18.435 -12.866 12.828 344 H GLY 580 H GLY 580 18.269 -10.544 17.268 345 HA2 GLY 580 HA2 GLY 580 18.431 -10.726 19.578 346 HA3 GLY 580 HA3 GLY 580 18.215 -12.481 19.497 347 H GLU 581 H GLU 581 20.576 -10.684 17.553 348 HA GLU 581 HA GLU 581 22.890 -11.816 19.039 349 HB2 GLU 581 HB2 GLU 581 22.358 -12.171 16.057 350 HB3 GLU 581 HB3 GLU 581 23.844 -12.597 16.868 351 HG2 GLU 581 HG2 GLU 581 21.109 -13.884 17.251 352 HG3 GLU 581 HG3 GLU 581 22.472 -14.555 16.378 353 H TRP 582 H TRP 582 24.960 -10.787 18.293 354 HA TRP 582 HA TRP 582 24.524 -7.975 17.412 355 HB2 TRP 582 HB2 TRP 582 26.766 -9.329 18.909 356 HB3 TRP 582 HB3 TRP 582 26.893 -7.705 18.256 357 HD1 TRP 582 HD1 TRP 582 24.429 -9.575 20.607 358 HE1 TRP 582 HE1 TRP 582 23.748 -8.022 22.532 359 HE3 TRP 582 HE3 TRP 582 27.103 -5.433 19.272 360 HZ2 TRP 582 HZ2 TRP 582 24.292 -5.323 23.378 361 HZ3 TRP 582 HZ3 TRP 582 27.013 -3.379 20.665 362 HH2 TRP 582 HH2 TRP 582 25.608 -3.305 22.697 363 H VAL 583 H VAL 583 25.737 -7.053 15.747 364 HA VAL 583 HA VAL 583 27.093 -8.901 13.838 365 HB VAL 583 HB VAL 583 25.964 -7.627 12.006 366 HG11 VAL 583 HG11 VAL 583 24.160 -9.294 13.805 367 HG12 VAL 583 HG12 VAL 583 23.883 -8.949 12.086 368 HG13 VAL 583 HG13 VAL 583 25.279 -9.908 12.569 369 HG21 VAL 583 HG21 VAL 583 23.837 -6.555 12.365 370 HG22 VAL 583 HG22 VAL 583 23.999 -6.723 14.125 371 HG23 VAL 583 HG23 VAL 583 25.125 -5.682 13.206 372 H TRP 584 H TRP 584 28.627 -8.144 12.544 373 HA TRP 584 HA TRP 584 29.841 -5.486 13.048 374 HB2 TRP 584 HB2 TRP 584 30.684 -8.119 11.829 375 HB3 TRP 584 HB3 TRP 584 31.583 -6.667 11.440 376 HD1 TRP 584 HD1 TRP 584 32.023 -5.260 14.061 377 HE1 TRP 584 HE1 TRP 584 33.350 -6.295 16.015 378 HE3 TRP 584 HE3 TRP 584 31.688 -10.208 12.769 379 HZ2 TRP 584 HZ2 TRP 584 34.479 -8.893 16.677 380 HZ3 TRP 584 HZ3 TRP 584 32.932 -11.919 14.041 381 HH2 TRP 584 HH2 TRP 584 34.322 -11.268 16.002 382 H LYS 585 H LYS 585 28.798 -3.975 11.859 383 HA LYS 585 HA LYS 585 27.599 -4.456 9.225 384 HB2 LYS 585 HB2 LYS 585 28.152 -1.895 10.791 385 HB3 LYS 585 HB3 LYS 585 27.217 -1.973 9.310 386 HG2 LYS 585 HG2 LYS 585 26.464 -3.341 11.921 387 HG3 LYS 585 HG3 LYS 585 25.814 -1.811 11.316 388 HD2 LYS 585 HD2 LYS 585 24.964 -3.042 9.280 389 HD3 LYS 585 HD3 LYS 585 25.439 -4.567 10.069 390 HE2 LYS 585 HE2 LYS 585 23.959 -4.053 11.977 391 HE3 LYS 585 HE3 LYS 585 23.533 -2.514 11.263 392 HZ1 LYS 585 HZ1 LYS 585 22.536 -3.715 9.386 393 HZ2 LYS 585 HZ2 LYS 585 21.846 -4.186 10.779 394 HZ3 LYS 585 HZ3 LYS 585 22.928 -5.161 10.047 395 H ASN 586 H ASN 586 28.198 -3.534 7.237 396 HA ASN 586 HA ASN 586 29.606 -3.181 5.521 397 HB2 ASN 586 HB2 ASN 586 29.600 -0.964 6.782 398 HB3 ASN 586 HB3 ASN 586 31.177 -1.408 7.423 399 HD21 ASN 586 HD21 ASN 586 31.471 -2.510 4.260 400 HD22 ASN 586 HD22 ASN 586 32.110 -0.997 3.634 401 H THR 587 H THR 587 30.163 -5.543 7.130 402 HA THR 587 HA THR 587 33.141 -5.829 6.869 403 HB THR 587 HB THR 587 31.380 -6.992 9.040 404 HG1 THR 587 HG1 THR 587 31.776 -4.740 9.223 405 HG21 THR 587 HG21 THR 587 33.403 -8.398 8.658 406 HG22 THR 587 HG22 THR 587 33.468 -7.549 10.206 407 HG23 THR 587 HG23 THR 587 34.418 -6.946 8.835 408 H ILE 588 H ILE 588 34.001 -7.769 6.329 409 HA ILE 588 HA ILE 588 32.306 -10.025 5.476 410 HB ILE 588 HB ILE 588 32.661 -8.745 3.481 411 HG12 ILE 588 HG12 ILE 588 34.661 -11.048 3.420 412 HG13 ILE 588 HG13 ILE 588 32.903 -11.276 3.393 413 HG21 ILE 588 HG21 ILE 588 35.675 -8.955 3.894 414 HG22 ILE 588 HG22 ILE 588 34.841 -8.121 2.570 415 HG23 ILE 588 HG23 ILE 588 34.738 -7.478 4.205 416 HD11 ILE 588 HD11 ILE 588 34.611 -9.912 1.274 417 HD12 ILE 588 HD12 ILE 588 33.715 -11.432 1.146 418 HD13 ILE 588 HD13 ILE 588 32.827 -9.904 1.282 419 H GLU 589 H GLU 589 33.287 -12.046 5.686 420 HA GLU 589 HA GLU 589 35.990 -12.156 6.956 421 HB2 GLU 589 HB2 GLU 589 34.119 -13.025 8.375 422 HB3 GLU 589 HB3 GLU 589 33.751 -14.204 7.113 423 HG2 GLU 589 HG2 GLU 589 36.100 -15.097 7.346 424 HG3 GLU 589 HG3 GLU 589 36.378 -13.938 8.637 425 H VAL 590 H VAL 590 37.549 -12.926 5.687 426 HA VAL 590 HA VAL 590 37.126 -14.998 3.692 427 HB VAL 590 HB VAL 590 36.328 -13.121 2.417 428 HG11 VAL 590 HG11 VAL 590 38.978 -11.712 2.891 429 HG12 VAL 590 HG12 VAL 590 37.639 -11.176 1.841 430 HG13 VAL 590 HG13 VAL 590 37.397 -11.246 3.576 431 HG21 VAL 590 HG21 VAL 590 37.716 -13.235 0.467 432 HG22 VAL 590 HG22 VAL 590 39.129 -13.745 1.412 433 HG23 VAL 590 HG23 VAL 590 37.720 -14.825 1.237 434 H ASN 591 H ASN 591 39.053 -15.954 2.991 435 HA ASN 591 HA ASN 591 41.064 -16.881 3.446 436 HB2 ASN 591 HB2 ASN 591 41.585 -14.825 2.065 437 HB3 ASN 591 HB3 ASN 591 42.075 -14.015 3.555 438 HD21 ASN 591 HD21 ASN 591 42.663 -17.111 1.766 439 HD22 ASN 591 HD22 ASN 591 44.395 -17.092 2.075 440 H GLY 592 H GLY 592 39.443 -16.692 5.706 441 HA2 GLY 592 HA2 GLY 592 39.481 -17.142 7.946 442 HA3 GLY 592 HA3 GLY 592 41.238 -17.301 7.844 443 H LYS 593 H LYS 593 39.988 -14.211 6.881 444 HA LYS 593 HA LYS 593 40.548 -12.954 9.538 445 HB2 LYS 593 HB2 LYS 593 41.712 -12.240 6.822 446 HB3 LYS 593 HB3 LYS 593 41.765 -11.157 8.212 447 HG2 LYS 593 HG2 LYS 593 43.072 -12.768 9.493 448 HG3 LYS 593 HG3 LYS 593 42.987 -13.958 8.196 449 HD2 LYS 593 HD2 LYS 593 44.295 -11.218 7.950 450 HD3 LYS 593 HD3 LYS 593 45.162 -12.695 8.327 451 HE2 LYS 593 HE2 LYS 593 43.592 -12.207 5.758 452 HE3 LYS 593 HE3 LYS 593 45.335 -12.036 5.933 453 HZ1 LYS 593 HZ1 LYS 593 45.445 -14.418 6.484 454 HZ2 LYS 593 HZ2 LYS 593 44.776 -14.200 5.018 455 HZ3 LYS 593 HZ3 LYS 593 43.826 -14.566 6.257 456 H TYR 594 H TYR 594 39.701 -10.828 9.803 457 HA TYR 594 HA TYR 594 37.195 -10.361 8.279 458 HB2 TYR 594 HB2 TYR 594 38.244 -9.112 10.817 459 HB3 TYR 594 HB3 TYR 594 36.759 -8.631 10.019 460 HD1 TYR 594 HD1 TYR 594 34.946 -10.309 9.562 461 HD2 TYR 594 HD2 TYR 594 38.208 -11.100 12.269 462 HE1 TYR 594 HE1 TYR 594 33.662 -12.185 10.548 463 HE2 TYR 594 HE2 TYR 594 36.911 -12.960 13.290 464 HH TYR 594 HH TYR 594 34.991 -14.203 13.208 465 H PHE 595 H PHE 595 36.694 -8.554 7.300 466 HA PHE 595 HA PHE 595 38.654 -6.387 6.765 467 HB2 PHE 595 HB2 PHE 595 37.486 -8.347 4.752 468 HB3 PHE 595 HB3 PHE 595 38.162 -6.820 4.269 469 HD1 PHE 595 HD1 PHE 595 38.834 -10.277 5.102 470 HD2 PHE 595 HD2 PHE 595 40.658 -6.390 4.739 471 HE1 PHE 595 HE1 PHE 595 41.043 -11.346 4.816 472 HE2 PHE 595 HE2 PHE 595 42.891 -7.481 4.482 473 HZ PHE 595 HZ PHE 595 43.082 -9.947 4.527 474 H HIS 596 H HIS 596 37.611 -4.578 5.570 475 HA HIS 596 HA HIS 596 34.719 -4.271 6.118 476 HB2 HIS 596 HB2 HIS 596 36.815 -2.612 4.756 477 HB3 HIS 596 HB3 HIS 596 35.140 -2.171 4.594 478 HD2 HIS 596 HD2 HIS 596 34.006 -1.903 7.461 479 HE1 HIS 596 HE1 HIS 596 37.604 0.125 8.474 480 HE2 HIS 596 HE2 HIS 596 35.192 -0.297 9.148 481 H SER 597 H SER 597 33.108 -4.507 4.576 482 HA SER 597 HA SER 597 33.518 -6.230 2.321 483 HB2 SER 597 HB2 SER 597 31.162 -5.648 1.792 484 HB3 SER 597 HB3 SER 597 31.396 -6.155 3.468 485 HG SER 597 HG SER 597 30.127 -4.131 2.890 486 H THR 598 H THR 598 33.218 -2.686 2.562 487 HA THR 598 HA THR 598 33.403 -2.141 -0.261 488 HB THR 598 HB THR 598 33.967 0.222 0.644 489 HG1 THR 598 HG1 THR 598 34.670 -0.234 2.675 490 HG21 THR 598 HG21 THR 598 31.672 0.631 1.454 491 HG22 THR 598 HG22 THR 598 31.386 -1.115 1.569 492 HG23 THR 598 HG23 THR 598 31.685 -0.356 -0.015 493 H CYS 599 H CYS 599 35.894 -2.359 2.320 494 HA CYS 599 HA CYS 599 38.101 -1.413 0.740 495 HB2 CYS 599 HB2 CYS 599 37.927 -3.201 3.195 496 HB3 CYS 599 HB3 CYS 599 39.431 -2.668 2.511 497 H TYR 600 H TYR 600 37.149 -4.768 1.634 498 HA TYR 600 HA TYR 600 39.066 -6.165 0.145 499 HB2 TYR 600 HB2 TYR 600 37.804 -7.268 1.811 500 HB3 TYR 600 HB3 TYR 600 36.271 -6.841 1.073 501 HD1 TYR 600 HD1 TYR 600 39.365 -8.906 0.600 502 HD2 TYR 600 HD2 TYR 600 35.279 -8.235 -0.605 503 HE1 TYR 600 HE1 TYR 600 39.415 -11.001 -0.765 504 HE2 TYR 600 HE2 TYR 600 35.319 -10.330 -1.936 505 HH TYR 600 HH TYR 600 36.567 -12.124 -2.616 506 H HIS 601 H HIS 601 35.848 -5.075 -0.969 507 HA HIS 601 HA HIS 601 35.822 -6.403 -3.448 508 HB2 HIS 601 HB2 HIS 601 33.878 -5.401 -2.302 509 HB3 HIS 601 HB3 HIS 601 34.508 -3.781 -2.604 510 HD2 HIS 601 HD2 HIS 601 33.676 -2.634 -4.787 511 HE1 HIS 601 HE1 HIS 601 32.036 -6.020 -6.777 512 HE2 HIS 601 HE2 HIS 601 32.308 -3.498 -6.862 513 H GLU 602 H GLU 602 37.343 -3.289 -2.709 514 HA GLU 602 HA GLU 602 37.935 -2.852 -5.593 515 HB2 GLU 602 HB2 GLU 602 36.807 -1.098 -4.265 516 HB3 GLU 602 HB3 GLU 602 38.160 -1.055 -3.154 517 HG2 GLU 602 HG2 GLU 602 38.152 0.835 -4.712 518 HG3 GLU 602 HG3 GLU 602 39.621 -0.110 -4.820 519 H THR 603 H THR 603 39.580 -3.947 -2.748 520 HA THR 603 HA THR 603 42.127 -2.687 -3.314 521 HB THR 603 HB THR 603 41.319 -4.792 -1.302 522 HG1 THR 603 HG1 THR 603 40.479 -2.795 -0.951 523 HG21 THR 603 HG21 THR 603 43.740 -5.066 -1.548 524 HG22 THR 603 HG22 THR 603 43.391 -4.168 -0.069 525 HG23 THR 603 HG23 THR 603 43.966 -3.302 -1.510 526 H SER 604 H SER 604 40.960 -5.940 -4.181 527 HA SER 604 HA SER 604 43.525 -7.128 -4.421 528 HB2 SER 604 HB2 SER 604 41.442 -8.409 -4.303 529 HB3 SER 604 HB3 SER 604 41.018 -7.880 -5.943 530 HG SER 604 HG SER 604 42.086 -9.934 -5.885 531 H GLN 605 H GLN 605 45.155 -6.853 -5.787 532 HA GLN 605 HA GLN 605 44.781 -5.354 -8.327 533 HB2 GLN 605 HB2 GLN 605 47.343 -6.149 -6.898 534 HB3 GLN 605 HB3 GLN 605 47.178 -5.060 -8.275 535 HG2 GLN 605 HG2 GLN 605 45.797 -3.518 -6.814 536 HG3 GLN 605 HG3 GLN 605 46.135 -4.589 -5.452 537 HE21 GLN 605 HE21 GLN 605 47.185 -2.813 -4.320 538 HE22 GLN 605 HE22 GLN 605 48.796 -2.298 -4.814 539 H ASN 606 H ASN 606 45.573 -8.611 -7.261 540 HA ASN 606 HA ASN 606 46.921 -9.358 -9.750 541 HB2 ASN 606 HB2 ASN 606 47.436 -10.071 -7.284 542 HB3 ASN 606 HB3 ASN 606 46.143 -11.249 -7.507 543 HD21 ASN 606 HD21 ASN 606 48.567 -12.244 -6.902 544 HD22 ASN 606 HD22 ASN 606 49.355 -12.901 -8.333 545 H SER 607 H SER 607 46.281 -11.557 -10.703 546 HA SER 607 HA SER 607 44.919 -12.725 -12.069 547 HB2 SER 607 HB2 SER 607 42.897 -12.474 -9.827 548 HB3 SER 607 HB3 SER 607 42.920 -13.698 -11.106 549 HG SER 607 HG SER 607 43.885 -14.435 -9.165 550 H SER 608 H SER 608 44.939 -9.980 -12.671 551 HA SER 608 HA SER 608 42.334 -8.977 -13.427 552 HB2 SER 608 HB2 SER 608 44.324 -7.563 -13.038 553 HB3 SER 608 HB3 SER 608 45.093 -8.244 -14.477 554 HG SER 608 HG SER 608 43.486 -7.323 -15.739 Start of MODEL 13 1 H1 GLY 533 H1 GLY 533 9.711 13.290 -6.283 2 H2 GLY 533 H2 GLY 533 9.410 14.851 -5.871 3 H3 GLY 533 H3 GLY 533 10.024 13.808 -4.760 4 HA2 GLY 533 HA2 GLY 533 11.412 14.730 -7.195 5 HA3 GLY 533 HA3 GLY 533 11.748 15.294 -5.549 6 H GLY 534 H GLY 534 13.931 14.495 -6.520 7 HA2 GLY 534 HA2 GLY 534 15.726 13.143 -6.002 8 HA3 GLY 534 HA3 GLY 534 14.655 12.022 -5.165 9 H SER 535 H SER 535 13.460 12.452 -8.282 10 HA SER 535 HA SER 535 14.282 9.831 -9.214 11 HB2 SER 535 HB2 SER 535 12.701 12.002 -10.637 12 HB3 SER 535 HB3 SER 535 12.827 10.300 -11.113 13 HG SER 535 HG SER 535 10.930 10.707 -9.923 14 H GLU 536 H GLU 536 16.653 10.755 -8.985 15 HA GLU 536 HA GLU 536 17.664 11.448 -11.687 16 HB2 GLU 536 HB2 GLU 536 19.005 13.267 -10.862 17 HB3 GLU 536 HB3 GLU 536 17.305 13.567 -10.517 18 HG2 GLU 536 HG2 GLU 536 17.702 12.829 -8.142 19 HG3 GLU 536 HG3 GLU 536 19.404 12.592 -8.527 20 H PHE 537 H PHE 537 19.872 11.037 -12.054 21 HA PHE 537 HA PHE 537 20.863 8.660 -10.708 22 HB2 PHE 537 HB2 PHE 537 22.056 10.337 -12.937 23 HB3 PHE 537 HB3 PHE 537 22.663 8.780 -12.396 24 HD1 PHE 537 HD1 PHE 537 21.096 6.727 -12.527 25 HD2 PHE 537 HD2 PHE 537 20.318 10.429 -14.598 26 HE1 PHE 537 HE1 PHE 537 19.526 5.550 -14.047 27 HE2 PHE 537 HE2 PHE 537 18.746 9.246 -16.110 28 HZ PHE 537 HZ PHE 537 18.348 6.807 -15.837 29 H SER 538 H SER 538 22.931 8.367 -9.812 30 HA SER 538 HA SER 538 24.578 10.581 -8.873 31 HB2 SER 538 HB2 SER 538 22.570 10.561 -7.307 32 HB3 SER 538 HB3 SER 538 23.037 8.925 -6.836 33 HG SER 538 HG SER 538 24.344 11.373 -6.365 34 H ASP 539 H ASP 539 26.054 9.425 -6.989 35 HA ASP 539 HA ASP 539 27.539 7.278 -8.290 36 HB2 ASP 539 HB2 ASP 539 27.864 8.541 -5.550 37 HB3 ASP 539 HB3 ASP 539 29.018 7.458 -6.318 38 H ARG 540 H ARG 540 24.711 7.037 -6.733 39 HA ARG 540 HA ARG 540 25.047 4.830 -4.905 40 HB2 ARG 540 HB2 ARG 540 23.242 6.628 -4.919 41 HB3 ARG 540 HB3 ARG 540 22.476 5.729 -6.220 42 HG2 ARG 540 HG2 ARG 540 23.113 3.778 -4.226 43 HG3 ARG 540 HG3 ARG 540 22.616 5.202 -3.317 44 HD2 ARG 540 HD2 ARG 540 20.694 3.859 -3.656 45 HD3 ARG 540 HD3 ARG 540 20.526 5.277 -4.717 46 HE ARG 540 HE ARG 540 21.770 3.355 -6.291 47 HH11 ARG 540 HH11 ARG 540 18.667 3.452 -4.661 48 HH12 ARG 540 HH12 ARG 540 17.947 2.322 -5.787 49 HH21 ARG 540 HH21 ARG 540 20.825 1.951 -7.662 50 HH22 ARG 540 HH22 ARG 540 19.150 1.495 -7.461 51 H SER 541 H SER 541 26.435 3.717 -6.593 52 HA SER 541 HA SER 541 25.118 1.909 -8.482 53 HB2 SER 541 HB2 SER 541 27.448 2.764 -8.695 54 HB3 SER 541 HB3 SER 541 27.904 1.816 -7.270 55 HG SER 541 HG SER 541 28.291 0.791 -9.342 56 H ASN 542 H ASN 542 26.737 -0.432 -7.438 57 HA ASN 542 HA ASN 542 24.784 -1.734 -5.786 58 HB2 ASN 542 HB2 ASN 542 26.233 -3.629 -5.871 59 HB3 ASN 542 HB3 ASN 542 26.258 -2.873 -7.457 60 HD21 ASN 542 HD21 ASN 542 28.219 -4.671 -6.764 61 HD22 ASN 542 HD22 ASN 542 29.737 -3.816 -6.495 62 H GLU 543 H GLU 543 26.411 0.712 -4.647 63 HA GLU 543 HA GLU 543 27.918 0.051 -2.381 64 HB2 GLU 543 HB2 GLU 543 25.927 2.298 -2.865 65 HB3 GLU 543 HB3 GLU 543 27.031 2.276 -1.503 66 HG2 GLU 543 HG2 GLU 543 28.071 2.142 -4.363 67 HG3 GLU 543 HG3 GLU 543 27.588 3.656 -3.623 68 H LEU 544 H LEU 544 24.352 0.263 -2.633 69 HA LEU 544 HA LEU 544 23.755 -0.104 0.134 70 HB2 LEU 544 HB2 LEU 544 22.229 -0.576 -2.454 71 HB3 LEU 544 HB3 LEU 544 21.545 -1.032 -0.903 72 HG LEU 544 HG LEU 544 21.649 1.261 -0.080 73 HD11 LEU 544 HD11 LEU 544 22.700 1.960 -2.853 74 HD12 LEU 544 HD12 LEU 544 23.530 2.221 -1.293 75 HD13 LEU 544 HD13 LEU 544 22.077 3.140 -1.669 76 HD21 LEU 544 HD21 LEU 544 19.886 2.181 -1.524 77 HD22 LEU 544 HD22 LEU 544 19.648 0.441 -1.300 78 HD23 LEU 544 HD23 LEU 544 20.327 1.050 -2.825 79 H GLU 545 H GLU 545 24.533 -2.476 -2.395 80 HA GLU 545 HA GLU 545 23.742 -4.733 -0.686 81 HB2 GLU 545 HB2 GLU 545 23.375 -4.700 -3.180 82 HB3 GLU 545 HB3 GLU 545 25.113 -4.647 -3.414 83 HG2 GLU 545 HG2 GLU 545 24.301 -6.899 -3.775 84 HG3 GLU 545 HG3 GLU 545 25.370 -6.858 -2.391 85 H ILE 546 H ILE 546 26.786 -3.212 -1.731 86 HA ILE 546 HA ILE 546 28.519 -5.086 -0.389 87 HB ILE 546 HB ILE 546 28.933 -2.137 -1.017 88 HG12 ILE 546 HG12 ILE 546 28.516 -3.496 -3.073 89 HG13 ILE 546 HG13 ILE 546 30.100 -2.760 -3.003 90 HG21 ILE 546 HG21 ILE 546 30.917 -4.298 -0.222 91 HG22 ILE 546 HG22 ILE 546 31.370 -2.706 -0.883 92 HG23 ILE 546 HG23 ILE 546 30.532 -2.833 0.674 93 HD11 ILE 546 HD11 ILE 546 30.187 -5.048 -3.916 94 HD12 ILE 546 HD12 ILE 546 31.133 -4.919 -2.429 95 HD13 ILE 546 HD13 ILE 546 29.524 -5.690 -2.399 96 H ARG 547 H ARG 547 26.826 -2.146 0.695 97 HA ARG 547 HA ARG 547 28.132 -2.227 3.357 98 HB2 ARG 547 HB2 ARG 547 26.118 -0.304 2.129 99 HB3 ARG 547 HB3 ARG 547 26.792 -0.148 3.751 100 HG2 ARG 547 HG2 ARG 547 29.077 0.028 2.869 101 HG3 ARG 547 HG3 ARG 547 28.495 -0.225 1.221 102 HD2 ARG 547 HD2 ARG 547 28.871 2.088 1.446 103 HD3 ARG 547 HD3 ARG 547 27.114 1.857 1.427 104 HE ARG 547 HE ARG 547 27.921 1.850 4.137 105 HH11 ARG 547 HH11 ARG 547 27.971 4.192 1.527 106 HH12 ARG 547 HH12 ARG 547 27.909 5.554 2.624 107 HH21 ARG 547 HH21 ARG 547 27.835 3.627 5.483 108 HH22 ARG 547 HH22 ARG 547 27.852 5.230 4.798 109 H GLY 548 H GLY 548 25.137 -3.288 1.987 110 HA2 GLY 548 HA2 GLY 548 23.686 -3.734 4.436 111 HA3 GLY 548 HA3 GLY 548 23.386 -4.471 2.856 112 H LYS 549 H LYS 549 26.463 -5.378 3.182 113 HA LYS 549 HA LYS 549 25.949 -8.040 4.212 114 HB2 LYS 549 HB2 LYS 549 28.603 -6.595 3.771 115 HB3 LYS 549 HB3 LYS 549 28.400 -8.323 4.032 116 HG2 LYS 549 HG2 LYS 549 27.632 -6.698 1.597 117 HG3 LYS 549 HG3 LYS 549 28.812 -8.001 1.735 118 HD2 LYS 549 HD2 LYS 549 26.892 -9.585 2.187 119 HD3 LYS 549 HD3 LYS 549 25.779 -8.245 1.842 120 HE2 LYS 549 HE2 LYS 549 26.893 -7.950 -0.385 121 HE3 LYS 549 HE3 LYS 549 27.890 -9.364 -0.044 122 HZ1 LYS 549 HZ1 LYS 549 24.956 -9.281 -0.428 123 HZ2 LYS 549 HZ2 LYS 549 25.716 -10.617 0.161 124 HZ3 LYS 549 HZ3 LYS 549 26.029 -10.066 -1.341 125 H TYR 550 H TYR 550 26.329 -8.957 6.134 126 HA TYR 550 HA TYR 550 28.051 -7.732 8.103 127 HB2 TYR 550 HB2 TYR 550 26.422 -7.718 9.961 128 HB3 TYR 550 HB3 TYR 550 26.012 -6.548 8.748 129 HD1 TYR 550 HD1 TYR 550 23.942 -6.722 7.477 130 HD2 TYR 550 HD2 TYR 550 25.060 -9.812 10.277 131 HE1 TYR 550 HE1 TYR 550 21.638 -7.646 7.377 132 HE2 TYR 550 HE2 TYR 550 22.760 -10.734 10.174 133 HH TYR 550 HH TYR 550 20.217 -9.286 8.107 134 H VAL 551 H VAL 551 28.364 -9.073 9.993 135 HA VAL 551 HA VAL 551 27.618 -11.939 9.743 136 HB VAL 551 HB VAL 551 30.021 -12.392 10.640 137 HG11 VAL 551 HG11 VAL 551 29.600 -11.678 7.709 138 HG12 VAL 551 HG12 VAL 551 30.816 -12.800 8.350 139 HG13 VAL 551 HG13 VAL 551 29.097 -13.201 8.475 140 HG21 VAL 551 HG21 VAL 551 30.830 -10.081 10.826 141 HG22 VAL 551 HG22 VAL 551 31.795 -11.024 9.689 142 HG23 VAL 551 HG23 VAL 551 30.616 -9.851 9.068 143 H VAL 552 H VAL 552 27.093 -12.917 11.648 144 HA VAL 552 HA VAL 552 26.438 -11.189 13.875 145 HB VAL 552 HB VAL 552 26.280 -14.189 13.472 146 HG11 VAL 552 HG11 VAL 552 24.877 -14.304 15.500 147 HG12 VAL 552 HG12 VAL 552 26.538 -13.860 15.902 148 HG13 VAL 552 HG13 VAL 552 25.270 -12.618 15.873 149 HG21 VAL 552 HG21 VAL 552 24.114 -12.063 13.720 150 HG22 VAL 552 HG22 VAL 552 24.684 -12.755 12.185 151 HG23 VAL 552 HG23 VAL 552 23.867 -13.785 13.372 152 H VAL 553 H VAL 553 27.444 -10.823 15.760 153 HA VAL 553 HA VAL 553 30.183 -11.844 16.141 154 HB VAL 553 HB VAL 553 28.764 -9.881 17.991 155 HG11 VAL 553 HG11 VAL 553 31.673 -10.680 17.423 156 HG12 VAL 553 HG12 VAL 553 31.194 -9.330 18.454 157 HG13 VAL 553 HG13 VAL 553 30.753 -10.976 18.922 158 HG21 VAL 553 HG21 VAL 553 30.371 -9.350 15.489 159 HG22 VAL 553 HG22 VAL 553 28.775 -8.687 15.930 160 HG23 VAL 553 HG23 VAL 553 30.232 -8.163 16.808 161 HA PRO 554 HA PRO 554 28.230 -14.854 18.956 162 HB2 PRO 554 HB2 PRO 554 30.293 -16.548 19.338 163 HB3 PRO 554 HB3 PRO 554 29.447 -16.418 17.765 164 HG2 PRO 554 HG2 PRO 554 32.029 -15.060 18.593 165 HG3 PRO 554 HG3 PRO 554 31.728 -16.028 17.115 166 HD2 PRO 554 HD2 PRO 554 31.546 -13.298 17.129 167 HD3 PRO 554 HD3 PRO 554 30.473 -14.316 16.116 168 H GLU 555 H GLU 555 28.525 -15.498 21.238 169 HA GLU 555 HA GLU 555 29.561 -13.461 22.974 170 HB2 GLU 555 HB2 GLU 555 28.888 -16.381 23.484 171 HB3 GLU 555 HB3 GLU 555 29.210 -15.231 24.756 172 HG2 GLU 555 HG2 GLU 555 26.928 -14.938 22.727 173 HG3 GLU 555 HG3 GLU 555 26.783 -15.754 24.258 174 H THR 556 H THR 556 31.096 -16.322 21.568 175 HA THR 556 HA THR 556 33.422 -16.430 23.265 176 HB THR 556 HB THR 556 34.386 -17.780 21.421 177 HG1 THR 556 HG1 THR 556 33.163 -18.171 19.627 178 HG21 THR 556 HG21 THR 556 32.913 -18.879 23.079 179 HG22 THR 556 HG22 THR 556 32.820 -19.643 21.483 180 HG23 THR 556 HG23 THR 556 31.505 -18.581 22.031 181 H SER 557 H SER 557 32.548 -14.229 20.723 182 HA SER 557 HA SER 557 35.302 -13.255 20.310 183 HB2 SER 557 HB2 SER 557 32.610 -12.449 19.206 184 HB3 SER 557 HB3 SER 557 34.051 -11.430 19.017 185 HG SER 557 HG SER 557 33.879 -14.168 18.281 186 H GLN 558 H GLN 558 33.207 -12.954 22.845 187 HA GLN 558 HA GLN 558 32.980 -11.598 24.618 188 HB2 GLN 558 HB2 GLN 558 35.980 -11.639 24.197 189 HB3 GLN 558 HB3 GLN 558 35.191 -11.115 25.695 190 HG2 GLN 558 HG2 GLN 558 34.065 -13.311 25.872 191 HG3 GLN 558 HG3 GLN 558 34.924 -13.873 24.432 192 HE21 GLN 558 HE21 GLN 558 35.193 -15.304 26.836 193 HE22 GLN 558 HE22 GLN 558 36.807 -15.026 27.479 194 H ASP 559 H ASP 559 35.681 -9.632 23.394 195 HA ASP 559 HA ASP 559 34.396 -7.154 24.214 196 HB2 ASP 559 HB2 ASP 559 36.902 -7.647 22.572 197 HB3 ASP 559 HB3 ASP 559 36.417 -6.103 23.260 198 H MET 560 H MET 560 34.011 -9.023 21.401 199 HA MET 560 HA MET 560 33.049 -8.722 19.410 200 HB2 MET 560 HB2 MET 560 31.667 -6.347 20.721 201 HB3 MET 560 HB3 MET 560 31.153 -7.178 19.256 202 HG2 MET 560 HG2 MET 560 31.139 -9.337 20.709 203 HG3 MET 560 HG3 MET 560 31.161 -8.234 22.084 204 HE1 MET 560 HE1 MET 560 28.928 -10.193 22.105 205 HE2 MET 560 HE2 MET 560 27.450 -9.874 21.177 206 HE3 MET 560 HE3 MET 560 28.905 -10.462 20.346 207 H ALA 561 H ALA 561 35.653 -7.510 19.604 208 HA ALA 561 HA ALA 561 35.378 -5.413 17.507 209 HB1 ALA 561 HB1 ALA 561 36.022 -4.423 19.614 210 HB2 ALA 561 HB2 ALA 561 37.402 -5.540 19.760 211 HB3 ALA 561 HB3 ALA 561 37.364 -4.334 18.460 212 H PHE 562 H PHE 562 36.699 -5.451 15.743 213 HA PHE 562 HA PHE 562 38.889 -7.401 15.477 214 HB2 PHE 562 HB2 PHE 562 36.278 -8.067 14.574 215 HB3 PHE 562 HB3 PHE 562 37.165 -7.622 13.141 216 HD1 PHE 562 HD1 PHE 562 39.211 -8.885 12.460 217 HD2 PHE 562 HD2 PHE 562 36.874 -10.052 15.883 218 HE1 PHE 562 HE1 PHE 562 40.308 -11.118 12.446 219 HE2 PHE 562 HE2 PHE 562 37.972 -12.277 15.871 220 HZ PHE 562 HZ PHE 562 39.681 -12.823 14.145 221 H LYS 563 H LYS 563 40.154 -7.055 13.486 222 HA LYS 563 HA LYS 563 40.280 -4.138 12.911 223 HB2 LYS 563 HB2 LYS 563 42.129 -5.225 14.128 224 HB3 LYS 563 HB3 LYS 563 42.424 -6.271 12.739 225 HG2 LYS 563 HG2 LYS 563 43.042 -4.318 11.361 226 HG3 LYS 563 HG3 LYS 563 42.565 -3.224 12.674 227 HD2 LYS 563 HD2 LYS 563 44.968 -3.401 12.588 228 HD3 LYS 563 HD3 LYS 563 44.375 -4.115 14.092 229 HE2 LYS 563 HE2 LYS 563 44.592 -6.389 13.047 230 HE3 LYS 563 HE3 LYS 563 45.194 -5.642 11.573 231 HZ1 LYS 563 HZ1 LYS 563 46.522 -5.472 14.218 232 HZ2 LYS 563 HZ2 LYS 563 47.093 -4.798 12.842 233 HZ3 LYS 563 HZ3 LYS 563 47.011 -6.414 12.987 234 H CYS 564 H CYS 564 40.511 -3.250 10.980 235 HA CYS 564 HA CYS 564 40.299 -4.848 8.486 236 HB2 CYS 564 HB2 CYS 564 38.760 -2.789 9.003 237 HB3 CYS 564 HB3 CYS 564 40.172 -1.827 8.788 238 HA PRO 565 HA PRO 565 44.807 -3.765 8.568 239 HB2 PRO 565 HB2 PRO 565 45.705 -5.532 6.689 240 HB3 PRO 565 HB3 PRO 565 45.251 -6.028 8.341 241 HG2 PRO 565 HG2 PRO 565 43.523 -6.115 5.854 242 HG3 PRO 565 HG3 PRO 565 43.864 -7.453 7.007 243 HD2 PRO 565 HD2 PRO 565 41.617 -5.962 7.219 244 HD3 PRO 565 HD3 PRO 565 42.508 -6.459 8.686 245 H ILE 566 H ILE 566 42.483 -3.501 5.969 246 HA ILE 566 HA ILE 566 44.254 -2.304 3.999 247 HB ILE 566 HB ILE 566 41.245 -2.381 4.254 248 HG12 ILE 566 HG12 ILE 566 43.084 -3.829 2.275 249 HG13 ILE 566 HG13 ILE 566 42.569 -4.543 3.799 250 HG21 ILE 566 HG21 ILE 566 41.219 -1.627 1.827 251 HG22 ILE 566 HG22 ILE 566 41.784 -0.390 2.935 252 HG23 ILE 566 HG23 ILE 566 42.960 -1.312 1.966 253 HD11 ILE 566 HD11 ILE 566 40.724 -3.765 1.514 254 HD12 ILE 566 HD12 ILE 566 41.186 -5.395 2.023 255 HD13 ILE 566 HD13 ILE 566 40.195 -4.376 3.096 256 H CYS 567 H CYS 567 41.647 -0.840 6.036 257 HA CYS 567 HA CYS 567 42.907 1.808 5.642 258 HB2 CYS 567 HB2 CYS 567 40.870 2.768 6.236 259 HB3 CYS 567 HB3 CYS 567 40.533 1.528 5.030 260 H LYS 568 H LYS 568 43.187 -0.606 7.861 261 HA LYS 568 HA LYS 568 43.948 -0.845 9.935 262 HB2 LYS 568 HB2 LYS 568 45.677 0.816 8.869 263 HB3 LYS 568 HB3 LYS 568 45.019 1.961 10.036 264 HG2 LYS 568 HG2 LYS 568 45.360 0.086 11.791 265 HG3 LYS 568 HG3 LYS 568 46.290 -0.762 10.555 266 HD2 LYS 568 HD2 LYS 568 47.839 1.171 10.361 267 HD3 LYS 568 HD3 LYS 568 46.909 2.041 11.602 268 HE2 LYS 568 HE2 LYS 568 47.396 0.219 13.221 269 HE3 LYS 568 HE3 LYS 568 48.330 -0.629 11.990 270 HZ1 LYS 568 HZ1 LYS 568 49.771 0.679 13.437 271 HZ2 LYS 568 HZ2 LYS 568 48.995 2.060 13.048 272 HZ3 LYS 568 HZ3 LYS 568 49.856 1.265 11.918 273 H GLU 569 H GLU 569 41.303 -0.514 9.913 274 HA GLU 569 HA GLU 569 40.741 1.238 12.302 275 HB2 GLU 569 HB2 GLU 569 39.011 0.646 9.888 276 HB3 GLU 569 HB3 GLU 569 38.352 1.254 11.378 277 HG2 GLU 569 HG2 GLU 569 40.474 2.671 9.722 278 HG3 GLU 569 HG3 GLU 569 38.750 3.035 9.723 279 H THR 570 H THR 570 38.841 0.570 13.594 280 HA THR 570 HA THR 570 38.800 -2.407 13.926 281 HB THR 570 HB THR 570 38.434 -0.257 16.026 282 HG1 THR 570 HG1 THR 570 40.397 -0.989 16.743 283 HG21 THR 570 HG21 THR 570 37.102 -2.229 16.639 284 HG22 THR 570 HG22 THR 570 38.555 -2.136 17.639 285 HG23 THR 570 HG23 THR 570 38.484 -3.295 16.297 286 H VAL 571 H VAL 571 36.945 -3.357 13.386 287 HA VAL 571 HA VAL 571 34.361 -1.901 13.367 288 HB VAL 571 HB VAL 571 33.400 -4.151 12.793 289 HG11 VAL 571 HG11 VAL 571 33.990 -3.938 10.435 290 HG12 VAL 571 HG12 VAL 571 33.667 -2.376 11.183 291 HG13 VAL 571 HG13 VAL 571 35.360 -2.879 10.866 292 HG21 VAL 571 HG21 VAL 571 36.254 -4.894 12.069 293 HG22 VAL 571 HG22 VAL 571 35.340 -5.587 13.440 294 HG23 VAL 571 HG23 VAL 571 34.773 -5.829 11.779 295 H THR 572 H THR 572 32.809 -2.116 14.885 296 HA THR 572 HA THR 572 33.297 -3.957 17.192 297 HB THR 572 HB THR 572 32.102 -2.326 18.604 298 HG1 THR 572 HG1 THR 572 31.091 -1.073 17.033 299 HG21 THR 572 HG21 THR 572 33.985 -0.832 18.932 300 HG22 THR 572 HG22 THR 572 34.630 -1.211 17.318 301 HG23 THR 572 HG23 THR 572 34.571 -2.463 18.582 302 H GLY 573 H GLY 573 31.577 -5.153 17.902 303 HA2 GLY 573 HA2 GLY 573 29.436 -5.719 16.124 304 HA3 GLY 573 HA3 GLY 573 29.545 -6.262 17.802 305 H VAL 574 H VAL 574 27.309 -5.173 16.082 306 HA VAL 574 HA VAL 574 26.256 -3.210 18.041 307 HB VAL 574 HB VAL 574 25.849 -3.239 15.010 308 HG11 VAL 574 HG11 VAL 574 24.619 -1.418 17.117 309 HG12 VAL 574 HG12 VAL 574 24.594 -1.085 15.381 310 HG13 VAL 574 HG13 VAL 574 23.763 -2.509 15.988 311 HG21 VAL 574 HG21 VAL 574 28.004 -2.277 15.624 312 HG22 VAL 574 HG22 VAL 574 26.912 -0.995 15.085 313 HG23 VAL 574 HG23 VAL 574 27.228 -1.221 16.829 314 H TYR 575 H TYR 575 24.243 -3.630 18.917 315 HA TYR 575 HA TYR 575 23.114 -6.245 18.492 316 HB2 TYR 575 HB2 TYR 575 23.172 -5.094 20.640 317 HB3 TYR 575 HB3 TYR 575 22.056 -3.878 20.045 318 HD1 TYR 575 HD1 TYR 575 22.440 -7.575 20.581 319 HD2 TYR 575 HD2 TYR 575 19.710 -4.259 20.262 320 HE1 TYR 575 HE1 TYR 575 20.589 -9.035 21.346 321 HE2 TYR 575 HE2 TYR 575 17.850 -5.710 21.059 322 HH TYR 575 HH TYR 575 18.390 -9.089 22.077 323 H ASP 576 H ASP 576 21.849 -6.849 16.866 324 HA ASP 576 HA ASP 576 20.041 -5.005 15.434 325 HB2 ASP 576 HB2 ASP 576 21.308 -6.735 14.178 326 HB3 ASP 576 HB3 ASP 576 20.553 -7.990 15.146 327 H GLU 577 H GLU 577 18.211 -4.519 16.511 328 HA GLU 577 HA GLU 577 17.071 -6.100 18.628 329 HB2 GLU 577 HB2 GLU 577 15.928 -3.810 16.977 330 HB3 GLU 577 HB3 GLU 577 15.190 -4.465 18.440 331 HG2 GLU 577 HG2 GLU 577 17.163 -3.820 19.773 332 HG3 GLU 577 HG3 GLU 577 17.962 -3.225 18.324 333 H GLU 578 H GLU 578 16.560 -6.237 15.145 334 HA GLU 578 HA GLU 578 13.895 -7.406 15.324 335 HB2 GLU 578 HB2 GLU 578 15.815 -7.237 12.972 336 HB3 GLU 578 HB3 GLU 578 14.109 -7.717 12.916 337 HG2 GLU 578 HG2 GLU 578 13.564 -5.439 13.955 338 HG3 GLU 578 HG3 GLU 578 15.231 -4.981 13.637 339 H SER 579 H SER 579 17.148 -8.776 14.738 340 HA SER 579 HA SER 579 16.048 -11.539 14.899 341 HB2 SER 579 HB2 SER 579 18.285 -12.283 14.401 342 HB3 SER 579 HB3 SER 579 17.772 -11.088 13.202 343 HG SER 579 HG SER 579 19.168 -9.683 13.957 344 H GLY 580 H GLY 580 17.790 -9.208 16.925 345 HA2 GLY 580 HA2 GLY 580 17.983 -9.232 19.240 346 HA3 GLY 580 HA3 GLY 580 17.421 -10.908 19.307 347 H GLU 581 H GLU 581 20.060 -9.631 17.297 348 HA GLU 581 HA GLU 581 22.111 -11.167 18.852 349 HB2 GLU 581 HB2 GLU 581 21.645 -11.307 15.852 350 HB3 GLU 581 HB3 GLU 581 23.038 -11.980 16.668 351 HG2 GLU 581 HG2 GLU 581 20.159 -12.859 17.160 352 HG3 GLU 581 HG3 GLU 581 21.255 -13.621 16.023 353 H TRP 582 H TRP 582 24.267 -10.411 18.626 354 HA TRP 582 HA TRP 582 24.561 -7.616 17.717 355 HB2 TRP 582 HB2 TRP 582 26.528 -9.547 18.967 356 HB3 TRP 582 HB3 TRP 582 26.861 -7.879 18.538 357 HD1 TRP 582 HD1 TRP 582 24.734 -9.920 20.999 358 HE1 TRP 582 HE1 TRP 582 24.137 -8.484 23.032 359 HE3 TRP 582 HE3 TRP 582 26.753 -5.491 19.467 360 HZ2 TRP 582 HZ2 TRP 582 24.452 -5.732 23.874 361 HZ3 TRP 582 HZ3 TRP 582 26.569 -3.461 20.888 362 HH2 TRP 582 HH2 TRP 582 25.421 -3.574 23.080 363 H VAL 583 H VAL 583 25.629 -6.958 15.927 364 HA VAL 583 HA VAL 583 26.822 -8.952 14.061 365 HB VAL 583 HB VAL 583 25.732 -7.778 12.188 366 HG11 VAL 583 HG11 VAL 583 23.522 -8.800 12.429 367 HG12 VAL 583 HG12 VAL 583 24.798 -9.888 12.992 368 HG13 VAL 583 HG13 VAL 583 23.786 -9.009 14.171 369 HG21 VAL 583 HG21 VAL 583 23.863 -6.510 14.210 370 HG22 VAL 583 HG22 VAL 583 25.126 -5.620 13.345 371 HG23 VAL 583 HG23 VAL 583 23.805 -6.379 12.442 372 H TRP 584 H TRP 584 28.389 -8.338 12.709 373 HA TRP 584 HA TRP 584 29.763 -5.718 13.096 374 HB2 TRP 584 HB2 TRP 584 30.561 -8.481 12.218 375 HB3 TRP 584 HB3 TRP 584 31.453 -7.123 11.571 376 HD1 TRP 584 HD1 TRP 584 31.919 -5.381 14.088 377 HE1 TRP 584 HE1 TRP 584 33.450 -6.189 15.999 378 HE3 TRP 584 HE3 TRP 584 31.917 -10.397 13.077 379 HZ2 TRP 584 HZ2 TRP 584 34.627 -8.653 16.878 380 HZ3 TRP 584 HZ3 TRP 584 33.282 -11.955 14.446 381 HH2 TRP 584 HH2 TRP 584 34.614 -11.111 16.359 382 H LYS 585 H LYS 585 28.741 -4.311 11.796 383 HA LYS 585 HA LYS 585 27.542 -5.066 9.233 384 HB2 LYS 585 HB2 LYS 585 27.783 -2.392 10.661 385 HB3 LYS 585 HB3 LYS 585 26.858 -2.689 9.177 386 HG2 LYS 585 HG2 LYS 585 25.509 -4.418 10.429 387 HG3 LYS 585 HG3 LYS 585 26.356 -3.957 11.911 388 HD2 LYS 585 HD2 LYS 585 25.510 -1.631 11.651 389 HD3 LYS 585 HD3 LYS 585 24.673 -2.116 10.161 390 HE2 LYS 585 HE2 LYS 585 23.387 -3.813 11.476 391 HE3 LYS 585 HE3 LYS 585 24.164 -3.240 12.950 392 HZ1 LYS 585 HZ1 LYS 585 23.145 -1.074 12.578 393 HZ2 LYS 585 HZ2 LYS 585 21.980 -2.216 12.611 394 HZ3 LYS 585 HZ3 LYS 585 22.452 -1.574 11.187 395 H ASN 586 H ASN 586 28.061 -4.327 7.192 396 HA ASN 586 HA ASN 586 29.434 -4.123 5.449 397 HB2 ASN 586 HB2 ASN 586 29.247 -1.738 6.071 398 HB3 ASN 586 HB3 ASN 586 30.703 -1.875 7.056 399 HD21 ASN 586 HD21 ASN 586 31.757 -0.243 5.807 400 HD22 ASN 586 HD22 ASN 586 32.327 -0.596 4.179 401 H THR 587 H THR 587 30.126 -6.221 7.183 402 HA THR 587 HA THR 587 33.119 -6.273 7.064 403 HB THR 587 HB THR 587 31.350 -7.584 9.141 404 HG1 THR 587 HG1 THR 587 31.666 -5.279 9.283 405 HG21 THR 587 HG21 THR 587 33.346 -8.948 8.868 406 HG22 THR 587 HG22 THR 587 33.507 -7.982 10.333 407 HG23 THR 587 HG23 THR 587 34.380 -7.500 8.852 408 H ILE 588 H ILE 588 34.163 -8.109 6.496 409 HA ILE 588 HA ILE 588 32.734 -10.476 5.463 410 HB ILE 588 HB ILE 588 32.771 -9.064 3.548 411 HG12 ILE 588 HG12 ILE 588 35.229 -10.838 3.252 412 HG13 ILE 588 HG13 ILE 588 33.567 -11.466 3.263 413 HG21 ILE 588 HG21 ILE 588 34.873 -8.003 2.666 414 HG22 ILE 588 HG22 ILE 588 34.416 -7.379 4.252 415 HG23 ILE 588 HG23 ILE 588 35.713 -8.587 4.117 416 HD11 ILE 588 HD11 ILE 588 33.079 -10.030 1.267 417 HD12 ILE 588 HD12 ILE 588 34.815 -9.629 1.194 418 HD13 ILE 588 HD13 ILE 588 34.295 -11.302 0.992 419 H GLU 589 H GLU 589 33.940 -12.343 5.450 420 HA GLU 589 HA GLU 589 36.770 -12.212 6.365 421 HB2 GLU 589 HB2 GLU 589 35.386 -13.287 8.065 422 HB3 GLU 589 HB3 GLU 589 34.715 -14.398 6.860 423 HG2 GLU 589 HG2 GLU 589 37.002 -15.320 6.463 424 HG3 GLU 589 HG3 GLU 589 37.654 -14.181 7.630 425 H VAL 590 H VAL 590 38.219 -12.953 4.921 426 HA VAL 590 HA VAL 590 37.634 -14.942 2.846 427 HB VAL 590 HB VAL 590 36.731 -12.959 1.756 428 HG11 VAL 590 HG11 VAL 590 37.913 -11.165 2.920 429 HG12 VAL 590 HG12 VAL 590 39.451 -11.641 2.137 430 HG13 VAL 590 HG13 VAL 590 38.092 -11.022 1.176 431 HG21 VAL 590 HG21 VAL 590 39.427 -13.580 0.507 432 HG22 VAL 590 HG22 VAL 590 37.970 -14.608 0.372 433 HG23 VAL 590 HG23 VAL 590 37.973 -12.970 -0.289 434 H ASN 591 H ASN 591 39.214 -16.051 2.195 435 HA ASN 591 HA ASN 591 41.161 -17.153 2.448 436 HB2 ASN 591 HB2 ASN 591 42.303 -14.360 2.165 437 HB3 ASN 591 HB3 ASN 591 43.151 -15.883 1.897 438 HD21 ASN 591 HD21 ASN 591 42.661 -13.653 -0.017 439 HD22 ASN 591 HD22 ASN 591 41.833 -14.427 -1.362 440 H GLY 592 H GLY 592 39.896 -16.608 4.922 441 HA2 GLY 592 HA2 GLY 592 40.313 -17.124 7.129 442 HA3 GLY 592 HA3 GLY 592 42.037 -17.246 6.775 443 H LYS 593 H LYS 593 40.718 -14.195 5.858 444 HA LYS 593 HA LYS 593 41.511 -12.888 8.438 445 HB2 LYS 593 HB2 LYS 593 42.240 -12.068 5.604 446 HB3 LYS 593 HB3 LYS 593 42.533 -11.081 7.042 447 HG2 LYS 593 HG2 LYS 593 44.017 -12.824 7.958 448 HG3 LYS 593 HG3 LYS 593 43.739 -13.839 6.527 449 HD2 LYS 593 HD2 LYS 593 44.687 -12.038 5.087 450 HD3 LYS 593 HD3 LYS 593 45.007 -11.068 6.538 451 HE2 LYS 593 HE2 LYS 593 46.479 -12.868 7.411 452 HE3 LYS 593 HE3 LYS 593 46.129 -13.848 5.994 453 HZ1 LYS 593 HZ1 LYS 593 48.223 -12.686 5.736 454 HZ2 LYS 593 HZ2 LYS 593 47.520 -11.228 5.939 455 HZ3 LYS 593 HZ3 LYS 593 47.177 -12.127 4.619 456 H TYR 594 H TYR 594 40.557 -10.903 8.896 457 HA TYR 594 HA TYR 594 37.839 -10.539 7.738 458 HB2 TYR 594 HB2 TYR 594 39.136 -9.775 10.345 459 HB3 TYR 594 HB3 TYR 594 37.767 -8.866 9.760 460 HD1 TYR 594 HD1 TYR 594 35.634 -9.461 10.345 461 HD2 TYR 594 HD2 TYR 594 38.684 -12.515 10.302 462 HE1 TYR 594 HE1 TYR 594 33.980 -11.127 11.161 463 HE2 TYR 594 HE2 TYR 594 37.036 -14.169 11.121 464 HH TYR 594 HH TYR 594 34.846 -14.554 11.681 465 H PHE 595 H PHE 595 37.096 -8.639 6.977 466 HA PHE 595 HA PHE 595 38.796 -6.248 6.653 467 HB2 PHE 595 HB2 PHE 595 37.668 -7.903 4.344 468 HB3 PHE 595 HB3 PHE 595 38.396 -6.350 4.149 469 HD1 PHE 595 HD1 PHE 595 38.914 -9.932 4.513 470 HD2 PHE 595 HD2 PHE 595 40.920 -6.121 4.517 471 HE1 PHE 595 HE1 PHE 595 41.050 -11.058 3.969 472 HE2 PHE 595 HE2 PHE 595 43.054 -7.250 3.909 473 HZ PHE 595 HZ PHE 595 43.127 -9.718 3.670 474 H HIS 596 H HIS 596 37.552 -4.461 5.608 475 HA HIS 596 HA HIS 596 34.634 -4.475 6.176 476 HB2 HIS 596 HB2 HIS 596 36.582 -2.482 5.020 477 HB3 HIS 596 HB3 HIS 596 34.882 -2.199 4.840 478 HD2 HIS 596 HD2 HIS 596 33.706 -2.328 7.740 479 HE1 HIS 596 HE1 HIS 596 37.009 0.101 8.890 480 HE2 HIS 596 HE2 HIS 596 34.687 -0.707 9.548 481 H SER 597 H SER 597 33.051 -4.595 4.489 482 HA SER 597 HA SER 597 33.849 -6.084 2.158 483 HB2 SER 597 HB2 SER 597 31.621 -6.222 3.371 484 HB3 SER 597 HB3 SER 597 31.178 -4.712 2.551 485 HG SER 597 HG SER 597 31.764 -7.245 1.436 486 H THR 598 H THR 598 32.973 -2.642 2.589 487 HA THR 598 HA THR 598 33.297 -1.840 -0.141 488 HB THR 598 HB THR 598 33.746 0.435 0.870 489 HG1 THR 598 HG1 THR 598 34.513 0.071 2.852 490 HG21 THR 598 HG21 THR 598 31.274 -1.036 1.867 491 HG22 THR 598 HG22 THR 598 31.470 -0.289 0.262 492 HG23 THR 598 HG23 THR 598 31.468 0.721 1.725 493 H CYS 599 H CYS 599 35.714 -1.951 2.546 494 HA CYS 599 HA CYS 599 37.903 -0.903 1.064 495 HB2 CYS 599 HB2 CYS 599 37.746 -2.790 3.439 496 HB3 CYS 599 HB3 CYS 599 39.233 -2.117 2.858 497 H TYR 600 H TYR 600 36.946 -4.308 1.691 498 HA TYR 600 HA TYR 600 38.957 -5.573 0.143 499 HB2 TYR 600 HB2 TYR 600 37.699 -6.875 1.685 500 HB3 TYR 600 HB3 TYR 600 36.169 -6.388 0.983 501 HD1 TYR 600 HD1 TYR 600 39.290 -8.325 0.214 502 HD2 TYR 600 HD2 TYR 600 35.137 -7.654 -0.740 503 HE1 TYR 600 HE1 TYR 600 39.345 -10.242 -1.363 504 HE2 TYR 600 HE2 TYR 600 35.184 -9.599 -2.300 505 HH TYR 600 HH TYR 600 38.159 -11.483 -2.885 506 H HIS 601 H HIS 601 35.663 -4.468 -0.852 507 HA HIS 601 HA HIS 601 35.804 -5.367 -3.537 508 HB2 HIS 601 HB2 HIS 601 33.744 -4.684 -2.370 509 HB3 HIS 601 HB3 HIS 601 34.287 -3.009 -2.364 510 HD2 HIS 601 HD2 HIS 601 33.553 -1.574 -4.416 511 HE1 HIS 601 HE1 HIS 601 32.412 -4.693 -7.086 512 HE2 HIS 601 HE2 HIS 601 32.498 -2.168 -6.747 513 H GLU 602 H GLU 602 36.835 -2.202 -2.176 514 HA GLU 602 HA GLU 602 37.767 -1.122 -4.695 515 HB2 GLU 602 HB2 GLU 602 38.359 -0.475 -1.787 516 HB3 GLU 602 HB3 GLU 602 39.105 0.404 -3.112 517 HG2 GLU 602 HG2 GLU 602 36.111 0.200 -2.614 518 HG3 GLU 602 HG3 GLU 602 37.136 1.563 -2.189 519 H THR 603 H THR 603 39.383 -3.065 -2.190 520 HA THR 603 HA THR 603 42.046 -2.720 -3.308 521 HB THR 603 HB THR 603 40.976 -4.635 -1.210 522 HG1 THR 603 HG1 THR 603 40.902 -2.496 -0.637 523 HG21 THR 603 HG21 THR 603 43.068 -5.574 -2.064 524 HG22 THR 603 HG22 THR 603 43.344 -4.834 -0.484 525 HG23 THR 603 HG23 THR 603 43.856 -3.979 -1.958 526 H SER 604 H SER 604 39.680 -5.398 -3.407 527 HA SER 604 HA SER 604 41.367 -7.037 -5.146 528 HB2 SER 604 HB2 SER 604 39.890 -7.949 -3.306 529 HB3 SER 604 HB3 SER 604 38.497 -7.539 -4.310 530 HG SER 604 HG SER 604 40.595 -9.374 -4.837 531 H GLN 605 H GLN 605 41.301 -4.890 -6.508 532 HA GLN 605 HA GLN 605 39.016 -4.325 -8.108 533 HB2 GLN 605 HB2 GLN 605 40.385 -2.753 -9.253 534 HB3 GLN 605 HB3 GLN 605 40.784 -2.727 -7.554 535 HG2 GLN 605 HG2 GLN 605 42.874 -2.598 -8.488 536 HG3 GLN 605 HG3 GLN 605 42.773 -4.324 -8.168 537 HE21 GLN 605 HE21 GLN 605 41.620 -2.174 -10.903 538 HE22 GLN 605 HE22 GLN 605 42.437 -3.129 -12.134 539 H ASN 606 H ASN 606 38.605 -4.590 -10.289 540 HA ASN 606 HA ASN 606 38.123 -5.821 -12.082 541 HB2 ASN 606 HB2 ASN 606 40.226 -4.835 -12.824 542 HB3 ASN 606 HB3 ASN 606 41.122 -6.222 -12.215 543 HD21 ASN 606 HD21 ASN 606 41.938 -6.705 -14.327 544 HD22 ASN 606 HD22 ASN 606 40.883 -7.387 -15.559 545 H SER 607 H SER 607 40.730 -8.122 -11.374 546 HA SER 607 HA SER 607 38.988 -10.111 -10.193 547 HB2 SER 607 HB2 SER 607 38.379 -10.318 -12.613 548 HB3 SER 607 HB3 SER 607 40.078 -10.643 -12.982 549 HG SER 607 HG SER 607 38.243 -12.217 -11.517 550 H SER 608 H SER 608 40.159 -11.711 -9.148 551 HA SER 608 HA SER 608 42.958 -11.183 -8.599 552 HB2 SER 608 HB2 SER 608 42.710 -13.076 -7.001 553 HB3 SER 608 HB3 SER 608 41.546 -11.771 -6.777 554 HG SER 608 HG SER 608 41.050 -14.193 -8.184 Start of MODEL 14 1 H1 GLY 533 H1 GLY 533 1.970 3.392 8.525 2 H2 GLY 533 H2 GLY 533 0.397 3.104 8.157 3 H3 GLY 533 H3 GLY 533 1.302 4.086 7.198 4 HA2 GLY 533 HA2 GLY 533 1.753 1.197 7.574 5 HA3 GLY 533 HA3 GLY 533 0.997 1.931 6.150 6 H GLY 534 H GLY 534 3.525 0.325 6.480 7 HA2 GLY 534 HA2 GLY 534 5.792 2.064 6.047 8 HA3 GLY 534 HA3 GLY 534 5.739 0.324 5.795 9 H SER 535 H SER 535 6.714 2.808 4.217 10 HA SER 535 HA SER 535 5.277 2.859 1.723 11 HB2 SER 535 HB2 SER 535 8.129 3.728 2.332 12 HB3 SER 535 HB3 SER 535 7.174 4.177 0.911 13 HG SER 535 HG SER 535 7.117 5.785 2.546 14 H GLU 536 H GLU 536 5.758 1.965 -0.278 15 HA GLU 536 HA GLU 536 7.430 -0.463 -0.360 16 HB2 GLU 536 HB2 GLU 536 5.205 -0.445 -1.373 17 HB3 GLU 536 HB3 GLU 536 5.696 0.835 -2.486 18 HG2 GLU 536 HG2 GLU 536 7.340 -0.662 -3.535 19 HG3 GLU 536 HG3 GLU 536 7.074 -1.875 -2.289 20 H PHE 537 H PHE 537 9.474 0.462 0.029 21 HA PHE 537 HA PHE 537 10.675 2.443 -1.720 22 HB2 PHE 537 HB2 PHE 537 11.219 2.116 0.690 23 HB3 PHE 537 HB3 PHE 537 11.922 0.553 0.307 24 HD1 PHE 537 HD1 PHE 537 12.202 4.220 -0.466 25 HD2 PHE 537 HD2 PHE 537 14.234 0.421 -0.285 26 HE1 PHE 537 HE1 PHE 537 14.360 5.350 -0.946 27 HE2 PHE 537 HE2 PHE 537 16.389 1.558 -0.754 28 HZ PHE 537 HZ PHE 537 16.457 4.019 -1.088 29 H SER 538 H SER 538 12.682 2.067 -2.972 30 HA SER 538 HA SER 538 13.100 -0.642 -4.072 31 HB2 SER 538 HB2 SER 538 13.011 0.160 -6.393 32 HB3 SER 538 HB3 SER 538 11.451 0.275 -5.578 33 HG SER 538 HG SER 538 13.265 2.392 -6.120 34 H ASP 539 H ASP 539 15.158 -1.062 -4.765 35 HA ASP 539 HA ASP 539 17.229 0.569 -3.615 36 HB2 ASP 539 HB2 ASP 539 18.730 -1.197 -4.368 37 HB3 ASP 539 HB3 ASP 539 17.334 -1.847 -3.531 38 H ARG 540 H ARG 540 18.962 1.593 -4.530 39 HA ARG 540 HA ARG 540 18.700 2.603 -7.313 40 HB2 ARG 540 HB2 ARG 540 20.681 3.294 -5.102 41 HB3 ARG 540 HB3 ARG 540 20.572 4.101 -6.651 42 HG2 ARG 540 HG2 ARG 540 18.361 4.064 -4.544 43 HG3 ARG 540 HG3 ARG 540 19.507 5.373 -4.791 44 HD2 ARG 540 HD2 ARG 540 17.499 4.413 -6.869 45 HD3 ARG 540 HD3 ARG 540 17.290 5.807 -5.806 46 HE ARG 540 HE ARG 540 19.737 6.232 -7.096 47 HH11 ARG 540 HH11 ARG 540 16.387 6.008 -8.125 48 HH12 ARG 540 HH12 ARG 540 16.665 7.022 -9.525 49 HH21 ARG 540 HH21 ARG 540 20.012 7.501 -8.887 50 HH22 ARG 540 HH22 ARG 540 18.658 7.852 -9.928 51 H SER 541 H SER 541 20.938 0.598 -5.422 52 HA SER 541 HA SER 541 22.186 -0.562 -7.796 53 HB2 SER 541 HB2 SER 541 23.361 1.615 -7.701 54 HB3 SER 541 HB3 SER 541 23.744 1.343 -5.994 55 HG SER 541 HG SER 541 24.776 0.074 -8.278 56 H ASN 542 H ASN 542 23.588 -2.327 -7.297 57 HA ASN 542 HA ASN 542 23.269 -3.678 -4.753 58 HB2 ASN 542 HB2 ASN 542 24.826 -5.304 -5.686 59 HB3 ASN 542 HB3 ASN 542 23.585 -4.902 -6.873 60 HD21 ASN 542 HD21 ASN 542 26.988 -5.031 -6.263 61 HD22 ASN 542 HD22 ASN 542 27.473 -4.288 -7.785 62 H GLU 543 H GLU 543 25.406 -1.102 -5.741 63 HA GLU 543 HA GLU 543 27.543 -1.680 -3.878 64 HB2 GLU 543 HB2 GLU 543 26.678 0.939 -5.153 65 HB3 GLU 543 HB3 GLU 543 28.140 0.692 -4.183 66 HG2 GLU 543 HG2 GLU 543 28.685 -1.242 -5.828 67 HG3 GLU 543 HG3 GLU 543 27.492 -0.513 -6.892 68 H LEU 544 H LEU 544 24.306 -0.472 -3.361 69 HA LEU 544 HA LEU 544 24.821 0.664 -0.714 70 HB2 LEU 544 HB2 LEU 544 22.245 -0.409 -1.938 71 HB3 LEU 544 HB3 LEU 544 22.377 0.540 -0.468 72 HG LEU 544 HG LEU 544 23.014 1.532 -3.279 73 HD11 LEU 544 HD11 LEU 544 21.005 2.948 -2.886 74 HD12 LEU 544 HD12 LEU 544 20.736 2.124 -1.343 75 HD13 LEU 544 HD13 LEU 544 20.621 1.208 -2.859 76 HD21 LEU 544 HD21 LEU 544 24.432 2.694 -1.625 77 HD22 LEU 544 HD22 LEU 544 23.006 3.020 -0.612 78 HD23 LEU 544 HD23 LEU 544 23.164 3.769 -2.219 79 H GLU 545 H GLU 545 23.917 -2.499 -2.019 80 HA GLU 545 HA GLU 545 23.283 -3.772 0.472 81 HB2 GLU 545 HB2 GLU 545 22.372 -4.482 -1.660 82 HB3 GLU 545 HB3 GLU 545 23.969 -4.821 -2.294 83 HG2 GLU 545 HG2 GLU 545 22.796 -6.858 -1.791 84 HG3 GLU 545 HG3 GLU 545 24.251 -6.712 -0.830 85 H ILE 546 H ILE 546 26.355 -3.014 -0.902 86 HA ILE 546 HA ILE 546 28.051 -4.998 0.213 87 HB ILE 546 HB ILE 546 28.557 -2.012 -0.137 88 HG12 ILE 546 HG12 ILE 546 27.897 -3.173 -2.261 89 HG13 ILE 546 HG13 ILE 546 29.487 -2.434 -2.276 90 HG21 ILE 546 HG21 ILE 546 30.961 -2.665 -0.276 91 HG22 ILE 546 HG22 ILE 546 30.240 -2.872 1.327 92 HG23 ILE 546 HG23 ILE 546 30.513 -4.287 0.288 93 HD11 ILE 546 HD11 ILE 546 29.445 -4.608 -3.426 94 HD12 ILE 546 HD12 ILE 546 30.567 -4.615 -2.052 95 HD13 ILE 546 HD13 ILE 546 28.978 -5.420 -1.918 96 H ARG 547 H ARG 547 26.651 -2.083 1.730 97 HA ARG 547 HA ARG 547 27.965 -2.329 4.293 98 HB2 ARG 547 HB2 ARG 547 25.241 -1.091 3.718 99 HB3 ARG 547 HB3 ARG 547 26.303 -0.750 5.079 100 HG2 ARG 547 HG2 ARG 547 26.772 0.015 2.166 101 HG3 ARG 547 HG3 ARG 547 26.322 1.082 3.486 102 HD2 ARG 547 HD2 ARG 547 28.505 0.544 4.619 103 HD3 ARG 547 HD3 ARG 547 28.948 -0.431 3.225 104 HE ARG 547 HE ARG 547 29.100 1.515 1.861 105 HH11 ARG 547 HH11 ARG 547 28.254 2.456 5.142 106 HH12 ARG 547 HH12 ARG 547 28.726 4.116 4.870 107 HH21 ARG 547 HH21 ARG 547 29.673 3.646 1.596 108 HH22 ARG 547 HH22 ARG 547 29.483 4.766 2.920 109 H GLY 548 H GLY 548 24.999 -3.631 2.960 110 HA2 GLY 548 HA2 GLY 548 23.786 -4.648 5.346 111 HA3 GLY 548 HA3 GLY 548 23.403 -5.089 3.682 112 H LYS 549 H LYS 549 26.466 -5.886 3.480 113 HA LYS 549 HA LYS 549 26.217 -8.650 4.457 114 HB2 LYS 549 HB2 LYS 549 28.682 -7.289 3.407 115 HB3 LYS 549 HB3 LYS 549 28.393 -9.017 3.549 116 HG2 LYS 549 HG2 LYS 549 27.169 -7.104 1.537 117 HG3 LYS 549 HG3 LYS 549 28.193 -8.505 1.231 118 HD2 LYS 549 HD2 LYS 549 26.353 -10.004 2.061 119 HD3 LYS 549 HD3 LYS 549 25.317 -8.568 2.244 120 HE2 LYS 549 HE2 LYS 549 25.757 -8.062 -0.196 121 HE3 LYS 549 HE3 LYS 549 26.544 -9.636 -0.323 122 HZ1 LYS 549 HZ1 LYS 549 24.224 -9.798 -0.975 123 HZ2 LYS 549 HZ2 LYS 549 23.720 -9.135 0.420 124 HZ3 LYS 549 HZ3 LYS 549 24.402 -10.620 0.428 125 H TYR 550 H TYR 550 25.974 -8.583 6.506 126 HA TYR 550 HA TYR 550 28.193 -7.636 8.244 127 HB2 TYR 550 HB2 TYR 550 26.647 -7.760 10.149 128 HB3 TYR 550 HB3 TYR 550 26.131 -6.604 8.959 129 HD1 TYR 550 HD1 TYR 550 23.990 -6.736 7.922 130 HD2 TYR 550 HD2 TYR 550 25.415 -9.995 10.364 131 HE1 TYR 550 HE1 TYR 550 21.697 -7.695 7.974 132 HE2 TYR 550 HE2 TYR 550 23.118 -10.966 10.396 133 HH TYR 550 HH TYR 550 20.368 -9.389 8.756 134 H VAL 551 H VAL 551 28.741 -8.972 10.022 135 HA VAL 551 HA VAL 551 28.180 -11.888 9.793 136 HB VAL 551 HB VAL 551 30.561 -12.250 10.623 137 HG11 VAL 551 HG11 VAL 551 29.771 -12.809 8.330 138 HG12 VAL 551 HG12 VAL 551 30.247 -11.177 7.795 139 HG13 VAL 551 HG13 VAL 551 31.472 -12.330 8.367 140 HG21 VAL 551 HG21 VAL 551 31.042 -9.464 9.514 141 HG22 VAL 551 HG22 VAL 551 31.234 -10.003 11.206 142 HG23 VAL 551 HG23 VAL 551 32.281 -10.661 9.946 143 H VAL 552 H VAL 552 27.894 -12.961 11.730 144 HA VAL 552 HA VAL 552 26.946 -11.304 13.896 145 HB VAL 552 HB VAL 552 27.345 -14.314 13.738 146 HG11 VAL 552 HG11 VAL 552 27.270 -13.680 16.111 147 HG12 VAL 552 HG12 VAL 552 25.825 -12.672 15.817 148 HG13 VAL 552 HG13 VAL 552 25.751 -14.432 15.642 149 HG21 VAL 552 HG21 VAL 552 25.670 -13.393 12.134 150 HG22 VAL 552 HG22 VAL 552 24.898 -14.350 13.401 151 HG23 VAL 552 HG23 VAL 552 24.847 -12.573 13.471 152 H VAL 553 H VAL 553 27.822 -10.753 15.836 153 HA VAL 553 HA VAL 553 30.702 -10.928 16.239 154 HB VAL 553 HB VAL 553 28.482 -9.931 18.065 155 HG11 VAL 553 HG11 VAL 553 30.383 -10.632 19.440 156 HG12 VAL 553 HG12 VAL 553 31.516 -9.782 18.353 157 HG13 VAL 553 HG13 VAL 553 30.344 -8.877 19.335 158 HG21 VAL 553 HG21 VAL 553 29.304 -7.712 17.564 159 HG22 VAL 553 HG22 VAL 553 30.612 -8.367 16.556 160 HG23 VAL 553 HG23 VAL 553 28.922 -8.515 16.025 161 HA PRO 554 HA PRO 554 30.092 -14.990 18.138 162 HB2 PRO 554 HB2 PRO 554 32.657 -15.755 18.529 163 HB3 PRO 554 HB3 PRO 554 31.967 -15.598 16.897 164 HG2 PRO 554 HG2 PRO 554 33.629 -13.553 18.405 165 HG3 PRO 554 HG3 PRO 554 33.868 -14.144 16.739 166 HD2 PRO 554 HD2 PRO 554 32.508 -11.827 17.317 167 HD3 PRO 554 HD3 PRO 554 32.054 -12.873 15.927 168 H GLU 555 H GLU 555 30.171 -15.963 20.211 169 HA GLU 555 HA GLU 555 30.347 -14.234 22.485 170 HB2 GLU 555 HB2 GLU 555 29.961 -16.209 23.811 171 HB3 GLU 555 HB3 GLU 555 28.896 -16.199 22.411 172 HG2 GLU 555 HG2 GLU 555 30.295 -17.875 21.291 173 HG3 GLU 555 HG3 GLU 555 31.487 -17.798 22.583 174 H THR 556 H THR 556 32.836 -15.896 20.771 175 HA THR 556 HA THR 556 34.798 -16.038 22.917 176 HB THR 556 HB THR 556 36.420 -16.407 21.101 177 HG1 THR 556 HG1 THR 556 35.689 -16.466 18.995 178 HG21 THR 556 HG21 THR 556 35.054 -18.314 21.932 179 HG22 THR 556 HG22 THR 556 35.517 -18.505 20.236 180 HG23 THR 556 HG23 THR 556 33.860 -18.014 20.651 181 H SER 557 H SER 557 33.673 -13.423 20.837 182 HA SER 557 HA SER 557 36.051 -11.743 21.309 183 HB2 SER 557 HB2 SER 557 34.723 -11.473 19.235 184 HB3 SER 557 HB3 SER 557 33.337 -10.958 20.206 185 HG SER 557 HG SER 557 35.833 -9.682 19.846 186 H GLN 558 H GLN 558 36.413 -11.069 23.341 187 HA GLN 558 HA GLN 558 34.385 -10.779 25.361 188 HB2 GLN 558 HB2 GLN 558 37.248 -9.723 25.370 189 HB3 GLN 558 HB3 GLN 558 36.193 -9.940 26.751 190 HG2 GLN 558 HG2 GLN 558 37.479 -11.808 26.943 191 HG3 GLN 558 HG3 GLN 558 36.116 -12.468 26.041 192 HE21 GLN 558 HE21 GLN 558 38.312 -13.987 25.948 193 HE22 GLN 558 HE22 GLN 558 39.131 -13.810 24.397 194 H ASP 559 H ASP 559 35.881 -8.510 23.141 195 HA ASP 559 HA ASP 559 34.586 -6.156 24.455 196 HB2 ASP 559 HB2 ASP 559 36.865 -6.313 22.467 197 HB3 ASP 559 HB3 ASP 559 36.268 -4.846 23.222 198 H MET 560 H MET 560 33.880 -8.200 21.894 199 HA MET 560 HA MET 560 32.773 -8.100 19.958 200 HB2 MET 560 HB2 MET 560 31.450 -5.589 21.029 201 HB3 MET 560 HB3 MET 560 30.884 -6.616 19.714 202 HG2 MET 560 HG2 MET 560 30.886 -8.536 21.428 203 HG3 MET 560 HG3 MET 560 31.042 -7.290 22.664 204 HE1 MET 560 HE1 MET 560 27.269 -9.006 21.973 205 HE2 MET 560 HE2 MET 560 28.622 -9.564 20.982 206 HE3 MET 560 HE3 MET 560 28.823 -9.394 22.748 207 H ALA 561 H ALA 561 35.357 -7.131 19.838 208 HA ALA 561 HA ALA 561 35.194 -5.074 17.699 209 HB1 ALA 561 HB1 ALA 561 35.747 -3.932 19.777 210 HB2 ALA 561 HB2 ALA 561 37.100 -5.056 20.078 211 HB3 ALA 561 HB3 ALA 561 37.148 -3.944 18.696 212 H PHE 562 H PHE 562 36.577 -5.191 16.042 213 HA PHE 562 HA PHE 562 38.928 -6.908 16.027 214 HB2 PHE 562 HB2 PHE 562 36.910 -8.398 15.378 215 HB3 PHE 562 HB3 PHE 562 36.815 -7.428 13.914 216 HD1 PHE 562 HD1 PHE 562 38.886 -9.808 15.860 217 HD2 PHE 562 HD2 PHE 562 38.477 -7.706 12.123 218 HE1 PHE 562 HE1 PHE 562 40.699 -11.199 14.882 219 HE2 PHE 562 HE2 PHE 562 40.341 -9.051 11.176 220 HZ PHE 562 HZ PHE 562 41.431 -10.809 12.537 221 H LYS 563 H LYS 563 40.177 -6.526 13.943 222 HA LYS 563 HA LYS 563 39.748 -3.696 13.046 223 HB2 LYS 563 HB2 LYS 563 41.476 -3.930 14.757 224 HB3 LYS 563 HB3 LYS 563 42.355 -5.079 13.748 225 HG2 LYS 563 HG2 LYS 563 42.784 -3.394 12.061 226 HG3 LYS 563 HG3 LYS 563 41.738 -2.221 12.868 227 HD2 LYS 563 HD2 LYS 563 44.293 -3.357 14.085 228 HD3 LYS 563 HD3 LYS 563 44.191 -1.839 13.180 229 HE2 LYS 563 HE2 LYS 563 42.527 -0.979 14.824 230 HE3 LYS 563 HE3 LYS 563 42.657 -2.477 15.732 231 HZ1 LYS 563 HZ1 LYS 563 45.028 -1.965 16.078 232 HZ2 LYS 563 HZ2 LYS 563 44.090 -0.781 16.685 233 HZ3 LYS 563 HZ3 LYS 563 44.874 -0.554 15.270 234 H CYS 564 H CYS 564 39.851 -3.149 11.055 235 HA CYS 564 HA CYS 564 40.173 -4.981 8.847 236 HB2 CYS 564 HB2 CYS 564 38.703 -2.849 9.027 237 HB3 CYS 564 HB3 CYS 564 40.157 -1.928 8.901 238 HA PRO 565 HA PRO 565 44.719 -4.084 8.857 239 HB2 PRO 565 HB2 PRO 565 45.521 -5.909 6.999 240 HB3 PRO 565 HB3 PRO 565 45.066 -6.365 8.665 241 HG2 PRO 565 HG2 PRO 565 43.321 -6.417 6.188 242 HG3 PRO 565 HG3 PRO 565 43.592 -7.746 7.370 243 HD2 PRO 565 HD2 PRO 565 41.424 -6.111 7.532 244 HD3 PRO 565 HD3 PRO 565 42.263 -6.686 9.003 245 H ILE 566 H ILE 566 42.394 -3.822 6.239 246 HA ILE 566 HA ILE 566 44.212 -2.841 4.205 247 HB ILE 566 HB ILE 566 41.197 -2.578 4.419 248 HG12 ILE 566 HG12 ILE 566 42.898 -4.608 2.878 249 HG13 ILE 566 HG13 ILE 566 42.006 -4.953 4.349 250 HG21 ILE 566 HG21 ILE 566 41.294 -2.107 1.960 251 HG22 ILE 566 HG22 ILE 566 42.152 -0.888 2.872 252 HG23 ILE 566 HG23 ILE 566 43.066 -2.162 2.041 253 HD11 ILE 566 HD11 ILE 566 40.761 -4.211 1.667 254 HD12 ILE 566 HD12 ILE 566 40.782 -5.790 2.451 255 HD13 ILE 566 HD13 ILE 566 39.860 -4.467 3.183 256 H CYS 567 H CYS 567 41.719 -1.137 6.212 257 HA CYS 567 HA CYS 567 43.149 1.414 5.714 258 HB2 CYS 567 HB2 CYS 567 41.140 2.519 6.223 259 HB3 CYS 567 HB3 CYS 567 40.751 1.253 5.064 260 H LYS 568 H LYS 568 43.245 -0.919 8.018 261 HA LYS 568 HA LYS 568 44.013 -1.118 10.104 262 HB2 LYS 568 HB2 LYS 568 45.700 0.601 8.964 263 HB3 LYS 568 HB3 LYS 568 45.103 1.661 10.241 264 HG2 LYS 568 HG2 LYS 568 45.579 -0.236 11.866 265 HG3 LYS 568 HG3 LYS 568 46.363 -1.097 10.534 266 HD2 LYS 568 HD2 LYS 568 47.964 0.772 10.225 267 HD3 LYS 568 HD3 LYS 568 47.208 1.647 11.566 268 HE2 LYS 568 HE2 LYS 568 47.806 -0.172 13.120 269 HE3 LYS 568 HE3 LYS 568 48.510 -1.105 11.800 270 HZ1 LYS 568 HZ1 LYS 568 50.220 0.117 13.023 271 HZ2 LYS 568 HZ2 LYS 568 49.484 1.541 12.721 272 HZ3 LYS 568 HZ3 LYS 568 50.139 0.682 11.499 273 H GLU 569 H GLU 569 41.271 -0.637 10.027 274 HA GLU 569 HA GLU 569 40.851 1.186 12.387 275 HB2 GLU 569 HB2 GLU 569 39.115 0.828 9.941 276 HB3 GLU 569 HB3 GLU 569 38.579 1.605 11.411 277 HG2 GLU 569 HG2 GLU 569 40.842 2.556 9.631 278 HG3 GLU 569 HG3 GLU 569 39.239 3.255 9.725 279 H THR 570 H THR 570 39.627 0.579 14.018 280 HA THR 570 HA THR 570 38.825 -2.220 14.240 281 HB THR 570 HB THR 570 38.622 0.070 16.217 282 HG1 THR 570 HG1 THR 570 40.492 -0.824 17.021 283 HG21 THR 570 HG21 THR 570 38.564 -1.755 17.920 284 HG22 THR 570 HG22 THR 570 38.435 -2.950 16.603 285 HG23 THR 570 HG23 THR 570 37.136 -1.769 16.888 286 H VAL 571 H VAL 571 36.894 -3.018 13.808 287 HA VAL 571 HA VAL 571 34.454 -1.377 13.548 288 HB VAL 571 HB VAL 571 34.335 -4.386 13.657 289 HG11 VAL 571 HG11 VAL 571 32.536 -4.053 12.038 290 HG12 VAL 571 HG12 VAL 571 32.278 -3.001 13.435 291 HG13 VAL 571 HG13 VAL 571 32.919 -2.319 11.926 292 HG21 VAL 571 HG21 VAL 571 35.287 -2.946 11.181 293 HG22 VAL 571 HG22 VAL 571 36.183 -4.165 12.127 294 HG23 VAL 571 HG23 VAL 571 34.700 -4.629 11.289 295 H THR 572 H THR 572 32.825 -1.327 15.125 296 HA THR 572 HA THR 572 33.145 -3.008 17.589 297 HB THR 572 HB THR 572 31.801 -1.315 18.769 298 HG1 THR 572 HG1 THR 572 30.872 -0.242 17.004 299 HG21 THR 572 HG21 THR 572 34.374 -0.214 17.577 300 HG22 THR 572 HG22 THR 572 34.262 -1.330 18.956 301 HG23 THR 572 HG23 THR 572 33.595 0.300 19.094 302 H GLY 573 H GLY 573 31.489 -4.291 18.167 303 HA2 GLY 573 HA2 GLY 573 29.557 -5.129 16.283 304 HA3 GLY 573 HA3 GLY 573 29.612 -5.580 17.973 305 H VAL 574 H VAL 574 27.334 -4.991 16.204 306 HA VAL 574 HA VAL 574 25.891 -2.995 17.875 307 HB VAL 574 HB VAL 574 25.819 -3.272 14.823 308 HG11 VAL 574 HG11 VAL 574 24.274 -1.363 16.632 309 HG12 VAL 574 HG12 VAL 574 24.350 -1.278 14.860 310 HG13 VAL 574 HG13 VAL 574 23.583 -2.662 15.623 311 HG21 VAL 574 HG21 VAL 574 26.648 -0.919 14.799 312 HG22 VAL 574 HG22 VAL 574 26.830 -0.992 16.565 313 HG23 VAL 574 HG23 VAL 574 27.815 -2.031 15.492 314 H TYR 575 H TYR 575 23.820 -3.597 18.534 315 HA TYR 575 HA TYR 575 23.009 -6.335 18.084 316 HB2 TYR 575 HB2 TYR 575 22.569 -5.080 20.163 317 HB3 TYR 575 HB3 TYR 575 21.466 -4.026 19.284 318 HD1 TYR 575 HD1 TYR 575 19.194 -4.732 18.833 319 HD2 TYR 575 HD2 TYR 575 22.084 -7.555 20.326 320 HE1 TYR 575 HE1 TYR 575 17.380 -6.389 19.206 321 HE2 TYR 575 HE2 TYR 575 20.258 -9.204 20.737 322 HH TYR 575 HH TYR 575 16.821 -8.428 20.128 323 H ASP 576 H ASP 576 21.480 -7.252 16.787 324 HA ASP 576 HA ASP 576 19.794 -5.477 15.098 325 HB2 ASP 576 HB2 ASP 576 21.795 -6.863 14.020 326 HB3 ASP 576 HB3 ASP 576 20.630 -8.182 14.084 327 H GLU 577 H GLU 577 17.658 -5.838 15.195 328 HA GLU 577 HA GLU 577 16.534 -7.835 16.975 329 HB2 GLU 577 HB2 GLU 577 15.326 -5.858 14.998 330 HB3 GLU 577 HB3 GLU 577 14.369 -6.897 16.072 331 HG2 GLU 577 HG2 GLU 577 15.487 -5.873 18.039 332 HG3 GLU 577 HG3 GLU 577 16.365 -4.786 16.970 333 H GLU 578 H GLU 578 17.169 -7.807 13.493 334 HA GLU 578 HA GLU 578 15.305 -9.973 12.858 335 HB2 GLU 578 HB2 GLU 578 16.061 -8.273 11.193 336 HB3 GLU 578 HB3 GLU 578 17.706 -8.864 11.352 337 HG2 GLU 578 HG2 GLU 578 16.945 -9.762 9.375 338 HG3 GLU 578 HG3 GLU 578 16.909 -11.119 10.470 339 H SER 579 H SER 579 18.847 -9.803 13.479 340 HA SER 579 HA SER 579 19.225 -12.694 13.458 341 HB2 SER 579 HB2 SER 579 20.938 -10.501 14.714 342 HB3 SER 579 HB3 SER 579 21.447 -12.148 14.397 343 HG SER 579 HG SER 579 21.211 -11.754 12.185 344 H GLY 580 H GLY 580 18.467 -10.247 15.891 345 HA2 GLY 580 HA2 GLY 580 17.755 -10.419 18.097 346 HA3 GLY 580 HA3 GLY 580 17.750 -12.181 17.986 347 H GLU 581 H GLU 581 20.522 -10.206 17.045 348 HA GLU 581 HA GLU 581 22.159 -10.800 19.383 349 HB2 GLU 581 HB2 GLU 581 22.322 -12.427 16.828 350 HB3 GLU 581 HB3 GLU 581 23.817 -12.029 17.629 351 HG2 GLU 581 HG2 GLU 581 21.531 -13.607 18.833 352 HG3 GLU 581 HG3 GLU 581 23.076 -14.212 18.279 353 H TRP 582 H TRP 582 24.447 -10.195 19.005 354 HA TRP 582 HA TRP 582 24.635 -7.558 17.739 355 HB2 TRP 582 HB2 TRP 582 26.637 -9.180 19.322 356 HB3 TRP 582 HB3 TRP 582 26.869 -7.529 18.752 357 HD1 TRP 582 HD1 TRP 582 24.642 -9.514 21.206 358 HE1 TRP 582 HE1 TRP 582 23.722 -7.948 22.995 359 HE3 TRP 582 HE3 TRP 582 26.514 -5.101 19.439 360 HZ2 TRP 582 HZ2 TRP 582 23.753 -5.115 23.580 361 HZ3 TRP 582 HZ3 TRP 582 26.014 -2.969 20.607 362 HH2 TRP 582 HH2 TRP 582 24.641 -2.956 22.656 363 H VAL 583 H VAL 583 25.844 -6.970 16.041 364 HA VAL 583 HA VAL 583 27.167 -8.997 14.312 365 HB VAL 583 HB VAL 583 26.064 -8.045 12.345 366 HG11 VAL 583 HG11 VAL 583 24.078 -9.172 14.364 367 HG12 VAL 583 HG12 VAL 583 23.875 -9.138 12.613 368 HG13 VAL 583 HG13 VAL 583 25.171 -10.119 13.318 369 HG21 VAL 583 HG21 VAL 583 24.086 -6.688 14.182 370 HG22 VAL 583 HG22 VAL 583 25.350 -5.833 13.264 371 HG23 VAL 583 HG23 VAL 583 24.079 -6.722 12.406 372 H TRP 584 H TRP 584 28.645 -8.281 12.890 373 HA TRP 584 HA TRP 584 29.849 -5.572 13.207 374 HB2 TRP 584 HB2 TRP 584 30.823 -8.317 12.416 375 HB3 TRP 584 HB3 TRP 584 31.670 -6.930 11.801 376 HD1 TRP 584 HD1 TRP 584 31.810 -5.126 14.365 377 HE1 TRP 584 HE1 TRP 584 33.160 -5.818 16.448 378 HE3 TRP 584 HE3 TRP 584 32.337 -10.107 13.347 379 HZ2 TRP 584 HZ2 TRP 584 34.456 -8.210 17.436 380 HZ3 TRP 584 HZ3 TRP 584 33.752 -11.536 14.800 381 HH2 TRP 584 HH2 TRP 584 34.774 -10.598 16.866 382 H LYS 585 H LYS 585 28.626 -4.339 11.898 383 HA LYS 585 HA LYS 585 27.641 -5.219 9.290 384 HB2 LYS 585 HB2 LYS 585 27.569 -2.503 10.669 385 HB3 LYS 585 HB3 LYS 585 26.805 -2.871 9.116 386 HG2 LYS 585 HG2 LYS 585 25.516 -4.707 10.223 387 HG3 LYS 585 HG3 LYS 585 26.175 -4.188 11.790 388 HD2 LYS 585 HD2 LYS 585 25.159 -1.973 11.494 389 HD3 LYS 585 HD3 LYS 585 24.498 -2.452 9.925 390 HE2 LYS 585 HE2 LYS 585 23.849 -3.857 12.558 391 HE3 LYS 585 HE3 LYS 585 22.874 -2.564 11.896 392 HZ1 LYS 585 HZ1 LYS 585 23.383 -5.133 10.488 393 HZ2 LYS 585 HZ2 LYS 585 22.407 -3.931 9.954 394 HZ3 LYS 585 HZ3 LYS 585 22.018 -4.776 11.276 395 H ASN 586 H ASN 586 28.103 -4.208 7.267 396 HA ASN 586 HA ASN 586 29.597 -4.022 5.572 397 HB2 ASN 586 HB2 ASN 586 29.264 -1.668 6.349 398 HB3 ASN 586 HB3 ASN 586 30.700 -1.827 7.360 399 HD21 ASN 586 HD21 ASN 586 31.715 -0.043 6.215 400 HD22 ASN 586 HD22 ASN 586 32.340 -0.332 4.591 401 H THR 587 H THR 587 30.299 -6.188 7.142 402 HA THR 587 HA THR 587 33.289 -6.214 7.054 403 HB THR 587 HB THR 587 31.613 -7.341 9.319 404 HG1 THR 587 HG1 THR 587 31.991 -5.095 9.397 405 HG21 THR 587 HG21 THR 587 33.570 -8.792 8.841 406 HG22 THR 587 HG22 THR 587 33.811 -7.883 10.341 407 HG23 THR 587 HG23 THR 587 34.627 -7.368 8.853 408 H ILE 588 H ILE 588 34.216 -7.984 6.276 409 HA ILE 588 HA ILE 588 32.534 -10.199 5.227 410 HB ILE 588 HB ILE 588 32.692 -8.547 3.530 411 HG12 ILE 588 HG12 ILE 588 34.850 -10.560 2.810 412 HG13 ILE 588 HG13 ILE 588 33.150 -11.038 2.965 413 HG21 ILE 588 HG21 ILE 588 35.711 -8.635 3.879 414 HG22 ILE 588 HG22 ILE 588 34.876 -7.699 2.624 415 HG23 ILE 588 HG23 ILE 588 34.651 -7.261 4.308 416 HD11 ILE 588 HD11 ILE 588 32.503 -9.524 1.168 417 HD12 ILE 588 HD12 ILE 588 34.175 -8.942 0.989 418 HD13 ILE 588 HD13 ILE 588 33.795 -10.624 0.621 419 H GLU 589 H GLU 589 33.400 -12.166 5.122 420 HA GLU 589 HA GLU 589 36.164 -12.613 6.139 421 HB2 GLU 589 HB2 GLU 589 34.225 -13.836 7.221 422 HB3 GLU 589 HB3 GLU 589 33.971 -14.657 5.681 423 HG2 GLU 589 HG2 GLU 589 36.394 -15.447 5.817 424 HG3 GLU 589 HG3 GLU 589 36.459 -14.760 7.430 425 H VAL 590 H VAL 590 37.725 -13.205 4.755 426 HA VAL 590 HA VAL 590 37.156 -14.826 2.355 427 HB VAL 590 HB VAL 590 37.006 -12.593 1.470 428 HG11 VAL 590 HG11 VAL 590 38.398 -11.332 3.071 429 HG12 VAL 590 HG12 VAL 590 39.861 -12.107 2.416 430 HG13 VAL 590 HG13 VAL 590 38.881 -11.032 1.400 431 HG21 VAL 590 HG21 VAL 590 38.023 -14.389 0.094 432 HG22 VAL 590 HG22 VAL 590 38.622 -12.777 -0.323 433 HG23 VAL 590 HG23 VAL 590 39.639 -13.867 0.633 434 H ASN 591 H ASN 591 38.408 -16.394 2.123 435 HA ASN 591 HA ASN 591 40.034 -17.918 2.535 436 HB2 ASN 591 HB2 ASN 591 41.745 -15.447 2.125 437 HB3 ASN 591 HB3 ASN 591 42.267 -17.123 1.943 438 HD21 ASN 591 HD21 ASN 591 42.510 -15.213 -0.135 439 HD22 ASN 591 HD22 ASN 591 41.433 -15.728 -1.428 440 H GLY 592 H GLY 592 38.905 -17.098 4.958 441 HA2 GLY 592 HA2 GLY 592 39.235 -17.650 7.179 442 HA3 GLY 592 HA3 GLY 592 40.929 -18.005 6.844 443 H LYS 593 H LYS 593 40.133 -14.857 5.794 444 HA LYS 593 HA LYS 593 40.982 -13.548 8.345 445 HB2 LYS 593 HB2 LYS 593 41.845 -12.940 5.484 446 HB3 LYS 593 HB3 LYS 593 42.173 -11.888 6.864 447 HG2 LYS 593 HG2 LYS 593 43.427 -13.718 7.983 448 HG3 LYS 593 HG3 LYS 593 43.161 -14.766 6.588 449 HD2 LYS 593 HD2 LYS 593 44.656 -12.109 6.515 450 HD3 LYS 593 HD3 LYS 593 45.404 -13.707 6.643 451 HE2 LYS 593 HE2 LYS 593 44.372 -14.363 4.478 452 HE3 LYS 593 HE3 LYS 593 43.700 -12.739 4.314 453 HZ1 LYS 593 HZ1 LYS 593 45.998 -11.881 4.340 454 HZ2 LYS 593 HZ2 LYS 593 45.785 -12.925 3.104 455 HZ3 LYS 593 HZ3 LYS 593 46.593 -13.397 4.433 456 H TYR 594 H TYR 594 40.326 -11.281 8.516 457 HA TYR 594 HA TYR 594 37.685 -10.780 7.212 458 HB2 TYR 594 HB2 TYR 594 38.632 -10.153 10.010 459 HB3 TYR 594 HB3 TYR 594 37.232 -9.389 9.283 460 HD1 TYR 594 HD1 TYR 594 35.243 -10.691 8.623 461 HD2 TYR 594 HD2 TYR 594 38.519 -12.498 10.763 462 HE1 TYR 594 HE1 TYR 594 33.779 -12.609 9.243 463 HE2 TYR 594 HE2 TYR 594 37.059 -14.418 11.373 464 HH TYR 594 HH TYR 594 34.985 -15.352 11.196 465 H PHE 595 H PHE 595 37.130 -8.901 6.482 466 HA PHE 595 HA PHE 595 38.919 -6.525 6.439 467 HB2 PHE 595 HB2 PHE 595 37.653 -7.956 4.063 468 HB3 PHE 595 HB3 PHE 595 38.314 -6.362 3.948 469 HD1 PHE 595 HD1 PHE 595 38.900 -8.647 2.162 470 HD2 PHE 595 HD2 PHE 595 40.935 -7.271 5.699 471 HE1 PHE 595 HE1 PHE 595 41.025 -9.597 1.319 472 HE2 PHE 595 HE2 PHE 595 43.048 -8.284 4.865 473 HZ PHE 595 HZ PHE 595 43.096 -9.425 2.663 474 H HIS 596 H HIS 596 37.594 -4.648 5.353 475 HA HIS 596 HA HIS 596 34.759 -4.611 6.309 476 HB2 HIS 596 HB2 HIS 596 36.637 -2.567 5.152 477 HB3 HIS 596 HB3 HIS 596 34.930 -2.257 5.124 478 HD2 HIS 596 HD2 HIS 596 33.996 -2.604 8.091 479 HE1 HIS 596 HE1 HIS 596 37.373 -0.207 9.106 480 HE2 HIS 596 HE2 HIS 596 35.107 -1.065 9.903 481 H SER 597 H SER 597 33.046 -4.602 4.804 482 HA SER 597 HA SER 597 33.508 -5.980 2.340 483 HB2 SER 597 HB2 SER 597 30.995 -4.454 3.077 484 HB3 SER 597 HB3 SER 597 31.163 -5.812 1.953 485 HG SER 597 HG SER 597 30.394 -6.385 4.068 486 H THR 598 H THR 598 32.796 -2.496 2.937 487 HA THR 598 HA THR 598 33.005 -1.687 0.199 488 HB THR 598 HB THR 598 33.581 0.579 1.181 489 HG1 THR 598 HG1 THR 598 34.440 0.174 3.115 490 HG21 THR 598 HG21 THR 598 31.371 0.960 2.125 491 HG22 THR 598 HG22 THR 598 31.081 -0.791 2.225 492 HG23 THR 598 HG23 THR 598 31.284 -0.014 0.639 493 H CYS 599 H CYS 599 35.552 -1.946 2.759 494 HA CYS 599 HA CYS 599 37.651 -0.784 1.251 495 HB2 CYS 599 HB2 CYS 599 37.655 -2.857 3.469 496 HB3 CYS 599 HB3 CYS 599 39.111 -2.158 2.818 497 H TYR 600 H TYR 600 36.834 -4.277 1.617 498 HA TYR 600 HA TYR 600 38.734 -5.281 -0.243 499 HB2 TYR 600 HB2 TYR 600 37.620 -6.633 1.372 500 HB3 TYR 600 HB3 TYR 600 36.062 -6.351 0.647 501 HD1 TYR 600 HD1 TYR 600 36.343 -8.937 1.161 502 HD2 TYR 600 HD2 TYR 600 38.380 -6.963 -2.096 503 HE1 TYR 600 HE1 TYR 600 36.396 -11.069 -0.116 504 HE2 TYR 600 HE2 TYR 600 38.468 -9.081 -3.327 505 HH TYR 600 HH TYR 600 37.880 -11.299 -3.362 506 H HIS 601 H HIS 601 35.277 -4.355 -0.803 507 HA HIS 601 HA HIS 601 35.237 -4.820 -3.559 508 HB2 HIS 601 HB2 HIS 601 33.229 -4.416 -2.209 509 HB3 HIS 601 HB3 HIS 601 33.733 -2.760 -1.889 510 HD2 HIS 601 HD2 HIS 601 32.822 -0.941 -3.483 511 HE1 HIS 601 HE1 HIS 601 31.353 -3.421 -6.615 512 HE2 HIS 601 HE2 HIS 601 31.474 -1.046 -5.747 513 H GLU 602 H GLU 602 36.137 -1.670 -1.997 514 HA GLU 602 HA GLU 602 36.604 -0.480 -4.612 515 HB2 GLU 602 HB2 GLU 602 36.986 1.521 -3.533 516 HB3 GLU 602 HB3 GLU 602 35.740 0.723 -2.580 517 HG2 GLU 602 HG2 GLU 602 37.514 0.060 -0.917 518 HG3 GLU 602 HG3 GLU 602 38.709 0.901 -1.895 519 H THR 603 H THR 603 38.681 -2.157 -2.328 520 HA THR 603 HA THR 603 41.180 -1.096 -3.480 521 HB THR 603 HB THR 603 40.735 -3.293 -1.432 522 HG1 THR 603 HG1 THR 603 40.127 -1.363 -0.637 523 HG21 THR 603 HG21 THR 603 43.284 -1.842 -2.270 524 HG22 THR 603 HG22 THR 603 42.960 -3.590 -2.378 525 HG23 THR 603 HG23 THR 603 43.113 -2.824 -0.796 526 H SER 604 H SER 604 39.242 -4.043 -3.771 527 HA SER 604 HA SER 604 40.873 -4.928 -6.078 528 HB2 SER 604 HB2 SER 604 41.791 -5.976 -3.978 529 HB3 SER 604 HB3 SER 604 40.229 -6.770 -3.754 530 HG SER 604 HG SER 604 42.113 -7.107 -5.850 531 H GLN 605 H GLN 605 38.884 -3.923 -6.971 532 HA GLN 605 HA GLN 605 36.360 -5.308 -6.813 533 HB2 GLN 605 HB2 GLN 605 36.760 -2.899 -7.449 534 HB3 GLN 605 HB3 GLN 605 37.378 -3.457 -9.007 535 HG2 GLN 605 HG2 GLN 605 35.201 -4.430 -9.571 536 HG3 GLN 605 HG3 GLN 605 34.605 -4.140 -7.934 537 HE21 GLN 605 HE21 GLN 605 32.838 -3.122 -9.417 538 HE22 GLN 605 HE22 GLN 605 33.060 -1.405 -9.741 539 H ASN 606 H ASN 606 39.217 -5.702 -8.841 540 HA ASN 606 HA ASN 606 38.064 -7.520 -10.786 541 HB2 ASN 606 HB2 ASN 606 40.070 -6.069 -11.179 542 HB3 ASN 606 HB3 ASN 606 40.955 -7.006 -9.972 543 HD21 ASN 606 HD21 ASN 606 42.527 -7.934 -11.323 544 HD22 ASN 606 HD22 ASN 606 42.100 -9.004 -12.655 545 H SER 607 H SER 607 38.552 -9.799 -10.983 546 HA SER 607 HA SER 607 39.029 -11.235 -8.395 547 HB2 SER 607 HB2 SER 607 36.955 -11.912 -10.502 548 HB3 SER 607 HB3 SER 607 37.319 -12.862 -9.053 549 HG SER 607 HG SER 607 35.527 -11.452 -8.770 550 H SER 608 H SER 608 39.987 -13.190 -8.450 551 HA SER 608 HA SER 608 41.551 -14.712 -8.950 552 HB2 SER 608 HB2 SER 608 39.590 -15.546 -10.260 553 HB3 SER 608 HB3 SER 608 40.348 -14.880 -11.711 554 HG SER 608 HG SER 608 40.953 -17.080 -11.328 Start of MODEL 15 1 H1 GLY 533 H1 GLY 533 27.213 20.735 -7.244 2 H2 GLY 533 H2 GLY 533 28.744 21.330 -7.223 3 H3 GLY 533 H3 GLY 533 28.491 19.709 -7.315 4 HA2 GLY 533 HA2 GLY 533 27.757 21.673 -9.389 5 HA3 GLY 533 HA3 GLY 533 29.148 20.576 -9.466 6 H GLY 534 H GLY 534 27.317 20.574 -11.494 7 HA2 GLY 534 HA2 GLY 534 25.255 18.552 -11.240 8 HA3 GLY 534 HA3 GLY 534 25.856 19.267 -12.729 9 H SER 535 H SER 535 25.159 16.616 -12.599 10 HA SER 535 HA SER 535 27.646 15.251 -13.350 11 HB2 SER 535 HB2 SER 535 27.236 13.310 -11.906 12 HB3 SER 535 HB3 SER 535 27.556 14.768 -10.963 13 HG SER 535 HG SER 535 25.783 13.577 -10.145 14 H GLU 536 H GLU 536 27.333 13.344 -14.561 15 HA GLU 536 HA GLU 536 24.866 13.248 -16.137 16 HB2 GLU 536 HB2 GLU 536 27.387 11.537 -16.242 17 HB3 GLU 536 HB3 GLU 536 26.021 11.415 -17.336 18 HG2 GLU 536 HG2 GLU 536 27.632 12.673 -18.492 19 HG3 GLU 536 HG3 GLU 536 26.349 13.778 -18.041 20 H PHE 537 H PHE 537 23.502 11.452 -16.387 21 HA PHE 537 HA PHE 537 22.978 9.965 -13.936 22 HB2 PHE 537 HB2 PHE 537 21.277 11.188 -15.330 23 HB3 PHE 537 HB3 PHE 537 21.520 10.001 -16.597 24 HD1 PHE 537 HD1 PHE 537 19.204 9.410 -16.710 25 HD2 PHE 537 HD2 PHE 537 21.287 9.066 -12.943 26 HE1 PHE 537 HE1 PHE 537 17.301 8.134 -15.768 27 HE2 PHE 537 HE2 PHE 537 19.390 7.782 -12.021 28 HZ PHE 537 HZ PHE 537 17.393 7.311 -13.422 29 H SER 538 H SER 538 25.259 9.276 -16.040 30 HA SER 538 HA SER 538 24.713 6.798 -17.225 31 HB2 SER 538 HB2 SER 538 27.425 7.838 -16.343 32 HB3 SER 538 HB3 SER 538 27.100 6.614 -17.584 33 HG SER 538 HG SER 538 27.393 8.663 -18.523 34 H ASP 539 H ASP 539 24.742 4.731 -16.633 35 HA ASP 539 HA ASP 539 24.653 4.069 -13.846 36 HB2 ASP 539 HB2 ASP 539 24.062 1.828 -14.644 37 HB3 ASP 539 HB3 ASP 539 23.108 3.087 -15.400 38 H ARG 540 H ARG 540 25.781 2.559 -12.680 39 HA ARG 540 HA ARG 540 28.564 1.838 -13.535 40 HB2 ARG 540 HB2 ARG 540 27.479 2.971 -10.944 41 HB3 ARG 540 HB3 ARG 540 28.825 1.854 -10.882 42 HG2 ARG 540 HG2 ARG 540 29.734 4.028 -10.865 43 HG3 ARG 540 HG3 ARG 540 30.143 3.278 -12.404 44 HD2 ARG 540 HD2 ARG 540 28.390 4.623 -13.527 45 HD3 ARG 540 HD3 ARG 540 27.940 5.340 -11.965 46 HE ARG 540 HE ARG 540 30.743 5.691 -12.422 47 HH11 ARG 540 HH11 ARG 540 27.732 7.024 -13.683 48 HH12 ARG 540 HH12 ARG 540 28.494 8.548 -14.068 49 HH21 ARG 540 HH21 ARG 540 31.637 7.598 -13.061 50 HH22 ARG 540 HH22 ARG 540 30.646 8.830 -13.795 51 H SER 541 H SER 541 29.457 -0.023 -12.315 52 HA SER 541 HA SER 541 27.984 -2.360 -12.904 53 HB2 SER 541 HB2 SER 541 30.460 -2.158 -12.815 54 HB3 SER 541 HB3 SER 541 30.377 -2.052 -11.052 55 HG SER 541 HG SER 541 30.806 -4.179 -11.809 56 H ASN 542 H ASN 542 28.203 -0.626 -9.831 57 HA ASN 542 HA ASN 542 25.938 -2.172 -8.777 58 HB2 ASN 542 HB2 ASN 542 26.995 -2.538 -6.587 59 HB3 ASN 542 HB3 ASN 542 27.867 -3.383 -7.857 60 HD21 ASN 542 HD21 ASN 542 28.076 -0.845 -5.423 61 HD22 ASN 542 HD22 ASN 542 29.779 -0.502 -5.708 62 H GLU 543 H GLU 543 24.722 -1.045 -7.194 63 HA GLU 543 HA GLU 543 24.922 1.875 -7.513 64 HB2 GLU 543 HB2 GLU 543 22.824 0.596 -7.992 65 HB3 GLU 543 HB3 GLU 543 22.705 0.214 -6.282 66 HG2 GLU 543 HG2 GLU 543 21.256 2.076 -6.757 67 HG3 GLU 543 HG3 GLU 543 22.573 2.630 -5.737 68 H LEU 544 H LEU 544 24.099 -0.135 -4.654 69 HA LEU 544 HA LEU 544 25.902 1.462 -2.926 70 HB2 LEU 544 HB2 LEU 544 24.296 2.413 -1.629 71 HB3 LEU 544 HB3 LEU 544 23.707 2.702 -3.263 72 HG LEU 544 HG LEU 544 22.637 0.664 -1.245 73 HD11 LEU 544 HD11 LEU 544 20.681 2.118 -1.149 74 HD12 LEU 544 HD12 LEU 544 21.413 3.229 -2.329 75 HD13 LEU 544 HD13 LEU 544 22.136 3.024 -0.719 76 HD21 LEU 544 HD21 LEU 544 20.729 0.358 -2.793 77 HD22 LEU 544 HD22 LEU 544 22.232 -0.222 -3.508 78 HD23 LEU 544 HD23 LEU 544 21.556 1.346 -4.014 79 H GLU 545 H GLU 545 24.426 -1.470 -3.494 80 HA GLU 545 HA GLU 545 23.660 -2.452 -1.007 81 HB2 GLU 545 HB2 GLU 545 23.113 -3.373 -3.226 82 HB3 GLU 545 HB3 GLU 545 24.759 -3.990 -3.395 83 HG2 GLU 545 HG2 GLU 545 24.414 -5.575 -1.582 84 HG3 GLU 545 HG3 GLU 545 22.874 -4.831 -1.158 85 H ILE 546 H ILE 546 26.961 -2.183 -2.041 86 HA ILE 546 HA ILE 546 28.230 -4.329 -0.832 87 HB ILE 546 HB ILE 546 29.263 -1.475 -0.934 88 HG12 ILE 546 HG12 ILE 546 28.522 -2.236 -3.198 89 HG13 ILE 546 HG13 ILE 546 30.226 -1.862 -3.069 90 HG21 ILE 546 HG21 ILE 546 31.512 -2.629 -1.135 91 HG22 ILE 546 HG22 ILE 546 30.731 -2.767 0.453 92 HG23 ILE 546 HG23 ILE 546 30.716 -4.136 -0.666 93 HD11 ILE 546 HD11 ILE 546 29.836 -3.878 -4.426 94 HD12 ILE 546 HD12 ILE 546 30.803 -4.247 -2.994 95 HD13 ILE 546 HD13 ILE 546 29.075 -4.686 -3.038 96 H ARG 547 H ARG 547 27.267 -1.323 0.816 97 HA ARG 547 HA ARG 547 28.649 -1.981 3.282 98 HB2 ARG 547 HB2 ARG 547 27.716 0.022 4.187 99 HB3 ARG 547 HB3 ARG 547 28.221 0.359 2.532 100 HG2 ARG 547 HG2 ARG 547 25.872 0.194 1.764 101 HG3 ARG 547 HG3 ARG 547 25.351 -0.194 3.416 102 HD2 ARG 547 HD2 ARG 547 26.265 1.993 4.186 103 HD3 ARG 547 HD3 ARG 547 26.649 2.402 2.506 104 HE ARG 547 HE ARG 547 24.037 1.813 2.257 105 HH11 ARG 547 HH11 ARG 547 22.199 3.003 2.682 106 HH12 ARG 547 HH12 ARG 547 22.251 4.294 3.854 107 HH21 ARG 547 HH21 ARG 547 25.563 3.878 4.646 108 HH22 ARG 547 HH22 ARG 547 24.099 4.792 4.927 109 H GLY 548 H GLY 548 25.650 -3.022 2.032 110 HA2 GLY 548 HA2 GLY 548 24.206 -3.385 4.516 111 HA3 GLY 548 HA3 GLY 548 23.793 -4.039 2.926 112 H LYS 549 H LYS 549 26.782 -5.175 3.117 113 HA LYS 549 HA LYS 549 26.080 -7.840 4.075 114 HB2 LYS 549 HB2 LYS 549 28.798 -6.659 3.381 115 HB3 LYS 549 HB3 LYS 549 28.433 -8.372 3.584 116 HG2 LYS 549 HG2 LYS 549 27.405 -6.533 1.388 117 HG3 LYS 549 HG3 LYS 549 28.611 -7.807 1.234 118 HD2 LYS 549 HD2 LYS 549 26.878 -9.518 1.780 119 HD3 LYS 549 HD3 LYS 549 25.666 -8.229 1.895 120 HE2 LYS 549 HE2 LYS 549 26.100 -7.611 -0.468 121 HE3 LYS 549 HE3 LYS 549 27.321 -8.884 -0.578 122 HZ1 LYS 549 HZ1 LYS 549 25.215 -9.639 -1.477 123 HZ2 LYS 549 HZ2 LYS 549 24.431 -9.336 -0.081 124 HZ3 LYS 549 HZ3 LYS 549 25.554 -10.517 -0.154 125 H TYR 550 H TYR 550 26.312 -8.705 6.035 126 HA TYR 550 HA TYR 550 28.203 -7.553 7.980 127 HB2 TYR 550 HB2 TYR 550 26.604 -7.602 9.807 128 HB3 TYR 550 HB3 TYR 550 26.122 -6.448 8.603 129 HD1 TYR 550 HD1 TYR 550 24.073 -6.748 7.324 130 HD2 TYR 550 HD2 TYR 550 25.337 -9.719 10.177 131 HE1 TYR 550 HE1 TYR 550 21.808 -7.791 7.248 132 HE2 TYR 550 HE2 TYR 550 23.086 -10.756 10.107 133 HH TYR 550 HH TYR 550 20.932 -10.604 9.260 134 H VAL 551 H VAL 551 28.561 -8.940 9.813 135 HA VAL 551 HA VAL 551 27.920 -11.833 9.471 136 HB VAL 551 HB VAL 551 30.184 -12.368 10.371 137 HG11 VAL 551 HG11 VAL 551 31.365 -12.147 8.243 138 HG12 VAL 551 HG12 VAL 551 29.664 -12.496 7.928 139 HG13 VAL 551 HG13 VAL 551 30.279 -10.844 7.718 140 HG21 VAL 551 HG21 VAL 551 32.028 -10.772 10.106 141 HG22 VAL 551 HG22 VAL 551 30.846 -9.468 9.886 142 HG23 VAL 551 HG23 VAL 551 30.903 -10.397 11.418 143 H VAL 552 H VAL 552 27.452 -12.943 11.433 144 HA VAL 552 HA VAL 552 26.671 -11.252 13.688 145 HB VAL 552 HB VAL 552 26.759 -14.275 13.403 146 HG11 VAL 552 HG11 VAL 552 25.282 -14.371 15.385 147 HG12 VAL 552 HG12 VAL 552 26.844 -13.686 15.809 148 HG13 VAL 552 HG13 VAL 552 25.441 -12.618 15.600 149 HG21 VAL 552 HG21 VAL 552 24.279 -14.055 13.222 150 HG22 VAL 552 HG22 VAL 552 24.445 -12.290 13.309 151 HG23 VAL 552 HG23 VAL 552 25.079 -13.183 11.915 152 H VAL 553 H VAL 553 27.716 -10.862 15.581 153 HA VAL 553 HA VAL 553 30.587 -11.095 15.646 154 HB VAL 553 HB VAL 553 28.640 -10.404 17.869 155 HG11 VAL 553 HG11 VAL 553 30.777 -11.159 18.839 156 HG12 VAL 553 HG12 VAL 553 31.682 -10.117 17.717 157 HG13 VAL 553 HG13 VAL 553 30.635 -9.405 18.962 158 HG21 VAL 553 HG21 VAL 553 29.392 -8.099 17.508 159 HG22 VAL 553 HG22 VAL 553 30.402 -8.620 16.136 160 HG23 VAL 553 HG23 VAL 553 28.626 -8.729 16.037 161 HA PRO 554 HA PRO 554 30.442 -15.354 17.029 162 HB2 PRO 554 HB2 PRO 554 33.103 -15.912 17.297 163 HB3 PRO 554 HB3 PRO 554 32.313 -15.680 15.705 164 HG2 PRO 554 HG2 PRO 554 33.869 -13.666 17.324 165 HG3 PRO 554 HG3 PRO 554 34.051 -14.047 15.582 166 HD2 PRO 554 HD2 PRO 554 32.571 -11.930 16.461 167 HD3 PRO 554 HD3 PRO 554 32.064 -12.861 15.027 168 H GLU 555 H GLU 555 30.593 -16.573 18.899 169 HA GLU 555 HA GLU 555 30.484 -15.245 21.412 170 HB2 GLU 555 HB2 GLU 555 30.207 -17.446 22.365 171 HB3 GLU 555 HB3 GLU 555 29.308 -17.336 20.865 172 HG2 GLU 555 HG2 GLU 555 31.275 -18.513 19.715 173 HG3 GLU 555 HG3 GLU 555 31.938 -18.792 21.322 174 H THR 556 H THR 556 33.278 -16.440 19.722 175 HA THR 556 HA THR 556 35.074 -16.657 22.003 176 HB THR 556 HB THR 556 36.834 -16.704 20.248 177 HG1 THR 556 HG1 THR 556 36.182 -16.672 18.122 178 HG21 THR 556 HG21 THR 556 36.212 -18.809 19.195 179 HG22 THR 556 HG22 THR 556 34.498 -18.573 19.638 180 HG23 THR 556 HG23 THR 556 35.733 -18.816 20.896 181 H SER 557 H SER 557 34.076 -14.016 19.879 182 HA SER 557 HA SER 557 36.330 -12.294 20.726 183 HB2 SER 557 HB2 SER 557 34.031 -11.827 18.801 184 HB3 SER 557 HB3 SER 557 35.266 -10.628 19.219 185 HG SER 557 HG SER 557 35.827 -13.221 18.199 186 H GLN 558 H GLN 558 35.819 -12.352 22.969 187 HA GLN 558 HA GLN 558 33.467 -11.440 24.199 188 HB2 GLN 558 HB2 GLN 558 36.354 -11.221 25.144 189 HB3 GLN 558 HB3 GLN 558 34.932 -10.991 26.163 190 HG2 GLN 558 HG2 GLN 558 34.212 -13.325 25.715 191 HG3 GLN 558 HG3 GLN 558 35.644 -13.592 24.709 192 HE21 GLN 558 HE21 GLN 558 35.569 -15.421 26.569 193 HE22 GLN 558 HE22 GLN 558 36.620 -15.035 27.925 194 H ASP 559 H ASP 559 36.131 -9.472 22.919 195 HA ASP 559 HA ASP 559 35.151 -6.966 24.029 196 HB2 ASP 559 HB2 ASP 559 37.570 -7.624 23.377 197 HB3 ASP 559 HB3 ASP 559 37.078 -7.297 21.719 198 H MET 560 H MET 560 34.043 -8.863 21.436 199 HA MET 560 HA MET 560 32.953 -8.566 19.504 200 HB2 MET 560 HB2 MET 560 31.637 -6.263 20.999 201 HB3 MET 560 HB3 MET 560 30.959 -7.165 19.637 202 HG2 MET 560 HG2 MET 560 31.190 -9.261 21.076 203 HG3 MET 560 HG3 MET 560 31.567 -8.194 22.422 204 HE1 MET 560 HE1 MET 560 27.643 -9.853 21.748 205 HE2 MET 560 HE2 MET 560 28.713 -9.883 20.333 206 HE3 MET 560 HE3 MET 560 29.289 -10.482 21.908 207 H ALA 561 H ALA 561 35.483 -7.388 19.356 208 HA ALA 561 HA ALA 561 35.011 -5.431 17.184 209 HB1 ALA 561 HB1 ALA 561 35.428 -4.140 19.260 210 HB2 ALA 561 HB2 ALA 561 36.943 -5.032 19.519 211 HB3 ALA 561 HB3 ALA 561 36.762 -3.952 18.117 212 H PHE 562 H PHE 562 36.636 -5.321 15.583 213 HA PHE 562 HA PHE 562 39.033 -6.976 15.786 214 HB2 PHE 562 HB2 PHE 562 36.985 -8.435 14.967 215 HB3 PHE 562 HB3 PHE 562 37.205 -7.564 13.452 216 HD1 PHE 562 HD1 PHE 562 38.603 -10.072 15.755 217 HD2 PHE 562 HD2 PHE 562 39.268 -7.892 12.104 218 HE1 PHE 562 HE1 PHE 562 40.404 -11.658 15.130 219 HE2 PHE 562 HE2 PHE 562 41.065 -9.472 11.473 220 HZ PHE 562 HZ PHE 562 41.632 -11.374 12.983 221 H LYS 563 H LYS 563 40.516 -6.581 13.951 222 HA LYS 563 HA LYS 563 40.159 -3.795 12.930 223 HB2 LYS 563 HB2 LYS 563 42.034 -4.208 14.453 224 HB3 LYS 563 HB3 LYS 563 42.697 -5.413 13.344 225 HG2 LYS 563 HG2 LYS 563 43.128 -3.725 11.655 226 HG3 LYS 563 HG3 LYS 563 42.194 -2.516 12.544 227 HD2 LYS 563 HD2 LYS 563 44.613 -2.124 12.795 228 HD3 LYS 563 HD3 LYS 563 43.838 -2.448 14.331 229 HE2 LYS 563 HE2 LYS 563 45.940 -3.573 14.318 230 HE3 LYS 563 HE3 LYS 563 44.669 -4.785 14.298 231 HZ1 LYS 563 HZ1 LYS 563 46.444 -5.304 12.716 232 HZ2 LYS 563 HZ2 LYS 563 46.226 -3.908 11.919 233 HZ3 LYS 563 HZ3 LYS 563 45.057 -5.056 11.894 234 H CYS 564 H CYS 564 40.077 -3.272 10.901 235 HA CYS 564 HA CYS 564 40.122 -5.138 8.680 236 HB2 CYS 564 HB2 CYS 564 38.707 -2.984 8.925 237 HB3 CYS 564 HB3 CYS 564 40.162 -2.081 8.772 238 HA PRO 565 HA PRO 565 44.665 -4.576 8.353 239 HB2 PRO 565 HB2 PRO 565 44.209 -6.282 5.912 240 HB3 PRO 565 HB3 PRO 565 45.484 -6.414 7.159 241 HG2 PRO 565 HG2 PRO 565 43.358 -8.097 7.183 242 HG3 PRO 565 HG3 PRO 565 43.972 -7.395 8.716 243 HD2 PRO 565 HD2 PRO 565 41.558 -6.547 7.098 244 HD3 PRO 565 HD3 PRO 565 41.755 -6.721 8.843 245 H ILE 566 H ILE 566 42.275 -3.966 5.777 246 HA ILE 566 HA ILE 566 44.123 -2.783 3.901 247 HB ILE 566 HB ILE 566 41.110 -2.662 4.107 248 HG12 ILE 566 HG12 ILE 566 42.895 -4.138 2.105 249 HG13 ILE 566 HG13 ILE 566 42.324 -4.878 3.588 250 HG21 ILE 566 HG21 ILE 566 41.163 -1.816 1.723 251 HG22 ILE 566 HG22 ILE 566 41.806 -0.656 2.869 252 HG23 ILE 566 HG23 ILE 566 42.915 -1.625 1.863 253 HD11 ILE 566 HD11 ILE 566 40.566 -3.928 1.289 254 HD12 ILE 566 HD12 ILE 566 40.884 -5.589 1.795 255 HD13 ILE 566 HD13 ILE 566 39.953 -4.510 2.851 256 H CYS 567 H CYS 567 41.583 -1.140 5.881 257 HA CYS 567 HA CYS 567 43.059 1.395 5.545 258 HB2 CYS 567 HB2 CYS 567 41.090 2.473 6.191 259 HB3 CYS 567 HB3 CYS 567 40.643 1.262 4.999 260 H LYS 568 H LYS 568 43.176 -1.057 7.714 261 HA LYS 568 HA LYS 568 44.051 -1.409 9.785 262 HB2 LYS 568 HB2 LYS 568 45.318 1.341 9.602 263 HB3 LYS 568 HB3 LYS 568 45.715 0.031 10.697 264 HG2 LYS 568 HG2 LYS 568 47.308 -0.490 9.194 265 HG3 LYS 568 HG3 LYS 568 46.006 -1.305 8.341 266 HD2 LYS 568 HD2 LYS 568 45.681 0.831 6.978 267 HD3 LYS 568 HD3 LYS 568 47.029 1.537 7.874 268 HE2 LYS 568 HE2 LYS 568 47.995 0.814 5.871 269 HE3 LYS 568 HE3 LYS 568 48.462 -0.417 7.041 270 HZ1 LYS 568 HZ1 LYS 568 46.610 -1.798 6.148 271 HZ2 LYS 568 HZ2 LYS 568 47.658 -1.392 4.961 272 HZ3 LYS 568 HZ3 LYS 568 46.220 -0.635 5.101 273 H GLU 569 H GLU 569 41.369 -0.857 9.819 274 HA GLU 569 HA GLU 569 41.064 0.942 12.221 275 HB2 GLU 569 HB2 GLU 569 39.210 0.648 9.852 276 HB3 GLU 569 HB3 GLU 569 38.751 1.393 11.347 277 HG2 GLU 569 HG2 GLU 569 40.949 2.366 9.502 278 HG3 GLU 569 HG3 GLU 569 39.349 3.074 9.684 279 H THR 570 H THR 570 39.758 0.399 13.858 280 HA THR 570 HA THR 570 38.996 -2.432 14.072 281 HB THR 570 HB THR 570 38.852 -0.159 16.080 282 HG1 THR 570 HG1 THR 570 40.943 -0.788 15.543 283 HG21 THR 570 HG21 THR 570 37.243 -1.888 16.725 284 HG22 THR 570 HG22 THR 570 38.679 -2.013 17.748 285 HG23 THR 570 HG23 THR 570 38.444 -3.166 16.417 286 H VAL 571 H VAL 571 37.095 -3.157 13.418 287 HA VAL 571 HA VAL 571 34.678 -1.471 13.295 288 HB VAL 571 HB VAL 571 35.275 -3.243 11.557 289 HG11 VAL 571 HG11 VAL 571 34.470 -5.494 11.909 290 HG12 VAL 571 HG12 VAL 571 35.747 -5.151 13.091 291 HG13 VAL 571 HG13 VAL 571 34.042 -5.141 13.591 292 HG21 VAL 571 HG21 VAL 571 33.081 -2.082 11.728 293 HG22 VAL 571 HG22 VAL 571 32.949 -3.729 11.128 294 HG23 VAL 571 HG23 VAL 571 32.495 -3.382 12.805 295 H THR 572 H THR 572 32.814 -1.862 14.597 296 HA THR 572 HA THR 572 33.258 -3.446 17.090 297 HB THR 572 HB THR 572 31.979 -1.709 18.306 298 HG1 THR 572 HG1 THR 572 30.984 -0.668 16.581 299 HG21 THR 572 HG21 THR 572 34.461 -1.728 18.348 300 HG22 THR 572 HG22 THR 572 33.777 -0.105 18.529 301 HG23 THR 572 HG23 THR 572 34.480 -0.600 16.972 302 H GLY 573 H GLY 573 31.579 -4.568 17.915 303 HA2 GLY 573 HA2 GLY 573 29.520 -5.438 16.119 304 HA3 GLY 573 HA3 GLY 573 29.732 -5.915 17.804 305 H VAL 574 H VAL 574 27.332 -5.173 16.160 306 HA VAL 574 HA VAL 574 26.143 -3.296 18.114 307 HB VAL 574 HB VAL 574 25.689 -3.333 15.073 308 HG11 VAL 574 HG11 VAL 574 24.279 -1.316 15.433 309 HG12 VAL 574 HG12 VAL 574 23.585 -2.722 16.214 310 HG13 VAL 574 HG13 VAL 574 24.456 -1.522 17.191 311 HG21 VAL 574 HG21 VAL 574 27.015 -1.231 16.830 312 HG22 VAL 574 HG22 VAL 574 27.802 -2.232 15.589 313 HG23 VAL 574 HG23 VAL 574 26.621 -1.022 15.106 314 H TYR 575 H TYR 575 24.247 -3.916 19.022 315 HA TYR 575 HA TYR 575 23.201 -6.534 18.484 316 HB2 TYR 575 HB2 TYR 575 23.190 -5.433 20.692 317 HB3 TYR 575 HB3 TYR 575 22.030 -4.254 20.095 318 HD1 TYR 575 HD1 TYR 575 19.674 -4.826 19.944 319 HD2 TYR 575 HD2 TYR 575 22.586 -7.861 20.824 320 HE1 TYR 575 HE1 TYR 575 17.842 -6.394 20.595 321 HE2 TYR 575 HE2 TYR 575 20.769 -9.432 21.500 322 HH TYR 575 HH TYR 575 18.512 -9.688 21.797 323 H ASP 576 H ASP 576 21.996 -7.125 16.795 324 HA ASP 576 HA ASP 576 20.141 -5.248 15.448 325 HB2 ASP 576 HB2 ASP 576 21.490 -6.757 14.059 326 HB3 ASP 576 HB3 ASP 576 20.855 -8.153 14.915 327 H GLU 577 H GLU 577 18.135 -5.034 16.256 328 HA GLU 577 HA GLU 577 16.986 -6.777 18.256 329 HB2 GLU 577 HB2 GLU 577 15.700 -4.621 16.543 330 HB3 GLU 577 HB3 GLU 577 14.987 -5.376 17.983 331 HG2 GLU 577 HG2 GLU 577 16.958 -4.526 19.305 332 HG3 GLU 577 HG3 GLU 577 17.463 -3.615 17.886 333 H GLU 578 H GLU 578 16.909 -6.891 14.729 334 HA GLU 578 HA GLU 578 14.449 -8.458 14.614 335 HB2 GLU 578 HB2 GLU 578 15.324 -6.824 12.855 336 HB3 GLU 578 HB3 GLU 578 16.454 -8.077 12.361 337 HG2 GLU 578 HG2 GLU 578 13.409 -8.362 12.501 338 HG3 GLU 578 HG3 GLU 578 14.274 -7.874 11.060 339 H SER 579 H SER 579 17.950 -9.210 14.074 340 HA SER 579 HA SER 579 17.583 -12.099 14.105 341 HB2 SER 579 HB2 SER 579 20.093 -10.488 14.693 342 HB3 SER 579 HB3 SER 579 19.999 -12.217 14.357 343 HG SER 579 HG SER 579 19.510 -10.059 12.633 344 H GLY 580 H GLY 580 18.115 -9.629 16.573 345 HA2 GLY 580 HA2 GLY 580 17.829 -9.720 18.864 346 HA3 GLY 580 HA3 GLY 580 17.533 -11.456 18.781 347 H GLU 581 H GLU 581 20.373 -9.962 17.290 348 HA GLU 581 HA GLU 581 22.240 -10.957 19.338 349 HB2 GLU 581 HB2 GLU 581 22.058 -12.150 16.532 350 HB3 GLU 581 HB3 GLU 581 23.457 -12.321 17.590 351 HG2 GLU 581 HG2 GLU 581 21.934 -13.353 19.324 352 HG3 GLU 581 HG3 GLU 581 20.670 -13.400 18.086 353 H TRP 582 H TRP 582 24.489 -10.427 18.841 354 HA TRP 582 HA TRP 582 24.706 -7.730 17.746 355 HB2 TRP 582 HB2 TRP 582 26.767 -9.590 18.964 356 HB3 TRP 582 HB3 TRP 582 27.040 -7.912 18.521 357 HD1 TRP 582 HD1 TRP 582 25.017 -10.013 21.042 358 HE1 TRP 582 HE1 TRP 582 24.476 -8.590 23.099 359 HE3 TRP 582 HE3 TRP 582 26.922 -5.535 19.464 360 HZ2 TRP 582 HZ2 TRP 582 24.748 -5.851 23.930 361 HZ3 TRP 582 HZ3 TRP 582 26.742 -3.523 20.899 362 HH2 TRP 582 HH2 TRP 582 25.656 -3.661 23.132 363 H VAL 583 H VAL 583 25.680 -7.063 15.915 364 HA VAL 583 HA VAL 583 26.942 -9.028 14.058 365 HB VAL 583 HB VAL 583 25.872 -7.833 12.165 366 HG11 VAL 583 HG11 VAL 583 25.010 -9.994 12.835 367 HG12 VAL 583 HG12 VAL 583 23.957 -9.237 14.072 368 HG13 VAL 583 HG13 VAL 583 23.672 -8.939 12.354 369 HG21 VAL 583 HG21 VAL 583 23.944 -6.656 14.191 370 HG22 VAL 583 HG22 VAL 583 25.180 -5.746 13.299 371 HG23 VAL 583 HG23 VAL 583 23.867 -6.550 12.418 372 H TRP 584 H TRP 584 28.387 -8.275 12.601 373 HA TRP 584 HA TRP 584 29.750 -5.678 13.114 374 HB2 TRP 584 HB2 TRP 584 30.586 -8.432 12.228 375 HB3 TRP 584 HB3 TRP 584 31.502 -7.098 11.617 376 HD1 TRP 584 HD1 TRP 584 31.252 -5.498 14.575 377 HE1 TRP 584 HE1 TRP 584 32.759 -6.289 16.493 378 HE3 TRP 584 HE3 TRP 584 32.701 -10.042 12.684 379 HZ2 TRP 584 HZ2 TRP 584 34.417 -8.571 17.121 380 HZ3 TRP 584 HZ3 TRP 584 34.278 -11.464 13.945 381 HH2 TRP 584 HH2 TRP 584 35.106 -10.728 16.204 382 H LYS 585 H LYS 585 28.755 -4.245 11.922 383 HA LYS 585 HA LYS 585 27.468 -4.751 9.356 384 HB2 LYS 585 HB2 LYS 585 28.201 -2.144 10.772 385 HB3 LYS 585 HB3 LYS 585 27.173 -2.256 9.358 386 HG2 LYS 585 HG2 LYS 585 26.532 -3.462 12.086 387 HG3 LYS 585 HG3 LYS 585 25.920 -1.942 11.424 388 HD2 LYS 585 HD2 LYS 585 24.897 -3.230 9.516 389 HD3 LYS 585 HD3 LYS 585 25.343 -4.734 10.362 390 HE2 LYS 585 HE2 LYS 585 24.031 -4.004 12.336 391 HE3 LYS 585 HE3 LYS 585 23.619 -2.495 11.509 392 HZ1 LYS 585 HZ1 LYS 585 22.405 -3.770 9.862 393 HZ2 LYS 585 HZ2 LYS 585 21.845 -4.168 11.335 394 HZ3 LYS 585 HZ3 LYS 585 22.833 -5.193 10.539 395 H ASN 586 H ASN 586 28.026 -3.946 7.313 396 HA ASN 586 HA ASN 586 29.404 -3.812 5.540 397 HB2 ASN 586 HB2 ASN 586 29.341 -1.458 6.318 398 HB3 ASN 586 HB3 ASN 586 30.816 -1.731 7.244 399 HD21 ASN 586 HD21 ASN 586 31.866 -0.010 6.011 400 HD22 ASN 586 HD22 ASN 586 32.390 -0.357 4.362 401 H THR 587 H THR 587 30.026 -6.064 6.989 402 HA THR 587 HA THR 587 33.031 -6.218 6.924 403 HB THR 587 HB THR 587 31.200 -7.467 8.978 404 HG1 THR 587 HG1 THR 587 31.694 -5.242 9.231 405 HG21 THR 587 HG21 THR 587 33.288 -8.123 10.143 406 HG22 THR 587 HG22 THR 587 34.243 -7.620 8.738 407 HG23 THR 587 HG23 THR 587 33.119 -8.987 8.611 408 H ILE 588 H ILE 588 34.005 -8.084 6.343 409 HA ILE 588 HA ILE 588 32.509 -10.324 5.164 410 HB ILE 588 HB ILE 588 32.698 -8.771 3.322 411 HG12 ILE 588 HG12 ILE 588 34.851 -10.890 2.925 412 HG13 ILE 588 HG13 ILE 588 33.116 -11.255 2.954 413 HG21 ILE 588 HG21 ILE 588 34.676 -7.433 4.144 414 HG22 ILE 588 HG22 ILE 588 35.722 -8.794 3.683 415 HG23 ILE 588 HG23 ILE 588 34.816 -7.901 2.449 416 HD11 ILE 588 HD11 ILE 588 33.847 -11.098 0.662 417 HD12 ILE 588 HD12 ILE 588 32.813 -9.692 1.001 418 HD13 ILE 588 HD13 ILE 588 34.587 -9.519 0.936 419 H GLU 589 H GLU 589 33.734 -12.246 5.017 420 HA GLU 589 HA GLU 589 36.422 -12.230 6.328 421 HB2 GLU 589 HB2 GLU 589 34.621 -13.501 7.533 422 HB3 GLU 589 HB3 GLU 589 34.463 -14.530 6.104 423 HG2 GLU 589 HG2 GLU 589 36.924 -15.106 6.352 424 HG3 GLU 589 HG3 GLU 589 36.952 -14.149 7.826 425 H VAL 590 H VAL 590 38.125 -12.808 5.092 426 HA VAL 590 HA VAL 590 37.882 -14.655 2.851 427 HB VAL 590 HB VAL 590 37.255 -12.585 1.731 428 HG11 VAL 590 HG11 VAL 590 38.327 -10.910 3.132 429 HG12 VAL 590 HG12 VAL 590 39.940 -11.450 2.608 430 HG13 VAL 590 HG13 VAL 590 38.822 -10.710 1.448 431 HG21 VAL 590 HG21 VAL 590 38.626 -14.272 0.496 432 HG22 VAL 590 HG22 VAL 590 38.797 -12.627 -0.105 433 HG23 VAL 590 HG23 VAL 590 40.084 -13.331 0.889 434 H ASN 591 H ASN 591 39.832 -15.627 2.286 435 HA ASN 591 HA ASN 591 41.782 -16.628 2.797 436 HB2 ASN 591 HB2 ASN 591 42.453 -14.450 1.675 437 HB3 ASN 591 HB3 ASN 591 42.853 -13.829 3.278 438 HD21 ASN 591 HD21 ASN 591 43.477 -16.771 1.254 439 HD22 ASN 591 HD22 ASN 591 45.180 -16.859 1.688 440 H GLY 592 H GLY 592 39.969 -16.469 5.001 441 HA2 GLY 592 HA2 GLY 592 39.935 -17.287 7.146 442 HA3 GLY 592 HA3 GLY 592 41.695 -17.361 7.149 443 H LYS 593 H LYS 593 40.509 -14.196 6.425 444 HA LYS 593 HA LYS 593 40.551 -13.283 9.261 445 HB2 LYS 593 HB2 LYS 593 42.265 -12.203 6.985 446 HB3 LYS 593 HB3 LYS 593 41.967 -11.328 8.490 447 HG2 LYS 593 HG2 LYS 593 42.922 -13.241 9.780 448 HG3 LYS 593 HG3 LYS 593 43.315 -14.047 8.251 449 HD2 LYS 593 HD2 LYS 593 44.774 -12.158 7.610 450 HD3 LYS 593 HD3 LYS 593 44.373 -11.327 9.131 451 HE2 LYS 593 HE2 LYS 593 45.305 -13.241 10.411 452 HE3 LYS 593 HE3 LYS 593 45.686 -14.072 8.909 453 HZ1 LYS 593 HZ1 LYS 593 47.223 -12.249 8.368 454 HZ2 LYS 593 HZ2 LYS 593 47.627 -12.926 9.794 455 HZ3 LYS 593 HZ3 LYS 593 46.866 -11.487 9.764 456 H TYR 594 H TYR 594 39.746 -11.116 9.580 457 HA TYR 594 HA TYR 594 37.374 -10.612 7.884 458 HB2 TYR 594 HB2 TYR 594 38.256 -9.453 10.524 459 HB3 TYR 594 HB3 TYR 594 36.757 -9.026 9.707 460 HD1 TYR 594 HD1 TYR 594 35.218 -10.974 8.919 461 HD2 TYR 594 HD2 TYR 594 38.101 -11.301 12.109 462 HE1 TYR 594 HE1 TYR 594 34.059 -12.993 9.751 463 HE2 TYR 594 HE2 TYR 594 36.912 -13.309 12.977 464 HH TYR 594 HH TYR 594 35.197 -14.792 12.637 465 H PHE 595 H PHE 595 36.797 -8.740 7.067 466 HA PHE 595 HA PHE 595 38.632 -6.434 6.728 467 HB2 PHE 595 HB2 PHE 595 37.620 -8.283 4.527 468 HB3 PHE 595 HB3 PHE 595 38.223 -6.679 4.198 469 HD1 PHE 595 HD1 PHE 595 39.104 -10.131 5.158 470 HD2 PHE 595 HD2 PHE 595 40.625 -6.172 4.454 471 HE1 PHE 595 HE1 PHE 595 41.400 -11.054 4.973 472 HE2 PHE 595 HE2 PHE 595 42.918 -7.099 4.215 473 HZ PHE 595 HZ PHE 595 43.314 -9.541 4.479 474 H HIS 596 H HIS 596 37.475 -4.628 5.597 475 HA HIS 596 HA HIS 596 34.575 -4.525 6.208 476 HB2 HIS 596 HB2 HIS 596 36.556 -2.572 5.063 477 HB3 HIS 596 HB3 HIS 596 34.860 -2.210 5.018 478 HD2 HIS 596 HD2 HIS 596 33.933 -2.582 8.036 479 HE1 HIS 596 HE1 HIS 596 37.378 -0.299 9.072 480 HE2 HIS 596 HE2 HIS 596 35.095 -1.133 9.870 481 H SER 597 H SER 597 32.980 -4.543 4.618 482 HA SER 597 HA SER 597 33.502 -6.034 2.224 483 HB2 SER 597 HB2 SER 597 31.362 -6.072 3.460 484 HB3 SER 597 HB3 SER 597 31.044 -4.410 2.931 485 HG SER 597 HG SER 597 30.098 -5.504 1.414 486 H THR 598 H THR 598 32.783 -2.512 2.662 487 HA THR 598 HA THR 598 33.134 -1.777 -0.075 488 HB THR 598 HB THR 598 33.599 0.524 0.887 489 HG1 THR 598 HG1 THR 598 34.424 0.181 2.848 490 HG21 THR 598 HG21 THR 598 31.121 -0.901 1.936 491 HG22 THR 598 HG22 THR 598 31.311 -0.143 0.337 492 HG23 THR 598 HG23 THR 598 31.351 0.853 1.802 493 H CYS 599 H CYS 599 35.575 -1.865 2.597 494 HA CYS 599 HA CYS 599 37.754 -0.838 1.122 495 HB2 CYS 599 HB2 CYS 599 37.632 -2.861 3.389 496 HB3 CYS 599 HB3 CYS 599 39.120 -2.164 2.812 497 H TYR 600 H TYR 600 36.823 -4.267 1.625 498 HA TYR 600 HA TYR 600 38.765 -5.466 -0.060 499 HB2 TYR 600 HB2 TYR 600 37.578 -6.745 1.567 500 HB3 TYR 600 HB3 TYR 600 36.019 -6.324 0.887 501 HD1 TYR 600 HD1 TYR 600 39.177 -8.226 0.261 502 HD2 TYR 600 HD2 TYR 600 35.093 -7.571 -0.958 503 HE1 TYR 600 HE1 TYR 600 39.293 -10.228 -1.220 504 HE2 TYR 600 HE2 TYR 600 35.197 -9.589 -2.412 505 HH TYR 600 HH TYR 600 36.511 -11.322 -3.174 506 H HIS 601 H HIS 601 35.403 -4.421 -0.878 507 HA HIS 601 HA HIS 601 35.466 -5.217 -3.613 508 HB2 HIS 601 HB2 HIS 601 33.400 -4.725 -2.427 509 HB3 HIS 601 HB3 HIS 601 33.908 -3.059 -2.159 510 HD2 HIS 601 HD2 HIS 601 32.834 -5.417 -5.052 511 HE1 HIS 601 HE1 HIS 601 32.212 -1.412 -6.378 512 HE2 HIS 601 HE2 HIS 601 31.884 -3.860 -6.966 513 H GLU 602 H GLU 602 36.326 -2.033 -2.161 514 HA GLU 602 HA GLU 602 37.008 -0.817 -4.690 515 HB2 GLU 602 HB2 GLU 602 37.620 -0.083 -1.808 516 HB3 GLU 602 HB3 GLU 602 38.109 0.900 -3.198 517 HG2 GLU 602 HG2 GLU 602 35.816 1.232 -3.880 518 HG3 GLU 602 HG3 GLU 602 35.218 0.108 -2.672 519 H THR 603 H THR 603 38.920 -2.682 -2.366 520 HA THR 603 HA THR 603 41.513 -2.119 -3.567 521 HB THR 603 HB THR 603 40.570 -4.330 -1.706 522 HG1 THR 603 HG1 THR 603 40.542 -2.311 -0.818 523 HG21 THR 603 HG21 THR 603 43.398 -3.577 -2.547 524 HG22 THR 603 HG22 THR 603 42.604 -5.155 -2.760 525 HG23 THR 603 HG23 THR 603 42.995 -4.583 -1.135 526 H SER 604 H SER 604 39.046 -4.646 -4.050 527 HA SER 604 HA SER 604 40.544 -6.303 -5.839 528 HB2 SER 604 HB2 SER 604 38.476 -7.015 -4.690 529 HB3 SER 604 HB3 SER 604 37.544 -5.859 -5.653 530 HG SER 604 HG SER 604 38.896 -8.193 -6.502 531 H GLN 605 H GLN 605 40.909 -6.233 -7.980 532 HA GLN 605 HA GLN 605 39.695 -4.171 -9.732 533 HB2 GLN 605 HB2 GLN 605 42.682 -4.439 -9.184 534 HB3 GLN 605 HB3 GLN 605 41.994 -3.536 -10.532 535 HG2 GLN 605 HG2 GLN 605 40.794 -2.048 -8.941 536 HG3 GLN 605 HG3 GLN 605 41.509 -2.926 -7.589 537 HE21 GLN 605 HE21 GLN 605 43.162 -1.768 -6.673 538 HE22 GLN 605 HE22 GLN 605 44.301 -0.786 -7.593 539 H ASN 606 H ASN 606 40.231 -4.480 -11.995 540 HA ASN 606 HA ASN 606 40.097 -5.714 -13.862 541 HB2 ASN 606 HB2 ASN 606 42.556 -5.699 -13.312 542 HB3 ASN 606 HB3 ASN 606 42.368 -7.329 -12.662 543 HD21 ASN 606 HD21 ASN 606 43.532 -8.512 -14.179 544 HD22 ASN 606 HD22 ASN 606 43.161 -8.498 -15.901 545 H SER 607 H SER 607 38.220 -6.509 -11.900 546 HA SER 607 HA SER 607 37.990 -9.336 -11.604 547 HB2 SER 607 HB2 SER 607 36.933 -7.635 -10.154 548 HB3 SER 607 HB3 SER 607 35.838 -7.195 -11.474 549 HG SER 607 HG SER 607 34.950 -8.693 -9.949 550 H SER 608 H SER 608 36.981 -7.235 -14.208 551 HA SER 608 HA SER 608 35.948 -7.497 -16.212 552 HB2 SER 608 HB2 SER 608 37.086 -10.300 -16.080 553 HB3 SER 608 HB3 SER 608 36.519 -9.460 -17.529 554 HG SER 608 HG SER 608 38.666 -8.707 -15.826 Start of MODEL 16 1 H1 GLY 533 H1 GLY 533 33.658 -4.564 -10.109 2 H2 GLY 533 H2 GLY 533 35.112 -3.862 -9.848 3 H3 GLY 533 H3 GLY 533 34.258 -3.497 -11.203 4 HA2 GLY 533 HA2 GLY 533 33.444 -2.849 -8.438 5 HA3 GLY 533 HA3 GLY 533 34.116 -1.693 -9.603 6 H GLY 534 H GLY 534 32.368 -0.344 -9.866 7 HA2 GLY 534 HA2 GLY 534 30.300 -1.076 -11.694 8 HA3 GLY 534 HA3 GLY 534 29.635 -1.016 -10.062 9 H SER 535 H SER 535 28.652 0.662 -11.969 10 HA SER 535 HA SER 535 29.843 3.326 -11.865 11 HB2 SER 535 HB2 SER 535 27.844 3.981 -13.131 12 HB3 SER 535 HB3 SER 535 28.652 2.584 -13.849 13 HG SER 535 HG SER 535 26.393 2.298 -13.737 14 H GLU 536 H GLU 536 28.573 5.221 -11.144 15 HA GLU 536 HA GLU 536 27.536 4.942 -8.421 16 HB2 GLU 536 HB2 GLU 536 27.772 7.334 -10.282 17 HB3 GLU 536 HB3 GLU 536 27.166 7.393 -8.620 18 HG2 GLU 536 HG2 GLU 536 29.328 6.539 -7.786 19 HG3 GLU 536 HG3 GLU 536 29.941 6.439 -9.433 20 H PHE 537 H PHE 537 25.697 3.674 -8.539 21 HA PHE 537 HA PHE 537 23.237 5.116 -9.284 22 HB2 PHE 537 HB2 PHE 537 23.990 3.576 -11.205 23 HB3 PHE 537 HB3 PHE 537 23.631 2.231 -10.141 24 HD1 PHE 537 HD1 PHE 537 22.262 4.969 -12.183 25 HD2 PHE 537 HD2 PHE 537 21.247 1.750 -9.501 26 HE1 PHE 537 HE1 PHE 537 19.888 5.124 -12.893 27 HE2 PHE 537 HE2 PHE 537 18.878 1.912 -10.212 28 HZ PHE 537 HZ PHE 537 18.192 3.597 -11.906 29 H SER 538 H SER 538 21.615 4.785 -7.793 30 HA SER 538 HA SER 538 22.530 3.680 -5.282 31 HB2 SER 538 HB2 SER 538 21.454 5.868 -5.447 32 HB3 SER 538 HB3 SER 538 19.946 5.102 -5.958 33 HG SER 538 HG SER 538 21.256 4.938 -3.456 34 H ASP 539 H ASP 539 19.172 3.250 -6.486 35 HA ASP 539 HA ASP 539 18.934 0.893 -4.819 36 HB2 ASP 539 HB2 ASP 539 16.592 0.999 -5.326 37 HB3 ASP 539 HB3 ASP 539 17.189 2.580 -4.881 38 H ARG 540 H ARG 540 18.117 -1.168 -5.460 39 HA ARG 540 HA ARG 540 18.477 -3.150 -6.558 40 HB2 ARG 540 HB2 ARG 540 17.357 -1.528 -8.886 41 HB3 ARG 540 HB3 ARG 540 17.590 -3.269 -8.886 42 HG2 ARG 540 HG2 ARG 540 15.379 -3.147 -8.358 43 HG3 ARG 540 HG3 ARG 540 16.112 -3.332 -6.766 44 HD2 ARG 540 HD2 ARG 540 15.906 -0.835 -6.462 45 HD3 ARG 540 HD3 ARG 540 15.108 -0.752 -8.043 46 HE ARG 540 HE ARG 540 13.757 -2.645 -6.356 47 HH11 ARG 540 HH11 ARG 540 14.135 0.839 -6.707 48 HH12 ARG 540 HH12 ARG 540 12.633 1.169 -5.883 49 HH21 ARG 540 HH21 ARG 540 11.849 -2.133 -5.319 50 HH22 ARG 540 HH22 ARG 540 11.383 -0.464 -5.117 51 H SER 541 H SER 541 20.760 -1.905 -6.110 52 HA SER 541 HA SER 541 22.587 -2.809 -8.259 53 HB2 SER 541 HB2 SER 541 22.145 -0.443 -8.752 54 HB3 SER 541 HB3 SER 541 22.568 0.000 -7.091 55 HG SER 541 HG SER 541 24.327 0.308 -8.459 56 H ASN 542 H ASN 542 24.879 -2.785 -7.480 57 HA ASN 542 HA ASN 542 25.149 -4.179 -4.990 58 HB2 ASN 542 HB2 ASN 542 27.243 -2.866 -6.772 59 HB3 ASN 542 HB3 ASN 542 27.596 -3.970 -5.442 60 HD21 ASN 542 HD21 ASN 542 27.524 -3.970 -8.700 61 HD22 ASN 542 HD22 ASN 542 26.997 -5.627 -8.960 62 H GLU 543 H GLU 543 25.323 -0.740 -5.708 63 HA GLU 543 HA GLU 543 26.653 0.208 -3.377 64 HB2 GLU 543 HB2 GLU 543 26.121 1.565 -5.361 65 HB3 GLU 543 HB3 GLU 543 24.399 1.374 -5.047 66 HG2 GLU 543 HG2 GLU 543 25.220 3.597 -4.421 67 HG3 GLU 543 HG3 GLU 543 24.504 2.739 -3.075 68 H LEU 544 H LEU 544 23.274 -0.841 -3.817 69 HA LEU 544 HA LEU 544 22.452 -0.100 -1.100 70 HB2 LEU 544 HB2 LEU 544 20.911 -0.080 -2.988 71 HB3 LEU 544 HB3 LEU 544 21.134 -1.798 -3.272 72 HG LEU 544 HG LEU 544 20.130 -0.866 -0.564 73 HD11 LEU 544 HD11 LEU 544 18.738 0.328 -2.211 74 HD12 LEU 544 HD12 LEU 544 17.815 -0.946 -1.402 75 HD13 LEU 544 HD13 LEU 544 18.409 -1.205 -3.057 76 HD21 LEU 544 HD21 LEU 544 18.844 -2.989 -0.675 77 HD22 LEU 544 HD22 LEU 544 20.562 -3.307 -0.875 78 HD23 LEU 544 HD23 LEU 544 19.490 -3.309 -2.296 79 H GLU 545 H GLU 545 23.432 -3.065 -2.817 80 HA GLU 545 HA GLU 545 22.813 -4.828 -0.666 81 HB2 GLU 545 HB2 GLU 545 22.917 -5.447 -3.085 82 HB3 GLU 545 HB3 GLU 545 24.656 -5.203 -3.050 83 HG2 GLU 545 HG2 GLU 545 24.411 -7.506 -2.957 84 HG3 GLU 545 HG3 GLU 545 24.794 -7.083 -1.308 85 H ILE 546 H ILE 546 26.035 -3.526 -1.624 86 HA ILE 546 HA ILE 546 27.542 -5.138 0.160 87 HB ILE 546 HB ILE 546 28.125 -2.381 -0.992 88 HG12 ILE 546 HG12 ILE 546 27.857 -4.248 -2.678 89 HG13 ILE 546 HG13 ILE 546 29.415 -3.441 -2.681 90 HG21 ILE 546 HG21 ILE 546 30.520 -2.865 -0.555 91 HG22 ILE 546 HG22 ILE 546 29.558 -2.568 0.904 92 HG23 ILE 546 HG23 ILE 546 30.019 -4.224 0.477 93 HD11 ILE 546 HD11 ILE 546 28.831 -6.166 -1.456 94 HD12 ILE 546 HD12 ILE 546 29.650 -5.847 -2.993 95 HD13 ILE 546 HD13 ILE 546 30.423 -5.355 -1.480 96 H ARG 547 H ARG 547 25.746 -2.186 0.806 97 HA ARG 547 HA ARG 547 26.901 -1.642 3.440 98 HB2 ARG 547 HB2 ARG 547 24.261 -0.769 2.184 99 HB3 ARG 547 HB3 ARG 547 24.933 -0.150 3.696 100 HG2 ARG 547 HG2 ARG 547 26.821 0.844 2.555 101 HG3 ARG 547 HG3 ARG 547 26.326 0.137 1.001 102 HD2 ARG 547 HD2 ARG 547 24.227 1.401 1.051 103 HD3 ARG 547 HD3 ARG 547 24.628 2.084 2.618 104 HE ARG 547 HE ARG 547 25.857 2.752 -0.010 105 HH11 ARG 547 HH11 ARG 547 25.869 3.487 3.428 106 HH12 ARG 547 HH12 ARG 547 26.722 4.992 3.156 107 HH21 ARG 547 HH21 ARG 547 26.856 4.566 -0.258 108 HH22 ARG 547 HH22 ARG 547 27.284 5.619 1.087 109 H GLY 548 H GLY 548 24.293 -3.643 2.252 110 HA2 GLY 548 HA2 GLY 548 23.030 -4.161 4.840 111 HA3 GLY 548 HA3 GLY 548 22.673 -4.924 3.290 112 H LYS 549 H LYS 549 25.854 -5.408 3.341 113 HA LYS 549 HA LYS 549 25.710 -8.135 4.358 114 HB2 LYS 549 HB2 LYS 549 28.028 -6.491 3.274 115 HB3 LYS 549 HB3 LYS 549 28.114 -8.211 3.704 116 HG2 LYS 549 HG2 LYS 549 26.455 -8.781 2.013 117 HG3 LYS 549 HG3 LYS 549 26.168 -7.086 1.639 118 HD2 LYS 549 HD2 LYS 549 27.527 -8.013 -0.094 119 HD3 LYS 549 HD3 LYS 549 28.511 -6.865 0.823 120 HE2 LYS 549 HE2 LYS 549 29.692 -8.561 1.947 121 HE3 LYS 549 HE3 LYS 549 28.566 -9.823 1.413 122 HZ1 LYS 549 HZ1 LYS 549 29.344 -9.426 -0.877 123 HZ2 LYS 549 HZ2 LYS 549 30.576 -9.889 0.078 124 HZ3 LYS 549 HZ3 LYS 549 30.422 -8.320 -0.355 125 H TYR 550 H TYR 550 26.299 -8.921 6.264 126 HA TYR 550 HA TYR 550 28.248 -7.611 7.985 127 HB2 TYR 550 HB2 TYR 550 26.709 -7.618 9.982 128 HB3 TYR 550 HB3 TYR 550 26.311 -6.425 8.778 129 HD1 TYR 550 HD1 TYR 550 24.126 -6.331 7.841 130 HD2 TYR 550 HD2 TYR 550 25.340 -9.807 10.084 131 HE1 TYR 550 HE1 TYR 550 21.789 -7.159 7.806 132 HE2 TYR 550 HE2 TYR 550 23.002 -10.658 10.014 133 HH TYR 550 HH TYR 550 20.357 -8.851 8.460 134 H VAL 551 H VAL 551 28.678 -8.907 9.953 135 HA VAL 551 HA VAL 551 28.040 -11.801 9.684 136 HB VAL 551 HB VAL 551 30.482 -12.150 10.587 137 HG11 VAL 551 HG11 VAL 551 31.234 -12.544 8.280 138 HG12 VAL 551 HG12 VAL 551 29.547 -13.058 8.479 139 HG13 VAL 551 HG13 VAL 551 29.929 -11.520 7.659 140 HG21 VAL 551 HG21 VAL 551 30.951 -9.651 8.934 141 HG22 VAL 551 HG22 VAL 551 31.185 -9.788 10.695 142 HG23 VAL 551 HG23 VAL 551 32.176 -10.753 9.586 143 H VAL 552 H VAL 552 27.542 -12.822 11.525 144 HA VAL 552 HA VAL 552 26.801 -11.256 13.826 145 HB VAL 552 HB VAL 552 26.922 -14.246 13.349 146 HG11 VAL 552 HG11 VAL 552 25.454 -14.494 15.332 147 HG12 VAL 552 HG12 VAL 552 27.065 -13.942 15.783 148 HG13 VAL 552 HG13 VAL 552 25.718 -12.783 15.739 149 HG21 VAL 552 HG21 VAL 552 24.480 -14.052 13.207 150 HG22 VAL 552 HG22 VAL 552 24.574 -12.307 13.505 151 HG23 VAL 552 HG23 VAL 552 25.250 -13.001 12.010 152 H VAL 553 H VAL 553 27.794 -10.885 15.741 153 HA VAL 553 HA VAL 553 30.642 -11.431 16.031 154 HB VAL 553 HB VAL 553 28.690 -10.315 18.082 155 HG11 VAL 553 HG11 VAL 553 30.836 -9.499 19.125 156 HG12 VAL 553 HG12 VAL 553 30.666 -11.261 19.157 157 HG13 VAL 553 HG13 VAL 553 31.735 -10.485 17.965 158 HG21 VAL 553 HG21 VAL 553 29.762 -8.159 17.669 159 HG22 VAL 553 HG22 VAL 553 30.664 -8.850 16.298 160 HG23 VAL 553 HG23 VAL 553 28.888 -8.717 16.220 161 HA PRO 554 HA PRO 554 29.556 -15.408 17.997 162 HB2 PRO 554 HB2 PRO 554 31.909 -16.670 17.859 163 HB3 PRO 554 HB3 PRO 554 30.981 -16.288 16.379 164 HG2 PRO 554 HG2 PRO 554 33.336 -14.787 17.531 165 HG3 PRO 554 HG3 PRO 554 33.044 -15.253 15.829 166 HD2 PRO 554 HD2 PRO 554 32.391 -12.747 16.908 167 HD3 PRO 554 HD3 PRO 554 31.598 -13.478 15.481 168 H GLU 555 H GLU 555 29.948 -16.420 20.032 169 HA GLU 555 HA GLU 555 30.870 -14.745 22.177 170 HB2 GLU 555 HB2 GLU 555 30.458 -16.639 23.588 171 HB3 GLU 555 HB3 GLU 555 29.111 -16.404 22.479 172 HG2 GLU 555 HG2 GLU 555 31.252 -18.450 21.808 173 HG3 GLU 555 HG3 GLU 555 30.101 -18.788 23.086 174 H THR 556 H THR 556 32.537 -16.984 20.085 175 HA THR 556 HA THR 556 34.870 -17.447 21.728 176 HB THR 556 HB THR 556 35.882 -18.266 19.650 177 HG1 THR 556 HG1 THR 556 35.080 -17.033 18.052 178 HG21 THR 556 HG21 THR 556 34.360 -20.096 19.180 179 HG22 THR 556 HG22 THR 556 32.998 -19.216 19.917 180 HG23 THR 556 HG23 THR 556 34.349 -19.768 20.923 181 H SER 557 H SER 557 33.863 -14.648 19.871 182 HA SER 557 HA SER 557 36.558 -13.618 19.415 183 HB2 SER 557 HB2 SER 557 35.533 -11.595 18.706 184 HB3 SER 557 HB3 SER 557 34.582 -12.925 18.043 185 HG SER 557 HG SER 557 33.028 -12.540 19.596 186 H GLN 558 H GLN 558 34.152 -13.309 21.942 187 HA GLN 558 HA GLN 558 33.981 -12.450 23.955 188 HB2 GLN 558 HB2 GLN 558 35.846 -13.980 24.333 189 HB3 GLN 558 HB3 GLN 558 37.005 -12.661 24.095 190 HG2 GLN 558 HG2 GLN 558 36.146 -11.500 26.076 191 HG3 GLN 558 HG3 GLN 558 34.816 -12.649 26.225 192 HE21 GLN 558 HE21 GLN 558 35.832 -12.716 28.512 193 HE22 GLN 558 HE22 GLN 558 37.102 -13.915 28.737 194 H ASP 559 H ASP 559 36.608 -10.620 22.390 195 HA ASP 559 HA ASP 559 35.951 -8.143 23.798 196 HB2 ASP 559 HB2 ASP 559 37.816 -8.686 21.466 197 HB3 ASP 559 HB3 ASP 559 37.720 -7.178 22.371 198 H MET 560 H MET 560 34.573 -9.657 21.079 199 HA MET 560 HA MET 560 33.213 -9.049 19.397 200 HB2 MET 560 HB2 MET 560 32.447 -6.680 21.135 201 HB3 MET 560 HB3 MET 560 31.494 -7.395 19.845 202 HG2 MET 560 HG2 MET 560 31.495 -9.579 21.189 203 HG3 MET 560 HG3 MET 560 32.317 -8.703 22.448 204 HE1 MET 560 HE1 MET 560 29.146 -7.847 20.105 205 HE2 MET 560 HE2 MET 560 29.046 -9.537 20.699 206 HE3 MET 560 HE3 MET 560 27.887 -8.313 21.263 207 H ALA 561 H ALA 561 35.963 -8.019 19.167 208 HA ALA 561 HA ALA 561 35.478 -6.028 17.047 209 HB1 ALA 561 HB1 ALA 561 37.213 -4.540 17.972 210 HB2 ALA 561 HB2 ALA 561 35.881 -4.751 19.133 211 HB3 ALA 561 HB3 ALA 561 37.408 -5.610 19.376 212 H PHE 562 H PHE 562 37.008 -5.840 15.489 213 HA PHE 562 HA PHE 562 39.497 -7.347 15.456 214 HB2 PHE 562 HB2 PHE 562 37.195 -8.024 13.576 215 HB3 PHE 562 HB3 PHE 562 38.863 -8.333 13.150 216 HD1 PHE 562 HD1 PHE 562 40.284 -9.609 15.092 217 HD2 PHE 562 HD2 PHE 562 36.047 -9.933 14.357 218 HE1 PHE 562 HE1 PHE 562 40.270 -11.841 16.162 219 HE2 PHE 562 HE2 PHE 562 36.063 -12.200 15.383 220 HZ PHE 562 HZ PHE 562 38.145 -13.126 16.330 221 H LYS 563 H LYS 563 40.751 -6.807 13.386 222 HA LYS 563 HA LYS 563 40.156 -3.986 12.542 223 HB2 LYS 563 HB2 LYS 563 42.094 -4.373 14.085 224 HB3 LYS 563 HB3 LYS 563 42.868 -5.312 12.797 225 HG2 LYS 563 HG2 LYS 563 42.657 -3.245 11.314 226 HG3 LYS 563 HG3 LYS 563 42.089 -2.357 12.725 227 HD2 LYS 563 HD2 LYS 563 44.800 -3.719 12.417 228 HD3 LYS 563 HD3 LYS 563 44.479 -1.984 12.297 229 HE2 LYS 563 HE2 LYS 563 43.734 -1.976 14.679 230 HE3 LYS 563 HE3 LYS 563 44.081 -3.695 14.795 231 HZ1 LYS 563 HZ1 LYS 563 46.104 -1.606 14.220 232 HZ2 LYS 563 HZ2 LYS 563 46.416 -3.209 14.318 233 HZ3 LYS 563 HZ3 LYS 563 45.924 -2.385 15.635 234 H CYS 564 H CYS 564 39.941 -3.512 10.531 235 HA CYS 564 HA CYS 564 40.119 -5.300 8.287 236 HB2 CYS 564 HB2 CYS 564 38.713 -3.130 8.628 237 HB3 CYS 564 HB3 CYS 564 40.166 -2.254 8.316 238 HA PRO 565 HA PRO 565 44.681 -4.496 8.120 239 HB2 PRO 565 HB2 PRO 565 45.404 -6.349 6.253 240 HB3 PRO 565 HB3 PRO 565 45.004 -6.781 7.938 241 HG2 PRO 565 HG2 PRO 565 43.180 -6.880 5.520 242 HG3 PRO 565 HG3 PRO 565 43.472 -8.170 6.733 243 HD2 PRO 565 HD2 PRO 565 41.328 -6.469 6.890 244 HD3 PRO 565 HD3 PRO 565 42.172 -7.055 8.352 245 H ILE 566 H ILE 566 42.284 -4.282 5.595 246 HA ILE 566 HA ILE 566 43.956 -3.333 3.444 247 HB ILE 566 HB ILE 566 40.976 -3.042 3.930 248 HG12 ILE 566 HG12 ILE 566 42.248 -5.026 2.006 249 HG13 ILE 566 HG13 ILE 566 42.068 -5.452 3.700 250 HG21 ILE 566 HG21 ILE 566 42.588 -2.640 1.369 251 HG22 ILE 566 HG22 ILE 566 40.825 -2.705 1.442 252 HG23 ILE 566 HG23 ILE 566 41.677 -1.399 2.255 253 HD11 ILE 566 HD11 ILE 566 40.195 -6.300 2.387 254 HD12 ILE 566 HD12 ILE 566 39.647 -5.137 3.609 255 HD13 ILE 566 HD13 ILE 566 39.750 -4.658 1.895 256 H CYS 567 H CYS 567 41.761 -1.578 5.703 257 HA CYS 567 HA CYS 567 43.169 0.951 5.033 258 HB2 CYS 567 HB2 CYS 567 41.222 2.106 5.604 259 HB3 CYS 567 HB3 CYS 567 40.761 0.819 4.479 260 H LYS 568 H LYS 568 43.237 -1.364 7.373 261 HA LYS 568 HA LYS 568 44.038 -1.580 9.476 262 HB2 LYS 568 HB2 LYS 568 45.400 1.077 8.976 263 HB3 LYS 568 HB3 LYS 568 45.751 -0.044 10.298 264 HG2 LYS 568 HG2 LYS 568 46.356 -1.804 8.650 265 HG3 LYS 568 HG3 LYS 568 46.073 -0.657 7.326 266 HD2 LYS 568 HD2 LYS 568 47.830 0.832 8.226 267 HD3 LYS 568 HD3 LYS 568 48.139 -0.323 9.537 268 HE2 LYS 568 HE2 LYS 568 48.699 -2.070 7.849 269 HE3 LYS 568 HE3 LYS 568 48.404 -0.906 6.554 270 HZ1 LYS 568 HZ1 LYS 568 50.501 -0.633 8.632 271 HZ2 LYS 568 HZ2 LYS 568 50.225 0.444 7.438 272 HZ3 LYS 568 HZ3 LYS 568 50.766 -1.043 7.074 273 H GLU 569 H GLU 569 41.411 -1.015 9.439 274 HA GLU 569 HA GLU 569 41.100 0.803 11.817 275 HB2 GLU 569 HB2 GLU 569 39.313 0.500 9.393 276 HB3 GLU 569 HB3 GLU 569 38.772 1.238 10.873 277 HG2 GLU 569 HG2 GLU 569 41.052 2.241 9.118 278 HG3 GLU 569 HG3 GLU 569 39.436 2.921 9.218 279 H THR 570 H THR 570 39.741 0.319 13.428 280 HA THR 570 HA THR 570 39.110 -2.541 13.716 281 HB THR 570 HB THR 570 38.956 -0.256 15.708 282 HG1 THR 570 HG1 THR 570 41.032 -0.721 15.147 283 HG21 THR 570 HG21 THR 570 38.964 -2.075 17.413 284 HG22 THR 570 HG22 THR 570 38.697 -3.269 16.126 285 HG23 THR 570 HG23 THR 570 37.470 -2.030 16.478 286 H VAL 571 H VAL 571 37.189 -3.455 13.629 287 HA VAL 571 HA VAL 571 34.663 -1.867 13.562 288 HB VAL 571 HB VAL 571 33.604 -4.096 13.066 289 HG11 VAL 571 HG11 VAL 571 33.838 -2.329 11.410 290 HG12 VAL 571 HG12 VAL 571 35.451 -2.959 10.952 291 HG13 VAL 571 HG13 VAL 571 33.982 -3.947 10.712 292 HG21 VAL 571 HG21 VAL 571 35.554 -5.544 13.650 293 HG22 VAL 571 HG22 VAL 571 34.870 -5.845 12.031 294 HG23 VAL 571 HG23 VAL 571 36.378 -4.921 12.199 295 H THR 572 H THR 572 32.974 -2.357 14.974 296 HA THR 572 HA THR 572 33.536 -4.107 17.312 297 HB THR 572 HB THR 572 32.502 -2.426 18.793 298 HG1 THR 572 HG1 THR 572 31.405 -1.159 17.283 299 HG21 THR 572 HG21 THR 572 34.931 -1.298 17.354 300 HG22 THR 572 HG22 THR 572 34.983 -2.574 18.596 301 HG23 THR 572 HG23 THR 572 34.405 -0.957 19.017 302 H GLY 573 H GLY 573 31.751 -5.062 18.268 303 HA2 GLY 573 HA2 GLY 573 29.631 -5.809 16.563 304 HA3 GLY 573 HA3 GLY 573 29.732 -6.132 18.298 305 H VAL 574 H VAL 574 27.501 -5.307 16.389 306 HA VAL 574 HA VAL 574 26.237 -3.347 18.219 307 HB VAL 574 HB VAL 574 26.191 -3.282 15.149 308 HG11 VAL 574 HG11 VAL 574 24.881 -1.158 15.409 309 HG12 VAL 574 HG12 VAL 574 23.997 -2.581 15.955 310 HG13 VAL 574 HG13 VAL 574 24.742 -1.479 17.143 311 HG21 VAL 574 HG21 VAL 574 28.271 -2.308 15.993 312 HG22 VAL 574 HG22 VAL 574 27.224 -1.018 15.418 313 HG23 VAL 574 HG23 VAL 574 27.368 -1.316 17.161 314 H TYR 575 H TYR 575 24.059 -3.770 18.748 315 HA TYR 575 HA TYR 575 23.084 -6.394 18.090 316 HB2 TYR 575 HB2 TYR 575 22.774 -5.315 20.258 317 HB3 TYR 575 HB3 TYR 575 21.730 -4.098 19.532 318 HD1 TYR 575 HD1 TYR 575 22.087 -7.726 20.268 319 HD2 TYR 575 HD2 TYR 575 19.402 -4.570 19.084 320 HE1 TYR 575 HE1 TYR 575 20.152 -9.233 20.673 321 HE2 TYR 575 HE2 TYR 575 17.453 -6.076 19.481 322 HH TYR 575 HH TYR 575 17.848 -9.384 20.764 323 H ASP 576 H ASP 576 21.939 -7.071 16.399 324 HA ASP 576 HA ASP 576 20.357 -5.241 14.690 325 HB2 ASP 576 HB2 ASP 576 21.826 -6.861 13.562 326 HB3 ASP 576 HB3 ASP 576 21.125 -8.178 14.493 327 H GLU 577 H GLU 577 18.238 -4.978 15.109 328 HA GLU 577 HA GLU 577 16.761 -6.580 17.014 329 HB2 GLU 577 HB2 GLU 577 15.857 -4.517 14.982 330 HB3 GLU 577 HB3 GLU 577 14.834 -5.178 16.247 331 HG2 GLU 577 HG2 GLU 577 15.651 -3.840 17.841 332 HG3 GLU 577 HG3 GLU 577 17.312 -4.097 17.389 333 H GLU 578 H GLU 578 17.172 -6.889 13.516 334 HA GLU 578 HA GLU 578 14.679 -8.299 13.033 335 HB2 GLU 578 HB2 GLU 578 17.214 -8.156 11.367 336 HB3 GLU 578 HB3 GLU 578 15.700 -8.839 10.817 337 HG2 GLU 578 HG2 GLU 578 15.836 -5.939 11.711 338 HG3 GLU 578 HG3 GLU 578 16.371 -6.448 10.118 339 H SER 579 H SER 579 18.093 -9.485 13.102 340 HA SER 579 HA SER 579 17.250 -12.271 13.382 341 HB2 SER 579 HB2 SER 579 19.331 -11.529 12.214 342 HB3 SER 579 HB3 SER 579 19.988 -11.029 13.783 343 HG SER 579 HG SER 579 19.863 -13.220 14.444 344 H GLY 580 H GLY 580 18.084 -9.634 15.604 345 HA2 GLY 580 HA2 GLY 580 17.723 -9.504 17.886 346 HA3 GLY 580 HA3 GLY 580 17.272 -11.210 17.955 347 H GLU 581 H GLU 581 20.287 -9.835 16.606 348 HA GLU 581 HA GLU 581 21.951 -11.150 18.676 349 HB2 GLU 581 HB2 GLU 581 22.052 -11.797 15.697 350 HB3 GLU 581 HB3 GLU 581 23.298 -12.253 16.829 351 HG2 GLU 581 HG2 GLU 581 20.411 -13.223 16.872 352 HG3 GLU 581 HG3 GLU 581 21.785 -14.104 16.262 353 H TRP 582 H TRP 582 24.208 -10.517 18.608 354 HA TRP 582 HA TRP 582 24.636 -7.775 17.656 355 HB2 TRP 582 HB2 TRP 582 26.498 -9.698 19.064 356 HB3 TRP 582 HB3 TRP 582 26.833 -8.009 18.677 357 HD1 TRP 582 HD1 TRP 582 24.560 -10.110 20.958 358 HE1 TRP 582 HE1 TRP 582 23.731 -8.666 22.905 359 HE3 TRP 582 HE3 TRP 582 26.562 -5.624 19.551 360 HZ2 TRP 582 HZ2 TRP 582 23.834 -5.906 23.709 361 HZ3 TRP 582 HZ3 TRP 582 26.162 -3.592 20.928 362 HH2 TRP 582 HH2 TRP 582 24.815 -3.720 22.994 363 H VAL 583 H VAL 583 25.790 -7.115 15.966 364 HA VAL 583 HA VAL 583 27.122 -9.048 14.130 365 HB VAL 583 HB VAL 583 26.064 -7.840 12.240 366 HG11 VAL 583 HG11 VAL 583 25.173 -10.021 12.933 367 HG12 VAL 583 HG12 VAL 583 24.098 -9.229 14.116 368 HG13 VAL 583 HG13 VAL 583 23.865 -8.967 12.380 369 HG21 VAL 583 HG21 VAL 583 25.347 -5.761 13.397 370 HG22 VAL 583 HG22 VAL 583 24.076 -6.541 12.450 371 HG23 VAL 583 HG23 VAL 583 24.084 -6.706 14.224 372 H TRP 584 H TRP 584 28.619 -8.272 12.743 373 HA TRP 584 HA TRP 584 29.855 -5.611 13.247 374 HB2 TRP 584 HB2 TRP 584 30.696 -8.232 12.000 375 HB3 TRP 584 HB3 TRP 584 31.593 -6.783 11.638 376 HD1 TRP 584 HD1 TRP 584 31.984 -5.426 14.318 377 HE1 TRP 584 HE1 TRP 584 33.292 -6.499 16.276 378 HE3 TRP 584 HE3 TRP 584 31.719 -10.334 12.890 379 HZ2 TRP 584 HZ2 TRP 584 34.303 -9.106 16.970 380 HZ3 TRP 584 HZ3 TRP 584 32.899 -12.075 14.176 381 HH2 TRP 584 HH2 TRP 584 34.153 -11.474 16.250 382 H LYS 585 H LYS 585 28.779 -4.132 12.107 383 HA LYS 585 HA LYS 585 27.342 -4.641 9.640 384 HB2 LYS 585 HB2 LYS 585 28.101 -2.032 10.988 385 HB3 LYS 585 HB3 LYS 585 27.014 -2.186 9.595 386 HG2 LYS 585 HG2 LYS 585 25.583 -3.748 10.983 387 HG3 LYS 585 HG3 LYS 585 26.547 -3.299 12.394 388 HD2 LYS 585 HD2 LYS 585 24.920 -1.413 10.635 389 HD3 LYS 585 HD3 LYS 585 24.441 -2.013 12.233 390 HE2 LYS 585 HE2 LYS 585 26.395 -0.869 13.253 391 HE3 LYS 585 HE3 LYS 585 26.885 -0.276 11.671 392 HZ1 LYS 585 HZ1 LYS 585 24.776 0.954 11.550 393 HZ2 LYS 585 HZ2 LYS 585 25.612 1.404 12.872 394 HZ3 LYS 585 HZ3 LYS 585 24.325 0.415 13.018 395 H ASN 586 H ASN 586 27.776 -4.027 7.535 396 HA ASN 586 HA ASN 586 29.073 -3.990 5.676 397 HB2 ASN 586 HB2 ASN 586 28.827 -1.605 6.161 398 HB3 ASN 586 HB3 ASN 586 30.288 -1.634 7.161 399 HD21 ASN 586 HD21 ASN 586 31.215 0.042 5.795 400 HD22 ASN 586 HD22 ASN 586 31.843 -0.406 4.210 401 H THR 587 H THR 587 29.877 -6.078 7.175 402 HA THR 587 HA THR 587 32.859 -6.137 6.912 403 HB THR 587 HB THR 587 31.290 -7.216 9.270 404 HG1 THR 587 HG1 THR 587 31.629 -4.932 9.251 405 HG21 THR 587 HG21 THR 587 34.298 -7.133 8.840 406 HG22 THR 587 HG22 THR 587 33.295 -8.610 8.842 407 HG23 THR 587 HG23 THR 587 33.467 -7.644 10.312 408 H ILE 588 H ILE 588 33.793 -8.018 6.376 409 HA ILE 588 HA ILE 588 32.231 -10.438 5.748 410 HB ILE 588 HB ILE 588 32.215 -9.112 3.718 411 HG12 ILE 588 HG12 ILE 588 34.193 -11.408 3.507 412 HG13 ILE 588 HG13 ILE 588 32.428 -11.562 3.513 413 HG21 ILE 588 HG21 ILE 588 34.385 -7.775 4.191 414 HG22 ILE 588 HG22 ILE 588 35.243 -9.210 3.570 415 HG23 ILE 588 HG23 ILE 588 34.118 -8.312 2.540 416 HD11 ILE 588 HD11 ILE 588 34.210 -10.336 1.378 417 HD12 ILE 588 HD12 ILE 588 33.175 -11.763 1.246 418 HD13 ILE 588 HD13 ILE 588 32.442 -10.146 1.377 419 H GLU 589 H GLU 589 33.575 -12.378 5.647 420 HA GLU 589 HA GLU 589 36.300 -12.075 6.843 421 HB2 GLU 589 HB2 GLU 589 34.659 -13.290 8.274 422 HB3 GLU 589 HB3 GLU 589 34.464 -14.477 6.983 423 HG2 GLU 589 HG2 GLU 589 36.938 -14.944 7.105 424 HG3 GLU 589 HG3 GLU 589 37.056 -13.783 8.424 425 H VAL 590 H VAL 590 37.885 -12.389 5.450 426 HA VAL 590 HA VAL 590 37.790 -14.411 3.293 427 HB VAL 590 HB VAL 590 37.800 -11.421 2.822 428 HG11 VAL 590 HG11 VAL 590 38.669 -11.767 0.545 429 HG12 VAL 590 HG12 VAL 590 39.893 -12.156 1.740 430 HG13 VAL 590 HG13 VAL 590 39.014 -13.470 0.908 431 HG21 VAL 590 HG21 VAL 590 36.539 -13.743 1.310 432 HG22 VAL 590 HG22 VAL 590 35.703 -12.637 2.415 433 HG23 VAL 590 HG23 VAL 590 36.378 -12.023 0.898 434 H ASN 591 H ASN 591 39.544 -15.270 2.730 435 HA ASN 591 HA ASN 591 41.605 -16.139 3.067 436 HB2 ASN 591 HB2 ASN 591 42.432 -13.211 3.104 437 HB3 ASN 591 HB3 ASN 591 43.435 -14.620 2.735 438 HD21 ASN 591 HD21 ASN 591 41.673 -16.046 0.937 439 HD22 ASN 591 HD22 ASN 591 41.533 -15.025 -0.486 440 H GLY 592 H GLY 592 40.134 -16.001 5.466 441 HA2 GLY 592 HA2 GLY 592 40.474 -16.597 7.660 442 HA3 GLY 592 HA3 GLY 592 42.219 -16.489 7.403 443 H LYS 593 H LYS 593 40.605 -13.565 6.610 444 HA LYS 593 HA LYS 593 41.007 -12.358 9.311 445 HB2 LYS 593 HB2 LYS 593 42.001 -11.260 6.647 446 HB3 LYS 593 HB3 LYS 593 41.987 -10.368 8.173 447 HG2 LYS 593 HG2 LYS 593 43.473 -12.139 9.172 448 HG3 LYS 593 HG3 LYS 593 43.562 -12.909 7.580 449 HD2 LYS 593 HD2 LYS 593 44.543 -10.798 6.640 450 HD3 LYS 593 HD3 LYS 593 44.438 -10.068 8.244 451 HE2 LYS 593 HE2 LYS 593 46.697 -10.785 7.935 452 HE3 LYS 593 HE3 LYS 593 45.954 -11.828 9.136 453 HZ1 LYS 593 HZ1 LYS 593 46.353 -12.528 6.272 454 HZ2 LYS 593 HZ2 LYS 593 45.670 -13.516 7.379 455 HZ3 LYS 593 HZ3 LYS 593 47.239 -13.101 7.516 456 H TYR 594 H TYR 594 39.875 -10.368 9.662 457 HA TYR 594 HA TYR 594 37.277 -10.253 8.234 458 HB2 TYR 594 HB2 TYR 594 38.252 -8.939 10.763 459 HB3 TYR 594 HB3 TYR 594 36.698 -8.588 10.005 460 HD1 TYR 594 HD1 TYR 594 35.027 -10.376 9.559 461 HD2 TYR 594 HD2 TYR 594 38.492 -11.085 12.018 462 HE1 TYR 594 HE1 TYR 594 34.002 -12.469 10.372 463 HE2 TYR 594 HE2 TYR 594 37.444 -13.182 12.873 464 HH TYR 594 HH TYR 594 34.263 -14.322 11.728 465 H PHE 595 H PHE 595 36.704 -8.803 6.923 466 HA PHE 595 HA PHE 595 38.411 -6.442 6.251 467 HB2 PHE 595 HB2 PHE 595 36.956 -8.482 4.530 468 HB3 PHE 595 HB3 PHE 595 37.443 -6.943 3.880 469 HD1 PHE 595 HD1 PHE 595 38.202 -8.724 2.178 470 HD2 PHE 595 HD2 PHE 595 40.164 -8.118 5.969 471 HE1 PHE 595 HE1 PHE 595 40.259 -9.755 1.278 472 HE2 PHE 595 HE2 PHE 595 42.186 -9.228 5.086 473 HZ PHE 595 HZ PHE 595 42.252 -10.041 2.744 474 H HIS 596 H HIS 596 37.179 -4.631 5.316 475 HA HIS 596 HA HIS 596 34.329 -4.449 6.160 476 HB2 HIS 596 HB2 HIS 596 36.257 -2.617 4.765 477 HB3 HIS 596 HB3 HIS 596 34.571 -2.212 4.801 478 HD2 HIS 596 HD2 HIS 596 33.793 -2.333 7.843 479 HE1 HIS 596 HE1 HIS 596 37.462 -0.342 8.672 480 HE2 HIS 596 HE2 HIS 596 35.163 -0.938 9.588 481 H SER 597 H SER 597 32.596 -4.620 4.664 482 HA SER 597 HA SER 597 33.107 -6.100 2.257 483 HB2 SER 597 HB2 SER 597 30.542 -4.668 3.013 484 HB3 SER 597 HB3 SER 597 30.748 -5.982 1.841 485 HG SER 597 HG SER 597 30.051 -6.634 3.989 486 H THR 598 H THR 598 32.391 -2.598 2.741 487 HA THR 598 HA THR 598 32.489 -1.899 -0.038 488 HB THR 598 HB THR 598 33.046 0.408 0.819 489 HG1 THR 598 HG1 THR 598 33.992 0.066 2.742 490 HG21 THR 598 HG21 THR 598 30.855 0.805 1.800 491 HG22 THR 598 HG22 THR 598 30.629 -0.935 2.091 492 HG23 THR 598 HG23 THR 598 30.728 -0.320 0.431 493 H CYS 599 H CYS 599 35.121 -2.185 2.390 494 HA CYS 599 HA CYS 599 37.244 -1.220 0.710 495 HB2 CYS 599 HB2 CYS 599 37.200 -3.123 3.079 496 HB3 CYS 599 HB3 CYS 599 38.661 -2.613 2.307 497 H TYR 600 H TYR 600 36.240 -4.583 1.463 498 HA TYR 600 HA TYR 600 37.890 -5.979 -0.322 499 HB2 TYR 600 HB2 TYR 600 36.733 -7.089 1.427 500 HB3 TYR 600 HB3 TYR 600 35.170 -6.524 0.886 501 HD1 TYR 600 HD1 TYR 600 38.063 -8.668 -0.208 502 HD2 TYR 600 HD2 TYR 600 33.840 -7.860 -0.541 503 HE1 TYR 600 HE1 TYR 600 37.773 -10.744 -1.569 504 HE2 TYR 600 HE2 TYR 600 33.556 -9.926 -1.902 505 HH TYR 600 HH TYR 600 34.593 -11.737 -2.859 506 H HIS 601 H HIS 601 34.646 -4.595 -1.030 507 HA HIS 601 HA HIS 601 34.324 -5.624 -3.646 508 HB2 HIS 601 HB2 HIS 601 32.602 -4.542 -2.223 509 HB3 HIS 601 HB3 HIS 601 33.377 -2.979 -2.479 510 HD2 HIS 601 HD2 HIS 601 32.295 -1.583 -4.365 511 HE1 HIS 601 HE1 HIS 601 30.381 -4.685 -6.569 512 HE2 HIS 601 HE2 HIS 601 30.695 -2.164 -6.365 513 H GLU 602 H GLU 602 36.337 -2.937 -2.589 514 HA GLU 602 HA GLU 602 36.998 -2.211 -5.414 515 HB2 GLU 602 HB2 GLU 602 37.143 -0.687 -2.797 516 HB3 GLU 602 HB3 GLU 602 37.915 -0.113 -4.268 517 HG2 GLU 602 HG2 GLU 602 34.932 -0.697 -4.029 518 HG3 GLU 602 HG3 GLU 602 35.659 0.883 -3.813 519 H THR 603 H THR 603 38.318 -3.994 -2.865 520 HA THR 603 HA THR 603 41.047 -3.153 -2.880 521 HB THR 603 HB THR 603 39.699 -5.742 -2.053 522 HG1 THR 603 HG1 THR 603 39.345 -3.784 -0.910 523 HG21 THR 603 HG21 THR 603 41.730 -6.222 -0.694 524 HG22 THR 603 HG22 THR 603 42.598 -4.936 -1.563 525 HG23 THR 603 HG23 THR 603 42.030 -6.388 -2.424 526 H SER 604 H SER 604 39.400 -5.580 -4.902 527 HA SER 604 HA SER 604 41.659 -5.544 -6.784 528 HB2 SER 604 HB2 SER 604 42.231 -7.304 -5.078 529 HB3 SER 604 HB3 SER 604 40.768 -8.177 -5.560 530 HG SER 604 HG SER 604 42.674 -8.870 -6.662 531 H GLN 605 H GLN 605 41.185 -6.911 -8.723 532 HA GLN 605 HA GLN 605 38.621 -6.291 -9.875 533 HB2 GLN 605 HB2 GLN 605 39.417 -7.519 -11.812 534 HB3 GLN 605 HB3 GLN 605 40.642 -6.411 -11.205 535 HG2 GLN 605 HG2 GLN 605 41.771 -8.363 -10.062 536 HG3 GLN 605 HG3 GLN 605 40.614 -9.445 -10.839 537 HE21 GLN 605 HE21 GLN 605 43.653 -9.130 -11.132 538 HE22 GLN 605 HE22 GLN 605 43.869 -8.929 -12.868 539 H ASN 606 H ASN 606 36.947 -7.672 -10.556 540 HA ASN 606 HA ASN 606 36.298 -9.681 -8.558 541 HB2 ASN 606 HB2 ASN 606 34.655 -8.627 -10.894 542 HB3 ASN 606 HB3 ASN 606 34.063 -9.648 -9.582 543 HD21 ASN 606 HD21 ASN 606 34.196 -8.712 -7.330 544 HD22 ASN 606 HD22 ASN 606 34.077 -6.960 -7.189 545 H SER 607 H SER 607 35.426 -10.180 -11.958 546 HA SER 607 HA SER 607 35.399 -12.062 -13.246 547 HB2 SER 607 HB2 SER 607 38.203 -12.485 -12.154 548 HB3 SER 607 HB3 SER 607 37.519 -13.205 -13.618 549 HG SER 607 HG SER 607 37.937 -10.451 -13.122 550 H SER 608 H SER 608 36.458 -14.647 -12.997 551 HA SER 608 HA SER 608 35.512 -15.872 -10.509 552 HB2 SER 608 HB2 SER 608 33.933 -17.370 -11.628 553 HB3 SER 608 HB3 SER 608 33.432 -15.683 -11.736 554 HG SER 608 HG SER 608 33.253 -16.797 -13.756 Start of MODEL 17 1 H1 GLY 533 H1 GLY 533 19.561 16.992 11.393 2 H2 GLY 533 H2 GLY 533 18.506 16.082 12.262 3 H3 GLY 533 H3 GLY 533 19.521 17.117 13.029 4 HA2 GLY 533 HA2 GLY 533 17.309 18.049 12.990 5 HA3 GLY 533 HA3 GLY 533 18.442 19.028 12.044 6 H GLY 534 H GLY 534 17.367 19.786 10.301 7 HA2 GLY 534 HA2 GLY 534 15.174 18.449 8.977 8 HA3 GLY 534 HA3 GLY 534 16.020 19.886 8.424 9 H SER 535 H SER 535 15.147 18.047 6.614 10 HA SER 535 HA SER 535 16.929 15.976 5.880 11 HB2 SER 535 HB2 SER 535 15.105 17.600 4.072 12 HB3 SER 535 HB3 SER 535 15.773 16.003 3.721 13 HG SER 535 HG SER 535 14.553 15.153 5.395 14 H GLU 536 H GLU 536 18.691 15.824 4.635 15 HA GLU 536 HA GLU 536 19.582 17.941 2.814 16 HB2 GLU 536 HB2 GLU 536 20.572 18.638 4.984 17 HB3 GLU 536 HB3 GLU 536 21.269 17.041 5.189 18 HG2 GLU 536 HG2 GLU 536 22.965 18.614 4.455 19 HG3 GLU 536 HG3 GLU 536 22.727 17.360 3.258 20 H PHE 537 H PHE 537 20.428 16.966 1.000 21 HA PHE 537 HA PHE 537 20.228 14.109 0.867 22 HB2 PHE 537 HB2 PHE 537 19.554 15.586 -0.961 23 HB3 PHE 537 HB3 PHE 537 21.221 16.096 -1.195 24 HD1 PHE 537 HD1 PHE 537 22.840 14.651 -2.335 25 HD2 PHE 537 HD2 PHE 537 18.848 13.251 -1.503 26 HE1 PHE 537 HE1 PHE 537 23.207 12.699 -3.827 27 HE2 PHE 537 HE2 PHE 537 19.217 11.310 -3.006 28 HZ PHE 537 HZ PHE 537 21.397 11.034 -4.169 29 H SER 538 H SER 538 21.635 12.580 1.136 30 HA SER 538 HA SER 538 24.363 12.669 0.204 31 HB2 SER 538 HB2 SER 538 24.631 13.761 2.436 32 HB3 SER 538 HB3 SER 538 23.945 12.328 3.206 33 HG SER 538 HG SER 538 25.700 11.145 2.454 34 H ASP 539 H ASP 539 22.397 11.263 -0.784 35 HA ASP 539 HA ASP 539 22.417 8.513 0.388 36 HB2 ASP 539 HB2 ASP 539 20.037 9.947 -0.825 37 HB3 ASP 539 HB3 ASP 539 20.039 8.375 -0.041 38 H ARG 540 H ARG 540 21.189 7.004 -1.183 39 HA ARG 540 HA ARG 540 21.155 5.716 -3.030 40 HB2 ARG 540 HB2 ARG 540 21.207 8.325 -4.536 41 HB3 ARG 540 HB3 ARG 540 20.768 6.740 -5.178 42 HG2 ARG 540 HG2 ARG 540 19.008 6.578 -3.319 43 HG3 ARG 540 HG3 ARG 540 19.349 8.279 -2.971 44 HD2 ARG 540 HD2 ARG 540 17.460 8.259 -4.388 45 HD3 ARG 540 HD3 ARG 540 18.830 8.815 -5.357 46 HE ARG 540 HE ARG 540 18.669 6.923 -6.700 47 HH11 ARG 540 HH11 ARG 540 16.566 6.372 -3.933 48 HH12 ARG 540 HH12 ARG 540 15.883 4.925 -4.642 49 HH21 ARG 540 HH21 ARG 540 17.750 5.087 -7.524 50 HH22 ARG 540 HH22 ARG 540 16.535 4.228 -6.615 51 H SER 541 H SER 541 24.023 7.027 -2.230 52 HA SER 541 HA SER 541 25.755 6.114 -4.336 53 HB2 SER 541 HB2 SER 541 26.265 6.268 -1.343 54 HB3 SER 541 HB3 SER 541 27.498 6.123 -2.606 55 HG SER 541 HG SER 541 27.204 8.289 -1.945 56 H ASN 542 H ASN 542 27.169 4.186 -4.274 57 HA ASN 542 HA ASN 542 25.803 1.723 -3.912 58 HB2 ASN 542 HB2 ASN 542 27.910 0.686 -4.423 59 HB3 ASN 542 HB3 ASN 542 27.716 2.086 -5.466 60 HD21 ASN 542 HD21 ASN 542 30.045 0.473 -3.857 61 HD22 ASN 542 HD22 ASN 542 31.093 1.827 -3.444 62 H GLU 543 H GLU 543 27.653 3.582 -1.580 63 HA GLU 543 HA GLU 543 28.279 1.646 0.366 64 HB2 GLU 543 HB2 GLU 543 27.341 4.518 0.756 65 HB3 GLU 543 HB3 GLU 543 28.103 3.514 1.991 66 HG2 GLU 543 HG2 GLU 543 30.147 3.346 0.587 67 HG3 GLU 543 HG3 GLU 543 29.388 4.355 -0.644 68 H LEU 544 H LEU 544 25.061 3.025 -0.374 69 HA LEU 544 HA LEU 544 23.702 2.182 2.007 70 HB2 LEU 544 HB2 LEU 544 22.820 2.740 -0.847 71 HB3 LEU 544 HB3 LEU 544 21.721 2.047 0.331 72 HG LEU 544 HG LEU 544 22.120 3.969 1.865 73 HD11 LEU 544 HD11 LEU 544 22.982 6.085 0.938 74 HD12 LEU 544 HD12 LEU 544 23.504 5.233 -0.532 75 HD13 LEU 544 HD13 LEU 544 24.253 4.863 1.037 76 HD21 LEU 544 HD21 LEU 544 21.060 4.613 -0.914 77 HD22 LEU 544 HD22 LEU 544 20.687 5.516 0.582 78 HD23 LEU 544 HD23 LEU 544 20.155 3.839 0.395 79 H GLU 545 H GLU 545 24.611 0.413 -0.935 80 HA GLU 545 HA GLU 545 23.136 -2.001 -0.074 81 HB2 GLU 545 HB2 GLU 545 24.903 -1.328 -2.466 82 HB3 GLU 545 HB3 GLU 545 24.177 -2.912 -2.227 83 HG2 GLU 545 HG2 GLU 545 22.711 -0.279 -2.660 84 HG3 GLU 545 HG3 GLU 545 22.897 -1.576 -3.829 85 H ILE 546 H ILE 546 26.554 -1.001 -0.435 86 HA ILE 546 HA ILE 546 27.552 -3.572 0.369 87 HB ILE 546 HB ILE 546 28.954 -0.884 0.426 88 HG12 ILE 546 HG12 ILE 546 28.133 -1.418 -1.868 89 HG13 ILE 546 HG13 ILE 546 29.871 -1.375 -1.751 90 HG21 ILE 546 HG21 ILE 546 31.023 -2.337 0.141 91 HG22 ILE 546 HG22 ILE 546 30.239 -2.441 1.733 92 HG23 ILE 546 HG23 ILE 546 30.010 -3.734 0.544 93 HD11 ILE 546 HD11 ILE 546 29.067 -3.213 -3.194 94 HD12 ILE 546 HD12 ILE 546 29.974 -3.840 -1.814 95 HD13 ILE 546 HD13 ILE 546 28.193 -3.923 -1.823 96 H ARG 547 H ARG 547 26.466 -0.801 2.308 97 HA ARG 547 HA ARG 547 27.675 -1.928 4.741 98 HB2 ARG 547 HB2 ARG 547 27.421 -0.026 5.717 99 HB3 ARG 547 HB3 ARG 547 27.014 0.644 4.175 100 HG2 ARG 547 HG2 ARG 547 25.072 -0.264 6.350 101 HG3 ARG 547 HG3 ARG 547 25.539 1.380 5.973 102 HD2 ARG 547 HD2 ARG 547 24.446 1.258 3.783 103 HD3 ARG 547 HD3 ARG 547 23.979 -0.429 4.095 104 HE ARG 547 HE ARG 547 23.131 1.531 6.126 105 HH11 ARG 547 HH11 ARG 547 22.056 -0.091 3.197 106 HH12 ARG 547 HH12 ARG 547 20.375 0.058 3.648 107 HH21 ARG 547 HH21 ARG 547 20.986 1.753 6.570 108 HH22 ARG 547 HH22 ARG 547 19.796 1.101 5.474 109 H GLY 548 H GLY 548 24.910 -2.675 2.995 110 HA2 GLY 548 HA2 GLY 548 23.284 -3.810 5.112 111 HA3 GLY 548 HA3 GLY 548 23.181 -4.132 3.374 112 H LYS 549 H LYS 549 26.281 -4.811 3.698 113 HA LYS 549 HA LYS 549 26.005 -7.694 4.207 114 HB2 LYS 549 HB2 LYS 549 28.563 -6.081 3.841 115 HB3 LYS 549 HB3 LYS 549 28.354 -7.820 3.702 116 HG2 LYS 549 HG2 LYS 549 27.278 -5.697 1.802 117 HG3 LYS 549 HG3 LYS 549 28.618 -6.812 1.526 118 HD2 LYS 549 HD2 LYS 549 27.009 -8.721 1.578 119 HD3 LYS 549 HD3 LYS 549 25.685 -7.589 1.872 120 HE2 LYS 549 HE2 LYS 549 25.647 -8.068 -0.449 121 HE3 LYS 549 HE3 LYS 549 26.232 -6.424 -0.283 122 HZ1 LYS 549 HZ1 LYS 549 27.938 -8.815 -0.738 123 HZ2 LYS 549 HZ2 LYS 549 28.506 -7.289 -0.598 124 HZ3 LYS 549 HZ3 LYS 549 27.558 -7.700 -1.863 125 H TYR 550 H TYR 550 26.240 -8.687 6.108 126 HA TYR 550 HA TYR 550 28.088 -7.653 8.103 127 HB2 TYR 550 HB2 TYR 550 26.482 -7.726 9.980 128 HB3 TYR 550 HB3 TYR 550 26.142 -6.442 8.875 129 HD1 TYR 550 HD1 TYR 550 24.032 -6.356 7.660 130 HD2 TYR 550 HD2 TYR 550 25.045 -9.789 10.061 131 HE1 TYR 550 HE1 TYR 550 21.695 -7.178 7.461 132 HE2 TYR 550 HE2 TYR 550 22.703 -10.616 9.868 133 HH TYR 550 HH TYR 550 20.215 -8.836 8.002 134 H VAL 551 H VAL 551 28.395 -9.072 9.913 135 HA VAL 551 HA VAL 551 27.605 -11.911 9.566 136 HB VAL 551 HB VAL 551 30.043 -12.421 10.397 137 HG11 VAL 551 HG11 VAL 551 29.493 -11.650 7.497 138 HG12 VAL 551 HG12 VAL 551 30.730 -12.798 8.070 139 HG13 VAL 551 HG13 VAL 551 29.013 -13.182 8.272 140 HG21 VAL 551 HG21 VAL 551 30.909 -10.112 10.555 141 HG22 VAL 551 HG22 VAL 551 31.798 -11.093 9.387 142 HG23 VAL 551 HG23 VAL 551 30.631 -9.895 8.808 143 H VAL 552 H VAL 552 27.035 -12.905 11.413 144 HA VAL 552 HA VAL 552 26.460 -11.255 13.709 145 HB VAL 552 HB VAL 552 26.176 -14.223 13.193 146 HG11 VAL 552 HG11 VAL 552 25.248 -12.715 15.668 147 HG12 VAL 552 HG12 VAL 552 24.737 -14.344 15.197 148 HG13 VAL 552 HG13 VAL 552 26.428 -14.054 15.603 149 HG21 VAL 552 HG21 VAL 552 24.095 -12.008 13.514 150 HG22 VAL 552 HG22 VAL 552 24.655 -12.650 11.955 151 HG23 VAL 552 HG23 VAL 552 23.790 -13.700 13.078 152 H VAL 553 H VAL 553 27.455 -11.031 15.645 153 HA VAL 553 HA VAL 553 30.195 -12.005 16.016 154 HB VAL 553 HB VAL 553 28.474 -10.601 18.098 155 HG11 VAL 553 HG11 VAL 553 30.726 -9.993 18.993 156 HG12 VAL 553 HG12 VAL 553 30.421 -11.741 19.005 157 HG13 VAL 553 HG13 VAL 553 31.476 -11.015 17.766 158 HG21 VAL 553 HG21 VAL 553 28.641 -9.046 16.204 159 HG22 VAL 553 HG22 VAL 553 29.710 -8.538 17.538 160 HG23 VAL 553 HG23 VAL 553 30.381 -9.343 16.097 161 HA PRO 554 HA PRO 554 28.332 -15.626 18.090 162 HB2 PRO 554 HB2 PRO 554 30.478 -17.270 18.202 163 HB3 PRO 554 HB3 PRO 554 29.673 -16.868 16.646 164 HG2 PRO 554 HG2 PRO 554 32.169 -15.606 17.821 165 HG3 PRO 554 HG3 PRO 554 31.921 -16.232 16.153 166 HD2 PRO 554 HD2 PRO 554 31.621 -13.581 16.833 167 HD3 PRO 554 HD3 PRO 554 30.714 -14.361 15.511 168 H GLU 555 H GLU 555 28.322 -16.365 20.274 169 HA GLU 555 HA GLU 555 29.441 -14.646 22.267 170 HB2 GLU 555 HB2 GLU 555 27.404 -15.955 22.532 171 HB3 GLU 555 HB3 GLU 555 28.337 -17.470 22.547 172 HG2 GLU 555 HG2 GLU 555 29.368 -16.879 24.652 173 HG3 GLU 555 HG3 GLU 555 28.807 -15.212 24.515 174 H THR 556 H THR 556 30.787 -17.475 20.693 175 HA THR 556 HA THR 556 32.989 -18.045 22.385 176 HB THR 556 HB THR 556 32.851 -18.180 19.390 177 HG1 THR 556 HG1 THR 556 32.012 -20.258 19.717 178 HG21 THR 556 HG21 THR 556 34.283 -20.218 19.663 179 HG22 THR 556 HG22 THR 556 34.437 -19.856 21.397 180 HG23 THR 556 HG23 THR 556 35.105 -18.743 20.184 181 H SER 557 H SER 557 32.516 -15.315 20.170 182 HA SER 557 HA SER 557 35.362 -14.660 19.946 183 HB2 SER 557 HB2 SER 557 33.838 -14.148 18.090 184 HB3 SER 557 HB3 SER 557 32.899 -13.080 19.151 185 HG SER 557 HG SER 557 35.559 -12.764 18.254 186 H GLN 558 H GLN 558 36.505 -13.481 21.325 187 HA GLN 558 HA GLN 558 35.270 -11.960 23.543 188 HB2 GLN 558 HB2 GLN 558 37.442 -11.653 24.388 189 HB3 GLN 558 HB3 GLN 558 37.147 -13.362 24.100 190 HG2 GLN 558 HG2 GLN 558 38.513 -11.654 22.016 191 HG3 GLN 558 HG3 GLN 558 39.428 -12.223 23.422 192 HE21 GLN 558 HE21 GLN 558 39.912 -14.508 23.633 193 HE22 GLN 558 HE22 GLN 558 39.680 -15.598 22.271 194 H ASP 559 H ASP 559 35.649 -9.780 23.913 195 HA ASP 559 HA ASP 559 35.587 -7.597 23.495 196 HB2 ASP 559 HB2 ASP 559 37.772 -8.141 21.480 197 HB3 ASP 559 HB3 ASP 559 37.401 -6.604 22.244 198 H MET 560 H MET 560 34.656 -9.483 20.808 199 HA MET 560 HA MET 560 33.186 -9.144 19.136 200 HB2 MET 560 HB2 MET 560 32.140 -6.769 20.709 201 HB3 MET 560 HB3 MET 560 31.263 -7.745 19.537 202 HG2 MET 560 HG2 MET 560 31.559 -9.736 21.077 203 HG3 MET 560 HG3 MET 560 32.360 -8.671 22.221 204 HE1 MET 560 HE1 MET 560 27.861 -9.019 21.514 205 HE2 MET 560 HE2 MET 560 28.865 -8.505 20.132 206 HE3 MET 560 HE3 MET 560 29.124 -10.097 20.904 207 H ALA 561 H ALA 561 35.745 -7.957 18.680 208 HA ALA 561 HA ALA 561 35.104 -5.948 16.610 209 HB1 ALA 561 HB1 ALA 561 35.434 -4.718 18.752 210 HB2 ALA 561 HB2 ALA 561 37.036 -5.478 18.931 211 HB3 ALA 561 HB3 ALA 561 36.732 -4.355 17.594 212 H PHE 562 H PHE 562 36.852 -5.539 15.097 213 HA PHE 562 HA PHE 562 39.332 -6.992 15.424 214 HB2 PHE 562 HB2 PHE 562 37.546 -8.620 14.313 215 HB3 PHE 562 HB3 PHE 562 37.907 -7.706 12.863 216 HD1 PHE 562 HD1 PHE 562 40.099 -7.952 11.765 217 HD2 PHE 562 HD2 PHE 562 39.279 -9.945 15.494 218 HE1 PHE 562 HE1 PHE 562 42.136 -9.330 11.473 219 HE2 PHE 562 HE2 PHE 562 41.312 -11.344 15.186 220 HZ PHE 562 HZ PHE 562 42.753 -11.030 13.184 221 H LYS 563 H LYS 563 40.978 -6.473 13.852 222 HA LYS 563 HA LYS 563 40.863 -3.671 13.076 223 HB2 LYS 563 HB2 LYS 563 42.811 -5.050 14.159 224 HB3 LYS 563 HB3 LYS 563 43.122 -5.623 12.526 225 HG2 LYS 563 HG2 LYS 563 44.601 -3.838 12.790 226 HG3 LYS 563 HG3 LYS 563 43.283 -3.105 11.877 227 HD2 LYS 563 HD2 LYS 563 42.332 -2.353 14.160 228 HD3 LYS 563 HD3 LYS 563 43.849 -2.877 14.880 229 HE2 LYS 563 HE2 LYS 563 43.566 -0.820 12.643 230 HE3 LYS 563 HE3 LYS 563 43.700 -0.421 14.354 231 HZ1 LYS 563 HZ1 LYS 563 45.796 -1.801 12.777 232 HZ2 LYS 563 HZ2 LYS 563 45.888 -1.481 14.378 233 HZ3 LYS 563 HZ3 LYS 563 45.850 -0.258 13.315 234 H CYS 564 H CYS 564 40.951 -2.770 11.080 235 HA CYS 564 HA CYS 564 40.591 -4.463 8.672 236 HB2 CYS 564 HB2 CYS 564 39.053 -2.419 9.145 237 HB3 CYS 564 HB3 CYS 564 40.447 -1.432 8.840 238 HA PRO 565 HA PRO 565 45.093 -3.490 8.348 239 HB2 PRO 565 HB2 PRO 565 45.725 -5.254 6.345 240 HB3 PRO 565 HB3 PRO 565 45.536 -5.746 8.054 241 HG2 PRO 565 HG2 PRO 565 43.454 -5.879 5.845 242 HG3 PRO 565 HG3 PRO 565 43.960 -7.188 6.962 243 HD2 PRO 565 HD2 PRO 565 41.757 -5.726 7.485 244 HD3 PRO 565 HD3 PRO 565 42.884 -6.125 8.808 245 H ILE 566 H ILE 566 42.546 -3.303 5.947 246 HA ILE 566 HA ILE 566 44.123 -2.184 3.797 247 HB ILE 566 HB ILE 566 41.138 -2.190 4.283 248 HG12 ILE 566 HG12 ILE 566 42.827 -3.965 2.451 249 HG13 ILE 566 HG13 ILE 566 42.254 -4.462 4.037 250 HG21 ILE 566 HG21 ILE 566 41.729 -0.374 2.727 251 HG22 ILE 566 HG22 ILE 566 42.731 -1.481 1.770 252 HG23 ILE 566 HG23 ILE 566 40.972 -1.665 1.812 253 HD11 ILE 566 HD11 ILE 566 40.820 -5.408 2.351 254 HD12 ILE 566 HD12 ILE 566 39.904 -4.228 3.302 255 HD13 ILE 566 HD13 ILE 566 40.471 -3.822 1.661 256 H CYS 567 H CYS 567 41.684 -0.638 5.978 257 HA CYS 567 HA CYS 567 42.887 1.994 5.364 258 HB2 CYS 567 HB2 CYS 567 40.875 2.976 6.023 259 HB3 CYS 567 HB3 CYS 567 40.477 1.658 4.917 260 H LYS 568 H LYS 568 43.375 -0.288 7.632 261 HA LYS 568 HA LYS 568 44.313 -0.426 9.692 262 HB2 LYS 568 HB2 LYS 568 45.344 2.377 9.138 263 HB3 LYS 568 HB3 LYS 568 45.864 1.305 10.423 264 HG2 LYS 568 HG2 LYS 568 47.504 0.975 8.881 265 HG3 LYS 568 HG3 LYS 568 46.450 -0.410 8.591 266 HD2 LYS 568 HD2 LYS 568 45.497 0.729 6.611 267 HD3 LYS 568 HD3 LYS 568 46.474 2.160 6.927 268 HE2 LYS 568 HE2 LYS 568 47.560 -0.632 6.344 269 HE3 LYS 568 HE3 LYS 568 47.296 0.604 5.119 270 HZ1 LYS 568 HZ1 LYS 568 49.592 0.598 5.838 271 HZ2 LYS 568 HZ2 LYS 568 49.186 0.859 7.395 272 HZ3 LYS 568 HZ3 LYS 568 48.903 2.014 6.278 273 H GLU 569 H GLU 569 41.660 -0.122 9.804 274 HA GLU 569 HA GLU 569 41.215 1.645 12.207 275 HB2 GLU 569 HB2 GLU 569 39.357 0.904 9.932 276 HB3 GLU 569 HB3 GLU 569 38.775 1.611 11.419 277 HG2 GLU 569 HG2 GLU 569 40.741 2.942 9.525 278 HG3 GLU 569 HG3 GLU 569 39.028 3.311 9.672 279 H THR 570 H THR 570 38.954 0.756 13.260 280 HA THR 570 HA THR 570 39.165 -2.213 13.580 281 HB THR 570 HB THR 570 38.640 -0.259 15.851 282 HG1 THR 570 HG1 THR 570 40.798 -0.332 15.248 283 HG21 THR 570 HG21 THR 570 38.862 -2.274 17.283 284 HG22 THR 570 HG22 THR 570 38.916 -3.296 15.826 285 HG23 THR 570 HG23 THR 570 37.451 -2.369 16.221 286 H VAL 571 H VAL 571 37.277 -3.230 13.222 287 HA VAL 571 HA VAL 571 34.737 -1.676 13.143 288 HB VAL 571 HB VAL 571 35.507 -3.204 11.221 289 HG11 VAL 571 HG11 VAL 571 36.035 -5.200 12.572 290 HG12 VAL 571 HG12 VAL 571 34.314 -5.369 12.982 291 HG13 VAL 571 HG13 VAL 571 34.848 -5.498 11.294 292 HG21 VAL 571 HG21 VAL 571 33.216 -3.694 10.652 293 HG22 VAL 571 HG22 VAL 571 32.696 -3.575 12.342 294 HG23 VAL 571 HG23 VAL 571 33.257 -2.130 11.464 295 H THR 572 H THR 572 32.951 -2.256 14.393 296 HA THR 572 HA THR 572 33.445 -4.090 16.709 297 HB THR 572 HB THR 572 32.354 -2.424 18.167 298 HG1 THR 572 HG1 THR 572 31.279 -1.220 16.579 299 HG21 THR 572 HG21 THR 572 34.841 -2.496 18.043 300 HG22 THR 572 HG22 THR 572 34.232 -0.868 18.390 301 HG23 THR 572 HG23 THR 572 34.798 -1.250 16.764 302 H GLY 573 H GLY 573 31.693 -5.151 17.554 303 HA2 GLY 573 HA2 GLY 573 29.486 -5.693 15.816 304 HA3 GLY 573 HA3 GLY 573 29.709 -6.285 17.462 305 H VAL 574 H VAL 574 27.266 -5.356 16.112 306 HA VAL 574 HA VAL 574 26.356 -3.589 18.283 307 HB VAL 574 HB VAL 574 26.884 -2.205 16.269 308 HG11 VAL 574 HG11 VAL 574 26.207 -3.788 14.489 309 HG12 VAL 574 HG12 VAL 574 24.501 -3.539 14.921 310 HG13 VAL 574 HG13 VAL 574 25.463 -2.183 14.316 311 HG21 VAL 574 HG21 VAL 574 24.839 -0.878 16.297 312 HG22 VAL 574 HG22 VAL 574 23.934 -2.231 16.995 313 HG23 VAL 574 HG23 VAL 574 25.226 -1.450 17.930 314 H TYR 575 H TYR 575 24.288 -3.975 19.070 315 HA TYR 575 HA TYR 575 23.162 -6.548 18.440 316 HB2 TYR 575 HB2 TYR 575 23.186 -5.539 20.687 317 HB3 TYR 575 HB3 TYR 575 22.070 -4.292 20.156 318 HD1 TYR 575 HD1 TYR 575 19.687 -4.760 20.017 319 HD2 TYR 575 HD2 TYR 575 22.495 -7.942 20.784 320 HE1 TYR 575 HE1 TYR 575 17.809 -6.269 20.654 321 HE2 TYR 575 HE2 TYR 575 20.629 -9.432 21.455 322 HH TYR 575 HH TYR 575 18.363 -9.594 21.807 323 H ASP 576 H ASP 576 21.827 -7.053 16.801 324 HA ASP 576 HA ASP 576 20.115 -5.047 15.469 325 HB2 ASP 576 HB2 ASP 576 21.299 -6.687 14.073 326 HB3 ASP 576 HB3 ASP 576 20.527 -8.014 14.944 327 H GLU 577 H GLU 577 18.112 -4.674 16.252 328 HA GLU 577 HA GLU 577 16.919 -6.307 18.317 329 HB2 GLU 577 HB2 GLU 577 15.860 -3.952 16.721 330 HB3 GLU 577 HB3 GLU 577 15.044 -4.678 18.114 331 HG2 GLU 577 HG2 GLU 577 17.097 -4.196 19.500 332 HG3 GLU 577 HG3 GLU 577 17.771 -3.305 18.138 333 H GLU 578 H GLU 578 16.591 -6.404 14.816 334 HA GLU 578 HA GLU 578 14.005 -7.802 14.839 335 HB2 GLU 578 HB2 GLU 578 16.037 -7.026 12.752 336 HB3 GLU 578 HB3 GLU 578 14.903 -8.312 12.380 337 HG2 GLU 578 HG2 GLU 578 14.087 -5.547 13.345 338 HG3 GLU 578 HG3 GLU 578 14.184 -6.009 11.663 339 H SER 579 H SER 579 17.389 -8.904 14.136 340 HA SER 579 HA SER 579 16.629 -11.695 14.267 341 HB2 SER 579 HB2 SER 579 18.549 -10.803 12.932 342 HB3 SER 579 HB3 SER 579 19.400 -10.459 14.449 343 HG SER 579 HG SER 579 19.292 -12.712 14.902 344 H GLY 580 H GLY 580 17.759 -9.302 16.616 345 HA2 GLY 580 HA2 GLY 580 17.753 -9.359 18.911 346 HA3 GLY 580 HA3 GLY 580 17.239 -11.047 18.901 347 H GLU 581 H GLU 581 20.085 -9.687 17.193 348 HA GLU 581 HA GLU 581 21.990 -11.161 18.910 349 HB2 GLU 581 HB2 GLU 581 21.583 -11.702 15.941 350 HB3 GLU 581 HB3 GLU 581 22.977 -12.236 16.841 351 HG2 GLU 581 HG2 GLU 581 20.102 -13.125 17.314 352 HG3 GLU 581 HG3 GLU 581 21.347 -14.035 16.497 353 H TRP 582 H TRP 582 24.175 -10.553 18.634 354 HA TRP 582 HA TRP 582 24.600 -7.825 17.701 355 HB2 TRP 582 HB2 TRP 582 26.474 -9.918 18.850 356 HB3 TRP 582 HB3 TRP 582 26.923 -8.266 18.441 357 HD1 TRP 582 HD1 TRP 582 24.787 -10.205 20.963 358 HE1 TRP 582 HE1 TRP 582 24.370 -8.747 23.036 359 HE3 TRP 582 HE3 TRP 582 26.957 -5.873 19.345 360 HZ2 TRP 582 HZ2 TRP 582 24.781 -5.993 23.826 361 HZ3 TRP 582 HZ3 TRP 582 26.922 -3.845 20.767 362 HH2 TRP 582 HH2 TRP 582 25.803 -3.873 22.976 363 H VAL 583 H VAL 583 25.557 -7.143 15.859 364 HA VAL 583 HA VAL 583 26.739 -9.090 13.942 365 HB VAL 583 HB VAL 583 25.703 -7.604 12.165 366 HG11 VAL 583 HG11 VAL 583 24.836 -9.874 12.644 367 HG12 VAL 583 HG12 VAL 583 23.793 -9.211 13.926 368 HG13 VAL 583 HG13 VAL 583 23.513 -8.775 12.231 369 HG21 VAL 583 HG21 VAL 583 25.006 -5.703 13.549 370 HG22 VAL 583 HG22 VAL 583 23.695 -6.404 12.572 371 HG23 VAL 583 HG23 VAL 583 23.761 -6.724 14.315 372 H TRP 584 H TRP 584 28.407 -8.496 12.742 373 HA TRP 584 HA TRP 584 29.818 -5.926 13.224 374 HB2 TRP 584 HB2 TRP 584 30.439 -8.576 11.911 375 HB3 TRP 584 HB3 TRP 584 31.444 -7.182 11.597 376 HD1 TRP 584 HD1 TRP 584 31.907 -5.942 14.318 377 HE1 TRP 584 HE1 TRP 584 33.193 -7.125 16.197 378 HE3 TRP 584 HE3 TRP 584 31.339 -10.786 12.763 379 HZ2 TRP 584 HZ2 TRP 584 34.103 -9.811 16.797 380 HZ3 TRP 584 HZ3 TRP 584 32.456 -12.624 13.990 381 HH2 TRP 584 HH2 TRP 584 33.842 -12.151 15.992 382 H LYS 585 H LYS 585 28.846 -4.324 12.114 383 HA LYS 585 HA LYS 585 27.472 -4.694 9.560 384 HB2 LYS 585 HB2 LYS 585 28.273 -2.169 11.073 385 HB3 LYS 585 HB3 LYS 585 27.260 -2.197 9.639 386 HG2 LYS 585 HG2 LYS 585 26.566 -3.538 12.275 387 HG3 LYS 585 HG3 LYS 585 26.019 -1.937 11.746 388 HD2 LYS 585 HD2 LYS 585 24.948 -3.033 9.739 389 HD3 LYS 585 HD3 LYS 585 25.326 -4.615 10.466 390 HE2 LYS 585 HE2 LYS 585 24.007 -4.040 12.460 391 HE3 LYS 585 HE3 LYS 585 23.716 -2.425 11.830 392 HZ1 LYS 585 HZ1 LYS 585 22.726 -4.919 10.562 393 HZ2 LYS 585 HZ2 LYS 585 22.460 -3.405 10.006 394 HZ3 LYS 585 HZ3 LYS 585 21.815 -3.871 11.424 395 H ASN 586 H ASN 586 28.048 -3.997 7.511 396 HA ASN 586 HA ASN 586 29.426 -3.811 5.735 397 HB2 ASN 586 HB2 ASN 586 29.349 -1.449 6.511 398 HB3 ASN 586 HB3 ASN 586 30.796 -1.728 7.476 399 HD21 ASN 586 HD21 ASN 586 31.734 0.074 6.255 400 HD22 ASN 586 HD22 ASN 586 32.399 -0.272 4.660 401 H THR 587 H THR 587 30.025 -6.085 7.125 402 HA THR 587 HA THR 587 33.023 -6.238 7.100 403 HB THR 587 HB THR 587 31.189 -7.534 9.123 404 HG1 THR 587 HG1 THR 587 31.650 -5.274 9.346 405 HG21 THR 587 HG21 THR 587 33.308 -8.140 10.272 406 HG22 THR 587 HG22 THR 587 34.225 -7.598 8.845 407 HG23 THR 587 HG23 THR 587 33.135 -8.996 8.741 408 H ILE 588 H ILE 588 34.002 -8.014 6.438 409 HA ILE 588 HA ILE 588 32.540 -10.339 5.334 410 HB ILE 588 HB ILE 588 32.695 -8.985 3.437 411 HG12 ILE 588 HG12 ILE 588 35.213 -10.682 3.320 412 HG13 ILE 588 HG13 ILE 588 33.573 -11.356 3.197 413 HG21 ILE 588 HG21 ILE 588 35.582 -8.395 4.157 414 HG22 ILE 588 HG22 ILE 588 34.783 -7.859 2.657 415 HG23 ILE 588 HG23 ILE 588 34.237 -7.232 4.208 416 HD11 ILE 588 HD11 ILE 588 33.213 -9.894 1.164 417 HD12 ILE 588 HD12 ILE 588 34.955 -9.518 1.219 418 HD13 ILE 588 HD13 ILE 588 34.430 -11.185 0.993 419 H GLU 589 H GLU 589 33.694 -12.239 5.346 420 HA GLU 589 HA GLU 589 36.375 -12.246 6.658 421 HB2 GLU 589 HB2 GLU 589 34.604 -13.092 8.165 422 HB3 GLU 589 HB3 GLU 589 34.195 -14.330 6.959 423 HG2 GLU 589 HG2 GLU 589 36.535 -15.195 7.095 424 HG3 GLU 589 HG3 GLU 589 36.892 -13.977 8.315 425 H VAL 590 H VAL 590 37.904 -12.956 5.346 426 HA VAL 590 HA VAL 590 37.452 -14.993 3.240 427 HB VAL 590 HB VAL 590 38.164 -12.094 2.758 428 HG11 VAL 590 HG11 VAL 590 40.077 -13.254 1.752 429 HG12 VAL 590 HG12 VAL 590 38.986 -14.432 0.969 430 HG13 VAL 590 HG13 VAL 590 38.985 -12.735 0.476 431 HG21 VAL 590 HG21 VAL 590 35.853 -12.819 2.288 432 HG22 VAL 590 HG22 VAL 590 36.695 -12.367 0.802 433 HG23 VAL 590 HG23 VAL 590 36.458 -14.086 1.210 434 H ASN 591 H ASN 591 38.955 -16.342 3.047 435 HA ASN 591 HA ASN 591 40.818 -17.540 3.532 436 HB2 ASN 591 HB2 ASN 591 42.076 -14.861 2.824 437 HB3 ASN 591 HB3 ASN 591 42.873 -16.437 2.785 438 HD21 ASN 591 HD21 ASN 591 42.611 -14.631 0.550 439 HD22 ASN 591 HD22 ASN 591 41.668 -15.503 -0.654 440 H GLY 592 H GLY 592 39.660 -16.945 5.864 441 HA2 GLY 592 HA2 GLY 592 40.053 -17.180 8.103 442 HA3 GLY 592 HA3 GLY 592 41.783 -17.280 7.776 443 H LYS 593 H LYS 593 40.433 -14.366 6.571 444 HA LYS 593 HA LYS 593 41.199 -12.800 8.994 445 HB2 LYS 593 HB2 LYS 593 41.894 -12.314 6.074 446 HB3 LYS 593 HB3 LYS 593 42.161 -11.136 7.363 447 HG2 LYS 593 HG2 LYS 593 43.682 -12.629 8.530 448 HG3 LYS 593 HG3 LYS 593 43.420 -13.924 7.364 449 HD2 LYS 593 HD2 LYS 593 44.604 -11.207 6.665 450 HD3 LYS 593 HD3 LYS 593 45.558 -12.628 7.059 451 HE2 LYS 593 HE2 LYS 593 43.604 -12.448 4.725 452 HE3 LYS 593 HE3 LYS 593 45.344 -12.194 4.618 453 HZ1 LYS 593 HZ1 LYS 593 44.028 -14.741 5.370 454 HZ2 LYS 593 HZ2 LYS 593 45.647 -14.494 5.411 455 HZ3 LYS 593 HZ3 LYS 593 44.838 -14.440 4.001 456 H TYR 594 H TYR 594 40.244 -10.785 9.252 457 HA TYR 594 HA TYR 594 37.576 -10.457 7.953 458 HB2 TYR 594 HB2 TYR 594 38.745 -9.270 10.478 459 HB3 TYR 594 HB3 TYR 594 37.211 -8.783 9.790 460 HD1 TYR 594 HD1 TYR 594 35.416 -10.531 9.320 461 HD2 TYR 594 HD2 TYR 594 38.752 -11.180 11.975 462 HE1 TYR 594 HE1 TYR 594 34.188 -12.396 10.399 463 HE2 TYR 594 HE2 TYR 594 37.517 -13.040 13.073 464 HH TYR 594 HH TYR 594 34.372 -14.179 11.891 465 H PHE 595 H PHE 595 36.911 -8.624 7.062 466 HA PHE 595 HA PHE 595 38.673 -6.271 6.763 467 HB2 PHE 595 HB2 PHE 595 37.538 -7.746 4.353 468 HB3 PHE 595 HB3 PHE 595 38.462 -6.281 4.307 469 HD1 PHE 595 HD1 PHE 595 38.522 -9.919 4.447 470 HD2 PHE 595 HD2 PHE 595 40.959 -6.383 4.820 471 HE1 PHE 595 HE1 PHE 595 40.558 -11.286 4.081 472 HE2 PHE 595 HE2 PHE 595 42.997 -7.754 4.398 473 HZ PHE 595 HZ PHE 595 42.795 -10.197 4.033 474 H HIS 596 H HIS 596 37.505 -4.418 5.813 475 HA HIS 596 HA HIS 596 34.627 -4.317 6.468 476 HB2 HIS 596 HB2 HIS 596 36.623 -2.404 5.270 477 HB3 HIS 596 HB3 HIS 596 34.926 -2.023 5.205 478 HD2 HIS 596 HD2 HIS 596 33.998 -2.414 8.233 479 HE1 HIS 596 HE1 HIS 596 37.294 0.131 9.161 480 HE2 HIS 596 HE2 HIS 596 35.078 -0.815 10.010 481 H SER 597 H SER 597 32.972 -4.324 4.838 482 HA SER 597 HA SER 597 33.650 -5.743 2.414 483 HB2 SER 597 HB2 SER 597 31.458 -5.950 3.647 484 HB3 SER 597 HB3 SER 597 31.009 -4.371 2.992 485 HG SER 597 HG SER 597 31.619 -6.756 1.568 486 H THR 598 H THR 598 32.768 -2.299 2.989 487 HA THR 598 HA THR 598 33.023 -1.401 0.294 488 HB THR 598 HB THR 598 33.632 0.823 1.342 489 HG1 THR 598 HG1 THR 598 34.529 0.341 3.235 490 HG21 THR 598 HG21 THR 598 31.292 0.241 0.879 491 HG22 THR 598 HG22 THR 598 31.461 1.243 2.331 492 HG23 THR 598 HG23 THR 598 31.150 -0.493 2.498 493 H CYS 599 H CYS 599 35.559 -1.838 2.774 494 HA CYS 599 HA CYS 599 37.691 -0.730 1.204 495 HB2 CYS 599 HB2 CYS 599 37.670 -2.643 3.562 496 HB3 CYS 599 HB3 CYS 599 39.115 -1.904 2.925 497 H TYR 600 H TYR 600 36.835 -4.175 1.904 498 HA TYR 600 HA TYR 600 38.852 -5.233 0.183 499 HB2 TYR 600 HB2 TYR 600 37.826 -6.386 2.119 500 HB3 TYR 600 HB3 TYR 600 36.335 -6.578 1.221 501 HD1 TYR 600 HD1 TYR 600 39.901 -7.569 1.509 502 HD2 TYR 600 HD2 TYR 600 36.214 -8.240 -0.632 503 HE1 TYR 600 HE1 TYR 600 40.915 -9.533 0.390 504 HE2 TYR 600 HE2 TYR 600 37.239 -10.224 -1.753 505 HH TYR 600 HH TYR 600 40.632 -11.178 -1.188 506 H HIS 601 H HIS 601 35.427 -4.448 -0.521 507 HA HIS 601 HA HIS 601 35.180 -5.626 -3.071 508 HB2 HIS 601 HB2 HIS 601 33.331 -4.651 -1.790 509 HB3 HIS 601 HB3 HIS 601 34.023 -3.036 -1.959 510 HD2 HIS 601 HD2 HIS 601 33.360 -1.679 -4.104 511 HE1 HIS 601 HE1 HIS 601 31.209 -4.716 -6.171 512 HE2 HIS 601 HE2 HIS 601 31.820 -2.256 -6.160 513 H GLU 602 H GLU 602 36.707 -2.528 -2.194 514 HA GLU 602 HA GLU 602 37.350 -1.928 -5.024 515 HB2 GLU 602 HB2 GLU 602 37.918 -0.423 -2.444 516 HB3 GLU 602 HB3 GLU 602 38.345 0.131 -4.071 517 HG2 GLU 602 HG2 GLU 602 35.934 0.019 -4.716 518 HG3 GLU 602 HG3 GLU 602 35.520 -0.397 -3.058 519 H THR 603 H THR 603 38.950 -3.303 -2.217 520 HA THR 603 HA THR 603 41.656 -2.805 -3.227 521 HB THR 603 HB THR 603 40.652 -4.358 -0.826 522 HG1 THR 603 HG1 THR 603 40.321 -2.174 -0.720 523 HG21 THR 603 HG21 THR 603 43.495 -3.555 -1.582 524 HG22 THR 603 HG22 THR 603 42.885 -5.211 -1.340 525 HG23 THR 603 HG23 THR 603 42.989 -4.099 0.031 526 H SER 604 H SER 604 39.484 -5.641 -3.093 527 HA SER 604 HA SER 604 41.398 -7.528 -4.166 528 HB2 SER 604 HB2 SER 604 39.443 -8.905 -4.689 529 HB3 SER 604 HB3 SER 604 39.417 -8.315 -3.023 530 HG SER 604 HG SER 604 37.854 -6.869 -3.560 531 H GLN 605 H GLN 605 41.577 -8.317 -6.320 532 HA GLN 605 HA GLN 605 41.722 -6.236 -8.253 533 HB2 GLN 605 HB2 GLN 605 42.573 -7.845 -9.775 534 HB3 GLN 605 HB3 GLN 605 43.245 -8.159 -8.185 535 HG2 GLN 605 HG2 GLN 605 41.611 -10.052 -7.901 536 HG3 GLN 605 HG3 GLN 605 40.988 -9.726 -9.524 537 HE21 GLN 605 HE21 GLN 605 41.907 -11.006 -11.129 538 HE22 GLN 605 HE22 GLN 605 43.511 -11.720 -11.010 539 H ASN 606 H ASN 606 40.657 -5.872 -10.215 540 HA ASN 606 HA ASN 606 37.842 -5.899 -9.993 541 HB2 ASN 606 HB2 ASN 606 39.042 -4.147 -11.184 542 HB3 ASN 606 HB3 ASN 606 39.653 -5.310 -12.370 543 HD21 ASN 606 HD21 ASN 606 36.477 -4.169 -11.019 544 HD22 ASN 606 HD22 ASN 606 35.639 -4.378 -12.549 545 H SER 607 H SER 607 36.259 -7.208 -10.610 546 HA SER 607 HA SER 607 36.855 -9.722 -12.083 547 HB2 SER 607 HB2 SER 607 34.911 -10.594 -10.856 548 HB3 SER 607 HB3 SER 607 36.156 -9.966 -9.768 549 HG SER 607 HG SER 607 34.017 -9.273 -9.220 550 H SER 608 H SER 608 35.568 -6.786 -12.876 551 HA SER 608 HA SER 608 33.043 -7.274 -14.042 552 HB2 SER 608 HB2 SER 608 35.153 -5.272 -14.924 553 HB3 SER 608 HB3 SER 608 33.427 -5.198 -15.282 554 HG SER 608 HG SER 608 33.004 -4.949 -13.085 Start of MODEL 18 1 H1 GLY 533 H1 GLY 533 21.202 -1.575 -5.458 2 H2 GLY 533 H2 GLY 533 19.728 -1.264 -6.107 3 H3 GLY 533 H3 GLY 533 20.173 -0.543 -4.703 4 HA2 GLY 533 HA2 GLY 533 20.320 1.037 -6.519 5 HA3 GLY 533 HA3 GLY 533 21.904 0.708 -5.797 6 H GLY 534 H GLY 534 20.237 0.894 -8.701 7 HA2 GLY 534 HA2 GLY 534 22.473 -0.151 -10.278 8 HA3 GLY 534 HA3 GLY 534 21.008 -1.132 -10.369 9 H SER 535 H SER 535 20.835 2.377 -10.016 10 HA SER 535 HA SER 535 20.339 2.979 -12.829 11 HB2 SER 535 HB2 SER 535 17.978 3.581 -12.512 12 HB3 SER 535 HB3 SER 535 18.231 1.859 -12.228 13 HG SER 535 HG SER 535 16.919 2.871 -10.622 14 H GLU 536 H GLU 536 19.600 5.235 -13.070 15 HA GLU 536 HA GLU 536 19.822 7.420 -12.900 16 HB2 GLU 536 HB2 GLU 536 18.659 8.481 -11.200 17 HB3 GLU 536 HB3 GLU 536 17.880 6.931 -11.474 18 HG2 GLU 536 HG2 GLU 536 18.700 6.046 -9.401 19 HG3 GLU 536 HG3 GLU 536 19.882 7.342 -9.220 20 H PHE 537 H PHE 537 22.280 5.879 -11.264 21 HA PHE 537 HA PHE 537 23.832 8.384 -11.339 22 HB2 PHE 537 HB2 PHE 537 24.643 8.347 -9.192 23 HB3 PHE 537 HB3 PHE 537 22.947 8.023 -8.973 24 HD1 PHE 537 HD1 PHE 537 26.337 6.839 -8.402 25 HD2 PHE 537 HD2 PHE 537 22.193 5.658 -8.399 26 HE1 PHE 537 HE1 PHE 537 26.901 4.878 -7.000 27 HE2 PHE 537 HE2 PHE 537 22.763 3.692 -6.995 28 HZ PHE 537 HZ PHE 537 25.115 3.306 -6.284 29 H SER 538 H SER 538 26.238 7.687 -10.576 30 HA SER 538 HA SER 538 27.456 6.652 -12.780 31 HB2 SER 538 HB2 SER 538 28.545 6.490 -9.953 32 HB3 SER 538 HB3 SER 538 29.487 6.582 -11.449 33 HG SER 538 HG SER 538 28.732 8.667 -11.763 34 H ASP 539 H ASP 539 28.609 4.857 -13.360 35 HA ASP 539 HA ASP 539 27.196 2.489 -13.261 36 HB2 ASP 539 HB2 ASP 539 30.101 2.819 -14.062 37 HB3 ASP 539 HB3 ASP 539 29.017 1.538 -14.581 38 H ARG 540 H ARG 540 29.492 3.365 -10.847 39 HA ARG 540 HA ARG 540 30.446 0.823 -9.932 40 HB2 ARG 540 HB2 ARG 540 29.764 3.436 -8.532 41 HB3 ARG 540 HB3 ARG 540 30.366 2.060 -7.630 42 HG2 ARG 540 HG2 ARG 540 31.944 3.176 -9.980 43 HG3 ARG 540 HG3 ARG 540 32.022 3.882 -8.371 44 HD2 ARG 540 HD2 ARG 540 33.851 2.426 -8.442 45 HD3 ARG 540 HD3 ARG 540 32.643 1.613 -7.449 46 HE ARG 540 HE ARG 540 32.643 0.874 -10.305 47 HH11 ARG 540 HH11 ARG 540 34.118 0.056 -7.202 48 HH12 ARG 540 HH12 ARG 540 34.534 -1.548 -7.738 49 HH21 ARG 540 HH21 ARG 540 33.191 -1.208 -10.882 50 HH22 ARG 540 HH22 ARG 540 34.058 -2.221 -9.760 51 H SER 541 H SER 541 27.365 2.400 -9.369 52 HA SER 541 HA SER 541 25.364 1.777 -8.567 53 HB2 SER 541 HB2 SER 541 26.141 -0.903 -9.745 54 HB3 SER 541 HB3 SER 541 24.506 -0.329 -9.411 55 HG SER 541 HG SER 541 26.358 0.603 -11.318 56 H ASN 542 H ASN 542 27.294 -1.115 -7.704 57 HA ASN 542 HA ASN 542 25.410 -1.962 -5.703 58 HB2 ASN 542 HB2 ASN 542 28.220 -2.951 -6.324 59 HB3 ASN 542 HB3 ASN 542 27.012 -3.815 -5.380 60 HD21 ASN 542 HD21 ASN 542 28.437 -4.179 -8.177 61 HD22 ASN 542 HD22 ASN 542 27.076 -4.671 -9.175 62 H GLU 543 H GLU 543 28.017 0.292 -5.381 63 HA GLU 543 HA GLU 543 29.109 -0.424 -2.900 64 HB2 GLU 543 HB2 GLU 543 29.901 1.839 -2.725 65 HB3 GLU 543 HB3 GLU 543 30.079 1.249 -4.375 66 HG2 GLU 543 HG2 GLU 543 28.075 2.500 -5.073 67 HG3 GLU 543 HG3 GLU 543 27.822 3.060 -3.423 68 H LEU 544 H LEU 544 26.006 1.106 -3.446 69 HA LEU 544 HA LEU 544 25.525 1.922 -0.697 70 HB2 LEU 544 HB2 LEU 544 23.587 1.445 -2.989 71 HB3 LEU 544 HB3 LEU 544 23.231 2.312 -1.500 72 HG LEU 544 HG LEU 544 25.201 3.212 -3.644 73 HD11 LEU 544 HD11 LEU 544 22.463 4.284 -2.830 74 HD12 LEU 544 HD12 LEU 544 22.830 3.358 -4.303 75 HD13 LEU 544 HD13 LEU 544 23.535 4.965 -4.071 76 HD21 LEU 544 HD21 LEU 544 25.939 4.031 -1.438 77 HD22 LEU 544 HD22 LEU 544 24.289 4.616 -1.095 78 HD23 LEU 544 HD23 LEU 544 25.255 5.348 -2.389 79 H GLU 545 H GLU 545 25.403 -1.131 -2.259 80 HA GLU 545 HA GLU 545 23.660 -2.351 -0.159 81 HB2 GLU 545 HB2 GLU 545 23.004 -2.550 -2.593 82 HB3 GLU 545 HB3 GLU 545 24.481 -3.452 -2.871 83 HG2 GLU 545 HG2 GLU 545 23.163 -4.726 -0.656 84 HG3 GLU 545 HG3 GLU 545 21.914 -4.337 -1.805 85 H ILE 546 H ILE 546 26.855 -2.550 -1.698 86 HA ILE 546 HA ILE 546 27.983 -4.800 -0.453 87 HB ILE 546 HB ILE 546 29.138 -2.095 -1.175 88 HG12 ILE 546 HG12 ILE 546 28.269 -3.713 -3.012 89 HG13 ILE 546 HG13 ILE 546 29.864 -2.987 -3.185 90 HG21 ILE 546 HG21 ILE 546 30.651 -2.936 0.507 91 HG22 ILE 546 HG22 ILE 546 30.676 -4.541 -0.251 92 HG23 ILE 546 HG23 ILE 546 31.402 -3.149 -1.084 93 HD11 ILE 546 HD11 ILE 546 29.769 -5.376 -3.836 94 HD12 ILE 546 HD12 ILE 546 30.947 -5.056 -2.548 95 HD13 ILE 546 HD13 ILE 546 29.385 -5.813 -2.155 96 H ARG 547 H ARG 547 27.621 -1.517 0.881 97 HA ARG 547 HA ARG 547 28.891 -1.983 3.413 98 HB2 ARG 547 HB2 ARG 547 27.856 0.126 4.082 99 HB3 ARG 547 HB3 ARG 547 28.524 0.262 2.459 100 HG2 ARG 547 HG2 ARG 547 26.267 -0.090 1.476 101 HG3 ARG 547 HG3 ARG 547 25.577 -0.222 3.109 102 HD2 ARG 547 HD2 ARG 547 26.260 2.081 3.584 103 HD3 ARG 547 HD3 ARG 547 26.958 2.219 1.948 104 HE ARG 547 HE ARG 547 24.329 1.357 1.569 105 HH11 ARG 547 HH11 ARG 547 25.730 4.241 2.968 106 HH12 ARG 547 HH12 ARG 547 24.339 5.224 2.557 107 HH21 ARG 547 HH21 ARG 547 22.601 2.618 1.089 108 HH22 ARG 547 HH22 ARG 547 22.601 4.306 1.524 109 H GLY 548 H GLY 548 25.776 -2.960 2.302 110 HA2 GLY 548 HA2 GLY 548 24.461 -3.080 4.906 111 HA3 GLY 548 HA3 GLY 548 23.838 -3.633 3.343 112 H LYS 549 H LYS 549 26.677 -5.152 3.301 113 HA LYS 549 HA LYS 549 25.693 -7.706 4.312 114 HB2 LYS 549 HB2 LYS 549 28.497 -6.901 3.465 115 HB3 LYS 549 HB3 LYS 549 27.910 -8.552 3.696 116 HG2 LYS 549 HG2 LYS 549 27.038 -6.587 1.540 117 HG3 LYS 549 HG3 LYS 549 28.051 -8.015 1.336 118 HD2 LYS 549 HD2 LYS 549 26.109 -9.472 1.985 119 HD3 LYS 549 HD3 LYS 549 25.100 -8.016 2.144 120 HE2 LYS 549 HE2 LYS 549 25.586 -7.421 -0.216 121 HE3 LYS 549 HE3 LYS 549 26.535 -8.896 -0.392 122 HZ1 LYS 549 HZ1 LYS 549 23.648 -8.830 0.272 123 HZ2 LYS 549 HZ2 LYS 549 24.532 -10.187 0.033 124 HZ3 LYS 549 HZ3 LYS 549 24.254 -9.161 -1.204 125 H TYR 550 H TYR 550 26.272 -8.830 6.135 126 HA TYR 550 HA TYR 550 28.234 -7.764 8.018 127 HB2 TYR 550 HB2 TYR 550 26.643 -7.674 9.927 128 HB3 TYR 550 HB3 TYR 550 26.276 -6.472 8.732 129 HD1 TYR 550 HD1 TYR 550 24.140 -6.437 7.602 130 HD2 TYR 550 HD2 TYR 550 25.205 -9.759 10.145 131 HE1 TYR 550 HE1 TYR 550 21.806 -7.245 7.513 132 HE2 TYR 550 HE2 TYR 550 22.844 -10.556 10.064 133 HH TYR 550 HH TYR 550 20.314 -8.834 8.209 134 H VAL 551 H VAL 551 28.509 -9.085 9.910 135 HA VAL 551 HA VAL 551 27.686 -11.926 9.652 136 HB VAL 551 HB VAL 551 30.091 -12.401 10.610 137 HG11 VAL 551 HG11 VAL 551 29.154 -13.303 8.493 138 HG12 VAL 551 HG12 VAL 551 29.606 -11.800 7.664 139 HG13 VAL 551 HG13 VAL 551 30.865 -12.870 8.324 140 HG21 VAL 551 HG21 VAL 551 31.883 -11.112 9.652 141 HG22 VAL 551 HG22 VAL 551 30.754 -9.971 8.893 142 HG23 VAL 551 HG23 VAL 551 30.890 -10.054 10.664 143 H VAL 552 H VAL 552 27.059 -12.878 11.514 144 HA VAL 552 HA VAL 552 26.447 -11.121 13.716 145 HB VAL 552 HB VAL 552 24.925 -12.865 12.932 146 HG11 VAL 552 HG11 VAL 552 26.762 -14.877 14.285 147 HG12 VAL 552 HG12 VAL 552 25.186 -15.195 13.533 148 HG13 VAL 552 HG13 VAL 552 26.553 -14.697 12.531 149 HG21 VAL 552 HG21 VAL 552 24.170 -13.687 15.117 150 HG22 VAL 552 HG22 VAL 552 25.680 -13.116 15.860 151 HG23 VAL 552 HG23 VAL 552 24.532 -11.966 15.124 152 H VAL 553 H VAL 553 27.355 -10.877 15.662 153 HA VAL 553 HA VAL 553 29.995 -12.068 16.208 154 HB VAL 553 HB VAL 553 28.595 -10.031 17.977 155 HG11 VAL 553 HG11 VAL 553 31.465 -11.020 17.558 156 HG12 VAL 553 HG12 VAL 553 31.024 -9.644 18.558 157 HG13 VAL 553 HG13 VAL 553 30.455 -11.258 19.005 158 HG21 VAL 553 HG21 VAL 553 30.155 -8.371 16.943 159 HG22 VAL 553 HG22 VAL 553 30.454 -9.537 15.637 160 HG23 VAL 553 HG23 VAL 553 28.823 -8.858 15.873 161 HA PRO 554 HA PRO 554 27.859 -14.852 19.137 162 HB2 PRO 554 HB2 PRO 554 29.888 -16.550 19.661 163 HB3 PRO 554 HB3 PRO 554 29.012 -16.548 18.092 164 HG2 PRO 554 HG2 PRO 554 31.667 -15.292 18.734 165 HG3 PRO 554 HG3 PRO 554 31.238 -16.319 17.332 166 HD2 PRO 554 HD2 PRO 554 31.239 -13.553 17.264 167 HD3 PRO 554 HD3 PRO 554 30.163 -14.551 16.239 168 H GLU 555 H GLU 555 27.796 -14.795 21.385 169 HA GLU 555 HA GLU 555 29.133 -12.669 22.739 170 HB2 GLU 555 HB2 GLU 555 26.935 -13.635 23.342 171 HB3 GLU 555 HB3 GLU 555 27.739 -15.106 23.917 172 HG2 GLU 555 HG2 GLU 555 28.786 -13.910 25.728 173 HG3 GLU 555 HG3 GLU 555 28.389 -12.351 25.012 174 H THR 556 H THR 556 30.191 -15.951 22.198 175 HA THR 556 HA THR 556 32.273 -16.074 24.199 176 HB THR 556 HB THR 556 33.129 -17.952 22.812 177 HG1 THR 556 HG1 THR 556 32.601 -17.411 20.773 178 HG21 THR 556 HG21 THR 556 31.338 -18.365 24.488 179 HG22 THR 556 HG22 THR 556 31.248 -19.456 23.092 180 HG23 THR 556 HG23 THR 556 30.115 -18.088 23.231 181 H SER 557 H SER 557 32.100 -14.376 21.150 182 HA SER 557 HA SER 557 34.973 -14.170 20.757 183 HB2 SER 557 HB2 SER 557 33.388 -14.083 18.891 184 HB3 SER 557 HB3 SER 557 32.772 -12.527 19.481 185 HG SER 557 HG SER 557 34.875 -11.707 19.190 186 H GLN 558 H GLN 558 34.549 -13.550 23.342 187 HA GLN 558 HA GLN 558 34.963 -12.087 25.015 188 HB2 GLN 558 HB2 GLN 558 37.068 -12.861 23.978 189 HB3 GLN 558 HB3 GLN 558 37.178 -11.351 23.082 190 HG2 GLN 558 HG2 GLN 558 37.296 -10.096 25.228 191 HG3 GLN 558 HG3 GLN 558 37.100 -11.601 26.128 192 HE21 GLN 558 HE21 GLN 558 39.210 -10.443 27.006 193 HE22 GLN 558 HE22 GLN 558 40.695 -11.047 26.276 194 H ASP 559 H ASP 559 36.240 -9.604 22.900 195 HA ASP 559 HA ASP 559 34.437 -7.640 24.180 196 HB2 ASP 559 HB2 ASP 559 37.037 -7.305 22.654 197 HB3 ASP 559 HB3 ASP 559 36.116 -5.991 23.374 198 H MET 560 H MET 560 34.088 -9.329 21.388 199 HA MET 560 HA MET 560 33.008 -9.037 19.445 200 HB2 MET 560 HB2 MET 560 31.658 -6.677 20.823 201 HB3 MET 560 HB3 MET 560 31.093 -7.509 19.382 202 HG2 MET 560 HG2 MET 560 30.938 -9.630 20.742 203 HG3 MET 560 HG3 MET 560 31.303 -8.687 22.179 204 HE1 MET 560 HE1 MET 560 27.295 -9.782 21.500 205 HE2 MET 560 HE2 MET 560 28.566 -10.365 20.407 206 HE3 MET 560 HE3 MET 560 28.794 -10.444 22.174 207 H ALA 561 H ALA 561 35.612 -7.883 19.411 208 HA ALA 561 HA ALA 561 35.207 -5.847 17.277 209 HB1 ALA 561 HB1 ALA 561 37.127 -5.571 19.619 210 HB2 ALA 561 HB2 ALA 561 36.942 -4.424 18.277 211 HB3 ALA 561 HB3 ALA 561 35.607 -4.670 19.424 212 H PHE 562 H PHE 562 36.823 -5.550 15.774 213 HA PHE 562 HA PHE 562 39.286 -7.108 15.799 214 HB2 PHE 562 HB2 PHE 562 37.381 -8.579 14.771 215 HB3 PHE 562 HB3 PHE 562 37.437 -7.468 13.415 216 HD1 PHE 562 HD1 PHE 562 39.294 -10.002 15.376 217 HD2 PHE 562 HD2 PHE 562 39.334 -7.576 11.814 218 HE1 PHE 562 HE1 PHE 562 41.191 -11.335 14.485 219 HE2 PHE 562 HE2 PHE 562 41.253 -8.881 10.944 220 HZ PHE 562 HZ PHE 562 42.180 -10.772 12.272 221 H LYS 563 H LYS 563 40.542 -6.438 13.579 222 HA LYS 563 HA LYS 563 39.874 -3.582 12.942 223 HB2 LYS 563 HB2 LYS 563 41.653 -3.635 14.581 224 HB3 LYS 563 HB3 LYS 563 42.611 -4.734 13.562 225 HG2 LYS 563 HG2 LYS 563 42.899 -3.019 11.875 226 HG3 LYS 563 HG3 LYS 563 41.718 -1.974 12.656 227 HD2 LYS 563 HD2 LYS 563 43.947 -1.148 13.011 228 HD3 LYS 563 HD3 LYS 563 43.200 -1.562 14.541 229 HE2 LYS 563 HE2 LYS 563 44.981 -3.574 13.135 230 HE3 LYS 563 HE3 LYS 563 45.714 -2.203 13.949 231 HZ1 LYS 563 HZ1 LYS 563 44.622 -2.887 16.012 232 HZ2 LYS 563 HZ2 LYS 563 45.560 -4.087 15.447 233 HZ3 LYS 563 HZ3 LYS 563 43.944 -4.185 15.284 234 H CYS 564 H CYS 564 39.719 -3.061 10.923 235 HA CYS 564 HA CYS 564 40.025 -4.806 8.682 236 HB2 CYS 564 HB2 CYS 564 38.503 -2.764 8.890 237 HB3 CYS 564 HB3 CYS 564 39.920 -1.769 8.787 238 HA PRO 565 HA PRO 565 44.544 -4.079 8.391 239 HB2 PRO 565 HB2 PRO 565 44.125 -5.712 5.890 240 HB3 PRO 565 HB3 PRO 565 45.420 -5.853 7.113 241 HG2 PRO 565 HG2 PRO 565 43.354 -7.601 7.109 242 HG3 PRO 565 HG3 PRO 565 43.911 -6.895 8.667 243 HD2 PRO 565 HD2 PRO 565 41.530 -6.070 6.977 244 HD3 PRO 565 HD3 PRO 565 41.643 -6.313 8.727 245 H ILE 566 H ILE 566 42.174 -3.421 5.842 246 HA ILE 566 HA ILE 566 44.027 -2.208 3.977 247 HB ILE 566 HB ILE 566 41.008 -2.226 4.133 248 HG12 ILE 566 HG12 ILE 566 42.908 -3.668 2.211 249 HG13 ILE 566 HG13 ILE 566 42.266 -4.406 3.675 250 HG21 ILE 566 HG21 ILE 566 42.791 -1.144 1.905 251 HG22 ILE 566 HG22 ILE 566 41.044 -1.405 1.743 252 HG23 ILE 566 HG23 ILE 566 41.641 -0.213 2.886 253 HD11 ILE 566 HD11 ILE 566 39.945 -4.121 2.796 254 HD12 ILE 566 HD12 ILE 566 40.638 -3.547 1.255 255 HD13 ILE 566 HD13 ILE 566 40.972 -5.185 1.815 256 H CYS 567 H CYS 567 41.430 -0.752 6.017 257 HA CYS 567 HA CYS 567 42.747 1.883 5.717 258 HB2 CYS 567 HB2 CYS 567 40.690 2.858 6.268 259 HB3 CYS 567 HB3 CYS 567 40.375 1.640 5.019 260 H LYS 568 H LYS 568 42.947 -0.590 7.838 261 HA LYS 568 HA LYS 568 43.684 -0.899 9.970 262 HB2 LYS 568 HB2 LYS 568 44.815 1.904 9.711 263 HB3 LYS 568 HB3 LYS 568 45.201 0.733 10.955 264 HG2 LYS 568 HG2 LYS 568 46.968 0.560 9.495 265 HG3 LYS 568 HG3 LYS 568 45.988 -0.865 9.151 266 HD2 LYS 568 HD2 LYS 568 45.204 0.136 7.060 267 HD3 LYS 568 HD3 LYS 568 45.883 1.706 7.510 268 HE2 LYS 568 HE2 LYS 568 47.250 0.669 5.828 269 HE3 LYS 568 HE3 LYS 568 48.165 0.781 7.326 270 HZ1 LYS 568 HZ1 LYS 568 46.740 -1.680 6.461 271 HZ2 LYS 568 HZ2 LYS 568 47.780 -1.566 7.708 272 HZ3 LYS 568 HZ3 LYS 568 48.332 -1.424 6.186 273 H GLU 569 H GLU 569 41.016 -0.515 9.893 274 HA GLU 569 HA GLU 569 40.479 1.330 12.216 275 HB2 GLU 569 HB2 GLU 569 38.773 0.737 9.806 276 HB3 GLU 569 HB3 GLU 569 38.103 1.407 11.270 277 HG2 GLU 569 HG2 GLU 569 40.297 2.733 9.632 278 HG3 GLU 569 HG3 GLU 569 38.589 3.144 9.580 279 H THR 570 H THR 570 39.383 0.712 13.924 280 HA THR 570 HA THR 570 38.940 -2.149 14.332 281 HB THR 570 HB THR 570 38.415 0.191 16.184 282 HG1 THR 570 HG1 THR 570 40.575 -0.088 15.734 283 HG21 THR 570 HG21 THR 570 38.508 -2.807 16.733 284 HG22 THR 570 HG22 THR 570 37.083 -1.763 16.892 285 HG23 THR 570 HG23 THR 570 38.464 -1.528 17.969 286 H VAL 571 H VAL 571 37.188 -3.199 13.763 287 HA VAL 571 HA VAL 571 34.548 -1.878 13.501 288 HB VAL 571 HB VAL 571 35.366 -3.503 11.760 289 HG11 VAL 571 HG11 VAL 571 36.263 -5.263 13.229 290 HG12 VAL 571 HG12 VAL 571 34.618 -5.606 13.826 291 HG13 VAL 571 HG13 VAL 571 35.012 -5.888 12.125 292 HG21 VAL 571 HG21 VAL 571 33.148 -4.481 11.428 293 HG22 VAL 571 HG22 VAL 571 32.714 -4.166 13.109 294 HG23 VAL 571 HG23 VAL 571 32.994 -2.809 11.984 295 H THR 572 H THR 572 32.817 -2.377 14.868 296 HA THR 572 HA THR 572 33.349 -4.085 17.249 297 HB THR 572 HB THR 572 32.154 -2.454 18.671 298 HG1 THR 572 HG1 THR 572 31.108 -1.279 17.027 299 HG21 THR 572 HG21 THR 572 34.604 -1.233 17.341 300 HG22 THR 572 HG22 THR 572 34.645 -2.486 18.601 301 HG23 THR 572 HG23 THR 572 33.980 -0.885 18.965 302 H GLY 573 H GLY 573 31.603 -5.202 18.035 303 HA2 GLY 573 HA2 GLY 573 29.471 -5.851 16.245 304 HA3 GLY 573 HA3 GLY 573 29.620 -6.368 17.927 305 H VAL 574 H VAL 574 27.402 -5.167 16.108 306 HA VAL 574 HA VAL 574 26.392 -3.214 18.094 307 HB VAL 574 HB VAL 574 26.064 -3.163 15.050 308 HG11 VAL 574 HG11 VAL 574 24.017 -2.291 16.050 309 HG12 VAL 574 HG12 VAL 574 24.951 -1.236 17.142 310 HG13 VAL 574 HG13 VAL 574 24.939 -0.954 15.391 311 HG21 VAL 574 HG21 VAL 574 28.277 -2.358 15.709 312 HG22 VAL 574 HG22 VAL 574 27.294 -0.991 15.198 313 HG23 VAL 574 HG23 VAL 574 27.554 -1.288 16.932 314 H TYR 575 H TYR 575 24.232 -3.293 18.707 315 HA TYR 575 HA TYR 575 23.122 -5.883 18.703 316 HB2 TYR 575 HB2 TYR 575 22.843 -4.229 20.487 317 HB3 TYR 575 HB3 TYR 575 21.847 -3.229 19.434 318 HD1 TYR 575 HD1 TYR 575 19.508 -3.441 19.609 319 HD2 TYR 575 HD2 TYR 575 22.019 -6.739 20.777 320 HE1 TYR 575 HE1 TYR 575 17.519 -4.650 20.475 321 HE2 TYR 575 HE2 TYR 575 20.032 -7.968 21.624 322 HH TYR 575 HH TYR 575 17.764 -7.835 22.069 323 H ASP 576 H ASP 576 21.885 -6.952 17.380 324 HA ASP 576 HA ASP 576 20.486 -5.754 15.062 325 HB2 ASP 576 HB2 ASP 576 21.900 -7.759 14.744 326 HB3 ASP 576 HB3 ASP 576 20.926 -8.642 15.902 327 H GLU 577 H GLU 577 18.691 -4.762 15.886 328 HA GLU 577 HA GLU 577 17.143 -5.584 18.106 329 HB2 GLU 577 HB2 GLU 577 16.377 -3.830 15.742 330 HB3 GLU 577 HB3 GLU 577 15.464 -3.954 17.247 331 HG2 GLU 577 HG2 GLU 577 17.354 -3.044 18.514 332 HG3 GLU 577 HG3 GLU 577 18.346 -2.990 17.066 333 H GLU 578 H GLU 578 16.903 -6.751 14.793 334 HA GLU 578 HA GLU 578 14.125 -7.613 15.017 335 HB2 GLU 578 HB2 GLU 578 15.135 -6.972 12.855 336 HB3 GLU 578 HB3 GLU 578 16.272 -8.309 12.976 337 HG2 GLU 578 HG2 GLU 578 14.443 -8.853 11.450 338 HG3 GLU 578 HG3 GLU 578 14.463 -9.935 12.831 339 H SER 579 H SER 579 17.242 -9.414 14.897 340 HA SER 579 HA SER 579 15.948 -11.895 15.827 341 HB2 SER 579 HB2 SER 579 18.856 -11.259 15.182 342 HB3 SER 579 HB3 SER 579 18.214 -12.856 15.579 343 HG SER 579 HG SER 579 17.021 -12.833 13.714 344 H GLY 580 H GLY 580 17.742 -9.262 17.309 345 HA2 GLY 580 HA2 GLY 580 18.052 -8.810 19.540 346 HA3 GLY 580 HA3 GLY 580 17.459 -10.415 20.007 347 H GLU 581 H GLU 581 20.021 -9.699 17.647 348 HA GLU 581 HA GLU 581 22.037 -11.167 19.317 349 HB2 GLU 581 HB2 GLU 581 21.725 -11.112 16.296 350 HB3 GLU 581 HB3 GLU 581 23.007 -11.939 17.173 351 HG2 GLU 581 HG2 GLU 581 20.045 -12.608 17.250 352 HG3 GLU 581 HG3 GLU 581 21.311 -13.509 16.431 353 H TRP 582 H TRP 582 24.322 -10.594 17.924 354 HA TRP 582 HA TRP 582 24.475 -7.634 17.655 355 HB2 TRP 582 HB2 TRP 582 26.475 -9.510 18.960 356 HB3 TRP 582 HB3 TRP 582 26.777 -7.824 18.568 357 HD1 TRP 582 HD1 TRP 582 24.559 -9.958 20.860 358 HE1 TRP 582 HE1 TRP 582 23.746 -8.587 22.849 359 HE3 TRP 582 HE3 TRP 582 26.569 -5.448 19.551 360 HZ2 TRP 582 HZ2 TRP 582 23.886 -5.815 23.739 361 HZ3 TRP 582 HZ3 TRP 582 26.207 -3.454 20.980 362 HH2 TRP 582 HH2 TRP 582 24.867 -3.616 23.047 363 H VAL 583 H VAL 583 25.791 -6.900 15.960 364 HA VAL 583 HA VAL 583 26.879 -8.921 14.053 365 HB VAL 583 HB VAL 583 25.833 -7.677 12.174 366 HG11 VAL 583 HG11 VAL 583 24.884 -9.795 12.870 367 HG12 VAL 583 HG12 VAL 583 23.895 -9.002 14.118 368 HG13 VAL 583 HG13 VAL 583 23.587 -8.689 12.402 369 HG21 VAL 583 HG21 VAL 583 23.906 -6.275 12.473 370 HG22 VAL 583 HG22 VAL 583 24.004 -6.406 14.238 371 HG23 VAL 583 HG23 VAL 583 25.267 -5.546 13.323 372 H TRP 584 H TRP 584 28.480 -8.368 12.727 373 HA TRP 584 HA TRP 584 29.890 -5.773 13.106 374 HB2 TRP 584 HB2 TRP 584 30.626 -8.530 12.108 375 HB3 TRP 584 HB3 TRP 584 31.607 -7.160 11.648 376 HD1 TRP 584 HD1 TRP 584 31.482 -5.769 14.619 377 HE1 TRP 584 HE1 TRP 584 32.951 -6.740 16.481 378 HE3 TRP 584 HE3 TRP 584 32.381 -10.401 12.620 379 HZ2 TRP 584 HZ2 TRP 584 34.321 -9.213 17.053 380 HZ3 TRP 584 HZ3 TRP 584 33.753 -12.056 13.877 381 HH2 TRP 584 HH2 TRP 584 34.690 -11.476 16.103 382 H LYS 585 H LYS 585 28.938 -4.306 11.851 383 HA LYS 585 HA LYS 585 27.659 -4.867 9.302 384 HB2 LYS 585 HB2 LYS 585 28.263 -2.240 10.706 385 HB3 LYS 585 HB3 LYS 585 27.265 -2.432 9.256 386 HG2 LYS 585 HG2 LYS 585 25.798 -4.035 10.584 387 HG3 LYS 585 HG3 LYS 585 26.714 -3.574 12.027 388 HD2 LYS 585 HD2 LYS 585 25.109 -1.688 10.244 389 HD3 LYS 585 HD3 LYS 585 24.572 -2.339 11.791 390 HE2 LYS 585 HE2 LYS 585 26.437 -1.216 12.950 391 HE3 LYS 585 HE3 LYS 585 27.021 -0.558 11.424 392 HZ1 LYS 585 HZ1 LYS 585 25.662 1.060 12.612 393 HZ2 LYS 585 HZ2 LYS 585 24.373 0.064 12.609 394 HZ3 LYS 585 HZ3 LYS 585 24.939 0.666 11.205 395 H ASN 586 H ASN 586 28.166 -4.056 7.249 396 HA ASN 586 HA ASN 586 29.514 -3.963 5.461 397 HB2 ASN 586 HB2 ASN 586 29.493 -1.595 6.219 398 HB3 ASN 586 HB3 ASN 586 30.986 -1.881 7.116 399 HD21 ASN 586 HD21 ASN 586 31.808 -0.055 5.780 400 HD22 ASN 586 HD22 ASN 586 32.369 -0.434 4.154 401 H THR 587 H THR 587 30.142 -6.192 7.048 402 HA THR 587 HA THR 587 33.134 -6.346 6.889 403 HB THR 587 HB THR 587 31.308 -7.676 8.896 404 HG1 THR 587 HG1 THR 587 31.799 -5.438 9.191 405 HG21 THR 587 HG21 THR 587 33.431 -8.349 10.003 406 HG22 THR 587 HG22 THR 587 34.339 -7.806 8.580 407 HG23 THR 587 HG23 THR 587 33.204 -9.169 8.452 408 H ILE 588 H ILE 588 34.126 -8.004 6.038 409 HA ILE 588 HA ILE 588 32.669 -10.343 4.952 410 HB ILE 588 HB ILE 588 32.870 -8.829 3.122 411 HG12 ILE 588 HG12 ILE 588 35.136 -10.839 2.798 412 HG13 ILE 588 HG13 ILE 588 33.418 -11.296 2.790 413 HG21 ILE 588 HG21 ILE 588 35.873 -8.701 3.597 414 HG22 ILE 588 HG22 ILE 588 34.994 -7.882 2.292 415 HG23 ILE 588 HG23 ILE 588 34.738 -7.387 3.965 416 HD11 ILE 588 HD11 ILE 588 33.080 -9.770 0.816 417 HD12 ILE 588 HD12 ILE 588 34.836 -9.512 0.762 418 HD13 ILE 588 HD13 ILE 588 34.178 -11.130 0.506 419 H GLU 589 H GLU 589 33.844 -12.242 4.944 420 HA GLU 589 HA GLU 589 36.545 -12.243 6.228 421 HB2 GLU 589 HB2 GLU 589 34.728 -13.378 7.520 422 HB3 GLU 589 HB3 GLU 589 34.544 -14.510 6.172 423 HG2 GLU 589 HG2 GLU 589 36.968 -15.138 6.444 424 HG3 GLU 589 HG3 GLU 589 37.065 -14.044 7.823 425 H VAL 590 H VAL 590 38.208 -12.961 5.026 426 HA VAL 590 HA VAL 590 37.864 -14.901 2.871 427 HB VAL 590 HB VAL 590 37.367 -12.893 1.639 428 HG11 VAL 590 HG11 VAL 590 38.974 -11.072 1.298 429 HG12 VAL 590 HG12 VAL 590 38.460 -11.172 2.989 430 HG13 VAL 590 HG13 VAL 590 40.058 -11.781 2.520 431 HG21 VAL 590 HG21 VAL 590 38.967 -13.044 -0.144 432 HG22 VAL 590 HG22 VAL 590 40.197 -13.743 0.922 433 HG23 VAL 590 HG23 VAL 590 38.721 -14.661 0.531 434 H ASN 591 H ASN 591 39.680 -16.095 2.486 435 HA ASN 591 HA ASN 591 41.599 -17.160 3.055 436 HB2 ASN 591 HB2 ASN 591 42.308 -15.272 1.576 437 HB3 ASN 591 HB3 ASN 591 42.762 -14.356 3.014 438 HD21 ASN 591 HD21 ASN 591 44.914 -14.286 2.102 439 HD22 ASN 591 HD22 ASN 591 45.962 -15.699 2.241 440 H GLY 592 H GLY 592 39.978 -16.804 5.284 441 HA2 GLY 592 HA2 GLY 592 40.038 -17.270 7.528 442 HA3 GLY 592 HA3 GLY 592 41.801 -17.351 7.444 443 H LYS 593 H LYS 593 40.594 -14.312 6.368 444 HA LYS 593 HA LYS 593 40.985 -12.998 9.030 445 HB2 LYS 593 HB2 LYS 593 42.238 -12.275 6.361 446 HB3 LYS 593 HB3 LYS 593 42.254 -11.214 7.772 447 HG2 LYS 593 HG2 LYS 593 43.500 -12.857 9.085 448 HG3 LYS 593 HG3 LYS 593 43.476 -14.017 7.757 449 HD2 LYS 593 HD2 LYS 593 44.808 -11.279 7.610 450 HD3 LYS 593 HD3 LYS 593 45.633 -12.788 8.015 451 HE2 LYS 593 HE2 LYS 593 44.902 -13.743 5.814 452 HE3 LYS 593 HE3 LYS 593 44.192 -12.189 5.396 453 HZ1 LYS 593 HZ1 LYS 593 46.433 -11.211 5.599 454 HZ2 LYS 593 HZ2 LYS 593 46.437 -12.408 4.494 455 HZ3 LYS 593 HZ3 LYS 593 47.075 -12.662 5.970 456 H TYR 594 H TYR 594 40.060 -10.945 9.284 457 HA TYR 594 HA TYR 594 37.593 -10.527 7.679 458 HB2 TYR 594 HB2 TYR 594 38.502 -9.337 10.296 459 HB3 TYR 594 HB3 TYR 594 37.009 -8.899 9.480 460 HD1 TYR 594 HD1 TYR 594 38.312 -11.085 11.945 461 HD2 TYR 594 HD2 TYR 594 35.429 -10.857 8.749 462 HE1 TYR 594 HE1 TYR 594 37.038 -12.980 12.953 463 HE2 TYR 594 HE2 TYR 594 34.186 -12.761 9.714 464 HH TYR 594 HH TYR 594 34.110 -14.333 11.400 465 H PHE 595 H PHE 595 36.996 -8.692 6.832 466 HA PHE 595 HA PHE 595 38.756 -6.339 6.549 467 HB2 PHE 595 HB2 PHE 595 37.792 -8.127 4.274 468 HB3 PHE 595 HB3 PHE 595 38.413 -6.530 4.010 469 HD1 PHE 595 HD1 PHE 595 39.239 -10.022 4.779 470 HD2 PHE 595 HD2 PHE 595 40.848 -6.056 4.369 471 HE1 PHE 595 HE1 PHE 595 41.512 -10.979 4.547 472 HE2 PHE 595 HE2 PHE 595 43.135 -7.012 4.128 473 HZ PHE 595 HZ PHE 595 43.467 -9.475 4.230 474 H HIS 596 H HIS 596 37.539 -4.569 5.367 475 HA HIS 596 HA HIS 596 34.644 -4.618 6.013 476 HB2 HIS 596 HB2 HIS 596 36.499 -2.509 4.954 477 HB3 HIS 596 HB3 HIS 596 34.770 -2.267 4.876 478 HD2 HIS 596 HD2 HIS 596 33.808 -2.784 7.853 479 HE1 HIS 596 HE1 HIS 596 37.000 -0.192 8.975 480 HE2 HIS 596 HE2 HIS 596 34.793 -1.232 9.723 481 H SER 597 H SER 597 33.038 -4.675 4.429 482 HA SER 597 HA SER 597 33.675 -6.038 2.017 483 HB2 SER 597 HB2 SER 597 31.080 -4.587 2.637 484 HB3 SER 597 HB3 SER 597 31.341 -5.904 1.493 485 HG SER 597 HG SER 597 30.551 -6.752 3.397 486 H THR 598 H THR 598 32.831 -2.558 2.531 487 HA THR 598 HA THR 598 33.065 -1.862 -0.258 488 HB THR 598 HB THR 598 33.278 0.487 0.578 489 HG1 THR 598 HG1 THR 598 34.224 0.311 2.517 490 HG21 THR 598 HG21 THR 598 31.052 0.690 1.508 491 HG22 THR 598 HG22 THR 598 30.992 -1.052 1.867 492 HG23 THR 598 HG23 THR 598 31.043 -0.479 0.183 493 H CYS 599 H CYS 599 35.471 -1.740 2.412 494 HA CYS 599 HA CYS 599 37.647 -0.645 0.973 495 HB2 CYS 599 HB2 CYS 599 37.545 -2.672 3.235 496 HB3 CYS 599 HB3 CYS 599 39.009 -1.904 2.691 497 H TYR 600 H TYR 600 36.818 -4.110 1.489 498 HA TYR 600 HA TYR 600 38.786 -5.234 -0.181 499 HB2 TYR 600 HB2 TYR 600 37.556 -6.519 1.438 500 HB3 TYR 600 HB3 TYR 600 36.027 -6.186 0.645 501 HD1 TYR 600 HD1 TYR 600 39.182 -8.111 0.483 502 HD2 TYR 600 HD2 TYR 600 35.360 -7.400 -1.394 503 HE1 TYR 600 HE1 TYR 600 39.504 -10.120 -0.940 504 HE2 TYR 600 HE2 TYR 600 35.678 -9.433 -2.794 505 HH TYR 600 HH TYR 600 38.614 -11.450 -2.585 506 H HIS 601 H HIS 601 35.418 -4.251 -1.021 507 HA HIS 601 HA HIS 601 35.447 -5.109 -3.710 508 HB2 HIS 601 HB2 HIS 601 33.431 -4.550 -2.449 509 HB3 HIS 601 HB3 HIS 601 33.914 -2.864 -2.340 510 HD2 HIS 601 HD2 HIS 601 32.984 -1.292 -4.150 511 HE1 HIS 601 HE1 HIS 601 31.689 -4.175 -7.009 512 HE2 HIS 601 HE2 HIS 601 31.718 -1.699 -6.421 513 H GLU 602 H GLU 602 36.374 -1.868 -2.452 514 HA GLU 602 HA GLU 602 37.044 -0.892 -5.131 515 HB2 GLU 602 HB2 GLU 602 37.426 0.220 -2.330 516 HB3 GLU 602 HB3 GLU 602 37.989 1.064 -3.766 517 HG2 GLU 602 HG2 GLU 602 35.101 0.284 -3.197 518 HG3 GLU 602 HG3 GLU 602 35.783 1.880 -2.991 519 H THR 603 H THR 603 38.904 -2.427 -2.531 520 HA THR 603 HA THR 603 41.476 -1.522 -3.703 521 HB THR 603 HB THR 603 40.925 -3.130 -1.186 522 HG1 THR 603 HG1 THR 603 40.171 -1.050 -1.056 523 HG21 THR 603 HG21 THR 603 43.474 -1.779 -2.172 524 HG22 THR 603 HG22 THR 603 43.233 -3.522 -1.919 525 HG23 THR 603 HG23 THR 603 43.223 -2.420 -0.536 526 H SER 604 H SER 604 39.817 -4.632 -3.100 527 HA SER 604 HA SER 604 42.108 -6.131 -4.156 528 HB2 SER 604 HB2 SER 604 39.592 -7.146 -2.801 529 HB3 SER 604 HB3 SER 604 41.058 -8.064 -3.165 530 HG SER 604 HG SER 604 41.126 -7.360 -1.034 531 H GLN 605 H GLN 605 40.760 -4.714 -6.208 532 HA GLN 605 HA GLN 605 38.955 -6.380 -7.678 533 HB2 GLN 605 HB2 GLN 605 39.306 -3.925 -8.048 534 HB3 GLN 605 HB3 GLN 605 40.877 -4.297 -8.759 535 HG2 GLN 605 HG2 GLN 605 39.355 -4.005 -10.574 536 HG3 GLN 605 HG3 GLN 605 39.667 -5.727 -10.496 537 HE21 GLN 605 HE21 GLN 605 37.747 -7.055 -10.513 538 HE22 GLN 605 HE22 GLN 605 36.174 -6.409 -10.103 539 H ASN 606 H ASN 606 39.252 -8.110 -8.918 540 HA ASN 606 HA ASN 606 41.697 -9.572 -8.917 541 HB2 ASN 606 HB2 ASN 606 40.415 -11.214 -10.194 542 HB3 ASN 606 HB3 ASN 606 39.415 -10.567 -8.900 543 HD21 ASN 606 HD21 ASN 606 39.713 -10.946 -12.361 544 HD22 ASN 606 HD22 ASN 606 38.220 -10.110 -12.745 545 H SER 607 H SER 607 42.887 -10.429 -10.668 546 HA SER 607 HA SER 607 43.373 -8.707 -13.003 547 HB2 SER 607 HB2 SER 607 44.458 -11.463 -12.288 548 HB3 SER 607 HB3 SER 607 45.032 -10.426 -13.603 549 HG SER 607 HG SER 607 46.307 -10.223 -11.711 550 H SER 608 H SER 608 43.283 -9.581 -15.186 551 HA SER 608 HA SER 608 42.142 -10.347 -17.005 552 HB2 SER 608 HB2 SER 608 42.058 -12.913 -15.395 553 HB3 SER 608 HB3 SER 608 41.866 -12.764 -17.147 554 HG SER 608 HG SER 608 44.042 -13.235 -16.578 Start of MODEL 19 1 H1 GLY 533 H1 GLY 533 5.512 8.710 -16.750 2 H2 GLY 533 H2 GLY 533 4.884 10.149 -17.228 3 H3 GLY 533 H3 GLY 533 5.095 9.834 -15.630 4 HA2 GLY 533 HA2 GLY 533 7.259 10.122 -17.613 5 HA3 GLY 533 HA3 GLY 533 6.799 11.344 -16.413 6 H GLY 534 H GLY 534 9.303 9.650 -16.896 7 HA2 GLY 534 HA2 GLY 534 9.648 8.009 -14.493 8 HA3 GLY 534 HA3 GLY 534 10.853 8.404 -15.706 9 H SER 535 H SER 535 12.154 8.502 -13.699 10 HA SER 535 HA SER 535 12.544 11.290 -12.841 11 HB2 SER 535 HB2 SER 535 11.050 10.333 -11.112 12 HB3 SER 535 HB3 SER 535 12.210 9.024 -10.842 13 HG SER 535 HG SER 535 12.455 10.755 -9.354 14 H GLU 536 H GLU 536 14.695 11.763 -12.388 15 HA GLU 536 HA GLU 536 16.640 10.002 -13.588 16 HB2 GLU 536 HB2 GLU 536 17.059 12.632 -12.105 17 HB3 GLU 536 HB3 GLU 536 18.248 11.761 -13.054 18 HG2 GLU 536 HG2 GLU 536 17.558 13.402 -14.512 19 HG3 GLU 536 HG3 GLU 536 16.714 11.972 -15.067 20 H PHE 537 H PHE 537 18.134 8.702 -12.751 21 HA PHE 537 HA PHE 537 19.235 8.976 -10.098 22 HB2 PHE 537 HB2 PHE 537 18.685 6.788 -9.240 23 HB3 PHE 537 HB3 PHE 537 17.216 7.678 -9.535 24 HD1 PHE 537 HD1 PHE 537 15.663 7.017 -11.343 25 HD2 PHE 537 HD2 PHE 537 19.233 4.753 -10.513 26 HE1 PHE 537 HE1 PHE 537 14.776 5.127 -12.685 27 HE2 PHE 537 HE2 PHE 537 18.341 2.862 -11.848 28 HZ PHE 537 HZ PHE 537 16.113 3.045 -12.938 29 H SER 538 H SER 538 20.850 6.992 -9.773 30 HA SER 538 HA SER 538 22.120 6.175 -12.329 31 HB2 SER 538 HB2 SER 538 23.060 8.379 -11.679 32 HB3 SER 538 HB3 SER 538 23.603 7.678 -10.147 33 HG SER 538 HG SER 538 25.181 7.720 -11.893 34 H ASP 539 H ASP 539 24.052 4.759 -11.872 35 HA ASP 539 HA ASP 539 23.078 2.454 -10.412 36 HB2 ASP 539 HB2 ASP 539 25.648 2.851 -11.970 37 HB3 ASP 539 HB3 ASP 539 25.026 1.306 -11.403 38 H ARG 540 H ARG 540 24.336 4.931 -8.937 39 HA ARG 540 HA ARG 540 26.473 3.926 -7.269 40 HB2 ARG 540 HB2 ARG 540 24.397 6.099 -6.742 41 HB3 ARG 540 HB3 ARG 540 25.841 5.805 -5.772 42 HG2 ARG 540 HG2 ARG 540 27.276 6.278 -7.753 43 HG3 ARG 540 HG3 ARG 540 25.820 6.668 -8.696 44 HD2 ARG 540 HD2 ARG 540 25.243 8.445 -7.076 45 HD3 ARG 540 HD3 ARG 540 26.686 8.052 -6.127 46 HE ARG 540 HE ARG 540 27.428 8.617 -8.842 47 HH11 ARG 540 HH11 ARG 540 26.384 10.330 -5.958 48 HH12 ARG 540 HH12 ARG 540 27.184 11.810 -6.443 49 HH21 ARG 540 HH21 ARG 540 28.407 10.529 -9.398 50 HH22 ARG 540 HH22 ARG 540 28.300 11.910 -8.338 51 H SER 541 H SER 541 23.199 3.010 -7.351 52 HA SER 541 HA SER 541 22.476 2.669 -4.669 53 HB2 SER 541 HB2 SER 541 20.869 1.011 -5.522 54 HB3 SER 541 HB3 SER 541 20.916 2.467 -6.525 55 HG SER 541 HG SER 541 20.960 0.526 -7.763 56 H ASN 542 H ASN 542 24.715 0.604 -6.521 57 HA ASN 542 HA ASN 542 24.598 -1.652 -4.763 58 HB2 ASN 542 HB2 ASN 542 26.946 -0.647 -6.430 59 HB3 ASN 542 HB3 ASN 542 26.813 -2.240 -5.691 60 HD21 ASN 542 HD21 ASN 542 24.265 -3.150 -6.339 61 HD22 ASN 542 HD22 ASN 542 24.136 -3.181 -8.087 62 H GLU 543 H GLU 543 26.094 1.494 -4.201 63 HA GLU 543 HA GLU 543 28.004 0.670 -2.222 64 HB2 GLU 543 HB2 GLU 543 26.526 3.304 -2.565 65 HB3 GLU 543 HB3 GLU 543 27.878 3.027 -1.459 66 HG2 GLU 543 HG2 GLU 543 29.304 2.364 -3.398 67 HG3 GLU 543 HG3 GLU 543 27.998 2.792 -4.495 68 H LEU 544 H LEU 544 24.526 1.510 -1.924 69 HA LEU 544 HA LEU 544 24.559 1.302 0.965 70 HB2 LEU 544 HB2 LEU 544 22.321 1.793 0.933 71 HB3 LEU 544 HB3 LEU 544 22.924 2.609 -0.485 72 HG LEU 544 HG LEU 544 22.107 0.224 -1.616 73 HD11 LEU 544 HD11 LEU 544 21.187 -0.626 0.530 74 HD12 LEU 544 HD12 LEU 544 19.935 -0.385 -0.692 75 HD13 LEU 544 HD13 LEU 544 20.121 0.794 0.624 76 HD21 LEU 544 HD21 LEU 544 20.073 1.431 -2.310 77 HD22 LEU 544 HD22 LEU 544 21.504 2.474 -2.396 78 HD23 LEU 544 HD23 LEU 544 20.355 2.658 -1.054 79 H GLU 545 H GLU 545 24.199 -1.033 -1.622 80 HA GLU 545 HA GLU 545 23.256 -3.204 0.065 81 HB2 GLU 545 HB2 GLU 545 24.721 -3.336 -2.608 82 HB3 GLU 545 HB3 GLU 545 23.859 -4.655 -1.819 83 HG2 GLU 545 HG2 GLU 545 21.731 -3.380 -2.004 84 HG3 GLU 545 HG3 GLU 545 22.580 -2.095 -2.855 85 H ILE 546 H ILE 546 26.508 -2.185 -1.045 86 HA ILE 546 HA ILE 546 27.960 -4.232 0.356 87 HB ILE 546 HB ILE 546 28.726 -1.426 -0.519 88 HG12 ILE 546 HG12 ILE 546 28.158 -2.985 -2.379 89 HG13 ILE 546 HG13 ILE 546 29.821 -2.421 -2.386 90 HG21 ILE 546 HG21 ILE 546 31.075 -2.158 -0.291 91 HG22 ILE 546 HG22 ILE 546 30.227 -2.022 1.264 92 HG23 ILE 546 HG23 ILE 546 30.521 -3.621 0.557 93 HD11 ILE 546 HD11 ILE 546 29.663 -4.787 -2.997 94 HD12 ILE 546 HD12 ILE 546 30.578 -4.608 -1.491 95 HD13 ILE 546 HD13 ILE 546 28.889 -5.168 -1.441 96 H ARG 547 H ARG 547 26.669 -1.100 1.401 97 HA ARG 547 HA ARG 547 27.835 -1.193 4.092 98 HB2 ARG 547 HB2 ARG 547 25.556 0.406 2.867 99 HB3 ARG 547 HB3 ARG 547 26.060 0.588 4.542 100 HG2 ARG 547 HG2 ARG 547 28.274 1.345 3.908 101 HG3 ARG 547 HG3 ARG 547 27.989 0.983 2.201 102 HD2 ARG 547 HD2 ARG 547 26.150 2.635 2.142 103 HD3 ARG 547 HD3 ARG 547 26.468 3.044 3.840 104 HE ARG 547 HE ARG 547 28.898 3.333 2.421 105 HH11 ARG 547 HH11 ARG 547 25.779 4.942 2.511 106 HH12 ARG 547 HH12 ARG 547 26.445 6.460 1.953 107 HH21 ARG 547 HH21 ARG 547 29.681 5.291 1.710 108 HH22 ARG 547 HH22 ARG 547 28.599 6.642 1.507 109 H GLY 548 H GLY 548 24.906 -2.447 2.632 110 HA2 GLY 548 HA2 GLY 548 23.562 -3.219 5.075 111 HA3 GLY 548 HA3 GLY 548 23.182 -3.738 3.434 112 H LYS 549 H LYS 549 26.309 -4.661 3.554 113 HA LYS 549 HA LYS 549 25.789 -7.431 4.267 114 HB2 LYS 549 HB2 LYS 549 28.459 -5.985 3.916 115 HB3 LYS 549 HB3 LYS 549 28.233 -7.724 4.001 116 HG2 LYS 549 HG2 LYS 549 27.316 -5.885 1.770 117 HG3 LYS 549 HG3 LYS 549 28.647 -7.028 1.737 118 HD2 LYS 549 HD2 LYS 549 27.270 -8.559 0.878 119 HD3 LYS 549 HD3 LYS 549 26.432 -8.632 2.429 120 HE2 LYS 549 HE2 LYS 549 25.028 -6.651 1.607 121 HE3 LYS 549 HE3 LYS 549 25.809 -6.813 0.058 122 HZ1 LYS 549 HZ1 LYS 549 23.704 -8.017 0.083 123 HZ2 LYS 549 HZ2 LYS 549 24.169 -8.930 1.350 124 HZ3 LYS 549 HZ3 LYS 549 24.915 -9.092 -0.098 125 H TYR 550 H TYR 550 26.267 -8.566 6.081 126 HA TYR 550 HA TYR 550 27.980 -7.490 8.148 127 HB2 TYR 550 HB2 TYR 550 26.410 -7.665 10.008 128 HB3 TYR 550 HB3 TYR 550 25.899 -6.439 8.890 129 HD1 TYR 550 HD1 TYR 550 23.818 -6.662 7.615 130 HD2 TYR 550 HD2 TYR 550 25.170 -9.817 10.217 131 HE1 TYR 550 HE1 TYR 550 21.557 -7.706 7.520 132 HE2 TYR 550 HE2 TYR 550 22.915 -10.872 10.114 133 HH TYR 550 HH TYR 550 20.769 -10.738 9.267 134 H VAL 551 H VAL 551 28.356 -8.981 9.884 135 HA VAL 551 HA VAL 551 27.592 -11.814 9.455 136 HB VAL 551 HB VAL 551 29.888 -12.467 10.324 137 HG11 VAL 551 HG11 VAL 551 29.181 -12.751 7.954 138 HG12 VAL 551 HG12 VAL 551 29.835 -11.138 7.593 139 HG13 VAL 551 HG13 VAL 551 30.920 -12.429 8.124 140 HG21 VAL 551 HG21 VAL 551 30.761 -10.366 11.138 141 HG22 VAL 551 HG22 VAL 551 31.789 -10.998 9.856 142 HG23 VAL 551 HG23 VAL 551 30.689 -9.657 9.502 143 H VAL 552 H VAL 552 27.012 -12.884 11.326 144 HA VAL 552 HA VAL 552 26.309 -11.204 13.586 145 HB VAL 552 HB VAL 552 24.947 -13.140 12.824 146 HG11 VAL 552 HG11 VAL 552 26.787 -14.776 12.431 147 HG12 VAL 552 HG12 VAL 552 27.026 -14.910 14.186 148 HG13 VAL 552 HG13 VAL 552 25.493 -15.409 13.461 149 HG21 VAL 552 HG21 VAL 552 24.546 -12.220 15.029 150 HG22 VAL 552 HG22 VAL 552 24.337 -13.967 15.055 151 HG23 VAL 552 HG23 VAL 552 25.813 -13.260 15.737 152 H VAL 553 H VAL 553 27.232 -10.905 15.529 153 HA VAL 553 HA VAL 553 30.001 -11.872 15.874 154 HB VAL 553 HB VAL 553 28.600 -9.960 17.768 155 HG11 VAL 553 HG11 VAL 553 31.012 -9.344 18.125 156 HG12 VAL 553 HG12 VAL 553 30.654 -11.029 18.558 157 HG13 VAL 553 HG13 VAL 553 31.482 -10.649 17.025 158 HG21 VAL 553 HG21 VAL 553 28.461 -8.756 15.733 159 HG22 VAL 553 HG22 VAL 553 29.895 -8.155 16.605 160 HG23 VAL 553 HG23 VAL 553 30.084 -9.271 15.228 161 HA PRO 554 HA PRO 554 28.002 -15.002 18.468 162 HB2 PRO 554 HB2 PRO 554 30.127 -16.644 18.940 163 HB3 PRO 554 HB3 PRO 554 29.349 -16.523 17.333 164 HG2 PRO 554 HG2 PRO 554 31.845 -15.087 18.273 165 HG3 PRO 554 HG3 PRO 554 31.604 -16.030 16.772 166 HD2 PRO 554 HD2 PRO 554 31.340 -13.309 16.837 167 HD3 PRO 554 HD3 PRO 554 30.307 -14.337 15.792 168 H GLU 555 H GLU 555 28.118 -15.776 20.693 169 HA GLU 555 HA GLU 555 29.061 -13.875 22.651 170 HB2 GLU 555 HB2 GLU 555 28.277 -15.463 24.278 171 HB3 GLU 555 HB3 GLU 555 27.102 -15.337 22.980 172 HG2 GLU 555 HG2 GLU 555 28.015 -17.475 21.990 173 HG3 GLU 555 HG3 GLU 555 29.112 -17.598 23.352 174 H THR 556 H THR 556 30.672 -16.502 21.054 175 HA THR 556 HA THR 556 32.906 -16.739 22.946 176 HB THR 556 HB THR 556 33.887 -18.151 21.154 177 HG1 THR 556 HG1 THR 556 32.671 -18.546 19.328 178 HG21 THR 556 HG21 THR 556 32.325 -19.182 22.793 179 HG22 THR 556 HG22 THR 556 32.296 -19.979 21.207 180 HG23 THR 556 HG23 THR 556 30.974 -18.888 21.682 181 H SER 557 H SER 557 32.068 -14.344 20.670 182 HA SER 557 HA SER 557 34.501 -13.808 19.365 183 HB2 SER 557 HB2 SER 557 32.400 -12.776 18.712 184 HB3 SER 557 HB3 SER 557 32.334 -11.862 20.230 185 HG SER 557 HG SER 557 33.302 -10.948 18.130 186 H GLN 558 H GLN 558 36.143 -12.318 19.649 187 HA GLN 558 HA GLN 558 37.017 -11.727 22.380 188 HB2 GLN 558 HB2 GLN 558 39.043 -10.857 21.343 189 HB3 GLN 558 HB3 GLN 558 38.674 -12.534 20.953 190 HG2 GLN 558 HG2 GLN 558 37.705 -11.691 18.757 191 HG3 GLN 558 HG3 GLN 558 38.402 -10.110 19.154 192 HE21 GLN 558 HE21 GLN 558 39.274 -13.594 18.587 193 HE22 GLN 558 HE22 GLN 558 40.923 -13.210 18.102 194 H ASP 559 H ASP 559 35.455 -10.396 23.143 195 HA ASP 559 HA ASP 559 34.413 -8.488 23.713 196 HB2 ASP 559 HB2 ASP 559 36.875 -7.100 22.633 197 HB3 ASP 559 HB3 ASP 559 35.768 -6.478 23.847 198 H MET 560 H MET 560 33.964 -9.370 20.833 199 HA MET 560 HA MET 560 32.955 -8.746 18.964 200 HB2 MET 560 HB2 MET 560 31.636 -6.511 20.547 201 HB3 MET 560 HB3 MET 560 31.070 -7.260 19.055 202 HG2 MET 560 HG2 MET 560 31.072 -9.492 20.363 203 HG3 MET 560 HG3 MET 560 31.179 -8.508 21.818 204 HE1 MET 560 HE1 MET 560 28.966 -10.395 21.924 205 HE2 MET 560 HE2 MET 560 27.450 -10.069 21.059 206 HE3 MET 560 HE3 MET 560 28.867 -10.630 20.162 207 H ALA 561 H ALA 561 35.560 -7.670 19.267 208 HA ALA 561 HA ALA 561 35.360 -5.424 17.332 209 HB1 ALA 561 HB1 ALA 561 37.220 -5.481 19.742 210 HB2 ALA 561 HB2 ALA 561 37.146 -4.226 18.490 211 HB3 ALA 561 HB3 ALA 561 35.758 -4.485 19.566 212 H PHE 562 H PHE 562 36.835 -5.419 15.660 213 HA PHE 562 HA PHE 562 39.228 -7.070 15.760 214 HB2 PHE 562 HB2 PHE 562 37.146 -8.561 15.044 215 HB3 PHE 562 HB3 PHE 562 37.350 -7.762 13.494 216 HD1 PHE 562 HD1 PHE 562 39.335 -8.258 12.102 217 HD2 PHE 562 HD2 PHE 562 38.896 -9.998 16.022 218 HE1 PHE 562 HE1 PHE 562 41.226 -9.799 11.634 219 HE2 PHE 562 HE2 PHE 562 40.764 -11.553 15.541 220 HZ PHE 562 HZ PHE 562 41.943 -11.451 13.351 221 H LYS 563 H LYS 563 40.580 -6.840 13.803 222 HA LYS 563 HA LYS 563 40.603 -4.011 13.027 223 HB2 LYS 563 HB2 LYS 563 42.510 -5.239 14.086 224 HB3 LYS 563 HB3 LYS 563 42.670 -6.206 12.623 225 HG2 LYS 563 HG2 LYS 563 43.251 -4.176 11.328 226 HG3 LYS 563 HG3 LYS 563 42.989 -3.178 12.787 227 HD2 LYS 563 HD2 LYS 563 44.807 -4.421 13.933 228 HD3 LYS 563 HD3 LYS 563 45.077 -5.381 12.462 229 HE2 LYS 563 HE2 LYS 563 45.614 -3.328 11.209 230 HE3 LYS 563 HE3 LYS 563 45.304 -2.349 12.644 231 HZ1 LYS 563 HZ1 LYS 563 47.152 -3.461 13.749 232 HZ2 LYS 563 HZ2 LYS 563 47.683 -2.798 12.362 233 HZ3 LYS 563 HZ3 LYS 563 47.440 -4.403 12.451 234 H CYS 564 H CYS 564 40.856 -3.190 10.982 235 HA CYS 564 HA CYS 564 40.325 -4.893 8.590 236 HB2 CYS 564 HB2 CYS 564 38.929 -2.728 9.014 237 HB3 CYS 564 HB3 CYS 564 40.398 -1.856 8.736 238 HA PRO 565 HA PRO 565 44.889 -4.334 8.351 239 HB2 PRO 565 HB2 PRO 565 44.458 -6.216 6.038 240 HB3 PRO 565 HB3 PRO 565 45.732 -6.250 7.294 241 HG2 PRO 565 HG2 PRO 565 43.628 -7.955 7.446 242 HG3 PRO 565 HG3 PRO 565 44.214 -7.121 8.919 243 HD2 PRO 565 HD2 PRO 565 41.844 -6.409 7.178 244 HD3 PRO 565 HD3 PRO 565 41.986 -6.452 8.954 245 H ILE 566 H ILE 566 42.504 -3.837 5.812 246 HA ILE 566 HA ILE 566 44.311 -2.804 3.787 247 HB ILE 566 HB ILE 566 41.316 -2.609 4.124 248 HG12 ILE 566 HG12 ILE 566 42.924 -4.290 2.125 249 HG13 ILE 566 HG13 ILE 566 42.439 -4.907 3.694 250 HG21 ILE 566 HG21 ILE 566 41.969 -0.740 2.697 251 HG22 ILE 566 HG22 ILE 566 43.064 -1.787 1.766 252 HG23 ILE 566 HG23 ILE 566 41.305 -1.974 1.641 253 HD11 ILE 566 HD11 ILE 566 40.873 -5.698 2.045 254 HD12 ILE 566 HD12 ILE 566 40.048 -4.553 3.118 255 HD13 ILE 566 HD13 ILE 566 40.536 -4.066 1.470 256 H CYS 567 H CYS 567 41.911 -1.140 5.938 257 HA CYS 567 HA CYS 567 43.319 1.411 5.375 258 HB2 CYS 567 HB2 CYS 567 41.334 2.517 5.895 259 HB3 CYS 567 HB3 CYS 567 40.901 1.186 4.816 260 H LYS 568 H LYS 568 43.475 -0.891 7.648 261 HA LYS 568 HA LYS 568 44.209 -1.163 9.750 262 HB2 LYS 568 HB2 LYS 568 45.950 0.132 10.676 263 HB3 LYS 568 HB3 LYS 568 46.265 -0.180 8.994 264 HG2 LYS 568 HG2 LYS 568 46.010 2.023 8.344 265 HG3 LYS 568 HG3 LYS 568 45.008 2.482 9.723 266 HD2 LYS 568 HD2 LYS 568 47.807 1.615 10.368 267 HD3 LYS 568 HD3 LYS 568 47.613 3.126 9.495 268 HE2 LYS 568 HE2 LYS 568 47.670 3.562 11.882 269 HE3 LYS 568 HE3 LYS 568 46.127 4.037 11.184 270 HZ1 LYS 568 HZ1 LYS 568 45.164 1.971 12.082 271 HZ2 LYS 568 HZ2 LYS 568 45.801 2.862 13.274 272 HZ3 LYS 568 HZ3 LYS 568 46.605 1.551 12.736 273 H GLU 569 H GLU 569 41.656 -0.604 9.721 274 HA GLU 569 HA GLU 569 41.246 1.222 12.081 275 HB2 GLU 569 HB2 GLU 569 39.429 0.632 9.734 276 HB3 GLU 569 HB3 GLU 569 38.836 1.335 11.217 277 HG2 GLU 569 HG2 GLU 569 40.982 2.549 9.441 278 HG3 GLU 569 HG3 GLU 569 39.303 3.056 9.526 279 H THR 570 H THR 570 38.939 0.555 13.106 280 HA THR 570 HA THR 570 38.991 -2.392 13.636 281 HB THR 570 HB THR 570 38.642 -0.171 15.673 282 HG1 THR 570 HG1 THR 570 40.780 -0.573 15.123 283 HG21 THR 570 HG21 THR 570 38.564 -3.193 16.023 284 HG22 THR 570 HG22 THR 570 37.217 -2.059 16.313 285 HG23 THR 570 HG23 THR 570 38.647 -2.002 17.348 286 H VAL 571 H VAL 571 37.135 -3.368 13.335 287 HA VAL 571 HA VAL 571 34.565 -1.876 13.143 288 HB VAL 571 HB VAL 571 33.640 -4.223 12.677 289 HG11 VAL 571 HG11 VAL 571 35.429 -2.882 10.646 290 HG12 VAL 571 HG12 VAL 571 34.123 -4.049 10.310 291 HG13 VAL 571 HG13 VAL 571 33.717 -2.491 11.030 292 HG21 VAL 571 HG21 VAL 571 35.655 -5.522 13.304 293 HG22 VAL 571 HG22 VAL 571 35.068 -5.856 11.662 294 HG23 VAL 571 HG23 VAL 571 36.508 -4.831 11.898 295 H THR 572 H THR 572 32.882 -2.198 14.536 296 HA THR 572 HA THR 572 33.297 -4.010 16.868 297 HB THR 572 HB THR 572 32.227 -2.332 18.339 298 HG1 THR 572 HG1 THR 572 31.280 -1.000 16.792 299 HG21 THR 572 HG21 THR 572 34.695 -2.585 18.312 300 HG22 THR 572 HG22 THR 572 34.182 -0.930 18.681 301 HG23 THR 572 HG23 THR 572 34.799 -1.319 17.064 302 H GLY 573 H GLY 573 31.515 -5.055 17.642 303 HA2 GLY 573 HA2 GLY 573 29.353 -5.549 15.873 304 HA3 GLY 573 HA3 GLY 573 29.480 -6.088 17.555 305 H VAL 574 H VAL 574 27.122 -5.136 16.045 306 HA VAL 574 HA VAL 574 26.156 -3.252 18.098 307 HB VAL 574 HB VAL 574 26.725 -1.995 16.008 308 HG11 VAL 574 HG11 VAL 574 26.129 -3.663 14.301 309 HG12 VAL 574 HG12 VAL 574 24.405 -3.497 14.734 310 HG13 VAL 574 HG13 VAL 574 25.291 -2.117 14.056 311 HG21 VAL 574 HG21 VAL 574 23.754 -2.011 16.647 312 HG22 VAL 574 HG22 VAL 574 25.001 -1.157 17.579 313 HG23 VAL 574 HG23 VAL 574 24.688 -0.682 15.908 314 H TYR 575 H TYR 575 23.991 -3.526 18.798 315 HA TYR 575 HA TYR 575 23.084 -6.237 18.463 316 HB2 TYR 575 HB2 TYR 575 23.029 -5.011 20.592 317 HB3 TYR 575 HB3 TYR 575 21.832 -3.909 19.944 318 HD1 TYR 575 HD1 TYR 575 22.463 -7.534 20.648 319 HD2 TYR 575 HD2 TYR 575 19.504 -4.449 20.122 320 HE1 TYR 575 HE1 TYR 575 20.695 -9.088 21.483 321 HE2 TYR 575 HE2 TYR 575 17.740 -5.989 20.979 322 HH TYR 575 HH TYR 575 18.471 -9.253 22.170 323 H ASP 576 H ASP 576 21.708 -7.074 17.036 324 HA ASP 576 HA ASP 576 19.801 -5.395 15.514 325 HB2 ASP 576 HB2 ASP 576 21.156 -7.070 14.285 326 HB3 ASP 576 HB3 ASP 576 20.458 -8.345 15.276 327 H GLU 577 H GLU 577 17.824 -5.110 16.351 328 HA GLU 577 HA GLU 577 16.831 -6.608 18.615 329 HB2 GLU 577 HB2 GLU 577 15.437 -4.595 16.811 330 HB3 GLU 577 HB3 GLU 577 14.787 -5.234 18.322 331 HG2 GLU 577 HG2 GLU 577 16.813 -4.337 19.511 332 HG3 GLU 577 HG3 GLU 577 17.293 -3.528 18.016 333 H GLU 578 H GLU 578 16.341 -6.988 15.141 334 HA GLU 578 HA GLU 578 13.887 -8.562 15.348 335 HB2 GLU 578 HB2 GLU 578 15.759 -7.779 13.119 336 HB3 GLU 578 HB3 GLU 578 14.691 -9.155 12.890 337 HG2 GLU 578 HG2 GLU 578 13.699 -7.122 12.016 338 HG3 GLU 578 HG3 GLU 578 12.721 -7.825 13.289 339 H SER 579 H SER 579 17.312 -9.486 14.605 340 HA SER 579 HA SER 579 16.760 -12.319 14.941 341 HB2 SER 579 HB2 SER 579 18.596 -11.383 13.519 342 HB3 SER 579 HB3 SER 579 19.438 -10.904 15.005 343 HG SER 579 HG SER 579 19.498 -13.110 15.592 344 H GLY 580 H GLY 580 17.774 -9.677 17.080 345 HA2 GLY 580 HA2 GLY 580 17.850 -9.592 19.367 346 HA3 GLY 580 HA3 GLY 580 17.416 -11.309 19.479 347 H GLU 581 H GLU 581 20.105 -9.959 17.584 348 HA GLU 581 HA GLU 581 22.163 -11.126 19.373 349 HB2 GLU 581 HB2 GLU 581 21.780 -11.902 16.459 350 HB3 GLU 581 HB3 GLU 581 23.205 -12.276 17.394 351 HG2 GLU 581 HG2 GLU 581 20.402 -13.323 17.939 352 HG3 GLU 581 HG3 GLU 581 21.700 -14.208 17.167 353 H TRP 582 H TRP 582 24.346 -10.485 18.763 354 HA TRP 582 HA TRP 582 24.445 -7.717 17.743 355 HB2 TRP 582 HB2 TRP 582 26.531 -9.546 18.941 356 HB3 TRP 582 HB3 TRP 582 26.830 -7.896 18.441 357 HD1 TRP 582 HD1 TRP 582 24.810 -9.862 21.056 358 HE1 TRP 582 HE1 TRP 582 24.308 -8.364 23.071 359 HE3 TRP 582 HE3 TRP 582 26.745 -5.468 19.291 360 HZ2 TRP 582 HZ2 TRP 582 24.539 -5.557 23.760 361 HZ3 TRP 582 HZ3 TRP 582 26.565 -3.380 20.663 362 HH2 TRP 582 HH2 TRP 582 25.465 -3.422 22.867 363 H VAL 583 H VAL 583 25.500 -7.021 15.938 364 HA VAL 583 HA VAL 583 26.595 -9.000 13.992 365 HB VAL 583 HB VAL 583 25.512 -7.593 12.205 366 HG11 VAL 583 HG11 VAL 583 24.669 -9.848 12.858 367 HG12 VAL 583 HG12 VAL 583 23.637 -9.097 14.079 368 HG13 VAL 583 HG13 VAL 583 23.360 -8.769 12.349 369 HG21 VAL 583 HG21 VAL 583 24.882 -5.620 13.527 370 HG22 VAL 583 HG22 VAL 583 23.529 -6.336 12.635 371 HG23 VAL 583 HG23 VAL 583 23.663 -6.607 14.381 372 H TRP 584 H TRP 584 28.277 -8.416 12.758 373 HA TRP 584 HA TRP 584 29.687 -5.831 13.239 374 HB2 TRP 584 HB2 TRP 584 30.439 -8.602 12.304 375 HB3 TRP 584 HB3 TRP 584 31.310 -7.270 11.589 376 HD1 TRP 584 HD1 TRP 584 31.943 -5.430 13.952 377 HE1 TRP 584 HE1 TRP 584 33.530 -6.167 15.860 378 HE3 TRP 584 HE3 TRP 584 31.827 -10.490 13.213 379 HZ2 TRP 584 HZ2 TRP 584 34.876 -8.597 16.653 380 HZ3 TRP 584 HZ3 TRP 584 33.330 -11.978 14.493 381 HH2 TRP 584 HH2 TRP 584 34.871 -11.043 16.208 382 H LYS 585 H LYS 585 28.604 -4.358 12.015 383 HA LYS 585 HA LYS 585 27.531 -4.968 9.359 384 HB2 LYS 585 HB2 LYS 585 27.778 -2.344 10.865 385 HB3 LYS 585 HB3 LYS 585 26.972 -2.539 9.304 386 HG2 LYS 585 HG2 LYS 585 25.535 -4.367 10.449 387 HG3 LYS 585 HG3 LYS 585 26.154 -3.724 11.970 388 HD2 LYS 585 HD2 LYS 585 24.468 -2.318 9.863 389 HD3 LYS 585 HD3 LYS 585 24.006 -2.729 11.513 390 HE2 LYS 585 HE2 LYS 585 25.763 -1.106 12.342 391 HE3 LYS 585 HE3 LYS 585 26.094 -0.663 10.674 392 HZ1 LYS 585 HZ1 LYS 585 23.785 0.083 10.461 393 HZ2 LYS 585 HZ2 LYS 585 24.536 0.879 11.674 394 HZ3 LYS 585 HZ3 LYS 585 23.468 -0.308 12.008 395 H ASN 586 H ASN 586 28.145 -4.129 7.382 396 HA ASN 586 HA ASN 586 29.615 -3.894 5.699 397 HB2 ASN 586 HB2 ASN 586 29.441 -1.533 6.449 398 HB3 ASN 586 HB3 ASN 586 30.836 -1.774 7.497 399 HD21 ASN 586 HD21 ASN 586 31.873 0.008 6.335 400 HD22 ASN 586 HD22 ASN 586 32.587 -0.330 4.757 401 H THR 587 H THR 587 30.175 -6.128 7.259 402 HA THR 587 HA THR 587 33.173 -6.272 7.227 403 HB THR 587 HB THR 587 31.348 -7.583 9.245 404 HG1 THR 587 HG1 THR 587 31.698 -5.325 9.508 405 HG21 THR 587 HG21 THR 587 34.378 -7.575 8.941 406 HG22 THR 587 HG22 THR 587 33.303 -8.991 8.945 407 HG23 THR 587 HG23 THR 587 33.521 -8.059 10.426 408 H ILE 588 H ILE 588 34.148 -8.075 6.551 409 HA ILE 588 HA ILE 588 32.663 -10.420 5.547 410 HB ILE 588 HB ILE 588 32.697 -9.036 3.626 411 HG12 ILE 588 HG12 ILE 588 35.137 -10.826 3.319 412 HG13 ILE 588 HG13 ILE 588 33.467 -11.438 3.342 413 HG21 ILE 588 HG21 ILE 588 34.758 -7.979 2.688 414 HG22 ILE 588 HG22 ILE 588 34.365 -7.346 4.279 415 HG23 ILE 588 HG23 ILE 588 35.654 -8.554 4.117 416 HD11 ILE 588 HD11 ILE 588 34.781 -9.686 1.247 417 HD12 ILE 588 HD12 ILE 588 34.133 -11.316 1.066 418 HD13 ILE 588 HD13 ILE 588 33.019 -9.953 1.328 419 H GLU 589 H GLU 589 33.883 -12.292 5.372 420 HA GLU 589 HA GLU 589 36.638 -12.281 6.534 421 HB2 GLU 589 HB2 GLU 589 34.948 -13.489 7.936 422 HB3 GLU 589 HB3 GLU 589 34.627 -14.555 6.561 423 HG2 GLU 589 HG2 GLU 589 37.060 -15.221 6.568 424 HG3 GLU 589 HG3 GLU 589 37.318 -14.163 7.942 425 H VAL 590 H VAL 590 38.175 -12.837 5.133 426 HA VAL 590 HA VAL 590 37.728 -14.553 2.758 427 HB VAL 590 HB VAL 590 38.248 -11.598 2.692 428 HG11 VAL 590 HG11 VAL 590 40.377 -12.416 1.734 429 HG12 VAL 590 HG12 VAL 590 39.476 -13.490 0.632 430 HG13 VAL 590 HG13 VAL 590 39.343 -11.724 0.488 431 HG21 VAL 590 HG21 VAL 590 36.960 -11.734 0.623 432 HG22 VAL 590 HG22 VAL 590 36.950 -13.504 0.711 433 HG23 VAL 590 HG23 VAL 590 36.103 -12.546 1.938 434 H ASN 591 H ASN 591 39.223 -15.890 2.418 435 HA ASN 591 HA ASN 591 41.091 -17.132 2.732 436 HB2 ASN 591 HB2 ASN 591 42.340 -14.397 2.322 437 HB3 ASN 591 HB3 ASN 591 43.138 -15.955 2.097 438 HD21 ASN 591 HD21 ASN 591 42.849 -13.918 0.064 439 HD22 ASN 591 HD22 ASN 591 41.890 -14.664 -1.212 440 H GLY 592 H GLY 592 39.956 -16.593 5.214 441 HA2 GLY 592 HA2 GLY 592 40.459 -17.146 7.402 442 HA3 GLY 592 HA3 GLY 592 42.171 -17.203 6.994 443 H LYS 593 H LYS 593 40.856 -14.178 6.091 444 HA LYS 593 HA LYS 593 41.462 -12.875 8.712 445 HB2 LYS 593 HB2 LYS 593 42.358 -12.064 5.920 446 HB3 LYS 593 HB3 LYS 593 42.415 -10.979 7.317 447 HG2 LYS 593 HG2 LYS 593 43.893 -12.529 8.517 448 HG3 LYS 593 HG3 LYS 593 43.872 -13.653 7.158 449 HD2 LYS 593 HD2 LYS 593 44.893 -10.791 6.976 450 HD3 LYS 593 HD3 LYS 593 45.916 -12.200 7.298 451 HE2 LYS 593 HE2 LYS 593 45.148 -13.213 5.146 452 HE3 LYS 593 HE3 LYS 593 44.218 -11.760 4.804 453 HZ1 LYS 593 HZ1 LYS 593 47.168 -11.867 5.139 454 HZ2 LYS 593 HZ2 LYS 593 46.328 -10.503 4.843 455 HZ3 LYS 593 HZ3 LYS 593 46.396 -11.690 3.723 456 H TYR 594 H TYR 594 40.460 -10.834 9.056 457 HA TYR 594 HA TYR 594 37.801 -10.591 7.722 458 HB2 TYR 594 HB2 TYR 594 38.814 -9.709 10.412 459 HB3 TYR 594 HB3 TYR 594 37.335 -9.072 9.717 460 HD1 TYR 594 HD1 TYR 594 35.346 -10.378 9.411 461 HD2 TYR 594 HD2 TYR 594 38.903 -12.156 11.074 462 HE1 TYR 594 HE1 TYR 594 34.013 -12.346 10.148 463 HE2 TYR 594 HE2 TYR 594 37.576 -14.155 11.762 464 HH TYR 594 HH TYR 594 35.516 -15.154 11.752 465 H PHE 595 H PHE 595 37.033 -8.669 7.012 466 HA PHE 595 HA PHE 595 38.773 -6.300 6.701 467 HB2 PHE 595 HB2 PHE 595 37.628 -7.957 4.406 468 HB3 PHE 595 HB3 PHE 595 38.394 -6.412 4.200 469 HD1 PHE 595 HD1 PHE 595 38.848 -9.983 4.432 470 HD2 PHE 595 HD2 PHE 595 40.895 -6.214 4.848 471 HE1 PHE 595 HE1 PHE 595 41.024 -11.117 4.055 472 HE2 PHE 595 HE2 PHE 595 43.072 -7.354 4.469 473 HZ PHE 595 HZ PHE 595 43.137 -9.806 4.064 474 H HIS 596 H HIS 596 37.611 -4.477 5.705 475 HA HIS 596 HA HIS 596 34.745 -4.323 6.388 476 HB2 HIS 596 HB2 HIS 596 36.739 -2.490 5.082 477 HB3 HIS 596 HB3 HIS 596 35.048 -2.106 4.951 478 HD2 HIS 596 HD2 HIS 596 33.954 -2.110 7.863 479 HE1 HIS 596 HE1 HIS 596 37.366 0.230 8.852 480 HE2 HIS 596 HE2 HIS 596 35.033 -0.439 9.576 481 H SER 597 H SER 597 33.061 -4.431 4.851 482 HA SER 597 HA SER 597 33.597 -5.872 2.402 483 HB2 SER 597 HB2 SER 597 31.454 -5.997 3.717 484 HB3 SER 597 HB3 SER 597 31.035 -4.398 3.075 485 HG SER 597 HG SER 597 31.487 -6.807 1.645 486 H THR 598 H THR 598 32.896 -2.391 3.021 487 HA THR 598 HA THR 598 33.109 -1.505 0.326 488 HB THR 598 HB THR 598 33.808 0.703 1.371 489 HG1 THR 598 HG1 THR 598 34.704 0.209 3.269 490 HG21 THR 598 HG21 THR 598 31.320 -0.557 2.565 491 HG22 THR 598 HG22 THR 598 31.437 0.111 0.924 492 HG23 THR 598 HG23 THR 598 31.648 1.173 2.333 493 H CYS 599 H CYS 599 35.759 -1.843 2.753 494 HA CYS 599 HA CYS 599 37.832 -0.848 1.082 495 HB2 CYS 599 HB2 CYS 599 37.819 -2.790 3.419 496 HB3 CYS 599 HB3 CYS 599 39.278 -2.169 2.704 497 H TYR 600 H TYR 600 36.798 -4.234 1.681 498 HA TYR 600 HA TYR 600 38.623 -5.461 -0.140 499 HB2 TYR 600 HB2 TYR 600 37.606 -6.755 1.585 500 HB3 TYR 600 HB3 TYR 600 35.987 -6.299 1.102 501 HD1 TYR 600 HD1 TYR 600 38.983 -8.281 0.124 502 HD2 TYR 600 HD2 TYR 600 34.816 -7.497 -0.658 503 HE1 TYR 600 HE1 TYR 600 38.895 -10.253 -1.394 504 HE2 TYR 600 HE2 TYR 600 34.726 -9.484 -2.158 505 HH TYR 600 HH TYR 600 37.588 -11.516 -2.802 506 H HIS 601 H HIS 601 35.244 -4.301 -0.642 507 HA HIS 601 HA HIS 601 35.048 -5.157 -3.366 508 HB2 HIS 601 HB2 HIS 601 33.144 -4.660 -1.875 509 HB3 HIS 601 HB3 HIS 601 33.564 -2.945 -1.906 510 HD2 HIS 601 HD2 HIS 601 32.741 -5.727 -4.545 511 HE1 HIS 601 HE1 HIS 601 30.691 -2.181 -5.702 512 HE2 HIS 601 HE2 HIS 601 31.099 -4.621 -6.274 513 H GLU 602 H GLU 602 36.198 -2.060 -1.976 514 HA GLU 602 HA GLU 602 36.657 -0.748 -4.502 515 HB2 GLU 602 HB2 GLU 602 36.427 0.451 -2.380 516 HB3 GLU 602 HB3 GLU 602 37.840 -0.363 -1.727 517 HG2 GLU 602 HG2 GLU 602 38.332 1.938 -2.347 518 HG3 GLU 602 HG3 GLU 602 39.317 0.800 -3.242 519 H THR 603 H THR 603 38.649 -2.927 -2.512 520 HA THR 603 HA THR 603 41.072 -2.706 -4.106 521 HB THR 603 HB THR 603 40.120 -4.890 -2.208 522 HG1 THR 603 HG1 THR 603 40.402 -2.925 -1.206 523 HG21 THR 603 HG21 THR 603 42.896 -4.331 -3.338 524 HG22 THR 603 HG22 THR 603 41.924 -5.799 -3.584 525 HG23 THR 603 HG23 THR 603 42.550 -5.422 -1.975 526 H SER 604 H SER 604 38.238 -4.814 -4.183 527 HA SER 604 HA SER 604 39.145 -6.599 -6.264 528 HB2 SER 604 HB2 SER 604 36.342 -6.022 -5.219 529 HB3 SER 604 HB3 SER 604 36.798 -7.373 -6.263 530 HG SER 604 HG SER 604 37.598 -6.877 -3.606 531 H GLN 605 H GLN 605 37.776 -6.946 -8.253 532 HA GLN 605 HA GLN 605 36.791 -4.477 -9.576 533 HB2 GLN 605 HB2 GLN 605 38.805 -6.405 -10.799 534 HB3 GLN 605 HB3 GLN 605 37.969 -5.104 -11.652 535 HG2 GLN 605 HG2 GLN 605 39.026 -3.457 -10.058 536 HG3 GLN 605 HG3 GLN 605 39.992 -4.779 -9.398 537 HE21 GLN 605 HE21 GLN 605 41.483 -2.772 -10.309 538 HE22 GLN 605 HE22 GLN 605 42.159 -3.141 -11.892 539 H ASN 606 H ASN 606 35.543 -4.957 -11.541 540 HA ASN 606 HA ASN 606 33.689 -7.166 -11.263 541 HB2 ASN 606 HB2 ASN 606 33.244 -4.819 -12.188 542 HB3 ASN 606 HB3 ASN 606 34.115 -5.310 -13.642 543 HD21 ASN 606 HD21 ASN 606 31.946 -4.667 -14.587 544 HD22 ASN 606 HD22 ASN 606 30.710 -5.921 -14.635 545 H SER 607 H SER 607 33.235 -8.587 -13.260 546 HA SER 607 HA SER 607 35.267 -10.489 -13.543 547 HB2 SER 607 HB2 SER 607 32.871 -10.918 -13.883 548 HB3 SER 607 HB3 SER 607 32.920 -10.005 -15.400 549 HG SER 607 HG SER 607 33.161 -12.256 -15.741 550 H SER 608 H SER 608 36.865 -10.932 -14.913 551 HA SER 608 HA SER 608 37.427 -9.415 -17.371 552 HB2 SER 608 HB2 SER 608 38.203 -7.928 -15.547 553 HB3 SER 608 HB3 SER 608 39.234 -9.225 -14.935 554 HG SER 608 HG SER 608 40.346 -7.771 -16.363 Start of MODEL 20 1 H1 GLY 533 H1 GLY 533 20.282 7.010 -5.324 2 H2 GLY 533 H2 GLY 533 20.146 8.318 -4.342 3 H3 GLY 533 H3 GLY 533 21.252 7.153 -4.007 4 HA2 GLY 533 HA2 GLY 533 22.343 9.089 -4.947 5 HA3 GLY 533 HA3 GLY 533 22.508 7.663 -5.988 6 H GLY 534 H GLY 534 22.133 10.826 -6.269 7 HA2 GLY 534 HA2 GLY 534 19.788 11.103 -7.966 8 HA3 GLY 534 HA3 GLY 534 21.009 12.320 -7.608 9 H SER 535 H SER 535 22.993 10.032 -8.686 10 HA SER 535 HA SER 535 23.047 11.091 -11.439 11 HB2 SER 535 HB2 SER 535 25.300 10.185 -11.498 12 HB3 SER 535 HB3 SER 535 25.067 11.218 -10.082 13 HG SER 535 HG SER 535 26.101 9.296 -9.488 14 H GLU 536 H GLU 536 23.489 9.776 -13.247 15 HA GLU 536 HA GLU 536 22.085 7.166 -13.314 16 HB2 GLU 536 HB2 GLU 536 21.995 7.496 -15.695 17 HB3 GLU 536 HB3 GLU 536 21.448 8.957 -14.880 18 HG2 GLU 536 HG2 GLU 536 23.738 9.957 -15.234 19 HG3 GLU 536 HG3 GLU 536 24.179 8.539 -16.176 20 H PHE 537 H PHE 537 25.045 7.763 -12.394 21 HA PHE 537 HA PHE 537 26.783 6.692 -14.357 22 HB2 PHE 537 HB2 PHE 537 27.268 7.006 -11.387 23 HB3 PHE 537 HB3 PHE 537 28.496 6.901 -12.635 24 HD1 PHE 537 HD1 PHE 537 26.704 8.951 -14.522 25 HD2 PHE 537 HD2 PHE 537 28.458 8.996 -10.575 26 HE1 PHE 537 HE1 PHE 537 26.806 11.417 -14.588 27 HE2 PHE 537 HE2 PHE 537 28.578 11.472 -10.666 28 HZ PHE 537 HZ PHE 537 27.738 12.687 -12.667 29 H SER 538 H SER 538 24.667 4.737 -12.758 30 HA SER 538 HA SER 538 26.293 2.389 -13.413 31 HB2 SER 538 HB2 SER 538 26.995 2.761 -11.106 32 HB3 SER 538 HB3 SER 538 25.308 2.738 -10.562 33 HG SER 538 HG SER 538 26.571 0.709 -10.433 34 H ASP 539 H ASP 539 23.209 3.291 -11.763 35 HA ASP 539 HA ASP 539 21.128 2.435 -11.887 36 HB2 ASP 539 HB2 ASP 539 21.346 3.626 -14.069 37 HB3 ASP 539 HB3 ASP 539 21.719 2.093 -14.845 38 H ARG 540 H ARG 540 22.809 0.610 -10.860 39 HA ARG 540 HA ARG 540 21.720 -2.020 -11.718 40 HB2 ARG 540 HB2 ARG 540 23.962 -1.422 -12.813 41 HB3 ARG 540 HB3 ARG 540 24.680 -1.563 -11.211 42 HG2 ARG 540 HG2 ARG 540 23.938 -3.952 -11.121 43 HG3 ARG 540 HG3 ARG 540 23.178 -3.757 -12.714 44 HD2 ARG 540 HD2 ARG 540 25.374 -3.174 -13.692 45 HD3 ARG 540 HD3 ARG 540 26.142 -3.384 -12.110 46 HE ARG 540 HE ARG 540 24.776 -5.788 -12.667 47 HH11 ARG 540 HH11 ARG 540 27.467 -4.042 -14.085 48 HH12 ARG 540 HH12 ARG 540 28.202 -5.500 -14.715 49 HH21 ARG 540 HH21 ARG 540 25.761 -7.606 -13.497 50 HH22 ARG 540 HH22 ARG 540 27.252 -7.460 -14.390 51 H SER 541 H SER 541 21.488 -3.528 -10.151 52 HA SER 541 HA SER 541 20.874 -2.516 -7.581 53 HB2 SER 541 HB2 SER 541 19.697 -4.357 -8.750 54 HB3 SER 541 HB3 SER 541 21.105 -5.399 -8.513 55 HG SER 541 HG SER 541 19.361 -4.329 -6.559 56 H ASN 542 H ASN 542 23.809 -4.150 -8.633 57 HA ASN 542 HA ASN 542 24.669 -5.231 -6.175 58 HB2 ASN 542 HB2 ASN 542 26.788 -5.535 -7.229 59 HB3 ASN 542 HB3 ASN 542 25.556 -5.827 -8.443 60 HD21 ASN 542 HD21 ASN 542 28.539 -4.666 -8.283 61 HD22 ASN 542 HD22 ASN 542 28.417 -3.312 -9.405 62 H GLU 543 H GLU 543 24.810 -1.879 -7.187 63 HA GLU 543 HA GLU 543 26.834 -0.881 -5.431 64 HB2 GLU 543 HB2 GLU 543 24.244 0.347 -6.473 65 HB3 GLU 543 HB3 GLU 543 25.458 1.260 -5.594 66 HG2 GLU 543 HG2 GLU 543 25.878 -0.154 -8.259 67 HG3 GLU 543 HG3 GLU 543 25.632 1.567 -8.036 68 H LEU 544 H LEU 544 23.487 -1.840 -4.748 69 HA LEU 544 HA LEU 544 23.414 -0.634 -2.077 70 HB2 LEU 544 HB2 LEU 544 21.604 -2.713 -3.366 71 HB3 LEU 544 HB3 LEU 544 21.254 -1.792 -1.911 72 HG LEU 544 HG LEU 544 21.520 -0.630 -4.722 73 HD11 LEU 544 HD11 LEU 544 19.072 -1.061 -2.963 74 HD12 LEU 544 HD12 LEU 544 19.503 -2.014 -4.396 75 HD13 LEU 544 HD13 LEU 544 19.096 -0.298 -4.568 76 HD21 LEU 544 HD21 LEU 544 20.695 0.668 -2.087 77 HD22 LEU 544 HD22 LEU 544 20.574 1.424 -3.691 78 HD23 LEU 544 HD23 LEU 544 22.164 1.038 -3.024 79 H GLU 545 H GLU 545 24.089 -3.831 -3.444 80 HA GLU 545 HA GLU 545 23.677 -5.320 -1.068 81 HB2 GLU 545 HB2 GLU 545 25.388 -5.948 -3.506 82 HB3 GLU 545 HB3 GLU 545 24.914 -7.146 -2.315 83 HG2 GLU 545 HG2 GLU 545 22.838 -5.587 -3.912 84 HG3 GLU 545 HG3 GLU 545 23.629 -7.012 -4.546 85 H ILE 546 H ILE 546 26.656 -3.802 -2.215 86 HA ILE 546 HA ILE 546 28.452 -5.230 -0.546 87 HB ILE 546 HB ILE 546 28.709 -2.373 -1.535 88 HG12 ILE 546 HG12 ILE 546 28.322 -3.924 -3.430 89 HG13 ILE 546 HG13 ILE 546 29.911 -3.199 -3.445 90 HG21 ILE 546 HG21 ILE 546 31.166 -2.809 -1.390 91 HG22 ILE 546 HG22 ILE 546 30.362 -2.820 0.192 92 HG23 ILE 546 HG23 ILE 546 30.819 -4.346 -0.554 93 HD11 ILE 546 HD11 ILE 546 30.927 -5.265 -2.580 94 HD12 ILE 546 HD12 ILE 546 29.320 -6.032 -2.491 95 HD13 ILE 546 HD13 ILE 546 30.002 -5.577 -4.063 96 H ARG 547 H ARG 547 26.441 -2.427 0.254 97 HA ARG 547 HA ARG 547 27.714 -2.235 2.946 98 HB2 ARG 547 HB2 ARG 547 26.446 -0.246 3.332 99 HB3 ARG 547 HB3 ARG 547 27.443 -0.110 1.913 100 HG2 ARG 547 HG2 ARG 547 24.489 -0.803 1.665 101 HG3 ARG 547 HG3 ARG 547 25.012 0.845 1.969 102 HD2 ARG 547 HD2 ARG 547 25.848 -0.812 -0.443 103 HD3 ARG 547 HD3 ARG 547 24.597 0.410 -0.428 104 HE ARG 547 HE ARG 547 27.488 0.810 -0.516 105 HH11 ARG 547 HH11 ARG 547 24.474 2.434 0.271 106 HH12 ARG 547 HH12 ARG 547 25.174 4.022 0.048 107 HH21 ARG 547 HH21 ARG 547 28.319 2.846 -0.765 108 HH22 ARG 547 HH22 ARG 547 27.302 4.240 -0.529 109 H GLY 548 H GLY 548 25.199 -3.954 1.565 110 HA2 GLY 548 HA2 GLY 548 23.542 -4.261 3.959 111 HA3 GLY 548 HA3 GLY 548 23.480 -5.216 2.477 112 H LYS 549 H LYS 549 26.622 -5.535 3.011 113 HA LYS 549 HA LYS 549 26.435 -8.180 4.123 114 HB2 LYS 549 HB2 LYS 549 28.872 -6.423 3.681 115 HB3 LYS 549 HB3 LYS 549 28.909 -8.158 3.957 116 HG2 LYS 549 HG2 LYS 549 27.751 -6.743 1.519 117 HG3 LYS 549 HG3 LYS 549 29.258 -7.658 1.612 118 HD2 LYS 549 HD2 LYS 549 27.960 -9.735 2.100 119 HD3 LYS 549 HD3 LYS 549 26.449 -8.818 1.959 120 HE2 LYS 549 HE2 LYS 549 27.007 -8.189 -0.353 121 HE3 LYS 549 HE3 LYS 549 28.540 -9.059 -0.234 122 HZ1 LYS 549 HZ1 LYS 549 26.860 -10.432 -1.325 123 HZ2 LYS 549 HZ2 LYS 549 25.848 -10.310 -0.057 124 HZ3 LYS 549 HZ3 LYS 549 27.260 -11.115 0.092 125 H TYR 550 H TYR 550 26.733 -9.002 6.043 126 HA TYR 550 HA TYR 550 28.393 -7.746 8.042 127 HB2 TYR 550 HB2 TYR 550 26.741 -7.753 9.868 128 HB3 TYR 550 HB3 TYR 550 26.414 -6.569 8.652 129 HD1 TYR 550 HD1 TYR 550 24.345 -6.607 7.371 130 HD2 TYR 550 HD2 TYR 550 25.302 -9.793 10.117 131 HE1 TYR 550 HE1 TYR 550 21.999 -7.413 7.248 132 HE2 TYR 550 HE2 TYR 550 22.950 -10.572 10.036 133 HH TYR 550 HH TYR 550 20.488 -8.966 7.991 134 H VAL 551 H VAL 551 28.713 -9.036 9.929 135 HA VAL 551 HA VAL 551 28.183 -11.948 9.682 136 HB VAL 551 HB VAL 551 30.679 -12.131 10.547 137 HG11 VAL 551 HG11 VAL 551 29.982 -11.683 7.614 138 HG12 VAL 551 HG12 VAL 551 31.400 -12.559 8.228 139 HG13 VAL 551 HG13 VAL 551 29.772 -13.206 8.505 140 HG21 VAL 551 HG21 VAL 551 32.255 -10.681 9.398 141 HG22 VAL 551 HG22 VAL 551 30.944 -9.666 8.767 142 HG23 VAL 551 HG23 VAL 551 31.263 -9.744 10.515 143 H VAL 552 H VAL 552 27.712 -12.933 11.586 144 HA VAL 552 HA VAL 552 27.043 -11.221 13.798 145 HB VAL 552 HB VAL 552 25.763 -13.233 13.082 146 HG11 VAL 552 HG11 VAL 552 26.362 -15.455 13.849 147 HG12 VAL 552 HG12 VAL 552 27.681 -14.835 12.850 148 HG13 VAL 552 HG13 VAL 552 27.843 -14.851 14.615 149 HG21 VAL 552 HG21 VAL 552 26.541 -13.144 16.022 150 HG22 VAL 552 HG22 VAL 552 25.267 -12.212 15.197 151 HG23 VAL 552 HG23 VAL 552 25.125 -13.968 15.341 152 H VAL 553 H VAL 553 27.910 -10.924 15.783 153 HA VAL 553 HA VAL 553 30.730 -11.605 16.253 154 HB VAL 553 HB VAL 553 28.739 -10.181 18.083 155 HG11 VAL 553 HG11 VAL 553 31.766 -10.582 18.217 156 HG12 VAL 553 HG12 VAL 553 30.821 -9.534 19.290 157 HG13 VAL 553 HG13 VAL 553 30.559 -11.276 19.335 158 HG21 VAL 553 HG21 VAL 553 30.168 -8.182 17.589 159 HG22 VAL 553 HG22 VAL 553 30.923 -9.107 16.275 160 HG23 VAL 553 HG23 VAL 553 29.181 -8.736 16.197 161 HA PRO 554 HA PRO 554 29.118 -15.327 18.367 162 HB2 PRO 554 HB2 PRO 554 31.370 -16.800 18.537 163 HB3 PRO 554 HB3 PRO 554 30.583 -16.479 16.955 164 HG2 PRO 554 HG2 PRO 554 32.910 -15.002 18.206 165 HG3 PRO 554 HG3 PRO 554 32.808 -15.680 16.545 166 HD2 PRO 554 HD2 PRO 554 32.237 -13.033 17.118 167 HD3 PRO 554 HD3 PRO 554 31.424 -13.951 15.809 168 H GLU 555 H GLU 555 29.313 -16.236 20.514 169 HA GLU 555 HA GLU 555 29.953 -14.364 22.568 170 HB2 GLU 555 HB2 GLU 555 28.212 -16.097 22.673 171 HB3 GLU 555 HB3 GLU 555 29.452 -17.364 22.729 172 HG2 GLU 555 HG2 GLU 555 30.241 -16.552 24.890 173 HG3 GLU 555 HG3 GLU 555 29.161 -15.160 24.808 174 H THR 556 H THR 556 31.970 -16.776 21.040 175 HA THR 556 HA THR 556 34.054 -16.972 23.048 176 HB THR 556 HB THR 556 35.383 -17.879 21.104 177 HG1 THR 556 HG1 THR 556 34.277 -18.182 19.188 178 HG21 THR 556 HG21 THR 556 34.059 -19.913 20.808 179 HG22 THR 556 HG22 THR 556 32.594 -19.101 21.414 180 HG23 THR 556 HG23 THR 556 33.971 -19.387 22.497 181 H SER 557 H SER 557 33.519 -14.854 20.226 182 HA SER 557 HA SER 557 35.980 -13.309 20.675 183 HB2 SER 557 HB2 SER 557 33.595 -12.790 18.859 184 HB3 SER 557 HB3 SER 557 35.088 -11.846 18.881 185 HG SER 557 HG SER 557 36.226 -13.667 18.213 186 H GLN 558 H GLN 558 35.050 -13.247 23.029 187 HA GLN 558 HA GLN 558 32.855 -11.640 23.681 188 HB2 GLN 558 HB2 GLN 558 34.000 -13.433 24.991 189 HB3 GLN 558 HB3 GLN 558 35.264 -12.290 25.431 190 HG2 GLN 558 HG2 GLN 558 33.746 -10.970 26.749 191 HG3 GLN 558 HG3 GLN 558 32.328 -11.693 25.969 192 HE21 GLN 558 HE21 GLN 558 32.334 -14.295 26.237 193 HE22 GLN 558 HE22 GLN 558 32.633 -14.818 27.889 194 H ASP 559 H ASP 559 36.018 -10.526 22.809 195 HA ASP 559 HA ASP 559 35.792 -7.840 23.943 196 HB2 ASP 559 HB2 ASP 559 37.470 -8.895 21.648 197 HB3 ASP 559 HB3 ASP 559 37.657 -7.319 22.412 198 H MET 560 H MET 560 34.345 -9.418 21.249 199 HA MET 560 HA MET 560 33.107 -8.848 19.506 200 HB2 MET 560 HB2 MET 560 32.286 -6.416 21.106 201 HB3 MET 560 HB3 MET 560 31.336 -7.277 19.887 202 HG2 MET 560 HG2 MET 560 31.485 -9.345 21.398 203 HG3 MET 560 HG3 MET 560 32.209 -8.277 22.597 204 HE1 MET 560 HE1 MET 560 27.801 -8.597 21.457 205 HE2 MET 560 HE2 MET 560 28.978 -8.181 20.192 206 HE3 MET 560 HE3 MET 560 29.117 -9.734 21.058 207 H ALA 561 H ALA 561 35.847 -7.795 19.310 208 HA ALA 561 HA ALA 561 35.369 -5.810 17.173 209 HB1 ALA 561 HB1 ALA 561 37.378 -5.465 19.455 210 HB2 ALA 561 HB2 ALA 561 37.156 -4.363 18.079 211 HB3 ALA 561 HB3 ALA 561 35.855 -4.566 19.262 212 H PHE 562 H PHE 562 37.002 -5.568 15.639 213 HA PHE 562 HA PHE 562 39.396 -7.203 15.590 214 HB2 PHE 562 HB2 PHE 562 37.214 -8.544 14.656 215 HB3 PHE 562 HB3 PHE 562 37.673 -7.706 13.189 216 HD1 PHE 562 HD1 PHE 562 38.560 -10.274 15.655 217 HD2 PHE 562 HD2 PHE 562 39.911 -8.214 12.120 218 HE1 PHE 562 HE1 PHE 562 40.260 -12.044 15.271 219 HE2 PHE 562 HE2 PHE 562 41.634 -9.970 11.764 220 HZ PHE 562 HZ PHE 562 41.802 -11.889 13.321 221 H LYS 563 H LYS 563 40.736 -6.639 13.603 222 HA LYS 563 HA LYS 563 40.193 -3.816 12.783 223 HB2 LYS 563 HB2 LYS 563 42.249 -4.490 14.121 224 HB3 LYS 563 HB3 LYS 563 42.835 -5.323 12.688 225 HG2 LYS 563 HG2 LYS 563 42.912 -3.195 11.450 226 HG3 LYS 563 HG3 LYS 563 42.131 -2.351 12.804 227 HD2 LYS 563 HD2 LYS 563 44.056 -2.920 14.273 228 HD3 LYS 563 HD3 LYS 563 44.860 -3.702 12.895 229 HE2 LYS 563 HE2 LYS 563 44.874 -1.547 11.691 230 HE3 LYS 563 HE3 LYS 563 43.975 -0.788 13.006 231 HZ1 LYS 563 HZ1 LYS 563 46.360 -0.325 13.191 232 HZ2 LYS 563 HZ2 LYS 563 46.727 -1.909 13.231 233 HZ3 LYS 563 HZ3 LYS 563 45.896 -1.235 14.460 234 H CYS 564 H CYS 564 40.386 -3.102 10.718 235 HA CYS 564 HA CYS 564 40.158 -4.974 8.452 236 HB2 CYS 564 HB2 CYS 564 38.689 -2.893 8.771 237 HB3 CYS 564 HB3 CYS 564 40.107 -1.929 8.567 238 HA PRO 565 HA PRO 565 44.710 -4.353 8.049 239 HB2 PRO 565 HB2 PRO 565 44.184 -6.246 5.758 240 HB3 PRO 565 HB3 PRO 565 45.519 -6.265 6.950 241 HG2 PRO 565 HG2 PRO 565 43.428 -7.981 7.192 242 HG3 PRO 565 HG3 PRO 565 44.081 -7.153 8.641 243 HD2 PRO 565 HD2 PRO 565 41.602 -6.480 7.074 244 HD3 PRO 565 HD3 PRO 565 41.897 -6.492 8.828 245 H ILE 566 H ILE 566 42.215 -3.618 5.733 246 HA ILE 566 HA ILE 566 44.032 -2.595 3.661 247 HB ILE 566 HB ILE 566 41.028 -2.511 3.979 248 HG12 ILE 566 HG12 ILE 566 42.776 -4.016 1.963 249 HG13 ILE 566 HG13 ILE 566 42.214 -4.729 3.460 250 HG21 ILE 566 HG21 ILE 566 40.948 -1.680 1.622 251 HG22 ILE 566 HG22 ILE 566 41.707 -0.514 2.684 252 HG23 ILE 566 HG23 ILE 566 42.716 -1.526 1.627 253 HD11 ILE 566 HD11 ILE 566 40.782 -5.465 1.682 254 HD12 ILE 566 HD12 ILE 566 39.843 -4.391 2.730 255 HD13 ILE 566 HD13 ILE 566 40.454 -3.808 1.160 256 H CYS 567 H CYS 567 41.535 -0.987 5.710 257 HA CYS 567 HA CYS 567 42.956 1.564 5.333 258 HB2 CYS 567 HB2 CYS 567 40.941 2.611 5.931 259 HB3 CYS 567 HB3 CYS 567 40.546 1.362 4.742 260 H LYS 568 H LYS 568 43.139 -0.819 7.526 261 HA LYS 568 HA LYS 568 43.948 -1.118 9.620 262 HB2 LYS 568 HB2 LYS 568 45.133 1.628 9.128 263 HB3 LYS 568 HB3 LYS 568 45.477 0.671 10.553 264 HG2 LYS 568 HG2 LYS 568 47.232 0.457 8.930 265 HG3 LYS 568 HG3 LYS 568 46.470 -1.103 9.247 266 HD2 LYS 568 HD2 LYS 568 45.378 -1.085 7.093 267 HD3 LYS 568 HD3 LYS 568 45.854 0.605 6.798 268 HE2 LYS 568 HE2 LYS 568 48.180 -0.014 6.646 269 HE3 LYS 568 HE3 LYS 568 47.845 -1.654 7.209 270 HZ1 LYS 568 HZ1 LYS 568 48.083 -1.551 4.777 271 HZ2 LYS 568 HZ2 LYS 568 46.800 -0.537 4.668 272 HZ3 LYS 568 HZ3 LYS 568 46.596 -2.063 5.212 273 H GLU 569 H GLU 569 41.300 -0.709 9.616 274 HA GLU 569 HA GLU 569 40.847 1.065 12.020 275 HB2 GLU 569 HB2 GLU 569 39.109 0.700 9.588 276 HB3 GLU 569 HB3 GLU 569 38.496 1.337 11.084 277 HG2 GLU 569 HG2 GLU 569 40.777 2.575 9.495 278 HG3 GLU 569 HG3 GLU 569 39.104 3.113 9.458 279 H THR 570 H THR 570 39.572 0.463 13.657 280 HA THR 570 HA THR 570 39.009 -2.406 13.857 281 HB THR 570 HB THR 570 38.779 -0.184 15.912 282 HG1 THR 570 HG1 THR 570 40.723 -1.014 16.590 283 HG21 THR 570 HG21 THR 570 38.686 -3.217 16.218 284 HG22 THR 570 HG22 THR 570 37.390 -2.063 16.616 285 HG23 THR 570 HG23 THR 570 38.871 -2.055 17.561 286 H VAL 571 H VAL 571 37.110 -3.346 13.513 287 HA VAL 571 HA VAL 571 34.556 -1.839 13.464 288 HB VAL 571 HB VAL 571 33.539 -4.112 13.083 289 HG11 VAL 571 HG11 VAL 571 35.397 -3.052 10.945 290 HG12 VAL 571 HG12 VAL 571 33.963 -4.082 10.716 291 HG13 VAL 571 HG13 VAL 571 33.763 -2.439 11.340 292 HG21 VAL 571 HG21 VAL 571 36.333 -4.935 12.280 293 HG22 VAL 571 HG22 VAL 571 35.496 -5.519 13.748 294 HG23 VAL 571 HG23 VAL 571 34.837 -5.884 12.141 295 H THR 572 H THR 572 32.864 -2.290 14.915 296 HA THR 572 HA THR 572 33.449 -4.010 17.277 297 HB THR 572 HB THR 572 32.302 -2.399 18.750 298 HG1 THR 572 HG1 THR 572 31.205 -1.147 17.260 299 HG21 THR 572 HG21 THR 572 34.148 -0.852 19.026 300 HG22 THR 572 HG22 THR 572 34.728 -1.181 17.378 301 HG23 THR 572 HG23 THR 572 34.791 -2.448 18.620 302 H GLY 573 H GLY 573 31.686 -5.088 18.146 303 HA2 GLY 573 HA2 GLY 573 29.621 -5.857 16.400 304 HA3 GLY 573 HA3 GLY 573 29.668 -6.179 18.141 305 H VAL 574 H VAL 574 27.496 -5.362 16.183 306 HA VAL 574 HA VAL 574 26.233 -3.333 17.938 307 HB VAL 574 HB VAL 574 26.083 -3.495 14.870 308 HG11 VAL 574 HG11 VAL 574 24.729 -1.576 16.805 309 HG12 VAL 574 HG12 VAL 574 24.778 -1.377 15.041 310 HG13 VAL 574 HG13 VAL 574 23.924 -2.749 15.734 311 HG21 VAL 574 HG21 VAL 574 27.122 -1.230 14.937 312 HG22 VAL 574 HG22 VAL 574 27.337 -1.397 16.694 313 HG23 VAL 574 HG23 VAL 574 28.198 -2.472 15.563 314 H TYR 575 H TYR 575 24.229 -3.867 18.684 315 HA TYR 575 HA TYR 575 23.154 -6.487 18.187 316 HB2 TYR 575 HB2 TYR 575 22.970 -5.305 20.314 317 HB3 TYR 575 HB3 TYR 575 21.955 -4.075 19.580 318 HD1 TYR 575 HD1 TYR 575 19.597 -4.362 19.391 319 HD2 TYR 575 HD2 TYR 575 22.112 -7.734 20.362 320 HE1 TYR 575 HE1 TYR 575 17.579 -5.699 19.937 321 HE2 TYR 575 HE2 TYR 575 20.076 -9.075 20.912 322 HH TYR 575 HH TYR 575 16.790 -7.713 20.751 323 H ASP 576 H ASP 576 22.116 -7.143 16.398 324 HA ASP 576 HA ASP 576 20.453 -5.340 14.766 325 HB2 ASP 576 HB2 ASP 576 21.922 -7.187 13.822 326 HB3 ASP 576 HB3 ASP 576 20.798 -8.346 14.508 327 H GLU 577 H GLU 577 18.409 -4.945 15.257 328 HA GLU 577 HA GLU 577 17.173 -5.994 17.567 329 HB2 GLU 577 HB2 GLU 577 16.036 -4.319 15.293 330 HB3 GLU 577 HB3 GLU 577 15.246 -4.572 16.849 331 HG2 GLU 577 HG2 GLU 577 17.052 -3.428 18.020 332 HG3 GLU 577 HG3 GLU 577 17.987 -3.285 16.531 333 H GLU 578 H GLU 578 16.592 -6.843 14.141 334 HA GLU 578 HA GLU 578 14.202 -8.456 14.876 335 HB2 GLU 578 HB2 GLU 578 15.496 -7.876 12.187 336 HB3 GLU 578 HB3 GLU 578 14.067 -8.888 12.445 337 HG2 GLU 578 HG2 GLU 578 13.068 -6.821 13.673 338 HG3 GLU 578 HG3 GLU 578 14.332 -5.891 12.878 339 H SER 579 H SER 579 17.569 -9.036 13.805 340 HA SER 579 HA SER 579 17.291 -11.945 13.813 341 HB2 SER 579 HB2 SER 579 19.820 -10.296 14.220 342 HB3 SER 579 HB3 SER 579 19.716 -11.996 13.759 343 HG SER 579 HG SER 579 18.967 -9.715 12.259 344 H GLY 580 H GLY 580 18.039 -9.463 16.225 345 HA2 GLY 580 HA2 GLY 580 17.939 -9.527 18.516 346 HA3 GLY 580 HA3 GLY 580 17.556 -11.247 18.487 347 H GLU 581 H GLU 581 20.402 -9.772 16.905 348 HA GLU 581 HA GLU 581 22.255 -11.069 18.827 349 HB2 GLU 581 HB2 GLU 581 22.111 -11.798 15.878 350 HB3 GLU 581 HB3 GLU 581 23.423 -12.241 16.953 351 HG2 GLU 581 HG2 GLU 581 20.530 -13.172 17.148 352 HG3 GLU 581 HG3 GLU 581 21.872 -14.093 16.520 353 H TRP 582 H TRP 582 24.390 -10.363 18.720 354 HA TRP 582 HA TRP 582 24.782 -7.686 17.619 355 HB2 TRP 582 HB2 TRP 582 26.637 -9.579 19.106 356 HB3 TRP 582 HB3 TRP 582 26.985 -7.907 18.694 357 HD1 TRP 582 HD1 TRP 582 24.738 -9.985 21.018 358 HE1 TRP 582 HE1 TRP 582 23.931 -8.529 22.948 359 HE3 TRP 582 HE3 TRP 582 26.635 -5.479 19.490 360 HZ2 TRP 582 HZ2 TRP 582 24.052 -5.758 23.737 361 HZ3 TRP 582 HZ3 TRP 582 26.287 -3.444 20.874 362 HH2 TRP 582 HH2 TRP 582 24.981 -3.571 22.986 363 H VAL 583 H VAL 583 25.814 -7.120 15.793 364 HA VAL 583 HA VAL 583 27.281 -9.130 14.150 365 HB VAL 583 HB VAL 583 26.156 -8.131 12.162 366 HG11 VAL 583 HG11 VAL 583 25.343 -10.284 12.966 367 HG12 VAL 583 HG12 VAL 583 24.265 -9.480 14.135 368 HG13 VAL 583 HG13 VAL 583 23.993 -9.306 12.396 369 HG21 VAL 583 HG21 VAL 583 24.072 -6.964 12.343 370 HG22 VAL 583 HG22 VAL 583 24.175 -6.914 14.115 371 HG23 VAL 583 HG23 VAL 583 25.341 -6.003 13.122 372 H TRP 584 H TRP 584 28.737 -8.351 12.651 373 HA TRP 584 HA TRP 584 29.875 -5.644 13.106 374 HB2 TRP 584 HB2 TRP 584 30.841 -8.243 11.906 375 HB3 TRP 584 HB3 TRP 584 31.687 -6.748 11.583 376 HD1 TRP 584 HD1 TRP 584 31.902 -5.432 14.317 377 HE1 TRP 584 HE1 TRP 584 33.294 -6.432 16.245 378 HE3 TRP 584 HE3 TRP 584 31.928 -10.308 12.822 379 HZ2 TRP 584 HZ2 TRP 584 34.475 -8.990 16.885 380 HZ3 TRP 584 HZ3 TRP 584 33.183 -12.023 14.116 381 HH2 TRP 584 HH2 TRP 584 34.475 -11.363 16.126 382 H LYS 585 H LYS 585 28.743 -4.222 11.955 383 HA LYS 585 HA LYS 585 27.472 -4.868 9.373 384 HB2 LYS 585 HB2 LYS 585 27.664 -2.282 10.956 385 HB3 LYS 585 HB3 LYS 585 26.752 -2.478 9.464 386 HG2 LYS 585 HG2 LYS 585 26.180 -3.949 12.072 387 HG3 LYS 585 HG3 LYS 585 25.333 -2.530 11.478 388 HD2 LYS 585 HD2 LYS 585 24.705 -3.901 9.391 389 HD3 LYS 585 HD3 LYS 585 25.307 -5.322 10.270 390 HE2 LYS 585 HE2 LYS 585 23.714 -4.800 12.125 391 HE3 LYS 585 HE3 LYS 585 23.093 -3.445 11.207 392 HZ1 LYS 585 HZ1 LYS 585 23.011 -6.227 10.170 393 HZ2 LYS 585 HZ2 LYS 585 22.230 -4.931 9.558 394 HZ3 LYS 585 HZ3 LYS 585 21.780 -5.552 10.986 395 H ASN 586 H ASN 586 27.946 -4.095 7.368 396 HA ASN 586 HA ASN 586 29.242 -3.560 5.604 397 HB2 ASN 586 HB2 ASN 586 28.934 -1.309 6.504 398 HB3 ASN 586 HB3 ASN 586 30.371 -1.466 7.493 399 HD21 ASN 586 HD21 ASN 586 30.819 -2.663 4.147 400 HD22 ASN 586 HD22 ASN 586 31.622 -1.171 3.668 401 H THR 587 H THR 587 29.950 -5.796 7.054 402 HA THR 587 HA THR 587 32.943 -5.923 6.838 403 HB THR 587 HB THR 587 31.246 -7.266 8.954 404 HG1 THR 587 HG1 THR 587 32.893 -4.969 9.046 405 HG21 THR 587 HG21 THR 587 33.335 -7.668 10.140 406 HG22 THR 587 HG22 THR 587 34.269 -6.936 8.822 407 HG23 THR 587 HG23 THR 587 33.395 -8.464 8.569 408 H ILE 588 H ILE 588 33.888 -7.797 6.263 409 HA ILE 588 HA ILE 588 32.291 -10.085 5.295 410 HB ILE 588 HB ILE 588 32.628 -8.672 3.368 411 HG12 ILE 588 HG12 ILE 588 34.633 -10.958 3.173 412 HG13 ILE 588 HG13 ILE 588 32.876 -11.214 3.210 413 HG21 ILE 588 HG21 ILE 588 35.634 -8.919 3.784 414 HG22 ILE 588 HG22 ILE 588 34.811 -8.053 2.480 415 HG23 ILE 588 HG23 ILE 588 34.702 -7.441 4.133 416 HD11 ILE 588 HD11 ILE 588 33.634 -11.293 0.922 417 HD12 ILE 588 HD12 ILE 588 32.697 -9.796 1.136 418 HD13 ILE 588 HD13 ILE 588 34.477 -9.751 1.073 419 H GLU 589 H GLU 589 33.311 -12.058 5.461 420 HA GLU 589 HA GLU 589 36.010 -12.156 6.749 421 HB2 GLU 589 HB2 GLU 589 34.140 -13.130 8.076 422 HB3 GLU 589 HB3 GLU 589 33.838 -14.280 6.766 423 HG2 GLU 589 HG2 GLU 589 36.194 -15.105 6.992 424 HG3 GLU 589 HG3 GLU 589 36.419 -14.016 8.354 425 H VAL 590 H VAL 590 37.630 -12.862 5.500 426 HA VAL 590 HA VAL 590 37.263 -14.755 3.282 427 HB VAL 590 HB VAL 590 36.576 -12.727 2.198 428 HG11 VAL 590 HG11 VAL 590 37.620 -10.999 3.573 429 HG12 VAL 590 HG12 VAL 590 39.237 -11.488 2.990 430 HG13 VAL 590 HG13 VAL 590 38.046 -10.781 1.881 431 HG21 VAL 590 HG21 VAL 590 39.415 -13.343 1.297 432 HG22 VAL 590 HG22 VAL 590 37.989 -14.355 0.933 433 HG23 VAL 590 HG23 VAL 590 38.075 -12.697 0.332 434 H ASN 591 H ASN 591 38.851 -15.935 2.843 435 HA ASN 591 HA ASN 591 40.722 -17.115 3.265 436 HB2 ASN 591 HB2 ASN 591 41.963 -14.354 3.059 437 HB3 ASN 591 HB3 ASN 591 42.793 -15.901 2.849 438 HD21 ASN 591 HD21 ASN 591 42.548 -13.717 0.894 439 HD22 ASN 591 HD22 ASN 591 41.757 -14.458 -0.494 440 H GLY 592 H GLY 592 39.316 -16.577 5.640 441 HA2 GLY 592 HA2 GLY 592 39.586 -17.178 7.848 442 HA3 GLY 592 HA3 GLY 592 41.334 -17.256 7.619 443 H LYS 593 H LYS 593 40.185 -14.184 6.654 444 HA LYS 593 HA LYS 593 40.582 -12.962 9.353 445 HB2 LYS 593 HB2 LYS 593 41.886 -12.121 6.734 446 HB3 LYS 593 HB3 LYS 593 41.877 -11.144 8.197 447 HG2 LYS 593 HG2 LYS 593 43.065 -12.967 9.419 448 HG3 LYS 593 HG3 LYS 593 43.127 -13.911 7.923 449 HD2 LYS 593 HD2 LYS 593 44.443 -12.125 6.835 450 HD3 LYS 593 HD3 LYS 593 44.393 -11.174 8.340 451 HE2 LYS 593 HE2 LYS 593 45.545 -12.990 9.547 452 HE3 LYS 593 HE3 LYS 593 45.563 -13.975 8.084 453 HZ1 LYS 593 HZ1 LYS 593 46.972 -12.278 7.043 454 HZ2 LYS 593 HZ2 LYS 593 47.675 -12.816 8.412 455 HZ3 LYS 593 HZ3 LYS 593 46.941 -11.363 8.396 456 H TYR 594 H TYR 594 39.771 -10.808 9.593 457 HA TYR 594 HA TYR 594 37.254 -10.373 8.086 458 HB2 TYR 594 HB2 TYR 594 38.308 -9.169 10.648 459 HB3 TYR 594 HB3 TYR 594 36.801 -8.695 9.879 460 HD1 TYR 594 HD1 TYR 594 35.033 -10.435 9.361 461 HD2 TYR 594 HD2 TYR 594 38.277 -11.158 12.109 462 HE1 TYR 594 HE1 TYR 594 33.787 -12.349 10.311 463 HE2 TYR 594 HE2 TYR 594 37.007 -13.069 13.091 464 HH TYR 594 HH TYR 594 33.964 -14.228 11.691 465 H PHE 595 H PHE 595 36.673 -8.532 7.186 466 HA PHE 595 HA PHE 595 38.533 -6.277 6.704 467 HB2 PHE 595 HB2 PHE 595 37.450 -8.236 4.644 468 HB3 PHE 595 HB3 PHE 595 37.988 -6.653 4.186 469 HD1 PHE 595 HD1 PHE 595 38.993 -10.030 5.170 470 HD2 PHE 595 HD2 PHE 595 40.425 -6.047 4.397 471 HE1 PHE 595 HE1 PHE 595 41.291 -10.923 4.850 472 HE2 PHE 595 HE2 PHE 595 42.725 -6.944 4.053 473 HZ PHE 595 HZ PHE 595 43.157 -9.377 4.299 474 H HIS 596 H HIS 596 37.365 -4.459 5.614 475 HA HIS 596 HA HIS 596 34.462 -4.355 6.233 476 HB2 HIS 596 HB2 HIS 596 36.400 -2.466 4.957 477 HB3 HIS 596 HB3 HIS 596 34.691 -2.134 4.898 478 HD2 HIS 596 HD2 HIS 596 33.751 -2.329 7.895 479 HE1 HIS 596 HE1 HIS 596 37.224 -0.057 8.867 480 HE2 HIS 596 HE2 HIS 596 34.930 -0.828 9.690 481 H SER 597 H SER 597 32.828 -4.533 4.644 482 HA SER 597 HA SER 597 33.415 -6.191 2.378 483 HB2 SER 597 HB2 SER 597 31.020 -5.817 1.833 484 HB3 SER 597 HB3 SER 597 31.298 -6.345 3.504 485 HG SER 597 HG SER 597 29.949 -4.309 2.784 486 H THR 598 H THR 598 32.775 -2.681 2.638 487 HA THR 598 HA THR 598 32.954 -2.142 -0.194 488 HB THR 598 HB THR 598 33.354 0.265 0.682 489 HG1 THR 598 HG1 THR 598 33.967 0.028 2.735 490 HG21 THR 598 HG21 THR 598 31.133 -0.558 -0.033 491 HG22 THR 598 HG22 THR 598 31.027 0.565 1.332 492 HG23 THR 598 HG23 THR 598 30.838 -1.179 1.606 493 H CYS 599 H CYS 599 35.389 -1.950 2.444 494 HA CYS 599 HA CYS 599 37.570 -0.971 0.913 495 HB2 CYS 599 HB2 CYS 599 37.453 -2.852 3.303 496 HB3 CYS 599 HB3 CYS 599 38.932 -2.191 2.679 497 H TYR 600 H TYR 600 36.689 -4.377 1.656 498 HA TYR 600 HA TYR 600 38.645 -5.666 0.081 499 HB2 TYR 600 HB2 TYR 600 37.441 -6.888 1.708 500 HB3 TYR 600 HB3 TYR 600 35.886 -6.455 1.030 501 HD1 TYR 600 HD1 TYR 600 38.968 -8.469 0.471 502 HD2 TYR 600 HD2 TYR 600 34.928 -7.721 -0.821 503 HE1 TYR 600 HE1 TYR 600 39.053 -10.498 -0.967 504 HE2 TYR 600 HE2 TYR 600 35.010 -9.749 -2.253 505 HH TYR 600 HH TYR 600 37.915 -11.815 -2.472 506 H HIS 601 H HIS 601 35.274 -4.775 -0.865 507 HA HIS 601 HA HIS 601 35.436 -5.782 -3.516 508 HB2 HIS 601 HB2 HIS 601 33.355 -5.279 -2.349 509 HB3 HIS 601 HB3 HIS 601 33.730 -3.557 -2.348 510 HD2 HIS 601 HD2 HIS 601 32.704 -2.208 -4.321 511 HE1 HIS 601 HE1 HIS 601 31.983 -5.370 -7.082 512 HE2 HIS 601 HE2 HIS 601 31.693 -2.880 -6.652 513 H GLU 602 H GLU 602 36.192 -2.491 -2.321 514 HA GLU 602 HA GLU 602 36.812 -1.414 -4.924 515 HB2 GLU 602 HB2 GLU 602 36.131 -0.070 -2.950 516 HB3 GLU 602 HB3 GLU 602 37.597 -0.559 -2.118 517 HG2 GLU 602 HG2 GLU 602 38.030 1.598 -2.793 518 HG3 GLU 602 HG3 GLU 602 38.930 0.639 -3.942 519 H THR 603 H THR 603 38.794 -2.982 -2.424 520 HA THR 603 HA THR 603 41.316 -2.256 -3.705 521 HB THR 603 HB THR 603 40.740 -3.996 -1.283 522 HG1 THR 603 HG1 THR 603 40.135 -1.909 -0.967 523 HG21 THR 603 HG21 THR 603 42.995 -4.512 -2.036 524 HG22 THR 603 HG22 THR 603 43.093 -3.439 -0.633 525 HG23 THR 603 HG23 THR 603 43.353 -2.781 -2.263 526 H SER 604 H SER 604 39.354 -5.229 -3.592 527 HA SER 604 HA SER 604 41.383 -7.035 -4.395 528 HB2 SER 604 HB2 SER 604 39.238 -7.734 -3.427 529 HB3 SER 604 HB3 SER 604 38.391 -7.197 -4.886 530 HG SER 604 HG SER 604 38.895 -9.450 -4.901 531 H GLN 605 H GLN 605 42.454 -7.288 -6.233 532 HA GLN 605 HA GLN 605 41.760 -5.790 -8.640 533 HB2 GLN 605 HB2 GLN 605 44.138 -6.842 -7.462 534 HB3 GLN 605 HB3 GLN 605 43.964 -7.676 -8.990 535 HG2 GLN 605 HG2 GLN 605 43.840 -4.639 -8.645 536 HG3 GLN 605 HG3 GLN 605 45.307 -5.526 -9.034 537 HE21 GLN 605 HE21 GLN 605 44.359 -3.469 -10.731 538 HE22 GLN 605 HE22 GLN 605 43.850 -4.227 -12.236 539 H ASN 606 H ASN 606 41.195 -6.600 -10.656 540 HA ASN 606 HA ASN 606 39.632 -9.039 -10.772 541 HB2 ASN 606 HB2 ASN 606 40.630 -7.168 -12.965 542 HB3 ASN 606 HB3 ASN 606 39.415 -8.424 -13.176 543 HD21 ASN 606 HD21 ASN 606 39.597 -5.183 -12.965 544 HD22 ASN 606 HD22 ASN 606 38.078 -4.872 -12.133 545 H SER 607 H SER 607 42.969 -8.253 -11.582 546 HA SER 607 HA SER 607 44.746 -9.443 -12.293 547 HB2 SER 607 HB2 SER 607 44.015 -10.814 -10.287 548 HB3 SER 607 HB3 SER 607 43.308 -11.961 -11.431 549 HG SER 607 HG SER 607 46.019 -11.234 -11.071 550 H SER 608 H SER 608 45.039 -11.972 -13.523 551 HA SER 608 HA SER 608 44.417 -11.297 -16.282 552 HB2 SER 608 HB2 SER 608 45.681 -13.329 -16.818 553 HB3 SER 608 HB3 SER 608 46.560 -12.253 -15.732 554 HG SER 608 HG SER 608 46.634 -14.464 -15.049
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