NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
22157 | 2jmf | 15016 | cing | 1-original | 8 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H VAL 515 H VAL 515 28.753 3.446 -9.884 2 HA VAL 515 HA VAL 515 29.433 5.448 -8.730 3 HB VAL 515 HB VAL 515 32.071 4.004 -8.311 4 HG11 VAL 515 HG11 VAL 515 32.422 6.428 -8.780 5 HG12 VAL 515 HG12 VAL 515 31.224 6.832 -7.525 6 HG13 VAL 515 HG13 VAL 515 32.749 6.039 -7.091 7 HG21 VAL 515 HG23 VAL 515 31.565 4.379 -5.894 8 HG22 VAL 515 HG21 VAL 515 29.958 4.992 -6.333 9 HG23 VAL 515 HG22 VAL 515 30.399 3.292 -6.641 10 H SER 516 H SER 516 31.852 3.651 -10.740 11 HA SER 516 HA SER 516 33.110 5.728 -11.815 12 HB2 SER 516 HB2 SER 516 32.564 3.180 -13.354 13 HB3 SER 516 HB3 SER 516 33.991 4.224 -13.467 14 HG SER 516 HG SER 516 34.414 2.444 -12.139 15 H LEU 517 H LEU 517 29.970 4.830 -13.086 16 HA LEU 517 HA LEU 517 30.118 7.178 -14.894 17 HB2 LEU 517 HB2 LEU 517 29.073 6.094 -16.715 18 HB3 LEU 517 HB3 LEU 517 30.532 5.222 -16.327 19 HG LEU 517 HG LEU 517 27.902 4.220 -15.191 20 HD11 LEU 517 1HD1 LEU 517 27.397 4.646 -17.545 21 HD12 LEU 517 2HD1 LEU 517 28.849 3.745 -18.042 22 HD13 LEU 517 3HD1 LEU 517 27.504 2.909 -17.231 23 HD21 LEU 517 3HD2 LEU 517 28.954 2.021 -15.514 24 HD22 LEU 517 1HD2 LEU 517 30.362 2.781 -16.283 25 HD23 LEU 517 2HD2 LEU 517 30.020 3.058 -14.564 26 H ILE 518 H ILE 518 28.855 6.454 -12.234 27 HA ILE 518 HA ILE 518 26.040 7.308 -12.810 28 HB ILE 518 HB ILE 518 26.872 5.349 -10.636 29 HG12 ILE 518 HG12 ILE 518 25.250 3.867 -12.291 30 HG13 ILE 518 HG13 ILE 518 26.048 4.859 -13.489 31 HG21 ILE 518 HG21 ILE 518 24.824 6.550 -10.052 32 HG22 ILE 518 HG22 ILE 518 24.129 6.203 -11.654 33 HG23 ILE 518 HG23 ILE 518 24.427 4.899 -10.483 34 HD11 ILE 518 3HD1 ILE 518 27.241 2.755 -13.183 35 HD12 ILE 518 1HD1 ILE 518 28.273 4.040 -12.531 36 HD13 ILE 518 2HD1 ILE 518 27.335 3.004 -11.433 37 H ASN 519 H ASN 519 28.948 7.911 -11.060 38 HA ASN 519 HA ASN 519 27.610 9.965 -9.356 39 HB2 ASN 519 HB2 ASN 519 28.788 7.797 -8.392 40 HB3 ASN 519 HB3 ASN 519 30.276 8.681 -8.731 41 HD21 ASN 519 2HD2 ASN 519 27.143 8.849 -7.000 42 HD22 ASN 519 1HD2 ASN 519 27.741 9.890 -5.716 43 H GLU 520 H GLU 520 28.754 10.109 -12.166 44 HA GLU 520 HA GLU 520 31.031 11.905 -12.172 45 HB2 GLU 520 HB2 GLU 520 28.880 11.259 -14.229 46 HB3 GLU 520 HB3 GLU 520 30.302 12.239 -14.572 47 HG2 GLU 520 HG2 GLU 520 30.452 9.339 -13.636 48 HG3 GLU 520 HG3 GLU 520 30.452 9.849 -15.315 49 H GLY 521 H GLY 521 30.625 14.063 -13.552 50 HA2 GLY 521 HA2 GLY 521 29.632 15.983 -11.766 51 HA3 GLY 521 HA3 GLY 521 30.032 16.274 -13.453 52 HA PRO 522 HA PRO 522 25.417 16.719 -12.314 53 HB2 PRO 522 HB2 PRO 522 25.091 19.442 -12.453 54 HB3 PRO 522 HB3 PRO 522 25.690 18.590 -10.998 55 HG2 PRO 522 HG2 PRO 522 27.328 19.952 -13.159 56 HG3 PRO 522 HG3 PRO 522 27.472 20.136 -11.381 57 HD2 PRO 522 HD2 PRO 522 29.086 18.452 -12.776 58 HD3 PRO 522 HD3 PRO 522 28.479 18.009 -11.152 59 H LEU 523 H LEU 523 23.646 17.056 -13.688 60 HA LEU 523 HA LEU 523 24.299 16.996 -16.518 61 HB2 LEU 523 HB2 LEU 523 22.175 16.154 -16.878 62 HB3 LEU 523 HB3 LEU 523 22.682 15.451 -15.380 63 HG LEU 523 HG LEU 523 21.095 17.932 -14.951 64 HD11 LEU 523 1HD1 LEU 523 20.051 17.197 -17.067 65 HD12 LEU 523 2HD1 LEU 523 19.768 15.590 -16.370 66 HD13 LEU 523 3HD1 LEU 523 18.955 17.021 -15.691 67 HD21 LEU 523 3HD2 LEU 523 19.815 16.482 -13.461 68 HD22 LEU 523 1HD2 LEU 523 20.647 15.046 -14.095 69 HD23 LEU 523 2HD2 LEU 523 21.550 16.271 -13.173 70 HA PRO 524 HA PRO 524 23.286 21.169 -17.650 71 HB2 PRO 524 HB2 PRO 524 22.190 20.890 -20.184 72 HB3 PRO 524 HB3 PRO 524 23.930 20.735 -19.795 73 HG2 PRO 524 HG2 PRO 524 21.877 18.529 -20.075 74 HG3 PRO 524 HG3 PRO 524 23.515 18.611 -20.795 75 HD2 PRO 524 HD2 PRO 524 23.015 17.216 -18.533 76 HD3 PRO 524 HD3 PRO 524 24.532 18.136 -18.711 77 HA PRO 525 HA PRO 525 19.278 22.074 -16.319 78 HB2 PRO 525 HB2 PRO 525 18.746 24.585 -17.280 79 HB3 PRO 525 HB3 PRO 525 20.036 24.233 -16.093 80 HG2 PRO 525 HG2 PRO 525 20.315 24.527 -19.103 81 HG3 PRO 525 HG3 PRO 525 21.295 25.305 -17.819 82 HD2 PRO 525 HD2 PRO 525 22.127 23.047 -19.078 83 HD3 PRO 525 HD3 PRO 525 22.422 23.291 -17.331 84 H GLY 526 H GLY 526 17.531 20.913 -16.919 85 HA2 GLY 526 HA2 GLY 526 15.564 20.367 -17.978 86 HA3 GLY 526 HA3 GLY 526 15.671 21.887 -18.868 87 H TRP 527 H TRP 527 18.187 19.457 -19.123 88 HA TRP 527 HA TRP 527 17.344 18.693 -21.904 89 HB2 TRP 527 HB2 TRP 527 20.004 19.491 -20.721 90 HB3 TRP 527 HB3 TRP 527 19.960 18.383 -22.076 91 HD1 TRP 527 HD1 TRP 527 19.639 22.024 -21.231 92 HE1 TRP 527 HE1 TRP 527 19.542 23.423 -23.378 93 HE3 TRP 527 HE3 TRP 527 19.170 18.237 -24.630 94 HZ2 TRP 527 HZ2 TRP 527 19.308 22.955 -26.219 95 HZ3 TRP 527 HZ3 TRP 527 19.016 18.740 -27.066 96 HH2 TRP 527 HH2 TRP 527 19.093 21.087 -27.867 97 H GLU 528 H GLU 528 18.075 16.646 -22.628 98 HA GLU 528 HA GLU 528 18.985 14.656 -20.604 99 HB2 GLU 528 HB2 GLU 528 16.630 14.278 -20.859 100 HB3 GLU 528 HB3 GLU 528 16.711 14.418 -22.602 101 HG2 GLU 528 HG2 GLU 528 16.390 12.131 -22.075 102 HG3 GLU 528 HG3 GLU 528 18.025 12.277 -22.689 103 H ILE 529 H ILE 529 20.260 12.963 -21.492 104 HA ILE 529 HA ILE 529 21.574 13.521 -24.100 105 HB ILE 529 HB ILE 529 23.288 13.154 -21.624 106 HG12 ILE 529 HG12 ILE 529 23.754 15.742 -21.972 107 HG13 ILE 529 HG13 ILE 529 22.107 15.773 -22.573 108 HG21 ILE 529 HG21 ILE 529 24.239 12.743 -23.881 109 HG22 ILE 529 HG22 ILE 529 23.808 14.403 -24.355 110 HG23 ILE 529 HG23 ILE 529 25.001 14.111 -23.067 111 HD11 ILE 529 3HD1 ILE 529 21.895 16.248 -20.267 112 HD12 ILE 529 1HD1 ILE 529 21.552 14.521 -20.275 113 HD13 ILE 529 2HD1 ILE 529 23.160 15.083 -19.809 114 H ARG 530 H ARG 530 21.983 11.675 -25.135 115 HA ARG 530 HA ARG 530 21.988 9.077 -23.624 116 HB2 ARG 530 HB2 ARG 530 20.345 9.746 -26.099 117 HB3 ARG 530 HB3 ARG 530 20.501 8.145 -25.397 118 HG2 ARG 530 HG2 ARG 530 19.609 9.989 -23.311 119 HG3 ARG 530 HG3 ARG 530 18.622 10.206 -24.748 120 HD2 ARG 530 HD2 ARG 530 17.563 8.580 -23.356 121 HD3 ARG 530 HD3 ARG 530 18.194 7.738 -24.781 122 HE ARG 530 HE ARG 530 20.057 7.727 -22.532 123 HH11 ARG 530 HH11 ARG 530 17.215 6.046 -23.712 124 HH12 ARG 530 HH12 ARG 530 17.594 4.598 -22.814 125 HH21 ARG 530 HH21 ARG 530 20.486 5.842 -21.438 126 HH22 ARG 530 HH22 ARG 530 19.390 4.494 -21.568 127 H TYR 531 H TYR 531 22.714 7.270 -24.815 128 HA TYR 531 HA TYR 531 24.932 7.868 -26.725 129 HB2 TYR 531 HB2 TYR 531 25.054 6.063 -24.280 130 HB3 TYR 531 HB3 TYR 531 26.344 6.358 -25.429 131 HD1 TYR 531 HD1 TYR 531 24.269 7.913 -22.738 132 HD2 TYR 531 HD2 TYR 531 27.840 8.218 -25.143 133 HE1 TYR 531 HE1 TYR 531 25.112 9.727 -21.256 134 HE2 TYR 531 HE2 TYR 531 28.710 9.981 -23.620 135 HH TYR 531 HH TYR 531 28.313 11.239 -21.746 136 H THR 532 H THR 532 24.458 6.751 -28.568 137 HA THR 532 HA THR 532 22.593 4.466 -28.488 138 HB THR 532 HB THR 532 22.715 4.527 -30.921 139 HG1 THR 532 HG1 THR 532 23.895 6.214 -31.888 140 HG21 THR 532 HG23 THR 532 21.731 6.741 -31.308 141 HG22 THR 532 HG21 THR 532 21.128 6.040 -29.799 142 HG23 THR 532 HG22 THR 532 22.360 7.315 -29.750 143 H ALA 533 H ALA 533 23.002 2.442 -29.598 144 HA ALA 533 HA ALA 533 25.417 1.153 -28.827 145 HB1 ALA 533 HB3 ALA 533 24.495 -0.762 -30.054 146 HB2 ALA 533 HB1 ALA 533 23.240 0.028 -29.084 147 HB3 ALA 533 HB2 ALA 533 23.300 0.287 -30.843 148 H ALA 534 H ALA 534 24.829 3.097 -31.635 149 HA ALA 534 HA ALA 534 26.926 2.067 -33.341 150 HB1 ALA 534 HB3 ALA 534 26.608 4.205 -34.526 151 HB2 ALA 534 HB1 ALA 534 25.046 3.453 -34.165 152 HB3 ALA 534 HB2 ALA 534 25.624 4.825 -33.187 153 H GLY 535 H GLY 535 27.115 3.731 -30.333 154 HA2 GLY 535 HA2 GLY 535 29.042 4.317 -29.166 155 HA3 GLY 535 HA3 GLY 535 30.018 4.173 -30.631 156 H GLU 536 H GLU 536 27.054 6.129 -30.320 157 HA GLU 536 HA GLU 536 28.637 8.662 -30.536 158 HB2 GLU 536 HB2 GLU 536 26.178 7.834 -32.127 159 HB3 GLU 536 HB3 GLU 536 26.841 9.461 -32.108 160 HG2 GLU 536 HG2 GLU 536 28.226 6.958 -33.157 161 HG3 GLU 536 HG3 GLU 536 27.479 8.227 -34.116 162 H ARG 537 H ARG 537 27.544 10.556 -29.886 163 HA ARG 537 HA ARG 537 25.554 10.127 -27.686 164 HB2 ARG 537 HB2 ARG 537 27.708 10.587 -26.766 165 HB3 ARG 537 HB3 ARG 537 27.998 11.913 -27.898 166 HG2 ARG 537 HG2 ARG 537 26.318 13.303 -26.814 167 HG3 ARG 537 HG3 ARG 537 25.850 11.971 -25.729 168 HD2 ARG 537 HD2 ARG 537 27.986 11.994 -24.644 169 HD3 ARG 537 HD3 ARG 537 28.693 13.049 -25.882 170 HE ARG 537 HE ARG 537 26.573 14.505 -24.776 171 HH11 ARG 537 HH11 ARG 537 29.615 13.209 -23.605 172 HH12 ARG 537 HH12 ARG 537 29.783 14.453 -22.392 173 HH21 ARG 537 HH21 ARG 537 26.878 16.079 -23.226 174 HH22 ARG 537 HH22 ARG 537 28.294 16.040 -22.212 175 H PHE 538 H PHE 538 23.891 11.452 -27.474 176 HA PHE 538 HA PHE 538 23.430 13.668 -29.428 177 HB2 PHE 538 HB2 PHE 538 21.541 11.350 -28.836 178 HB3 PHE 538 HB3 PHE 538 21.166 12.752 -29.824 179 HD1 PHE 538 HD1 PHE 538 23.111 9.598 -29.663 180 HD2 PHE 538 HD2 PHE 538 22.004 12.974 -32.094 181 HE1 PHE 538 HE1 PHE 538 23.968 8.432 -31.675 182 HE2 PHE 538 HE2 PHE 538 22.840 11.785 -34.123 183 HZ PHE 538 HZ PHE 538 23.828 9.516 -33.909 184 H PHE 539 H PHE 539 21.781 15.116 -28.829 185 HA PHE 539 HA PHE 539 21.147 15.204 -25.901 186 HB2 PHE 539 HB2 PHE 539 21.691 17.472 -27.842 187 HB3 PHE 539 HB3 PHE 539 21.230 17.650 -26.161 188 HD1 PHE 539 HD1 PHE 539 23.968 16.474 -28.412 189 HD2 PHE 539 HD2 PHE 539 22.836 17.560 -24.395 190 HE1 PHE 539 HE1 PHE 539 26.360 16.501 -27.746 191 HE2 PHE 539 HE2 PHE 539 25.227 17.648 -23.745 192 HZ PHE 539 HZ PHE 539 27.000 17.125 -25.427 193 H VAL 540 H VAL 540 19.165 15.883 -25.292 194 HA VAL 540 HA VAL 540 16.943 15.923 -27.301 195 HB VAL 540 HB VAL 540 17.211 14.334 -24.722 196 HG11 VAL 540 HG11 VAL 540 14.865 15.099 -25.096 197 HG12 VAL 540 HG12 VAL 540 14.897 14.332 -26.701 198 HG13 VAL 540 HG13 VAL 540 15.058 13.360 -25.214 199 HG21 VAL 540 HG23 VAL 540 17.038 12.320 -26.106 200 HG22 VAL 540 HG21 VAL 540 17.055 13.312 -27.578 201 HG23 VAL 540 HG22 VAL 540 18.477 13.253 -26.514 202 H ASP 541 H ASP 541 15.641 17.594 -27.043 203 HA ASP 541 HA ASP 541 15.575 19.111 -24.467 204 HB2 ASP 541 HB2 ASP 541 16.308 20.432 -26.357 205 HB3 ASP 541 HB3 ASP 541 14.933 19.902 -27.330 206 H HIS 542 H HIS 542 13.978 18.208 -23.232 207 HA HIS 542 HA HIS 542 11.499 17.153 -24.260 208 HB2 HIS 542 HB2 HIS 542 12.185 18.154 -21.469 209 HB3 HIS 542 HB3 HIS 542 10.801 17.152 -21.895 210 HD2 HIS 542 HD2 HIS 542 12.548 15.078 -23.829 211 HE1 HIS 542 HE1 HIS 542 14.345 14.019 -20.111 212 H ASN 543 H ASN 543 12.458 20.434 -23.691 213 HA ASN 543 HA ASN 543 9.885 21.536 -23.034 214 HB2 ASN 543 HB2 ASN 543 12.316 22.932 -24.232 215 HB3 ASN 543 HB3 ASN 543 10.985 23.690 -23.369 216 HD21 ASN 543 2HD2 ASN 543 14.043 22.140 -23.049 217 HD22 ASN 543 1HD2 ASN 543 14.055 22.029 -21.291 218 H THR 544 H THR 544 11.523 21.044 -26.144 219 HA THR 544 HA THR 544 9.005 21.806 -27.597 220 HB THR 544 HB THR 544 10.338 22.754 -29.371 221 HG1 THR 544 HG1 THR 544 12.578 22.139 -27.718 222 HG21 THR 544 HG23 THR 544 11.210 24.744 -28.336 223 HG22 THR 544 HG21 THR 544 9.729 24.261 -27.489 224 HG23 THR 544 HG22 THR 544 11.318 23.949 -26.751 225 H ARG 545 H ARG 545 10.767 19.213 -26.850 226 HA ARG 545 HA ARG 545 11.127 17.151 -27.597 227 HB2 ARG 545 HB2 ARG 545 8.595 17.625 -28.315 228 HB3 ARG 545 HB3 ARG 545 9.251 17.367 -29.934 229 HG2 ARG 545 HG2 ARG 545 10.159 15.151 -29.151 230 HG3 ARG 545 HG3 ARG 545 9.473 15.469 -27.554 231 HD2 ARG 545 HD2 ARG 545 7.898 15.183 -30.148 232 HD3 ARG 545 HD3 ARG 545 8.079 13.944 -28.918 233 HE ARG 545 HE ARG 545 6.783 15.239 -27.350 234 HH11 ARG 545 HH11 ARG 545 6.638 16.607 -30.591 235 HH12 ARG 545 HH12 ARG 545 5.164 17.467 -30.238 236 HH21 ARG 545 HH21 ARG 545 4.939 16.377 -26.991 237 HH22 ARG 545 HH22 ARG 545 4.238 17.345 -28.261 238 H ARG 546 H ARG 546 12.559 19.510 -28.890 239 HA ARG 546 HA ARG 546 13.596 18.497 -31.434 240 HB2 ARG 546 HB2 ARG 546 14.327 20.769 -29.546 241 HB3 ARG 546 HB3 ARG 546 15.403 20.349 -30.861 242 HG2 ARG 546 HG2 ARG 546 12.481 21.121 -31.228 243 HG3 ARG 546 HG3 ARG 546 13.849 22.219 -31.404 244 HD2 ARG 546 HD2 ARG 546 13.307 19.754 -33.108 245 HD3 ARG 546 HD3 ARG 546 13.030 21.422 -33.579 246 HE ARG 546 HE ARG 546 15.586 21.706 -33.173 247 HH11 ARG 546 HH11 ARG 546 14.221 18.768 -34.536 248 HH12 ARG 546 HH12 ARG 546 15.656 18.458 -35.476 249 HH21 ARG 546 HH21 ARG 546 17.271 21.344 -34.605 250 HH22 ARG 546 HH22 ARG 546 17.346 19.810 -35.422 251 H THR 547 H THR 547 15.831 18.126 -31.833 252 HA THR 547 HA THR 547 17.472 16.923 -29.694 253 HB THR 547 HB THR 547 17.884 14.901 -31.142 254 HG1 THR 547 HG1 THR 547 16.917 15.805 -33.051 255 HG21 THR 547 HG23 THR 547 15.975 13.636 -30.416 256 HG22 THR 547 HG21 THR 547 16.360 14.817 -29.160 257 HG23 THR 547 HG22 THR 547 14.982 15.094 -30.245 258 H THR 548 H THR 548 19.702 16.665 -30.288 259 HA THR 548 HA THR 548 20.625 17.548 -32.928 260 HB THR 548 HB THR 548 20.178 19.703 -31.990 261 HG1 THR 548 HG1 THR 548 22.174 20.587 -32.157 262 HG21 THR 548 HG23 THR 548 21.400 20.541 -29.969 263 HG22 THR 548 HG21 THR 548 20.161 19.330 -29.610 264 HG23 THR 548 HG22 THR 548 21.870 18.863 -29.622 265 H PHE 549 H PHE 549 22.958 17.550 -33.137 266 HA PHE 549 HA PHE 549 24.079 15.097 -31.980 267 HB2 PHE 549 HB2 PHE 549 25.348 16.983 -33.984 268 HB3 PHE 549 HB3 PHE 549 25.676 15.272 -33.760 269 HD1 PHE 549 HD2 PHE 549 22.835 14.184 -33.777 270 HD2 PHE 549 HD1 PHE 549 24.774 17.115 -36.267 271 HE1 PHE 549 HE2 PHE 549 21.251 13.662 -35.614 272 HE2 PHE 549 HE1 PHE 549 23.194 16.587 -38.110 273 HZ PHE 549 HZ PHE 549 21.428 14.865 -37.786 274 H GLU 550 H GLU 550 24.299 18.405 -31.191 275 HA GLU 550 HA GLU 550 26.693 18.086 -29.499 276 HB2 GLU 550 HB2 GLU 550 27.907 19.916 -30.510 277 HB3 GLU 550 HB3 GLU 550 27.620 18.657 -31.697 278 HG2 GLU 550 HG2 GLU 550 25.721 20.003 -32.644 279 HG3 GLU 550 HG3 GLU 550 26.090 21.284 -31.486 280 H ASP 551 H ASP 551 27.086 20.796 -28.864 281 HA ASP 551 HA ASP 551 24.468 21.591 -27.635 282 HB2 ASP 551 HB2 ASP 551 25.971 20.594 -26.009 283 HB3 ASP 551 HB3 ASP 551 27.245 21.733 -26.444 284 HA PRO 552 HA PRO 552 26.012 25.069 -30.316 285 HB2 PRO 552 HB2 PRO 552 23.788 25.545 -31.797 286 HB3 PRO 552 HB3 PRO 552 24.850 24.142 -32.120 287 HG2 PRO 552 HG2 PRO 552 22.283 24.191 -30.494 288 HG3 PRO 552 HG3 PRO 552 22.726 23.074 -31.827 289 HD2 PRO 552 HD2 PRO 552 23.091 22.437 -29.188 290 HD3 PRO 552 HD3 PRO 552 24.208 21.887 -30.468 291 H ARG 553 H ARG 553 25.095 27.311 -30.620 292 HA ARG 553 HA ARG 553 24.195 28.617 -28.238 293 HB2 ARG 553 HB2 ARG 553 24.216 29.363 -31.194 294 HB3 ARG 553 HB3 ARG 553 23.565 30.466 -29.996 295 HG2 ARG 553 HG2 ARG 553 26.414 29.392 -29.857 296 HG3 ARG 553 HG3 ARG 553 25.948 30.881 -30.685 297 HD2 ARG 553 HD2 ARG 553 24.916 31.683 -28.494 298 HD3 ARG 553 HD3 ARG 553 25.638 30.276 -27.716 299 HE ARG 553 HE ARG 553 27.727 31.277 -27.806 300 HH11 ARG 553 HH11 ARG 553 25.623 33.167 -29.895 301 HH12 ARG 553 HH12 ARG 553 26.798 34.447 -30.052 302 HH21 ARG 553 HH21 ARG 553 29.154 32.951 -28.051 303 HH22 ARG 553 HH22 ARG 553 28.731 34.324 -29.038 304 HA PRO 554 HA PRO 554 19.729 28.037 -28.454 305 HB2 PRO 554 HB2 PRO 554 18.830 30.274 -27.150 306 HB3 PRO 554 HB3 PRO 554 19.600 28.892 -26.314 307 HG2 PRO 554 HG2 PRO 554 20.886 31.497 -27.174 308 HG3 PRO 554 HG3 PRO 554 21.018 30.663 -25.593 309 HD2 PRO 554 HD2 PRO 554 22.917 30.427 -27.540 310 HD3 PRO 554 HD3 PRO 554 22.508 29.061 -26.460 311 H GLY 555 H GLY 555 18.172 28.564 -29.948 312 HA2 GLY 555 HA2 GLY 555 17.635 30.916 -31.351 313 HA3 GLY 555 HA3 GLY 555 19.013 30.192 -32.183 314 H ALA 556 H ALA 556 17.750 29.933 -34.040 315 HA ALA 556 HA ALA 556 15.364 28.469 -34.356 316 HB1 ALA 556 HB3 ALA 556 16.149 28.296 -36.725 317 HB2 ALA 556 HB1 ALA 556 16.367 29.925 -36.064 318 HB3 ALA 556 HB2 ALA 556 17.760 28.828 -36.214 319 HA PRO 557 HA PRO 557 16.301 24.249 -33.597 320 HB2 PRO 557 HB2 PRO 557 14.848 22.883 -35.530 321 HB3 PRO 557 HB3 PRO 557 14.155 23.668 -34.076 322 HG2 PRO 557 HG2 PRO 557 14.356 24.772 -36.888 323 HG3 PRO 557 HG3 PRO 557 12.940 24.782 -35.786 324 HD2 PRO 557 HD2 PRO 557 14.514 26.954 -36.042 325 HD3 PRO 557 HD3 PRO 557 13.896 26.480 -34.434 326 H ASN2319 H ASN2319 26.684 19.057 -43.213 327 HA ASN2319 HA ASN2319 27.884 17.756 -41.601 328 HB2 ASN2319 HB2 ASN2319 25.413 18.214 -39.877 329 HB3 ASN2319 HB3 ASN2319 26.629 16.983 -39.550 330 HD21 ASN2319 2HD2 ASN2319 25.803 20.209 -38.825 331 HD22 ASN2319 1HD2 ASN2319 27.394 20.714 -38.293 332 H THR2320 H THR2320 27.714 16.509 -43.501 333 HA THR2320 HA THR2320 25.358 14.786 -43.956 334 HB THR2320 HB THR2320 26.890 13.751 -45.689 335 HG1 THR2320 HG1 THR2320 28.854 14.442 -44.716 336 HG21 THR2320 HG23 THR2320 26.767 15.638 -47.246 337 HG22 THR2320 HG21 THR2320 25.279 15.524 -46.290 338 HG23 THR2320 HG22 THR2320 26.490 16.767 -45.902 339 H GLY2321 H GLY2321 25.146 12.689 -43.309 340 HA2 GLY2321 HA2 GLY2321 26.714 10.603 -42.952 341 HA3 GLY2321 HA3 GLY2321 27.260 11.517 -41.545 342 H ALA2322 H ALA2322 24.267 10.234 -43.070 343 HA ALA2322 HA ALA2322 22.545 10.402 -40.844 344 HB1 ALA2322 HB3 ALA2322 21.249 8.647 -41.997 345 HB2 ALA2322 HB1 ALA2322 21.800 9.896 -43.128 346 HB3 ALA2322 HB2 ALA2322 22.627 8.321 -43.070 347 H LYS2323 H LYS2323 22.106 9.177 -39.119 348 HA LYS2323 HA LYS2323 23.680 6.754 -38.407 349 HB2 LYS2323 HB2 LYS2323 24.572 9.266 -37.630 350 HB3 LYS2323 HB3 LYS2323 23.475 8.897 -36.317 351 HG2 LYS2323 HG2 LYS2323 25.521 8.087 -35.545 352 HG3 LYS2323 HG3 LYS2323 24.772 6.611 -36.164 353 HD2 LYS2323 HD2 LYS2323 26.063 6.948 -38.325 354 HD3 LYS2323 HD3 LYS2323 26.835 8.364 -37.582 355 HE2 LYS2323 HE2 LYS2323 27.637 6.836 -35.716 356 HE3 LYS2323 HE3 LYS2323 27.013 5.466 -36.644 357 HZ1 LYS2323 HZ3 LYS2323 29.368 5.818 -37.079 358 HZ2 LYS2323 HZ1 LYS2323 28.534 6.114 -38.452 359 HZ3 LYS2323 HZ2 LYS2323 29.117 7.356 -37.560 360 H GLN2324 H GLN2324 22.860 6.287 -35.882 361 HA GLN2324 HA GLN2324 20.092 5.589 -35.980 362 HB2 GLN2324 HB2 GLN2324 21.976 5.949 -33.620 363 HB3 GLN2324 HB3 GLN2324 20.299 5.404 -33.483 364 HG2 GLN2324 HG2 GLN2324 20.877 3.528 -35.123 365 HG3 GLN2324 HG3 GLN2324 22.566 4.009 -34.953 366 HE21 GLN2324 HE22 GLN2324 23.239 2.028 -33.943 367 HE22 GLN2324 HE21 GLN2324 22.627 1.549 -32.367 368 HA PRO2325 HA PRO2325 18.685 9.821 -35.403 369 HB2 PRO2325 HB2 PRO2325 15.975 9.476 -35.575 370 HB3 PRO2325 HB3 PRO2325 17.078 9.398 -36.980 371 HG2 PRO2325 HG2 PRO2325 15.940 7.093 -35.376 372 HG3 PRO2325 HG3 PRO2325 16.037 7.269 -37.156 373 HD2 PRO2325 HD2 PRO2325 17.872 5.844 -35.703 374 HD3 PRO2325 HD3 PRO2325 18.322 6.749 -37.179 375 HA PRO2326 HA PRO2326 17.793 9.504 -30.931 376 HB2 PRO2326 HB2 PRO2326 17.928 12.145 -30.258 377 HB3 PRO2326 HB3 PRO2326 19.372 11.147 -30.605 378 HG2 PRO2326 HG2 PRO2326 17.915 13.013 -32.504 379 HG3 PRO2326 HG3 PRO2326 19.669 12.932 -32.176 380 HD2 PRO2326 HD2 PRO2326 18.506 11.691 -34.309 381 HD3 PRO2326 HD3 PRO2326 19.889 10.949 -33.447 382 H SER2327 H SER2327 15.789 9.091 -30.305 383 HA SER2327 HA SER2327 13.575 11.039 -30.615 384 HB2 SER2327 HB2 SER2327 13.405 8.170 -31.632 385 HB3 SER2327 HB3 SER2327 12.030 9.266 -31.406 386 HG SER2327 HG SER2327 12.726 9.278 -33.551 387 H TYR2328 H TYR2328 13.626 11.322 -28.388 388 HA TYR2328 HA TYR2328 13.265 8.996 -26.584 389 HB2 TYR2328 HB2 TYR2328 14.826 10.853 -26.062 390 HB3 TYR2328 HB3 TYR2328 13.480 11.970 -26.008 391 HD1 TYR2328 HD1 TYR2328 15.042 9.006 -24.393 392 HD2 TYR2328 HD2 TYR2328 12.102 12.145 -23.990 393 HE1 TYR2328 HE1 TYR2328 14.810 8.483 -21.970 394 HE2 TYR2328 HE2 TYR2328 11.859 11.604 -21.577 395 HH TYR2328 HH TYR2328 13.776 9.024 -20.011 396 H GLU2329 H GLU2329 11.578 12.059 -26.137 397 HA GLU2329 HA GLU2329 9.009 11.013 -25.555 398 HB2 GLU2329 HB2 GLU2329 10.264 13.642 -26.089 399 HB3 GLU2329 HB3 GLU2329 8.588 13.570 -26.586 400 HG2 GLU2329 HG2 GLU2329 9.269 12.552 -23.835 401 HG3 GLU2329 HG3 GLU2329 9.321 14.287 -24.128 402 H ASP2330 H ASP2330 10.412 11.994 -28.670 403 HA ASP2330 HA ASP2330 7.968 11.885 -30.162 404 HB2 ASP2330 HB2 ASP2330 10.104 13.124 -30.735 405 HB3 ASP2330 HB3 ASP2330 10.800 11.576 -31.215 406 H CYS2331 H CYS2331 9.954 9.312 -28.996 407 HA CYS2331 HA CYS2331 8.832 7.342 -30.942 408 HB2 CYS2331 HB2 CYS2331 11.271 7.319 -30.419 409 HB3 CYS2331 HB3 CYS2331 10.892 7.000 -28.719 410 HG CYS2331 HG CYS2331 10.074 5.213 -31.408 411 H ILE2332 H ILE2332 8.804 8.160 -27.442 412 HA ILE2332 HA ILE2332 7.046 5.900 -26.844 413 HB ILE2332 HB ILE2332 7.229 6.517 -24.539 414 HG12 ILE2332 HG12 ILE2332 9.091 8.811 -25.176 415 HG13 ILE2332 HG13 ILE2332 7.359 9.098 -25.029 416 HG21 ILE2332 HG21 ILE2332 8.998 5.170 -25.629 417 HG22 ILE2332 HG22 ILE2332 9.956 6.643 -25.891 418 HG23 ILE2332 HG23 ILE2332 9.603 6.087 -24.245 419 HD11 ILE2332 3HD1 ILE2332 8.499 9.544 -22.913 420 HD12 ILE2332 1HD1 ILE2332 7.376 8.183 -22.740 421 HD13 ILE2332 2HD1 ILE2332 9.126 7.887 -22.861 422 H LYS2333 H LYS2333 5.970 8.160 -28.542 423 HA LYS2333 HA LYS2333 3.441 8.632 -27.021 424 HB2 LYS2333 HB2 LYS2333 3.254 10.843 -27.751 425 HB3 LYS2333 HB3 LYS2333 4.903 10.687 -27.157 426 HG2 LYS2333 HG2 LYS2333 5.660 10.408 -29.574 427 HG3 LYS2333 HG3 LYS2333 3.987 10.723 -30.068 428 HD2 LYS2333 HD2 LYS2333 4.125 12.950 -28.836 429 HD3 LYS2333 HD3 LYS2333 5.835 12.609 -28.554 430 HE2 LYS2333 HE2 LYS2333 5.848 13.976 -30.462 431 HE3 LYS2333 HE3 LYS2333 6.075 12.347 -31.101 432 HZ1 LYS2333 HZ3 LYS2333 4.428 13.578 -32.374 433 HZ2 LYS2333 HZ1 LYS2333 3.686 12.325 -31.639 434 HZ3 LYS2333 HZ2 LYS2333 3.506 13.842 -31.053 Start of MODEL 2 1 H VAL 515 H VAL 515 27.472 4.718 -17.549 2 HA VAL 515 HA VAL 515 26.566 6.914 -17.205 3 HB VAL 515 HB VAL 515 24.489 6.149 -16.169 4 HG11 VAL 515 HG11 VAL 515 25.357 4.597 -14.405 5 HG12 VAL 515 HG12 VAL 515 25.943 6.017 -13.497 6 HG13 VAL 515 HG13 VAL 515 24.220 5.807 -13.811 7 HG21 VAL 515 HG23 VAL 515 24.175 8.079 -14.708 8 HG22 VAL 515 HG21 VAL 515 25.929 8.329 -14.611 9 HG23 VAL 515 HG22 VAL 515 25.074 8.506 -16.167 10 H SER 516 H SER 516 27.850 4.944 -14.461 11 HA SER 516 HA SER 516 28.788 6.850 -12.905 12 HB2 SER 516 HB2 SER 516 30.243 4.228 -13.308 13 HB3 SER 516 HB3 SER 516 30.099 5.178 -11.806 14 HG SER 516 HG SER 516 28.586 3.413 -11.926 15 H LEU 517 H LEU 517 30.704 5.876 -15.725 16 HA LEU 517 HA LEU 517 32.698 7.982 -15.017 17 HB2 LEU 517 HB2 LEU 517 34.514 6.708 -15.772 18 HB3 LEU 517 HB3 LEU 517 33.680 5.755 -14.572 19 HG LEU 517 HG LEU 517 33.072 5.268 -17.512 20 HD11 LEU 517 1HD1 LEU 517 35.515 5.330 -17.403 21 HD12 LEU 517 2HD1 LEU 517 35.504 4.198 -16.031 22 HD13 LEU 517 3HD1 LEU 517 34.938 3.675 -17.637 23 HD21 LEU 517 3HD2 LEU 517 32.809 2.945 -16.761 24 HD22 LEU 517 1HD2 LEU 517 33.304 3.395 -15.115 25 HD23 LEU 517 2HD2 LEU 517 31.780 4.004 -15.793 26 H ILE 518 H ILE 518 30.273 7.785 -16.845 27 HA ILE 518 HA ILE 518 31.542 8.763 -19.384 28 HB ILE 518 HB ILE 518 28.936 7.209 -19.115 29 HG12 ILE 518 HG12 ILE 518 30.521 5.637 -20.707 30 HG13 ILE 518 HG13 ILE 518 31.757 6.308 -19.663 31 HG21 ILE 518 HG21 ILE 518 28.888 8.754 -21.012 32 HG22 ILE 518 HG22 ILE 518 30.460 8.148 -21.581 33 HG23 ILE 518 HG23 ILE 518 29.022 7.102 -21.586 34 HD11 ILE 518 3HD1 ILE 518 30.954 4.171 -18.799 35 HD12 ILE 518 1HD1 ILE 518 30.421 5.434 -17.677 36 HD13 ILE 518 2HD1 ILE 518 29.275 4.735 -18.841 37 H ASN 519 H ASN 519 29.167 9.315 -16.865 38 HA ASN 519 HA ASN 519 28.434 11.939 -18.082 39 HB2 ASN 519 HB2 ASN 519 26.742 9.931 -18.070 40 HB3 ASN 519 HB3 ASN 519 26.560 10.301 -16.360 41 HD21 ASN 519 2HD2 ASN 519 24.638 10.521 -18.652 42 HD22 ASN 519 1HD2 ASN 519 24.137 12.202 -18.650 43 H GLU 520 H GLU 520 30.630 11.927 -16.617 44 HA GLU 520 HA GLU 520 30.424 12.237 -13.783 45 HB2 GLU 520 HB2 GLU 520 32.420 13.446 -15.743 46 HB3 GLU 520 HB3 GLU 520 32.609 13.376 -13.988 47 HG2 GLU 520 HG2 GLU 520 32.521 10.875 -14.101 48 HG3 GLU 520 HG3 GLU 520 32.455 10.973 -15.863 49 H GLY 521 H GLY 521 30.281 14.048 -12.447 50 HA2 GLY 521 HA2 GLY 521 29.788 16.218 -11.779 51 HA3 GLY 521 HA3 GLY 521 29.876 16.760 -13.450 52 HA PRO 522 HA PRO 522 25.366 16.699 -12.071 53 HB2 PRO 522 HB2 PRO 522 24.808 19.364 -12.256 54 HB3 PRO 522 HB3 PRO 522 25.572 18.636 -10.810 55 HG2 PRO 522 HG2 PRO 522 26.937 20.058 -13.117 56 HG3 PRO 522 HG3 PRO 522 27.173 20.323 -11.360 57 HD2 PRO 522 HD2 PRO 522 28.834 18.733 -12.840 58 HD3 PRO 522 HD3 PRO 522 28.438 18.349 -11.138 59 H LEU 523 H LEU 523 23.536 16.932 -13.467 60 HA LEU 523 HA LEU 523 24.203 16.841 -16.296 61 HB2 LEU 523 HB2 LEU 523 22.157 15.882 -16.651 62 HB3 LEU 523 HB3 LEU 523 22.599 15.298 -15.085 63 HG LEU 523 HG LEU 523 20.960 17.735 -14.807 64 HD11 LEU 523 1HD1 LEU 523 20.097 17.040 -17.030 65 HD12 LEU 523 2HD1 LEU 523 19.719 15.436 -16.371 66 HD13 LEU 523 3HD1 LEU 523 18.884 16.881 -15.753 67 HD21 LEU 523 3HD2 LEU 523 19.544 16.269 -13.467 68 HD22 LEU 523 1HD2 LEU 523 20.419 14.839 -14.055 69 HD23 LEU 523 2HD2 LEU 523 21.247 16.041 -13.038 70 HA PRO 524 HA PRO 524 23.181 20.987 -17.457 71 HB2 PRO 524 HB2 PRO 524 22.138 20.718 -20.009 72 HB3 PRO 524 HB3 PRO 524 23.867 20.532 -19.587 73 HG2 PRO 524 HG2 PRO 524 21.780 18.361 -19.893 74 HG3 PRO 524 HG3 PRO 524 23.428 18.414 -20.594 75 HD2 PRO 524 HD2 PRO 524 22.867 17.033 -18.335 76 HD3 PRO 524 HD3 PRO 524 24.408 17.920 -18.497 77 HA PRO 525 HA PRO 525 19.166 21.920 -16.183 78 HB2 PRO 525 HB2 PRO 525 18.642 24.420 -17.181 79 HB3 PRO 525 HB3 PRO 525 19.912 24.081 -15.969 80 HG2 PRO 525 HG2 PRO 525 20.243 24.344 -18.977 81 HG3 PRO 525 HG3 PRO 525 21.199 25.137 -17.684 82 HD2 PRO 525 HD2 PRO 525 22.059 22.870 -18.903 83 HD3 PRO 525 HD3 PRO 525 22.316 23.126 -17.151 84 H GLY 526 H GLY 526 17.445 20.724 -16.801 85 HA2 GLY 526 HA2 GLY 526 15.504 20.133 -17.880 86 HA3 GLY 526 HA3 GLY 526 15.579 21.668 -18.750 87 H TRP 527 H TRP 527 18.189 19.356 -19.061 88 HA TRP 527 HA TRP 527 17.354 18.607 -21.849 89 HB2 TRP 527 HB2 TRP 527 19.994 19.410 -20.630 90 HB3 TRP 527 HB3 TRP 527 19.976 18.313 -21.996 91 HD1 TRP 527 HD1 TRP 527 19.597 21.944 -21.120 92 HE1 TRP 527 HE1 TRP 527 19.501 23.360 -23.255 93 HE3 TRP 527 HE3 TRP 527 19.225 18.182 -24.560 94 HZ2 TRP 527 HZ2 TRP 527 19.285 22.916 -26.102 95 HZ3 TRP 527 HZ3 TRP 527 19.067 18.705 -26.990 96 HH2 TRP 527 HH2 TRP 527 19.106 21.062 -27.769 97 H GLU 528 H GLU 528 18.076 16.576 -22.600 98 HA GLU 528 HA GLU 528 18.961 14.542 -20.609 99 HB2 GLU 528 HB2 GLU 528 16.607 14.196 -20.869 100 HB3 GLU 528 HB3 GLU 528 16.682 14.379 -22.607 101 HG2 GLU 528 HG2 GLU 528 16.343 12.081 -22.132 102 HG3 GLU 528 HG3 GLU 528 17.980 12.228 -22.748 103 H ILE 529 H ILE 529 20.244 12.871 -21.519 104 HA ILE 529 HA ILE 529 21.555 13.463 -24.119 105 HB ILE 529 HB ILE 529 23.312 13.107 -21.676 106 HG12 ILE 529 HG12 ILE 529 23.707 15.702 -21.928 107 HG13 ILE 529 HG13 ILE 529 22.058 15.727 -22.521 108 HG21 ILE 529 HG21 ILE 529 24.220 12.774 -23.942 109 HG22 ILE 529 HG22 ILE 529 23.715 14.415 -24.398 110 HG23 ILE 529 HG23 ILE 529 24.958 14.172 -23.153 111 HD11 ILE 529 3HD1 ILE 529 21.824 16.105 -20.206 112 HD12 ILE 529 1HD1 ILE 529 21.544 14.368 -20.268 113 HD13 ILE 529 2HD1 ILE 529 23.132 14.973 -19.786 114 H ARG 530 H ARG 530 21.891 11.607 -25.156 115 HA ARG 530 HA ARG 530 21.978 9.031 -23.611 116 HB2 ARG 530 HB2 ARG 530 20.266 9.609 -26.064 117 HB3 ARG 530 HB3 ARG 530 20.444 8.046 -25.284 118 HG2 ARG 530 HG2 ARG 530 19.611 9.909 -23.233 119 HG3 ARG 530 HG3 ARG 530 18.627 10.210 -24.658 120 HD2 ARG 530 HD2 ARG 530 17.474 8.612 -23.323 121 HD3 ARG 530 HD3 ARG 530 18.104 7.742 -24.733 122 HE ARG 530 HE ARG 530 19.876 7.698 -22.392 123 HH11 ARG 530 HH11 ARG 530 17.139 6.015 -23.792 124 HH12 ARG 530 HH12 ARG 530 17.469 4.556 -22.899 125 HH21 ARG 530 HH21 ARG 530 20.247 5.798 -21.302 126 HH22 ARG 530 HH22 ARG 530 19.179 4.446 -21.531 127 H TYR 531 H TYR 531 22.697 7.211 -24.807 128 HA TYR 531 HA TYR 531 24.940 7.858 -26.681 129 HB2 TYR 531 HB2 TYR 531 24.975 6.060 -24.225 130 HB3 TYR 531 HB3 TYR 531 26.292 6.273 -25.365 131 HD1 TYR 531 HD1 TYR 531 24.292 7.929 -22.698 132 HD2 TYR 531 HD2 TYR 531 27.767 8.188 -25.246 133 HE1 TYR 531 HE1 TYR 531 25.120 9.855 -21.364 134 HE2 TYR 531 HE2 TYR 531 28.627 10.075 -23.862 135 HH TYR 531 HH TYR 531 26.801 11.368 -21.063 136 H THR 532 H THR 532 24.153 7.012 -28.523 137 HA THR 532 HA THR 532 22.458 4.662 -28.667 138 HB THR 532 HB THR 532 22.753 4.828 -31.091 139 HG1 THR 532 HG1 THR 532 24.511 6.965 -30.513 140 HG21 THR 532 HG23 THR 532 21.820 7.085 -31.443 141 HG22 THR 532 HG21 THR 532 21.058 6.258 -30.075 142 HG23 THR 532 HG22 THR 532 22.256 7.532 -29.781 143 H ALA 533 H ALA 533 22.912 2.616 -29.636 144 HA ALA 533 HA ALA 533 25.308 1.386 -28.754 145 HB1 ALA 533 HB3 ALA 533 24.430 -0.603 -29.878 146 HB2 ALA 533 HB1 ALA 533 23.146 0.240 -28.997 147 HB3 ALA 533 HB2 ALA 533 23.252 0.385 -30.768 148 H ALA 534 H ALA 534 24.837 3.186 -31.661 149 HA ALA 534 HA ALA 534 26.977 2.095 -33.262 150 HB1 ALA 534 HB3 ALA 534 26.769 4.262 -34.446 151 HB2 ALA 534 HB1 ALA 534 25.183 3.527 -34.170 152 HB3 ALA 534 HB2 ALA 534 25.726 4.881 -33.149 153 H GLY 535 H GLY 535 27.063 3.794 -30.267 154 HA2 GLY 535 HA2 GLY 535 28.961 4.331 -29.009 155 HA3 GLY 535 HA3 GLY 535 29.985 4.256 -30.448 156 H GLU 536 H GLU 536 26.943 6.110 -30.191 157 HA GLU 536 HA GLU 536 28.479 8.666 -30.503 158 HB2 GLU 536 HB2 GLU 536 26.054 7.743 -32.081 159 HB3 GLU 536 HB3 GLU 536 26.793 9.326 -32.207 160 HG2 GLU 536 HG2 GLU 536 28.202 6.700 -32.890 161 HG3 GLU 536 HG3 GLU 536 27.319 7.696 -34.025 162 H ARG 537 H ARG 537 27.864 10.283 -29.311 163 HA ARG 537 HA ARG 537 25.534 10.072 -27.518 164 HB2 ARG 537 HB2 ARG 537 27.642 10.685 -26.558 165 HB3 ARG 537 HB3 ARG 537 27.873 12.014 -27.699 166 HG2 ARG 537 HG2 ARG 537 26.211 13.362 -26.675 167 HG3 ARG 537 HG3 ARG 537 25.485 11.986 -25.833 168 HD2 ARG 537 HD2 ARG 537 26.758 12.243 -24.065 169 HD3 ARG 537 HD3 ARG 537 28.250 12.185 -25.013 170 HE ARG 537 HE ARG 537 27.251 14.782 -25.321 171 HH11 ARG 537 HH11 ARG 537 28.225 12.824 -22.561 172 HH12 ARG 537 HH12 ARG 537 28.957 14.178 -21.750 173 HH21 ARG 537 HH21 ARG 537 28.209 16.477 -24.172 174 HH22 ARG 537 HH22 ARG 537 28.881 16.179 -22.600 175 H PHE 538 H PHE 538 23.807 11.353 -27.500 176 HA PHE 538 HA PHE 538 23.544 13.652 -29.376 177 HB2 PHE 538 HB2 PHE 538 21.553 11.364 -29.088 178 HB3 PHE 538 HB3 PHE 538 21.217 12.885 -29.892 179 HD1 PHE 538 HD1 PHE 538 23.058 9.689 -30.139 180 HD2 PHE 538 HD2 PHE 538 22.102 13.400 -32.112 181 HE1 PHE 538 HE1 PHE 538 23.809 8.731 -32.304 182 HE2 PHE 538 HE2 PHE 538 22.848 12.438 -34.279 183 HZ PHE 538 HZ PHE 538 23.703 10.103 -34.374 184 H PHE 539 H PHE 539 21.859 15.102 -28.783 185 HA PHE 539 HA PHE 539 21.153 15.090 -25.875 186 HB2 PHE 539 HB2 PHE 539 21.587 17.424 -27.763 187 HB3 PHE 539 HB3 PHE 539 21.146 17.530 -26.072 188 HD1 PHE 539 HD2 PHE 539 23.901 16.699 -28.417 189 HD2 PHE 539 HD1 PHE 539 22.771 17.363 -24.309 190 HE1 PHE 539 HE2 PHE 539 26.292 16.933 -27.799 191 HE2 PHE 539 HE1 PHE 539 25.163 17.616 -23.693 192 HZ PHE 539 HZ PHE 539 26.922 17.450 -25.451 193 H VAL 540 H VAL 540 19.163 15.819 -25.285 194 HA VAL 540 HA VAL 540 16.936 15.858 -27.287 195 HB VAL 540 HB VAL 540 17.188 14.273 -24.701 196 HG11 VAL 540 HG11 VAL 540 14.844 15.052 -25.159 197 HG12 VAL 540 HG12 VAL 540 14.914 14.198 -26.719 198 HG13 VAL 540 HG13 VAL 540 15.052 13.314 -25.171 199 HG21 VAL 540 HG23 VAL 540 17.046 12.234 -26.026 200 HG22 VAL 540 HG21 VAL 540 17.087 13.176 -27.527 201 HG23 VAL 540 HG22 VAL 540 18.488 13.155 -26.437 202 H ASP 541 H ASP 541 15.508 17.458 -26.901 203 HA ASP 541 HA ASP 541 15.498 18.827 -24.225 204 HB2 ASP 541 HB2 ASP 541 16.369 20.327 -25.855 205 HB3 ASP 541 HB3 ASP 541 15.129 19.885 -27.025 206 H HIS 542 H HIS 542 13.778 18.240 -23.087 207 HA HIS 542 HA HIS 542 11.348 17.171 -24.274 208 HB2 HIS 542 HB2 HIS 542 11.862 18.092 -21.424 209 HB3 HIS 542 HB3 HIS 542 10.572 17.024 -21.973 210 HD2 HIS 542 HD2 HIS 542 12.501 15.080 -23.819 211 HE1 HIS 542 HE1 HIS 542 14.326 14.150 -20.078 212 H ASN 543 H ASN 543 12.355 20.418 -23.538 213 HA ASN 543 HA ASN 543 9.782 21.566 -22.977 214 HB2 ASN 543 HB2 ASN 543 12.291 22.905 -24.080 215 HB3 ASN 543 HB3 ASN 543 10.927 23.709 -23.317 216 HD21 ASN 543 2HD2 ASN 543 13.923 22.087 -22.768 217 HD22 ASN 543 1HD2 ASN 543 13.828 22.073 -21.007 218 H THR 544 H THR 544 11.489 20.981 -26.017 219 HA THR 544 HA THR 544 9.043 21.785 -27.564 220 HB THR 544 HB THR 544 10.499 22.630 -29.320 221 HG1 THR 544 HG1 THR 544 12.601 22.014 -27.494 222 HG21 THR 544 HG23 THR 544 11.347 24.634 -28.296 223 HG22 THR 544 HG21 THR 544 9.807 24.215 -27.527 224 HG23 THR 544 HG22 THR 544 11.341 23.895 -26.683 225 H ARG 545 H ARG 545 10.632 19.136 -26.696 226 HA ARG 545 HA ARG 545 10.784 16.998 -27.349 227 HB2 ARG 545 HB2 ARG 545 8.393 17.691 -28.330 228 HB3 ARG 545 HB3 ARG 545 9.206 17.430 -29.870 229 HG2 ARG 545 HG2 ARG 545 9.902 15.106 -28.630 230 HG3 ARG 545 HG3 ARG 545 8.450 15.478 -27.705 231 HD2 ARG 545 HD2 ARG 545 8.707 15.148 -30.716 232 HD3 ARG 545 HD3 ARG 545 7.921 14.024 -29.595 233 HE ARG 545 HE ARG 545 6.521 16.368 -29.217 234 HH11 ARG 545 HH11 ARG 545 7.184 14.462 -32.127 235 HH12 ARG 545 HH12 ARG 545 5.797 15.131 -32.945 236 HH21 ARG 545 HH21 ARG 545 4.785 17.150 -30.361 237 HH22 ARG 545 HH22 ARG 545 4.472 16.571 -31.969 238 H ARG 546 H ARG 546 12.406 19.298 -28.919 239 HA ARG 546 HA ARG 546 13.297 17.901 -31.312 240 HB2 ARG 546 HB2 ARG 546 14.623 19.806 -31.755 241 HB3 ARG 546 HB3 ARG 546 13.113 20.400 -31.070 242 HG2 ARG 546 HG2 ARG 546 14.237 20.628 -28.851 243 HG3 ARG 546 HG3 ARG 546 15.768 20.112 -29.563 244 HD2 ARG 546 HD2 ARG 546 14.173 22.569 -30.374 245 HD3 ARG 546 HD3 ARG 546 15.590 22.562 -29.331 246 HE ARG 546 HE ARG 546 16.975 21.839 -31.182 247 HH11 ARG 546 HH11 ARG 546 13.834 23.109 -32.189 248 HH12 ARG 546 HH12 ARG 546 14.341 23.226 -33.842 249 HH21 ARG 546 HH21 ARG 546 17.536 22.079 -33.305 250 HH22 ARG 546 HH22 ARG 546 16.382 22.688 -34.452 251 H THR 547 H THR 547 15.679 17.805 -31.795 252 HA THR 547 HA THR 547 17.392 16.814 -29.593 253 HB THR 547 HB THR 547 18.028 14.819 -30.944 254 HG1 THR 547 HG1 THR 547 15.640 15.292 -32.391 255 HG21 THR 547 HG23 THR 547 16.136 13.411 -30.410 256 HG22 THR 547 HG21 THR 547 16.384 14.586 -29.107 257 HG23 THR 547 HG22 THR 547 15.057 14.810 -30.259 258 H THR 548 H THR 548 19.647 16.478 -30.278 259 HA THR 548 HA THR 548 20.567 17.405 -32.868 260 HB THR 548 HB THR 548 20.226 19.604 -31.984 261 HG1 THR 548 HG1 THR 548 22.029 19.990 -32.891 262 HG21 THR 548 HG23 THR 548 21.385 20.429 -29.954 263 HG22 THR 548 HG21 THR 548 20.127 19.242 -29.585 264 HG23 THR 548 HG22 THR 548 21.834 18.758 -29.559 265 H PHE 549 H PHE 549 22.889 17.184 -33.128 266 HA PHE 549 HA PHE 549 24.040 14.959 -31.559 267 HB2 PHE 549 HB2 PHE 549 24.074 14.945 -34.016 268 HB3 PHE 549 HB3 PHE 549 24.947 16.470 -34.038 269 HD1 PHE 549 HD2 PHE 549 25.253 12.959 -32.674 270 HD2 PHE 549 HD1 PHE 549 27.298 16.428 -34.220 271 HE1 PHE 549 HE2 PHE 549 27.389 11.706 -32.656 272 HE2 PHE 549 HE1 PHE 549 29.439 15.171 -34.190 273 HZ PHE 549 HZ PHE 549 29.488 12.805 -33.414 274 H GLU 550 H GLU 550 24.185 18.405 -31.452 275 HA GLU 550 HA GLU 550 26.702 18.369 -29.846 276 HB2 GLU 550 HB2 GLU 550 27.621 20.211 -31.065 277 HB3 GLU 550 HB3 GLU 550 27.278 18.893 -32.173 278 HG2 GLU 550 HG2 GLU 550 25.172 20.073 -32.884 279 HG3 GLU 550 HG3 GLU 550 25.605 21.417 -31.826 280 H ASP 551 H ASP 551 26.910 21.117 -29.381 281 HA ASP 551 HA ASP 551 24.419 21.716 -27.826 282 HB2 ASP 551 HB2 ASP 551 26.198 20.900 -26.386 283 HB3 ASP 551 HB3 ASP 551 27.298 22.136 -26.998 284 HA PRO 552 HA PRO 552 25.270 25.218 -30.765 285 HB2 PRO 552 HB2 PRO 552 22.824 25.437 -31.928 286 HB3 PRO 552 HB3 PRO 552 23.968 24.138 -32.372 287 HG2 PRO 552 HG2 PRO 552 21.657 23.982 -30.407 288 HG3 PRO 552 HG3 PRO 552 22.023 22.877 -31.773 289 HD2 PRO 552 HD2 PRO 552 22.809 22.353 -29.204 290 HD3 PRO 552 HD3 PRO 552 23.789 21.878 -30.619 291 H ARG 553 H ARG 553 23.885 27.305 -31.033 292 HA ARG 553 HA ARG 553 23.574 28.709 -28.601 293 HB2 ARG 553 HB2 ARG 553 22.557 29.161 -31.432 294 HB3 ARG 553 HB3 ARG 553 22.186 30.306 -30.143 295 HG2 ARG 553 HG2 ARG 553 24.485 30.796 -29.726 296 HG3 ARG 553 HG3 ARG 553 25.057 29.490 -30.768 297 HD2 ARG 553 HD2 ARG 553 23.384 31.811 -31.806 298 HD3 ARG 553 HD3 ARG 553 25.154 31.864 -31.717 299 HE ARG 553 HE ARG 553 24.630 29.504 -33.072 300 HH11 ARG 553 HH11 ARG 553 23.893 32.866 -33.729 301 HH12 ARG 553 HH12 ARG 553 23.964 32.634 -35.455 302 HH21 ARG 553 HH21 ARG 553 24.710 29.281 -35.274 303 HH22 ARG 553 HH22 ARG 553 24.419 30.656 -36.299 304 HA PRO 554 HA PRO 554 19.720 27.412 -26.970 305 HB2 PRO 554 HB2 PRO 554 18.933 29.536 -25.429 306 HB3 PRO 554 HB3 PRO 554 20.365 28.530 -25.059 307 HG2 PRO 554 HG2 PRO 554 20.294 31.183 -26.536 308 HG3 PRO 554 HG3 PRO 554 21.342 30.714 -25.157 309 HD2 PRO 554 HD2 PRO 554 22.222 30.557 -27.718 310 HD3 PRO 554 HD3 PRO 554 22.660 29.303 -26.520 311 H GLY 555 H GLY 555 19.697 30.111 -29.141 312 HA2 GLY 555 HA2 GLY 555 16.835 30.574 -29.276 313 HA3 GLY 555 HA3 GLY 555 18.068 31.168 -30.390 314 H ALA 556 H ALA 556 16.825 27.940 -29.449 315 HA ALA 556 HA ALA 556 16.420 27.211 -32.321 316 HB1 ALA 556 HB3 ALA 556 17.539 25.074 -31.860 317 HB2 ALA 556 HB1 ALA 556 18.627 26.440 -31.554 318 HB3 ALA 556 HB2 ALA 556 17.869 25.588 -30.191 319 HA PRO 557 HA PRO 557 12.629 25.815 -29.925 320 HB2 PRO 557 HB2 PRO 557 10.742 27.194 -31.335 321 HB3 PRO 557 HB3 PRO 557 11.581 27.867 -29.905 322 HG2 PRO 557 HG2 PRO 557 12.217 28.345 -32.829 323 HG3 PRO 557 HG3 PRO 557 12.098 29.546 -31.507 324 HD2 PRO 557 HD2 PRO 557 14.487 28.507 -32.367 325 HD3 PRO 557 HD3 PRO 557 14.202 28.971 -30.663 326 H ASN2319 H ASN2319 32.687 16.716 -38.163 327 HA ASN2319 HA ASN2319 32.003 16.193 -40.981 328 HB2 ASN2319 HB2 ASN2319 34.428 15.897 -40.527 329 HB3 ASN2319 HB3 ASN2319 34.057 14.777 -39.219 330 HD21 ASN2319 2HD2 ASN2319 33.548 12.573 -39.777 331 HD22 ASN2319 1HD2 ASN2319 33.539 12.035 -41.447 332 H THR2320 H THR2320 29.948 15.450 -40.921 333 HA THR2320 HA THR2320 29.245 13.137 -39.194 334 HB THR2320 HB THR2320 27.044 14.260 -38.643 335 HG1 THR2320 HG1 THR2320 26.991 15.977 -40.021 336 HG21 THR2320 HG23 THR2320 27.822 15.506 -36.757 337 HG22 THR2320 HG21 THR2320 28.883 14.103 -36.967 338 HG23 THR2320 HG22 THR2320 29.432 15.721 -37.465 339 H GLY2321 H GLY2321 26.973 12.347 -39.771 340 HA2 GLY2321 HA2 GLY2321 25.834 12.869 -42.359 341 HA3 GLY2321 HA3 GLY2321 26.829 11.408 -42.390 342 H ALA2322 H ALA2322 24.514 10.626 -42.951 343 HA ALA2322 HA ALA2322 22.470 10.357 -41.024 344 HB1 ALA2322 HB3 ALA2322 21.693 8.495 -42.441 345 HB2 ALA2322 HB1 ALA2322 22.181 9.893 -43.416 346 HB3 ALA2322 HB2 ALA2322 23.253 8.477 -43.292 347 H LYS2323 H LYS2323 22.172 9.164 -39.282 348 HA LYS2323 HA LYS2323 23.783 6.815 -38.525 349 HB2 LYS2323 HB2 LYS2323 24.955 9.150 -38.019 350 HB3 LYS2323 HB3 LYS2323 23.815 9.246 -36.696 351 HG2 LYS2323 HG2 LYS2323 25.149 7.916 -35.439 352 HG3 LYS2323 HG3 LYS2323 25.039 6.618 -36.624 353 HD2 LYS2323 HD2 LYS2323 27.363 7.147 -36.267 354 HD3 LYS2323 HD3 LYS2323 26.919 7.613 -37.910 355 HE2 LYS2323 HE2 LYS2323 26.768 9.971 -37.268 356 HE3 LYS2323 HE3 LYS2323 26.996 9.566 -35.563 357 HZ1 LYS2323 HZ3 LYS2323 29.056 10.349 -36.654 358 HZ2 LYS2323 HZ1 LYS2323 29.229 8.860 -36.022 359 HZ3 LYS2323 HZ2 LYS2323 29.050 9.048 -37.648 360 H GLN2324 H GLN2324 23.065 6.370 -35.985 361 HA GLN2324 HA GLN2324 20.321 5.708 -36.010 362 HB2 GLN2324 HB2 GLN2324 22.239 6.051 -33.679 363 HB3 GLN2324 HB3 GLN2324 20.556 5.543 -33.499 364 HG2 GLN2324 HG2 GLN2324 21.066 3.668 -35.185 365 HG3 GLN2324 HG3 GLN2324 22.767 4.093 -34.992 366 HE21 GLN2324 HE22 GLN2324 23.297 2.014 -34.040 367 HE22 GLN2324 HE21 GLN2324 22.661 1.555 -32.469 368 HA PRO2325 HA PRO2325 18.813 9.895 -35.332 369 HB2 PRO2325 HB2 PRO2325 16.120 9.496 -35.587 370 HB3 PRO2325 HB3 PRO2325 17.259 9.500 -36.966 371 HG2 PRO2325 HG2 PRO2325 16.126 7.106 -35.496 372 HG3 PRO2325 HG3 PRO2325 16.277 7.360 -37.262 373 HD2 PRO2325 HD2 PRO2325 18.095 5.916 -35.796 374 HD3 PRO2325 HD3 PRO2325 18.563 6.869 -37.236 375 HA PRO2326 HA PRO2326 17.835 9.304 -30.886 376 HB2 PRO2326 HB2 PRO2326 17.958 11.904 -30.070 377 HB3 PRO2326 HB3 PRO2326 19.415 10.930 -30.427 378 HG2 PRO2326 HG2 PRO2326 17.992 12.864 -32.284 379 HG3 PRO2326 HG3 PRO2326 19.733 12.814 -31.890 380 HD2 PRO2326 HD2 PRO2326 18.704 11.654 -34.121 381 HD3 PRO2326 HD3 PRO2326 20.042 10.871 -33.221 382 H SER2327 H SER2327 15.839 9.158 -30.022 383 HA SER2327 HA SER2327 13.633 11.015 -30.596 384 HB2 SER2327 HB2 SER2327 13.623 8.163 -31.668 385 HB3 SER2327 HB3 SER2327 12.152 9.122 -31.415 386 HG SER2327 HG SER2327 14.211 10.326 -32.856 387 H TYR2328 H TYR2328 13.844 11.270 -28.311 388 HA TYR2328 HA TYR2328 13.268 8.997 -26.533 389 HB2 TYR2328 HB2 TYR2328 14.849 10.841 -25.982 390 HB3 TYR2328 HB3 TYR2328 13.501 11.963 -25.954 391 HD1 TYR2328 HD1 TYR2328 14.908 8.889 -24.354 392 HD2 TYR2328 HD2 TYR2328 12.199 12.221 -23.938 393 HE1 TYR2328 HE1 TYR2328 14.595 8.345 -21.937 394 HE2 TYR2328 HE2 TYR2328 11.878 11.669 -21.539 395 HH TYR2328 HH TYR2328 12.438 10.271 -19.816 396 H GLU2329 H GLU2329 11.582 12.129 -26.177 397 HA GLU2329 HA GLU2329 9.037 10.926 -25.684 398 HB2 GLU2329 HB2 GLU2329 9.783 13.768 -26.433 399 HB3 GLU2329 HB3 GLU2329 8.131 13.237 -26.119 400 HG2 GLU2329 HG2 GLU2329 9.341 12.248 -23.880 401 HG3 GLU2329 HG3 GLU2329 10.396 13.621 -24.217 402 H ASP2330 H ASP2330 10.502 11.987 -28.719 403 HA ASP2330 HA ASP2330 8.110 11.867 -30.288 404 HB2 ASP2330 HB2 ASP2330 10.384 13.018 -30.764 405 HB3 ASP2330 HB3 ASP2330 10.916 11.444 -31.354 406 H CYS2331 H CYS2331 9.878 9.273 -28.925 407 HA CYS2331 HA CYS2331 8.681 7.314 -30.858 408 HB2 CYS2331 HB2 CYS2331 11.181 7.314 -30.539 409 HB3 CYS2331 HB3 CYS2331 10.916 6.858 -28.848 410 HG CYS2331 HG CYS2331 9.406 4.713 -29.485 411 H ILE2332 H ILE2332 8.796 8.263 -27.413 412 HA ILE2332 HA ILE2332 7.121 5.958 -26.659 413 HB ILE2332 HB ILE2332 7.392 6.612 -24.391 414 HG12 ILE2332 HG12 ILE2332 9.294 8.852 -25.006 415 HG13 ILE2332 HG13 ILE2332 7.565 9.213 -25.037 416 HG21 ILE2332 HG21 ILE2332 9.131 5.253 -25.481 417 HG22 ILE2332 HG22 ILE2332 10.062 6.720 -25.849 418 HG23 ILE2332 HG23 ILE2332 9.790 6.238 -24.166 419 HD11 ILE2332 3HD1 ILE2332 8.555 9.688 -22.852 420 HD12 ILE2332 1HD1 ILE2332 7.324 8.412 -22.737 421 HD13 ILE2332 2HD1 ILE2332 9.055 7.991 -22.682 422 H LYS2333 H LYS2333 6.039 8.267 -28.352 423 HA LYS2333 HA LYS2333 3.542 8.734 -26.781 424 HB2 LYS2333 HB2 LYS2333 3.301 10.900 -27.625 425 HB3 LYS2333 HB3 LYS2333 4.955 10.794 -27.011 426 HG2 LYS2333 HG2 LYS2333 5.711 10.391 -29.411 427 HG3 LYS2333 HG3 LYS2333 4.062 10.715 -29.933 428 HD2 LYS2333 HD2 LYS2333 5.859 12.708 -28.471 429 HD3 LYS2333 HD3 LYS2333 5.570 12.635 -30.203 430 HE2 LYS2333 HE2 LYS2333 4.092 14.283 -29.647 431 HE3 LYS2333 HE3 LYS2333 3.037 12.876 -29.600 432 HZ1 LYS2333 HZ3 LYS2333 2.745 14.310 -27.654 433 HZ2 LYS2333 HZ1 LYS2333 3.318 12.871 -27.153 434 HZ3 LYS2333 HZ2 LYS2333 4.313 14.166 -27.230 Start of MODEL 3 1 H VAL 515 H VAL 515 29.165 6.378 -19.423 2 HA VAL 515 HA VAL 515 28.020 8.377 -18.707 3 HB VAL 515 HB VAL 515 26.728 6.615 -16.605 4 HG11 VAL 515 HG11 VAL 515 27.241 8.920 -15.746 5 HG12 VAL 515 HG12 VAL 515 26.372 9.601 -17.142 6 HG13 VAL 515 HG13 VAL 515 25.514 8.637 -15.936 7 HG21 VAL 515 HG23 VAL 515 24.603 7.346 -17.710 8 HG22 VAL 515 HG21 VAL 515 25.539 8.125 -18.991 9 HG23 VAL 515 HG22 VAL 515 25.577 6.358 -18.784 10 H SER 516 H SER 516 29.110 6.031 -16.114 11 HA SER 516 HA SER 516 29.840 7.826 -14.354 12 HB2 SER 516 HB2 SER 516 31.387 5.207 -14.788 13 HB3 SER 516 HB3 SER 516 31.031 6.062 -13.238 14 HG SER 516 HG SER 516 29.644 4.359 -13.514 15 H LEU 517 H LEU 517 32.002 7.202 -17.001 16 HA LEU 517 HA LEU 517 33.838 9.266 -15.888 17 HB2 LEU 517 HB2 LEU 517 35.778 8.123 -16.560 18 HB3 LEU 517 HB3 LEU 517 34.868 7.064 -15.505 19 HG LEU 517 HG LEU 517 34.584 6.741 -18.512 20 HD11 LEU 517 1HD1 LEU 517 37.003 6.841 -18.136 21 HD12 LEU 517 2HD1 LEU 517 36.871 5.632 -16.839 22 HD13 LEU 517 3HD1 LEU 517 36.497 5.194 -18.520 23 HD21 LEU 517 3HD2 LEU 517 34.305 4.369 -17.928 24 HD22 LEU 517 1HD2 LEU 517 34.607 4.731 -16.218 25 HD23 LEU 517 2HD2 LEU 517 33.149 5.342 -17.023 26 H ILE 518 H ILE 518 31.640 9.150 -18.015 27 HA ILE 518 HA ILE 518 33.135 10.548 -20.195 28 HB ILE 518 HB ILE 518 30.721 8.789 -20.738 29 HG12 ILE 518 HG12 ILE 518 32.671 7.307 -21.885 30 HG13 ILE 518 HG13 ILE 518 33.622 7.946 -20.563 31 HG21 ILE 518 HG21 ILE 518 31.254 10.461 -22.491 32 HG22 ILE 518 HG22 ILE 518 32.923 9.867 -22.557 33 HG23 ILE 518 HG23 ILE 518 31.567 8.840 -23.064 34 HD11 ILE 518 3HD1 ILE 518 32.681 5.761 -20.011 35 HD12 ILE 518 1HD1 ILE 518 31.881 6.953 -18.976 36 HD13 ILE 518 2HD1 ILE 518 31.047 6.311 -20.407 37 H ASN 519 H ASN 519 30.843 10.804 -17.779 38 HA ASN 519 HA ASN 519 29.638 13.268 -18.919 39 HB2 ASN 519 HB2 ASN 519 28.268 11.014 -19.140 40 HB3 ASN 519 HB3 ASN 519 27.967 11.225 -17.426 41 HD21 ASN 519 2HD2 ASN 519 26.867 11.924 -20.515 42 HD22 ASN 519 1HD2 ASN 519 25.758 13.234 -20.088 43 H GLU 520 H GLU 520 31.773 13.345 -17.222 44 HA GLU 520 HA GLU 520 31.193 13.351 -14.413 45 HB2 GLU 520 HB2 GLU 520 33.321 14.883 -15.963 46 HB3 GLU 520 HB3 GLU 520 33.273 14.659 -14.210 47 HG2 GLU 520 HG2 GLU 520 33.372 12.167 -14.570 48 HG3 GLU 520 HG3 GLU 520 33.605 12.457 -16.295 49 H GLY 521 H GLY 521 30.822 15.037 -12.946 50 HA2 GLY 521 HA2 GLY 521 30.164 17.151 -12.191 51 HA3 GLY 521 HA3 GLY 521 30.149 17.760 -13.840 52 HA PRO 522 HA PRO 522 25.721 17.051 -12.362 53 HB2 PRO 522 HB2 PRO 522 24.814 19.629 -12.424 54 HB3 PRO 522 HB3 PRO 522 25.689 18.940 -11.023 55 HG2 PRO 522 HG2 PRO 522 26.821 20.629 -13.275 56 HG3 PRO 522 HG3 PRO 522 27.053 20.840 -11.510 57 HD2 PRO 522 HD2 PRO 522 28.879 19.551 -13.080 58 HD3 PRO 522 HD3 PRO 522 28.558 19.030 -11.399 59 H LEU 523 H LEU 523 23.826 17.126 -13.682 60 HA LEU 523 HA LEU 523 24.382 17.053 -16.506 61 HB2 LEU 523 HB2 LEU 523 22.345 16.019 -16.749 62 HB3 LEU 523 HB3 LEU 523 22.844 15.536 -15.166 63 HG LEU 523 HG LEU 523 21.211 17.925 -14.853 64 HD11 LEU 523 1HD1 LEU 523 20.349 17.348 -17.133 65 HD12 LEU 523 2HD1 LEU 523 19.897 15.744 -16.530 66 HD13 LEU 523 3HD1 LEU 523 19.119 17.200 -15.870 67 HD21 LEU 523 3HD2 LEU 523 19.736 16.422 -13.610 68 HD22 LEU 523 1HD2 LEU 523 20.593 15.007 -14.262 69 HD23 LEU 523 2HD2 LEU 523 21.429 16.139 -13.174 70 HA PRO 524 HA PRO 524 23.355 21.126 -17.786 71 HB2 PRO 524 HB2 PRO 524 22.190 20.799 -20.280 72 HB3 PRO 524 HB3 PRO 524 23.929 20.591 -19.926 73 HG2 PRO 524 HG2 PRO 524 21.793 18.447 -20.073 74 HG3 PRO 524 HG3 PRO 524 23.413 18.447 -20.835 75 HD2 PRO 524 HD2 PRO 524 22.922 17.156 -18.507 76 HD3 PRO 524 HD3 PRO 524 24.467 18.017 -18.758 77 HA PRO 525 HA PRO 525 19.454 22.205 -16.321 78 HB2 PRO 525 HB2 PRO 525 18.972 24.719 -17.315 79 HB3 PRO 525 HB3 PRO 525 20.287 24.342 -16.163 80 HG2 PRO 525 HG2 PRO 525 20.478 24.571 -19.185 81 HG3 PRO 525 HG3 PRO 525 21.525 25.336 -17.949 82 HD2 PRO 525 HD2 PRO 525 22.239 23.026 -19.188 83 HD3 PRO 525 HD3 PRO 525 22.593 23.286 -17.454 84 H GLY 526 H GLY 526 17.674 21.053 -16.845 85 HA2 GLY 526 HA2 GLY 526 15.680 20.486 -17.844 86 HA3 GLY 526 HA3 GLY 526 15.746 22.010 -18.731 87 H TRP 527 H TRP 527 18.259 19.579 -19.056 88 HA TRP 527 HA TRP 527 17.371 18.832 -21.826 89 HB2 TRP 527 HB2 TRP 527 20.033 19.675 -20.686 90 HB3 TRP 527 HB3 TRP 527 20.004 18.534 -22.014 91 HD1 TRP 527 HD1 TRP 527 19.648 22.187 -21.269 92 HE1 TRP 527 HE1 TRP 527 19.493 23.518 -23.453 93 HE3 TRP 527 HE3 TRP 527 19.126 18.295 -24.548 94 HZ2 TRP 527 HZ2 TRP 527 19.192 22.967 -26.274 95 HZ3 TRP 527 HZ3 TRP 527 18.899 18.728 -26.989 96 HH2 TRP 527 HH2 TRP 527 18.940 21.052 -27.859 97 H GLU 528 H GLU 528 18.182 16.784 -22.587 98 HA GLU 528 HA GLU 528 18.944 14.750 -20.554 99 HB2 GLU 528 HB2 GLU 528 16.417 14.962 -21.082 100 HB3 GLU 528 HB3 GLU 528 16.781 14.314 -22.661 101 HG2 GLU 528 HG2 GLU 528 17.381 12.960 -19.986 102 HG3 GLU 528 HG3 GLU 528 15.920 12.686 -20.923 103 H ILE 529 H ILE 529 20.142 12.938 -21.525 104 HA ILE 529 HA ILE 529 21.236 13.419 -24.230 105 HB ILE 529 HB ILE 529 23.245 13.066 -22.003 106 HG12 ILE 529 HG12 ILE 529 23.666 15.641 -22.238 107 HG13 ILE 529 HG13 ILE 529 21.971 15.734 -22.665 108 HG21 ILE 529 HG21 ILE 529 23.853 12.789 -24.394 109 HG22 ILE 529 HG22 ILE 529 23.333 14.456 -24.713 110 HG23 ILE 529 HG23 ILE 529 24.714 14.141 -23.650 111 HD11 ILE 529 3HD1 ILE 529 22.022 16.106 -20.334 112 HD12 ILE 529 1HD1 ILE 529 21.609 14.393 -20.386 113 HD13 ILE 529 2HD1 ILE 529 23.279 14.879 -20.062 114 H ARG 530 H ARG 530 21.708 11.583 -25.250 115 HA ARG 530 HA ARG 530 21.704 8.985 -23.721 116 HB2 ARG 530 HB2 ARG 530 20.348 9.738 -26.338 117 HB3 ARG 530 HB3 ARG 530 20.513 8.077 -25.798 118 HG2 ARG 530 HG2 ARG 530 19.222 9.967 -23.850 119 HG3 ARG 530 HG3 ARG 530 18.348 9.643 -25.338 120 HD2 ARG 530 HD2 ARG 530 17.502 8.065 -23.851 121 HD3 ARG 530 HD3 ARG 530 18.611 7.139 -24.841 122 HE ARG 530 HE ARG 530 19.026 8.054 -22.009 123 HH11 ARG 530 HH11 ARG 530 20.134 5.884 -24.561 124 HH12 ARG 530 HH12 ARG 530 21.053 4.919 -23.445 125 HH21 ARG 530 HH21 ARG 530 20.109 6.703 -20.653 126 HH22 ARG 530 HH22 ARG 530 21.027 5.368 -21.282 127 H TYR 531 H TYR 531 22.813 7.282 -24.606 128 HA TYR 531 HA TYR 531 24.990 7.890 -26.574 129 HB2 TYR 531 HB2 TYR 531 25.063 6.146 -24.082 130 HB3 TYR 531 HB3 TYR 531 26.328 6.236 -25.292 131 HD1 TYR 531 HD2 TYR 531 24.478 8.288 -22.745 132 HD2 TYR 531 HD1 TYR 531 28.050 7.851 -25.128 133 HE1 TYR 531 HE2 TYR 531 25.557 10.123 -21.464 134 HE2 TYR 531 HE1 TYR 531 29.148 9.644 -23.804 135 HH TYR 531 HH TYR 531 28.953 11.113 -22.052 136 H THR 532 H THR 532 24.426 6.909 -28.401 137 HA THR 532 HA THR 532 22.548 4.650 -28.497 138 HB THR 532 HB THR 532 22.852 4.751 -30.922 139 HG1 THR 532 HG1 THR 532 24.494 6.991 -30.475 140 HG21 THR 532 HG23 THR 532 21.916 7.009 -31.312 141 HG22 THR 532 HG21 THR 532 21.173 6.188 -29.955 142 HG23 THR 532 HG22 THR 532 22.348 7.478 -29.648 143 H ALA 533 H ALA 533 22.943 2.608 -29.506 144 HA ALA 533 HA ALA 533 25.313 1.276 -28.679 145 HB1 ALA 533 HB3 ALA 533 24.369 -0.643 -29.870 146 HB2 ALA 533 HB1 ALA 533 23.121 0.196 -28.935 147 HB3 ALA 533 HB2 ALA 533 23.206 0.412 -30.700 148 H ALA 534 H ALA 534 24.829 3.199 -31.517 149 HA ALA 534 HA ALA 534 26.882 2.052 -33.197 150 HB1 ALA 534 HB3 ALA 534 26.652 4.192 -34.414 151 HB2 ALA 534 HB1 ALA 534 25.066 3.493 -34.056 152 HB3 ALA 534 HB2 ALA 534 25.675 4.859 -33.089 153 H GLY 535 H GLY 535 27.117 3.774 -30.223 154 HA2 GLY 535 HA2 GLY 535 29.083 4.295 -29.065 155 HA3 GLY 535 HA3 GLY 535 30.035 4.161 -30.546 156 H GLU 536 H GLU 536 27.080 6.135 -30.143 157 HA GLU 536 HA GLU 536 28.659 8.664 -30.384 158 HB2 GLU 536 HB2 GLU 536 26.273 7.817 -32.073 159 HB3 GLU 536 HB3 GLU 536 26.993 9.417 -32.092 160 HG2 GLU 536 HG2 GLU 536 28.339 6.826 -32.976 161 HG3 GLU 536 HG3 GLU 536 27.620 8.037 -34.022 162 H ARG 537 H ARG 537 27.736 10.483 -29.529 163 HA ARG 537 HA ARG 537 25.471 10.028 -27.646 164 HB2 ARG 537 HB2 ARG 537 27.724 10.645 -26.735 165 HB3 ARG 537 HB3 ARG 537 27.611 12.202 -27.571 166 HG2 ARG 537 HG2 ARG 537 25.592 12.784 -26.242 167 HG3 ARG 537 HG3 ARG 537 25.590 11.161 -25.542 168 HD2 ARG 537 HD2 ARG 537 26.504 12.340 -23.848 169 HD3 ARG 537 HD3 ARG 537 27.961 11.750 -24.665 170 HE ARG 537 HE ARG 537 27.579 14.225 -25.803 171 HH11 ARG 537 HH11 ARG 537 27.839 13.169 -22.472 172 HH12 ARG 537 HH12 ARG 537 28.459 14.704 -21.928 173 HH21 ARG 537 HH21 ARG 537 28.486 16.136 -25.048 174 HH22 ARG 537 HH22 ARG 537 28.807 16.333 -23.350 175 H PHE 538 H PHE 538 23.749 11.345 -27.524 176 HA PHE 538 HA PHE 538 23.414 13.600 -29.462 177 HB2 PHE 538 HB2 PHE 538 21.498 11.268 -29.043 178 HB3 PHE 538 HB3 PHE 538 21.158 12.711 -29.983 179 HD1 PHE 538 HD2 PHE 538 23.160 9.585 -29.865 180 HD2 PHE 538 HD1 PHE 538 22.035 13.004 -32.222 181 HE1 PHE 538 HE2 PHE 538 24.066 8.481 -31.902 182 HE2 PHE 538 HE1 PHE 538 22.947 11.893 -34.262 183 HZ PHE 538 HZ PHE 538 23.968 9.638 -34.092 184 H PHE 539 H PHE 539 22.067 15.217 -28.791 185 HA PHE 539 HA PHE 539 21.194 15.182 -25.936 186 HB2 PHE 539 HB2 PHE 539 21.617 17.419 -27.931 187 HB3 PHE 539 HB3 PHE 539 21.015 17.640 -26.299 188 HD1 PHE 539 HD2 PHE 539 24.005 16.857 -28.330 189 HD2 PHE 539 HD1 PHE 539 22.462 17.545 -24.363 190 HE1 PHE 539 HE2 PHE 539 26.319 17.184 -27.486 191 HE2 PHE 539 HE1 PHE 539 24.775 17.884 -23.523 192 HZ PHE 539 HZ PHE 539 26.700 17.732 -25.085 193 H VAL 540 H VAL 540 19.175 15.788 -25.351 194 HA VAL 540 HA VAL 540 16.937 15.771 -27.333 195 HB VAL 540 HB VAL 540 17.328 14.120 -24.805 196 HG11 VAL 540 HG11 VAL 540 14.965 14.884 -24.961 197 HG12 VAL 540 HG12 VAL 540 14.870 14.195 -26.600 198 HG13 VAL 540 HG13 VAL 540 15.145 13.155 -25.174 199 HG21 VAL 540 HG23 VAL 540 17.076 12.152 -26.221 200 HG22 VAL 540 HG21 VAL 540 16.916 13.169 -27.665 201 HG23 VAL 540 HG22 VAL 540 18.447 13.118 -26.762 202 H ASP 541 H ASP 541 15.512 17.341 -26.970 203 HA ASP 541 HA ASP 541 15.493 18.776 -24.339 204 HB2 ASP 541 HB2 ASP 541 16.279 20.160 -26.174 205 HB3 ASP 541 HB3 ASP 541 14.884 19.723 -27.164 206 H HIS 542 H HIS 542 13.753 18.345 -23.122 207 HA HIS 542 HA HIS 542 11.325 17.135 -24.246 208 HB2 HIS 542 HB2 HIS 542 11.955 18.062 -21.422 209 HB3 HIS 542 HB3 HIS 542 10.594 17.058 -21.903 210 HD2 HIS 542 HD2 HIS 542 12.536 15.111 -23.872 211 HE1 HIS 542 HE1 HIS 542 14.096 13.914 -20.088 212 H ASN 543 H ASN 543 12.306 20.368 -23.946 213 HA ASN 543 HA ASN 543 9.776 21.513 -23.049 214 HB2 ASN 543 HB2 ASN 543 12.214 22.896 -24.251 215 HB3 ASN 543 HB3 ASN 543 10.922 23.639 -23.323 216 HD21 ASN 543 2HD2 ASN 543 13.988 22.048 -23.135 217 HD22 ASN 543 1HD2 ASN 543 14.020 21.854 -21.388 218 H THR 544 H THR 544 11.408 21.084 -26.189 219 HA THR 544 HA THR 544 8.805 21.630 -27.586 220 HB THR 544 HB THR 544 10.012 22.645 -29.430 221 HG1 THR 544 HG1 THR 544 12.252 23.172 -29.055 222 HG21 THR 544 HG23 THR 544 10.685 24.738 -28.454 223 HG22 THR 544 HG21 THR 544 9.299 24.124 -27.539 224 HG23 THR 544 HG22 THR 544 10.938 23.991 -26.862 225 H ARG 545 H ARG 545 10.698 19.176 -26.811 226 HA ARG 545 HA ARG 545 11.010 17.065 -27.487 227 HB2 ARG 545 HB2 ARG 545 8.526 17.647 -28.461 228 HB3 ARG 545 HB3 ARG 545 9.338 17.148 -29.946 229 HG2 ARG 545 HG2 ARG 545 10.068 15.032 -28.697 230 HG3 ARG 545 HG3 ARG 545 9.075 15.580 -27.340 231 HD2 ARG 545 HD2 ARG 545 8.138 14.837 -30.133 232 HD3 ARG 545 HD3 ARG 545 7.854 13.940 -28.649 233 HE ARG 545 HE ARG 545 6.409 15.756 -27.847 234 HH11 ARG 545 HH11 ARG 545 7.016 15.802 -31.307 235 HH12 ARG 545 HH12 ARG 545 5.682 16.881 -31.610 236 HH21 ARG 545 HH21 ARG 545 4.715 17.107 -28.318 237 HH22 ARG 545 HH22 ARG 545 4.401 17.570 -29.963 238 H ARG 546 H ARG 546 12.440 19.448 -28.940 239 HA ARG 546 HA ARG 546 13.501 18.298 -31.397 240 HB2 ARG 546 HB2 ARG 546 14.266 20.698 -29.679 241 HB3 ARG 546 HB3 ARG 546 15.188 20.228 -31.106 242 HG2 ARG 546 HG2 ARG 546 13.059 20.361 -32.477 243 HG3 ARG 546 HG3 ARG 546 12.247 21.013 -31.053 244 HD2 ARG 546 HD2 ARG 546 12.891 22.861 -32.439 245 HD3 ARG 546 HD3 ARG 546 13.938 22.879 -31.007 246 HE ARG 546 HE ARG 546 15.202 21.391 -33.114 247 HH11 ARG 546 HH11 ARG 546 14.450 24.733 -32.395 248 HH12 ARG 546 HH12 ARG 546 15.783 25.334 -33.342 249 HH21 ARG 546 HH21 ARG 546 16.894 22.212 -34.284 250 HH22 ARG 546 HH22 ARG 546 17.122 23.931 -34.395 251 H THR 547 H THR 547 15.808 18.090 -31.792 252 HA THR 547 HA THR 547 17.474 16.926 -29.631 253 HB THR 547 HB THR 547 18.008 14.996 -31.153 254 HG1 THR 547 HG1 THR 547 17.120 15.832 -33.099 255 HG21 THR 547 HG23 THR 547 16.100 13.644 -30.559 256 HG22 THR 547 HG21 THR 547 16.442 14.752 -29.226 257 HG23 THR 547 HG22 THR 547 15.075 15.071 -30.314 258 H THR 548 H THR 548 19.737 16.638 -30.280 259 HA THR 548 HA THR 548 20.647 17.766 -32.813 260 HB THR 548 HB THR 548 20.410 19.874 -31.986 261 HG1 THR 548 HG1 THR 548 22.813 19.834 -30.768 262 HG21 THR 548 HG23 THR 548 20.979 20.723 -29.777 263 HG22 THR 548 HG21 THR 548 19.759 19.459 -29.651 264 HG23 THR 548 HG22 THR 548 21.450 19.099 -29.246 265 H PHE 549 H PHE 549 22.797 17.474 -33.280 266 HA PHE 549 HA PHE 549 24.073 15.141 -32.094 267 HB2 PHE 549 HB2 PHE 549 25.276 17.049 -34.114 268 HB3 PHE 549 HB3 PHE 549 25.604 15.337 -33.915 269 HD1 PHE 549 HD1 PHE 549 22.791 14.224 -33.927 270 HD2 PHE 549 HD2 PHE 549 24.644 17.249 -36.366 271 HE1 PHE 549 HE1 PHE 549 21.189 13.722 -35.757 272 HE2 PHE 549 HE2 PHE 549 23.045 16.750 -38.196 273 HZ PHE 549 HZ PHE 549 21.313 14.988 -37.896 274 H GLU 550 H GLU 550 24.225 18.493 -31.465 275 HA GLU 550 HA GLU 550 26.661 18.308 -29.784 276 HB2 GLU 550 HB2 GLU 550 27.663 20.246 -30.798 277 HB3 GLU 550 HB3 GLU 550 27.374 19.046 -32.050 278 HG2 GLU 550 HG2 GLU 550 25.279 20.310 -32.705 279 HG3 GLU 550 HG3 GLU 550 25.713 21.553 -31.530 280 H ASP 551 H ASP 551 26.870 20.874 -28.923 281 HA ASP 551 HA ASP 551 24.254 21.386 -27.563 282 HB2 ASP 551 HB2 ASP 551 25.955 20.429 -26.129 283 HB3 ASP 551 HB3 ASP 551 27.088 21.708 -26.557 284 HA PRO 552 HA PRO 552 25.152 25.291 -29.960 285 HB2 PRO 552 HB2 PRO 552 22.718 25.653 -31.119 286 HB3 PRO 552 HB3 PRO 552 23.881 24.444 -31.733 287 HG2 PRO 552 HG2 PRO 552 21.560 23.976 -29.825 288 HG3 PRO 552 HG3 PRO 552 21.929 23.101 -31.348 289 HD2 PRO 552 HD2 PRO 552 22.728 22.160 -28.920 290 HD3 PRO 552 HD3 PRO 552 23.742 21.983 -30.385 291 H ARG 553 H ARG 553 23.696 27.384 -29.945 292 HA ARG 553 HA ARG 553 23.194 28.365 -27.334 293 HB2 ARG 553 HB2 ARG 553 22.283 29.192 -30.118 294 HB3 ARG 553 HB3 ARG 553 21.710 30.074 -28.714 295 HG2 ARG 553 HG2 ARG 553 24.676 29.679 -29.296 296 HG3 ARG 553 HG3 ARG 553 23.726 31.054 -29.878 297 HD2 ARG 553 HD2 ARG 553 23.107 31.625 -27.543 298 HD3 ARG 553 HD3 ARG 553 24.138 30.308 -26.948 299 HE ARG 553 HE ARG 553 25.838 31.801 -28.530 300 HH11 ARG 553 HH11 ARG 553 23.861 32.616 -25.749 301 HH12 ARG 553 HH12 ARG 553 24.927 33.901 -25.254 302 HH21 ARG 553 HH21 ARG 553 27.158 33.452 -27.832 303 HH22 ARG 553 HH22 ARG 553 26.744 34.350 -26.401 304 HA PRO 554 HA PRO 554 19.399 26.540 -26.130 305 HB2 PRO 554 HB2 PRO 554 18.470 28.227 -24.201 306 HB3 PRO 554 HB3 PRO 554 20.000 27.323 -24.049 307 HG2 PRO 554 HG2 PRO 554 19.649 30.188 -24.999 308 HG3 PRO 554 HG3 PRO 554 20.747 29.576 -23.719 309 HD2 PRO 554 HD2 PRO 554 21.607 29.968 -26.265 310 HD3 PRO 554 HD3 PRO 554 22.187 28.581 -25.296 311 H GLY 555 H GLY 555 18.656 26.904 -28.382 312 HA2 GLY 555 HA2 GLY 555 16.104 27.229 -28.921 313 HA3 GLY 555 HA3 GLY 555 16.521 28.942 -28.793 314 H ALA 556 H ALA 556 19.292 27.833 -29.985 315 HA ALA 556 HA ALA 556 20.313 28.428 -31.924 316 HB1 ALA 556 HB3 ALA 556 19.995 26.716 -33.638 317 HB2 ALA 556 HB1 ALA 556 19.990 26.011 -32.010 318 HB3 ALA 556 HB2 ALA 556 18.457 26.229 -32.887 319 HA PRO 557 HA PRO 557 16.828 31.149 -33.581 320 HB2 PRO 557 HB2 PRO 557 17.866 33.615 -32.987 321 HB3 PRO 557 HB3 PRO 557 16.912 32.632 -31.834 322 HG2 PRO 557 HG2 PRO 557 19.932 32.838 -32.056 323 HG3 PRO 557 HG3 PRO 557 18.919 32.965 -30.581 324 HD2 PRO 557 HD2 PRO 557 20.150 30.637 -31.275 325 HD3 PRO 557 HD3 PRO 557 18.517 30.645 -30.541 326 H ASN2319 H ASN2319 31.123 16.734 -37.248 327 HA ASN2319 HA ASN2319 32.198 15.305 -39.585 328 HB2 ASN2319 HB2 ASN2319 32.880 14.327 -37.356 329 HB3 ASN2319 HB3 ASN2319 31.176 14.135 -36.948 330 HD21 ASN2319 2HD2 ASN2319 33.854 12.879 -38.938 331 HD22 ASN2319 1HD2 ASN2319 32.968 11.477 -39.501 332 H THR2320 H THR2320 30.678 14.321 -40.954 333 HA THR2320 HA THR2320 27.786 14.823 -40.395 334 HB THR2320 HB THR2320 27.570 15.452 -42.845 335 HG1 THR2320 HG1 THR2320 29.447 16.255 -43.821 336 HG21 THR2320 HG23 THR2320 28.194 17.778 -42.538 337 HG22 THR2320 HG21 THR2320 27.465 17.151 -41.047 338 HG23 THR2320 HG22 THR2320 29.234 17.366 -41.152 339 H GLY2321 H GLY2321 26.321 13.525 -41.349 340 HA2 GLY2321 HA2 GLY2321 26.183 11.796 -43.354 341 HA3 GLY2321 HA3 GLY2321 27.181 10.842 -42.254 342 H ALA2322 H ALA2322 24.677 9.931 -43.069 343 HA ALA2322 HA ALA2322 22.679 10.353 -40.997 344 HB1 ALA2322 HB3 ALA2322 21.605 8.379 -42.015 345 HB2 ALA2322 HB1 ALA2322 22.081 9.560 -43.247 346 HB3 ALA2322 HB2 ALA2322 23.049 8.086 -43.007 347 H LYS2323 H LYS2323 22.236 9.126 -39.216 348 HA LYS2323 HA LYS2323 23.877 6.833 -38.367 349 HB2 LYS2323 HB2 LYS2323 24.816 9.338 -37.644 350 HB3 LYS2323 HB3 LYS2323 23.687 9.040 -36.338 351 HG2 LYS2323 HG2 LYS2323 25.706 8.191 -35.511 352 HG3 LYS2323 HG3 LYS2323 24.924 6.722 -36.100 353 HD2 LYS2323 HD2 LYS2323 26.249 7.005 -38.273 354 HD3 LYS2323 HD3 LYS2323 27.076 8.374 -37.510 355 HE2 LYS2323 HE2 LYS2323 27.753 6.782 -35.635 356 HE3 LYS2323 HE3 LYS2323 27.090 5.462 -36.601 357 HZ1 LYS2323 HZ3 LYS2323 29.479 5.704 -36.992 358 HZ2 LYS2323 HZ1 LYS2323 28.695 6.079 -38.369 359 HZ3 LYS2323 HZ2 LYS2323 29.317 7.260 -37.430 360 H GLN2324 H GLN2324 23.023 6.409 -35.846 361 HA GLN2324 HA GLN2324 20.266 5.709 -36.009 362 HB2 GLN2324 HB2 GLN2324 22.087 6.069 -33.601 363 HB3 GLN2324 HB3 GLN2324 20.406 5.524 -33.506 364 HG2 GLN2324 HG2 GLN2324 21.028 3.655 -35.146 365 HG3 GLN2324 HG3 GLN2324 22.712 4.130 -34.915 366 HE21 GLN2324 HE22 GLN2324 23.180 1.987 -34.013 367 HE22 GLN2324 HE21 GLN2324 22.576 1.554 -32.419 368 HA PRO2325 HA PRO2325 18.777 9.916 -35.408 369 HB2 PRO2325 HB2 PRO2325 16.082 9.530 -35.663 370 HB3 PRO2325 HB3 PRO2325 17.224 9.499 -37.039 371 HG2 PRO2325 HG2 PRO2325 16.079 7.141 -35.518 372 HG3 PRO2325 HG3 PRO2325 16.225 7.357 -37.290 373 HD2 PRO2325 HD2 PRO2325 18.041 5.932 -35.809 374 HD3 PRO2325 HD3 PRO2325 18.516 6.868 -37.257 375 HA PRO2326 HA PRO2326 17.757 9.458 -30.971 376 HB2 PRO2326 HB2 PRO2326 17.889 12.073 -30.211 377 HB3 PRO2326 HB3 PRO2326 19.336 11.080 -30.550 378 HG2 PRO2326 HG2 PRO2326 17.944 13.014 -32.428 379 HG3 PRO2326 HG3 PRO2326 19.687 12.914 -32.052 380 HD2 PRO2326 HD2 PRO2326 18.577 11.747 -34.256 381 HD3 PRO2326 HD3 PRO2326 19.937 10.977 -33.382 382 H SER2327 H SER2327 15.730 9.053 -30.411 383 HA SER2327 HA SER2327 13.515 10.987 -30.830 384 HB2 SER2327 HB2 SER2327 13.419 8.118 -31.853 385 HB3 SER2327 HB3 SER2327 12.048 9.240 -31.753 386 HG SER2327 HG SER2327 12.931 9.199 -33.845 387 H TYR2328 H TYR2328 13.908 11.146 -28.498 388 HA TYR2328 HA TYR2328 13.279 8.842 -26.796 389 HB2 TYR2328 HB2 TYR2328 14.961 10.588 -26.252 390 HB3 TYR2328 HB3 TYR2328 13.678 11.772 -26.125 391 HD1 TYR2328 HD1 TYR2328 15.000 8.580 -24.678 392 HD2 TYR2328 HD2 TYR2328 12.522 12.047 -24.039 393 HE1 TYR2328 HE1 TYR2328 14.826 8.010 -22.260 394 HE2 TYR2328 HE2 TYR2328 12.313 11.455 -21.625 395 HH TYR2328 HH TYR2328 13.962 8.602 -20.218 396 H GLU2329 H GLU2329 11.726 11.999 -26.202 397 HA GLU2329 HA GLU2329 9.138 10.863 -25.733 398 HB2 GLU2329 HB2 GLU2329 10.101 13.688 -26.204 399 HB3 GLU2329 HB3 GLU2329 8.378 13.308 -26.068 400 HG2 GLU2329 HG2 GLU2329 8.850 12.168 -23.865 401 HG3 GLU2329 HG3 GLU2329 10.487 12.818 -23.938 402 H ASP2330 H ASP2330 10.634 12.002 -28.715 403 HA ASP2330 HA ASP2330 8.203 12.141 -30.249 404 HB2 ASP2330 HB2 ASP2330 10.468 13.267 -30.683 405 HB3 ASP2330 HB3 ASP2330 11.001 11.720 -31.339 406 H CYS2331 H CYS2331 9.783 9.382 -29.049 407 HA CYS2331 HA CYS2331 8.438 7.636 -31.093 408 HB2 CYS2331 HB2 CYS2331 10.951 7.477 -30.953 409 HB3 CYS2331 HB3 CYS2331 10.769 6.898 -29.289 410 HG CYS2331 HG CYS2331 9.160 4.867 -29.934 411 H ILE2332 H ILE2332 8.997 8.137 -27.569 412 HA ILE2332 HA ILE2332 7.031 6.041 -26.916 413 HB ILE2332 HB ILE2332 7.590 6.373 -24.635 414 HG12 ILE2332 HG12 ILE2332 9.807 8.309 -24.940 415 HG13 ILE2332 HG13 ILE2332 8.222 9.027 -25.268 416 HG21 ILE2332 HG21 ILE2332 9.054 4.954 -26.012 417 HG22 ILE2332 HG22 ILE2332 10.137 6.332 -26.304 418 HG23 ILE2332 HG23 ILE2332 9.925 5.701 -24.660 419 HD11 ILE2332 3HD1 ILE2332 8.854 9.260 -22.907 420 HD12 ILE2332 1HD1 ILE2332 7.387 8.279 -23.082 421 HD13 ILE2332 2HD1 ILE2332 8.947 7.492 -22.736 422 H LYS2333 H LYS2333 6.213 8.532 -28.311 423 HA LYS2333 HA LYS2333 4.825 10.474 -27.086 424 HB2 LYS2333 HB2 LYS2333 4.104 8.792 -29.508 425 HB3 LYS2333 HB3 LYS2333 3.096 10.140 -29.051 426 HG2 LYS2333 HG2 LYS2333 6.055 10.322 -29.734 427 HG3 LYS2333 HG3 LYS2333 4.730 10.693 -30.820 428 HD2 LYS2333 HD2 LYS2333 5.461 12.260 -28.302 429 HD3 LYS2333 HD3 LYS2333 5.718 12.725 -29.972 430 HE2 LYS2333 HE2 LYS2333 3.836 13.939 -29.565 431 HE3 LYS2333 HE3 LYS2333 3.107 12.465 -30.209 432 HZ1 LYS2333 HZ3 LYS2333 1.993 13.181 -28.189 433 HZ2 LYS2333 HZ1 LYS2333 2.736 11.763 -27.858 434 HZ3 LYS2333 HZ2 LYS2333 3.377 13.170 -27.324 Start of MODEL 4 1 H VAL 515 H VAL 515 34.301 5.946 -7.875 2 HA VAL 515 HA VAL 515 35.541 7.840 -8.564 3 HB VAL 515 HB VAL 515 37.726 6.818 -8.220 4 HG11 VAL 515 HG11 VAL 515 37.496 4.726 -9.600 5 HG12 VAL 515 HG12 VAL 515 37.622 5.747 -11.062 6 HG13 VAL 515 HG13 VAL 515 38.952 5.672 -9.907 7 HG21 VAL 515 HG23 VAL 515 38.893 8.155 -9.863 8 HG22 VAL 515 HG21 VAL 515 37.439 8.261 -10.877 9 HG23 VAL 515 HG22 VAL 515 37.470 9.018 -9.265 10 H SER 516 H SER 516 35.478 5.043 -10.891 11 HA SER 516 HA SER 516 35.156 6.561 -13.119 12 HB2 SER 516 HB2 SER 516 34.123 3.741 -12.658 13 HB3 SER 516 HB3 SER 516 34.348 4.502 -14.241 14 HG SER 516 HG SER 516 36.260 3.547 -12.444 15 H LEU 517 H LEU 517 32.394 5.610 -11.123 16 HA LEU 517 HA LEU 517 30.671 7.355 -12.808 17 HB2 LEU 517 HB2 LEU 517 28.848 5.846 -12.793 18 HB3 LEU 517 HB3 LEU 517 30.221 5.045 -13.514 19 HG LEU 517 HG LEU 517 29.683 4.567 -10.571 20 HD11 LEU 517 1HD1 LEU 517 27.466 4.349 -11.582 21 HD12 LEU 517 2HD1 LEU 517 28.117 3.254 -12.823 22 HD13 LEU 517 3HD1 LEU 517 28.101 2.767 -11.111 23 HD21 LEU 517 3HD2 LEU 517 30.474 2.306 -11.105 24 HD22 LEU 517 1HD2 LEU 517 30.569 2.719 -12.830 25 HD23 LEU 517 2HD2 LEU 517 31.657 3.494 -11.661 26 H ILE 518 H ILE 518 32.048 7.554 -10.104 27 HA ILE 518 HA ILE 518 29.711 8.536 -8.555 28 HB ILE 518 HB ILE 518 31.891 7.126 -7.021 29 HG12 ILE 518 HG12 ILE 518 30.147 5.146 -6.882 30 HG13 ILE 518 HG13 ILE 518 29.629 5.696 -8.459 31 HG21 ILE 518 HG21 ILE 518 30.142 8.526 -5.860 32 HG22 ILE 518 HG22 ILE 518 28.892 7.468 -6.537 33 HG23 ILE 518 HG23 ILE 518 30.088 6.837 -5.385 34 HD11 ILE 518 3HD1 ILE 518 31.232 3.858 -8.638 35 HD12 ILE 518 1HD1 ILE 518 32.040 5.310 -9.247 36 HD13 ILE 518 2HD1 ILE 518 32.396 4.709 -7.614 37 H ASN 519 H ASN 519 32.038 9.687 -10.201 38 HA ASN 519 HA ASN 519 32.612 11.915 -8.343 39 HB2 ASN 519 HB2 ASN 519 34.464 9.960 -8.504 40 HB3 ASN 519 HB3 ASN 519 34.929 10.833 -9.954 41 HD21 ASN 519 2HD2 ASN 519 34.858 10.825 -6.452 42 HD22 ASN 519 1HD2 ASN 519 35.811 12.287 -6.253 43 H GLU 520 H GLU 520 30.987 11.386 -10.879 44 HA GLU 520 HA GLU 520 32.264 12.993 -12.989 45 HB2 GLU 520 HB2 GLU 520 29.508 11.711 -12.798 46 HB3 GLU 520 HB3 GLU 520 30.193 12.451 -14.243 47 HG2 GLU 520 HG2 GLU 520 31.320 9.984 -12.837 48 HG3 GLU 520 HG3 GLU 520 30.306 9.979 -14.267 49 H GLY 521 H GLY 521 30.925 14.708 -14.110 50 HA2 GLY 521 HA2 GLY 521 30.270 16.824 -12.217 51 HA3 GLY 521 HA3 GLY 521 30.307 16.942 -13.970 52 HA PRO 522 HA PRO 522 25.829 16.856 -12.369 53 HB2 PRO 522 HB2 PRO 522 25.138 19.487 -12.528 54 HB3 PRO 522 HB3 PRO 522 26.013 18.810 -11.120 55 HG2 PRO 522 HG2 PRO 522 27.190 20.262 -13.514 56 HG3 PRO 522 HG3 PRO 522 27.486 20.581 -11.775 57 HD2 PRO 522 HD2 PRO 522 29.167 19.041 -13.284 58 HD3 PRO 522 HD3 PRO 522 28.851 18.674 -11.561 59 H LEU 523 H LEU 523 23.865 17.298 -13.641 60 HA LEU 523 HA LEU 523 24.399 17.059 -16.505 61 HB2 LEU 523 HB2 LEU 523 22.388 16.045 -16.712 62 HB3 LEU 523 HB3 LEU 523 22.827 15.595 -15.104 63 HG LEU 523 HG LEU 523 21.202 18.040 -14.986 64 HD11 LEU 523 1HD1 LEU 523 20.366 17.247 -17.196 65 HD12 LEU 523 2HD1 LEU 523 19.944 15.689 -16.459 66 HD13 LEU 523 3HD1 LEU 523 19.131 17.182 -15.933 67 HD21 LEU 523 3HD2 LEU 523 19.742 16.657 -13.609 68 HD22 LEU 523 1HD2 LEU 523 20.608 15.189 -14.115 69 HD23 LEU 523 2HD2 LEU 523 21.435 16.427 -13.140 70 HA PRO 524 HA PRO 524 23.331 21.190 -17.718 71 HB2 PRO 524 HB2 PRO 524 22.207 20.848 -20.223 72 HB3 PRO 524 HB3 PRO 524 23.946 20.652 -19.856 73 HG2 PRO 524 HG2 PRO 524 21.822 18.501 -20.015 74 HG3 PRO 524 HG3 PRO 524 23.439 18.512 -20.787 75 HD2 PRO 524 HD2 PRO 524 22.947 17.210 -18.463 76 HD3 PRO 524 HD3 PRO 524 24.498 18.061 -18.721 77 HA PRO 525 HA PRO 525 19.330 22.188 -16.404 78 HB2 PRO 525 HB2 PRO 525 18.761 24.619 -17.537 79 HB3 PRO 525 HB3 PRO 525 20.067 24.366 -16.341 80 HG2 PRO 525 HG2 PRO 525 20.314 24.441 -19.368 81 HG3 PRO 525 HG3 PRO 525 21.295 25.324 -18.156 82 HD2 PRO 525 HD2 PRO 525 22.148 22.994 -19.249 83 HD3 PRO 525 HD3 PRO 525 22.446 23.360 -17.524 84 H GLY 526 H GLY 526 17.589 20.963 -16.905 85 HA2 GLY 526 HA2 GLY 526 15.657 20.255 -17.925 86 HA3 GLY 526 HA3 GLY 526 15.650 21.782 -18.811 87 H TRP 527 H TRP 527 18.270 19.480 -19.156 88 HA TRP 527 HA TRP 527 17.412 18.719 -21.933 89 HB2 TRP 527 HB2 TRP 527 20.047 19.544 -20.727 90 HB3 TRP 527 HB3 TRP 527 20.051 18.391 -22.047 91 HD1 TRP 527 HD1 TRP 527 19.748 22.047 -21.327 92 HE1 TRP 527 HE1 TRP 527 19.645 23.380 -23.512 93 HE3 TRP 527 HE3 TRP 527 19.223 18.167 -24.612 94 HZ2 TRP 527 HZ2 TRP 527 19.371 22.838 -26.336 95 HZ3 TRP 527 HZ3 TRP 527 19.017 18.604 -27.055 96 HH2 TRP 527 HH2 TRP 527 19.100 20.928 -27.925 97 H GLU 528 H GLU 528 18.019 16.654 -22.648 98 HA GLU 528 HA GLU 528 18.930 14.656 -20.634 99 HB2 GLU 528 HB2 GLU 528 16.598 14.224 -20.907 100 HB3 GLU 528 HB3 GLU 528 16.661 14.501 -22.634 101 HG2 GLU 528 HG2 GLU 528 16.333 12.194 -22.299 102 HG3 GLU 528 HG3 GLU 528 17.953 12.390 -22.937 103 H ILE 529 H ILE 529 20.304 13.062 -21.442 104 HA ILE 529 HA ILE 529 21.504 13.514 -24.126 105 HB ILE 529 HB ILE 529 23.337 13.237 -21.731 106 HG12 ILE 529 HG12 ILE 529 23.716 15.827 -22.078 107 HG13 ILE 529 HG13 ILE 529 22.048 15.827 -22.620 108 HG21 ILE 529 HG21 ILE 529 24.181 12.834 -24.004 109 HG22 ILE 529 HG22 ILE 529 23.639 14.449 -24.510 110 HG23 ILE 529 HG23 ILE 529 24.921 14.276 -23.295 111 HD11 ILE 529 3HD1 ILE 529 21.827 16.251 -20.326 112 HD12 ILE 529 1HD1 ILE 529 21.666 14.498 -20.291 113 HD13 ILE 529 2HD1 ILE 529 23.222 15.232 -19.898 114 H ARG 530 H ARG 530 21.936 11.646 -25.104 115 HA ARG 530 HA ARG 530 22.034 9.111 -23.497 116 HB2 ARG 530 HB2 ARG 530 20.330 9.621 -25.973 117 HB3 ARG 530 HB3 ARG 530 20.542 8.064 -25.191 118 HG2 ARG 530 HG2 ARG 530 19.633 9.933 -23.164 119 HG3 ARG 530 HG3 ARG 530 18.646 10.157 -24.600 120 HD2 ARG 530 HD2 ARG 530 17.560 8.551 -23.221 121 HD3 ARG 530 HD3 ARG 530 18.213 7.673 -24.617 122 HE ARG 530 HE ARG 530 20.070 7.687 -22.387 123 HH11 ARG 530 HH11 ARG 530 17.108 6.088 -23.359 124 HH12 ARG 530 HH12 ARG 530 17.421 4.702 -22.351 125 HH21 ARG 530 HH21 ARG 530 20.426 5.868 -21.157 126 HH22 ARG 530 HH22 ARG 530 19.251 4.588 -21.145 127 H TYR 531 H TYR 531 22.878 7.312 -24.587 128 HA TYR 531 HA TYR 531 24.971 7.937 -26.641 129 HB2 TYR 531 HB2 TYR 531 25.132 6.260 -24.108 130 HB3 TYR 531 HB3 TYR 531 26.312 6.196 -25.402 131 HD1 TYR 531 HD2 TYR 531 24.829 8.467 -22.812 132 HD2 TYR 531 HD1 TYR 531 28.088 7.757 -25.553 133 HE1 TYR 531 HE2 TYR 531 26.138 10.282 -21.726 134 HE2 TYR 531 HE1 TYR 531 29.409 9.550 -24.439 135 HH TYR 531 HH TYR 531 28.134 11.426 -21.668 136 H THR 532 H THR 532 24.256 6.997 -28.446 137 HA THR 532 HA THR 532 22.466 4.712 -28.509 138 HB THR 532 HB THR 532 22.842 4.693 -30.938 139 HG1 THR 532 HG1 THR 532 24.651 6.805 -30.395 140 HG21 THR 532 HG23 THR 532 21.942 6.955 -31.414 141 HG22 THR 532 HG21 THR 532 21.132 6.167 -30.052 142 HG23 THR 532 HG22 THR 532 22.319 7.448 -29.753 143 H ALA 533 H ALA 533 22.847 2.566 -29.056 144 HA ALA 533 HA ALA 533 25.191 1.378 -28.048 145 HB1 ALA 533 HB3 ALA 533 24.224 -0.707 -28.937 146 HB2 ALA 533 HB1 ALA 533 22.981 0.294 -28.164 147 HB3 ALA 533 HB2 ALA 533 23.093 0.228 -29.941 148 H ALA 534 H ALA 534 24.623 2.580 -31.277 149 HA ALA 534 HA ALA 534 26.765 1.220 -32.643 150 HB1 ALA 534 HB3 ALA 534 26.363 2.994 -34.336 151 HB2 ALA 534 HB1 ALA 534 24.850 2.243 -33.791 152 HB3 ALA 534 HB2 ALA 534 25.322 3.841 -33.170 153 H GLY 535 H GLY 535 26.852 3.747 -30.263 154 HA2 GLY 535 HA2 GLY 535 28.944 4.028 -29.171 155 HA3 GLY 535 HA3 GLY 535 29.797 3.999 -30.708 156 H GLU 536 H GLU 536 26.906 6.049 -30.268 157 HA GLU 536 HA GLU 536 28.663 8.480 -30.174 158 HB2 GLU 536 HB2 GLU 536 26.445 7.897 -32.162 159 HB3 GLU 536 HB3 GLU 536 27.187 9.482 -31.926 160 HG2 GLU 536 HG2 GLU 536 29.400 8.558 -32.544 161 HG3 GLU 536 HG3 GLU 536 28.669 6.971 -32.817 162 H ARG 537 H ARG 537 27.907 10.248 -29.219 163 HA ARG 537 HA ARG 537 25.529 10.025 -27.484 164 HB2 ARG 537 HB2 ARG 537 27.488 10.681 -26.359 165 HB3 ARG 537 HB3 ARG 537 27.943 11.858 -27.593 166 HG2 ARG 537 HG2 ARG 537 26.332 13.430 -26.898 167 HG3 ARG 537 HG3 ARG 537 25.403 12.235 -25.989 168 HD2 ARG 537 HD2 ARG 537 26.762 13.924 -24.635 169 HD3 ARG 537 HD3 ARG 537 26.824 12.231 -24.186 170 HE ARG 537 HE ARG 537 29.063 12.158 -24.622 171 HH11 ARG 537 HH11 ARG 537 27.915 15.139 -26.041 172 HH12 ARG 537 HH12 ARG 537 29.531 15.736 -26.319 173 HH21 ARG 537 HH21 ARG 537 31.083 12.944 -25.044 174 HH22 ARG 537 HH22 ARG 537 31.278 14.512 -25.768 175 H PHE 538 H PHE 538 23.824 11.322 -27.490 176 HA PHE 538 HA PHE 538 23.507 13.512 -29.489 177 HB2 PHE 538 HB2 PHE 538 21.570 11.204 -29.020 178 HB3 PHE 538 HB3 PHE 538 21.213 12.647 -29.952 179 HD1 PHE 538 HD1 PHE 538 23.274 9.545 -29.878 180 HD2 PHE 538 HD2 PHE 538 21.975 12.912 -32.217 181 HE1 PHE 538 HE1 PHE 538 24.167 8.468 -31.929 182 HE2 PHE 538 HE2 PHE 538 22.854 11.815 -34.280 183 HZ PHE 538 HZ PHE 538 23.963 9.599 -34.127 184 H PHE 539 H PHE 539 21.880 15.035 -28.923 185 HA PHE 539 HA PHE 539 21.185 15.096 -26.006 186 HB2 PHE 539 HB2 PHE 539 21.773 17.332 -27.964 187 HB3 PHE 539 HB3 PHE 539 21.180 17.562 -26.332 188 HD1 PHE 539 HD2 PHE 539 24.109 16.419 -28.325 189 HD2 PHE 539 HD1 PHE 539 22.623 17.522 -24.432 190 HE1 PHE 539 HE2 PHE 539 26.436 16.573 -27.484 191 HE2 PHE 539 HE1 PHE 539 24.953 17.673 -23.587 192 HZ PHE 539 HZ PHE 539 26.864 17.211 -25.106 193 H VAL 540 H VAL 540 19.214 15.736 -25.386 194 HA VAL 540 HA VAL 540 16.960 15.799 -27.353 195 HB VAL 540 HB VAL 540 17.240 14.215 -24.767 196 HG11 VAL 540 HG11 VAL 540 14.891 15.004 -25.205 197 HG12 VAL 540 HG12 VAL 540 14.936 14.131 -26.753 198 HG13 VAL 540 HG13 VAL 540 15.094 13.267 -25.196 199 HG21 VAL 540 HG23 VAL 540 17.109 12.175 -26.058 200 HG22 VAL 540 HG21 VAL 540 17.035 13.081 -27.577 201 HG23 VAL 540 HG22 VAL 540 18.506 13.113 -26.581 202 H ASP 541 H ASP 541 15.549 17.388 -26.990 203 HA ASP 541 HA ASP 541 15.504 18.762 -24.320 204 HB2 ASP 541 HB2 ASP 541 16.411 20.223 -25.991 205 HB3 ASP 541 HB3 ASP 541 15.135 19.802 -27.133 206 H HIS 542 H HIS 542 13.731 18.283 -23.205 207 HA HIS 542 HA HIS 542 11.342 17.157 -24.452 208 HB2 HIS 542 HB2 HIS 542 11.738 18.109 -21.595 209 HB3 HIS 542 HB3 HIS 542 10.510 16.992 -22.184 210 HD2 HIS 542 HD2 HIS 542 12.599 15.096 -23.917 211 HE1 HIS 542 HE1 HIS 542 14.295 14.296 -20.086 212 H ASN 543 H ASN 543 12.355 20.391 -23.842 213 HA ASN 543 HA ASN 543 9.822 21.565 -23.157 214 HB2 ASN 543 HB2 ASN 543 12.325 22.900 -24.275 215 HB3 ASN 543 HB3 ASN 543 10.998 23.687 -23.433 216 HD21 ASN 543 2HD2 ASN 543 14.016 22.083 -23.042 217 HD22 ASN 543 1HD2 ASN 543 13.948 21.915 -21.291 218 H THR 544 H THR 544 11.474 21.140 -26.307 219 HA THR 544 HA THR 544 8.828 21.696 -27.625 220 HB THR 544 HB THR 544 9.885 22.673 -29.514 221 HG1 THR 544 HG1 THR 544 12.097 22.961 -29.615 222 HG21 THR 544 HG23 THR 544 10.839 24.713 -28.655 223 HG22 THR 544 HG21 THR 544 9.531 24.212 -27.570 224 HG23 THR 544 HG22 THR 544 11.228 23.952 -27.099 225 H ARG 545 H ARG 545 10.652 19.233 -26.826 226 HA ARG 545 HA ARG 545 10.869 17.084 -27.407 227 HB2 ARG 545 HB2 ARG 545 8.419 17.732 -28.543 228 HB3 ARG 545 HB3 ARG 545 9.292 17.045 -29.914 229 HG2 ARG 545 HG2 ARG 545 9.883 15.088 -28.327 230 HG3 ARG 545 HG3 ARG 545 8.715 15.799 -27.204 231 HD2 ARG 545 HD2 ARG 545 8.229 14.588 -29.938 232 HD3 ARG 545 HD3 ARG 545 7.605 14.029 -28.390 233 HE ARG 545 HE ARG 545 6.533 16.110 -30.126 234 HH11 ARG 545 HH11 ARG 545 6.332 14.970 -26.744 235 HH12 ARG 545 HH12 ARG 545 4.992 16.034 -26.453 236 HH21 ARG 545 HH21 ARG 545 4.754 17.280 -29.629 237 HH22 ARG 545 HH22 ARG 545 4.066 17.203 -28.037 238 H ARG 546 H ARG 546 12.306 19.408 -29.057 239 HA ARG 546 HA ARG 546 13.314 18.073 -31.414 240 HB2 ARG 546 HB2 ARG 546 14.704 19.995 -31.710 241 HB3 ARG 546 HB3 ARG 546 13.131 20.548 -31.148 242 HG2 ARG 546 HG2 ARG 546 14.022 20.813 -28.854 243 HG3 ARG 546 HG3 ARG 546 15.610 20.234 -29.374 244 HD2 ARG 546 HD2 ARG 546 14.248 22.694 -30.519 245 HD3 ARG 546 HD3 ARG 546 15.392 22.722 -29.164 246 HE ARG 546 HE ARG 546 16.666 21.329 -31.261 247 HH11 ARG 546 HH11 ARG 546 15.563 24.603 -30.711 248 HH12 ARG 546 HH12 ARG 546 16.770 25.288 -31.766 249 HH21 ARG 546 HH21 ARG 546 18.172 22.258 -32.605 250 HH22 ARG 546 HH22 ARG 546 18.212 23.985 -32.800 251 H THR 547 H THR 547 15.635 17.874 -31.870 252 HA THR 547 HA THR 547 17.376 16.905 -29.674 253 HB THR 547 HB THR 547 17.949 14.920 -31.165 254 HG1 THR 547 HG1 THR 547 16.091 14.259 -32.457 255 HG21 THR 547 HG23 THR 547 16.138 13.512 -30.331 256 HG22 THR 547 HG21 THR 547 16.672 14.651 -29.105 257 HG23 THR 547 HG22 THR 547 15.147 14.937 -29.971 258 H THR 548 H THR 548 19.624 16.530 -30.401 259 HA THR 548 HA THR 548 20.506 17.671 -32.943 260 HB THR 548 HB THR 548 20.043 19.742 -31.807 261 HG1 THR 548 HG1 THR 548 21.782 20.166 -32.879 262 HG21 THR 548 HG23 THR 548 21.123 20.444 -29.754 263 HG22 THR 548 HG21 THR 548 20.135 19.015 -29.445 264 HG23 THR 548 HG22 THR 548 21.897 18.858 -29.585 265 H PHE 549 H PHE 549 22.787 17.594 -33.268 266 HA PHE 549 HA PHE 549 24.039 15.211 -32.074 267 HB2 PHE 549 HB2 PHE 549 25.196 17.033 -34.197 268 HB3 PHE 549 HB3 PHE 549 25.541 15.334 -33.921 269 HD1 PHE 549 HD2 PHE 549 22.779 14.170 -33.838 270 HD2 PHE 549 HD1 PHE 549 24.487 17.153 -36.427 271 HE1 PHE 549 HE2 PHE 549 21.142 13.562 -35.606 272 HE2 PHE 549 HE1 PHE 549 22.855 16.549 -38.197 273 HZ PHE 549 HZ PHE 549 21.179 14.754 -37.791 274 H GLU 550 H GLU 550 24.216 18.605 -31.601 275 HA GLU 550 HA GLU 550 26.872 18.465 -30.232 276 HB2 GLU 550 HB2 GLU 550 27.464 20.605 -31.136 277 HB3 GLU 550 HB3 GLU 550 27.073 19.513 -32.455 278 HG2 GLU 550 HG2 GLU 550 24.770 20.584 -32.568 279 HG3 GLU 550 HG3 GLU 550 25.321 21.757 -31.369 280 H ASP 551 H ASP 551 26.902 21.029 -29.147 281 HA ASP 551 HA ASP 551 24.489 21.049 -27.369 282 HB2 ASP 551 HB2 ASP 551 26.436 20.119 -26.250 283 HB3 ASP 551 HB3 ASP 551 27.360 21.581 -26.597 284 HA PRO 552 HA PRO 552 24.759 25.162 -29.535 285 HB2 PRO 552 HB2 PRO 552 22.202 25.338 -30.433 286 HB3 PRO 552 HB3 PRO 552 23.398 24.270 -31.216 287 HG2 PRO 552 HG2 PRO 552 21.325 23.506 -29.129 288 HG3 PRO 552 HG3 PRO 552 21.627 22.738 -30.723 289 HD2 PRO 552 HD2 PRO 552 22.728 21.796 -28.404 290 HD3 PRO 552 HD3 PRO 552 23.583 21.715 -29.969 291 H ARG 553 H ARG 553 22.845 27.028 -29.236 292 HA ARG 553 HA ARG 553 22.757 27.847 -26.520 293 HB2 ARG 553 HB2 ARG 553 20.951 28.546 -28.881 294 HB3 ARG 553 HB3 ARG 553 20.773 29.274 -27.289 295 HG2 ARG 553 HG2 ARG 553 23.300 29.889 -27.487 296 HG3 ARG 553 HG3 ARG 553 23.089 29.584 -29.217 297 HD2 ARG 553 HD2 ARG 553 21.510 31.538 -27.487 298 HD3 ARG 553 HD3 ARG 553 22.792 31.975 -28.625 299 HE ARG 553 HE ARG 553 20.982 30.635 -30.216 300 HH11 ARG 553 HH11 ARG 553 20.666 33.432 -28.126 301 HH12 ARG 553 HH12 ARG 553 19.359 34.100 -29.065 302 HH21 ARG 553 HH21 ARG 553 19.305 31.546 -31.365 303 HH22 ARG 553 HH22 ARG 553 18.622 33.060 -30.851 304 HA PRO 554 HA PRO 554 19.858 25.269 -24.582 305 HB2 PRO 554 HB2 PRO 554 18.684 26.896 -22.670 306 HB3 PRO 554 HB3 PRO 554 20.350 26.253 -22.579 307 HG2 PRO 554 HG2 PRO 554 19.455 28.977 -23.562 308 HG3 PRO 554 HG3 PRO 554 20.789 28.589 -22.430 309 HD2 PRO 554 HD2 PRO 554 21.268 29.061 -25.047 310 HD3 PRO 554 HD3 PRO 554 22.159 27.776 -24.181 311 H GLY 555 H GLY 555 18.433 28.376 -25.640 312 HA2 GLY 555 HA2 GLY 555 16.390 28.927 -26.552 313 HA3 GLY 555 HA3 GLY 555 16.189 27.236 -26.999 314 H ALA 556 H ALA 556 13.925 28.093 -26.528 315 HA ALA 556 HA ALA 556 11.992 28.053 -25.374 316 HB1 ALA 556 HB3 ALA 556 12.193 26.190 -23.369 317 HB2 ALA 556 HB1 ALA 556 11.990 25.819 -25.095 318 HB3 ALA 556 HB2 ALA 556 13.589 25.762 -24.342 319 HA PRO 557 HA PRO 557 11.803 30.636 -21.711 320 HB2 PRO 557 HB2 PRO 557 9.802 29.582 -20.137 321 HB3 PRO 557 HB3 PRO 557 9.522 30.520 -21.634 322 HG2 PRO 557 HG2 PRO 557 9.591 27.507 -21.306 323 HG3 PRO 557 HG3 PRO 557 8.371 28.502 -22.165 324 HD2 PRO 557 HD2 PRO 557 10.346 27.269 -23.511 325 HD3 PRO 557 HD3 PRO 557 9.849 28.915 -23.969 326 H ASN2319 H ASN2319 31.222 16.913 -40.502 327 HA ASN2319 HA ASN2319 31.343 14.565 -40.004 328 HB2 ASN2319 HB2 ASN2319 31.853 15.552 -37.169 329 HB3 ASN2319 HB3 ASN2319 31.266 13.931 -37.526 330 HD21 ASN2319 2HD2 ASN2319 34.162 15.807 -37.249 331 HD22 ASN2319 1HD2 ASN2319 35.206 14.629 -38.018 332 H THR2320 H THR2320 29.391 14.965 -41.051 333 HA THR2320 HA THR2320 26.976 14.773 -39.373 334 HB THR2320 HB THR2320 25.816 16.456 -40.912 335 HG1 THR2320 HG1 THR2320 27.441 16.743 -42.443 336 HG21 THR2320 HG23 THR2320 26.340 18.389 -39.597 337 HG22 THR2320 HG21 THR2320 26.365 16.974 -38.531 338 HG23 THR2320 HG22 THR2320 27.891 17.706 -39.079 339 H GLY2321 H GLY2321 25.153 13.938 -40.585 340 HA2 GLY2321 HA2 GLY2321 24.749 13.373 -43.201 341 HA3 GLY2321 HA3 GLY2321 25.950 12.149 -42.783 342 H ALA2322 H ALA2322 24.126 10.730 -43.458 343 HA ALA2322 HA ALA2322 21.866 10.220 -41.772 344 HB1 ALA2322 HB3 ALA2322 21.878 8.012 -42.877 345 HB2 ALA2322 HB1 ALA2322 22.058 9.333 -44.047 346 HB3 ALA2322 HB2 ALA2322 23.473 8.360 -43.576 347 H LYS2323 H LYS2323 21.980 9.851 -39.702 348 HA LYS2323 HA LYS2323 23.930 7.955 -38.457 349 HB2 LYS2323 HB2 LYS2323 23.717 10.870 -38.042 350 HB3 LYS2323 HB3 LYS2323 23.280 10.023 -36.580 351 HG2 LYS2323 HG2 LYS2323 25.567 10.439 -36.386 352 HG3 LYS2323 HG3 LYS2323 25.441 8.714 -36.748 353 HD2 LYS2323 HD2 LYS2323 26.074 9.142 -39.096 354 HD3 LYS2323 HD3 LYS2323 26.077 10.896 -38.793 355 HE2 LYS2323 HE2 LYS2323 27.863 10.560 -37.076 356 HE3 LYS2323 HE3 LYS2323 27.869 8.832 -37.431 357 HZ1 LYS2323 HZ3 LYS2323 29.626 9.983 -38.637 358 HZ2 LYS2323 HZ1 LYS2323 28.561 9.372 -39.711 359 HZ3 LYS2323 HZ2 LYS2323 28.561 10.974 -39.376 360 H GLN2324 H GLN2324 23.184 7.316 -36.271 361 HA GLN2324 HA GLN2324 20.617 6.214 -36.073 362 HB2 GLN2324 HB2 GLN2324 22.268 7.229 -33.723 363 HB3 GLN2324 HB3 GLN2324 20.988 6.026 -33.688 364 HG2 GLN2324 HG2 GLN2324 22.955 4.784 -33.521 365 HG3 GLN2324 HG3 GLN2324 22.490 4.588 -35.212 366 HE21 GLN2324 HE22 GLN2324 24.744 6.345 -32.989 367 HE22 GLN2324 HE21 GLN2324 25.872 6.791 -34.293 368 HA PRO2325 HA PRO2325 18.536 10.227 -35.568 369 HB2 PRO2325 HB2 PRO2325 15.921 9.478 -35.804 370 HB3 PRO2325 HB3 PRO2325 17.049 9.605 -37.185 371 HG2 PRO2325 HG2 PRO2325 16.226 7.112 -35.678 372 HG3 PRO2325 HG3 PRO2325 16.362 7.353 -37.446 373 HD2 PRO2325 HD2 PRO2325 18.334 6.175 -35.927 374 HD3 PRO2325 HD3 PRO2325 18.687 7.133 -37.395 375 HA PRO2326 HA PRO2326 17.811 9.445 -31.109 376 HB2 PRO2326 HB2 PRO2326 17.996 11.994 -30.169 377 HB3 PRO2326 HB3 PRO2326 19.422 11.028 -30.653 378 HG2 PRO2326 HG2 PRO2326 17.927 13.065 -32.335 379 HG3 PRO2326 HG3 PRO2326 19.684 12.984 -32.034 380 HD2 PRO2326 HD2 PRO2326 18.516 11.949 -34.263 381 HD3 PRO2326 HD3 PRO2326 19.900 11.133 -33.473 382 H SER2327 H SER2327 15.838 9.040 -30.439 383 HA SER2327 HA SER2327 13.596 10.972 -30.682 384 HB2 SER2327 HB2 SER2327 13.478 8.119 -31.745 385 HB3 SER2327 HB3 SER2327 12.093 9.208 -31.535 386 HG SER2327 HG SER2327 12.862 9.226 -33.682 387 H TYR2328 H TYR2328 13.903 11.170 -28.417 388 HA TYR2328 HA TYR2328 13.438 8.835 -26.661 389 HB2 TYR2328 HB2 TYR2328 15.058 10.638 -26.127 390 HB3 TYR2328 HB3 TYR2328 13.754 11.801 -26.095 391 HD1 TYR2328 HD1 TYR2328 15.112 8.744 -24.446 392 HD2 TYR2328 HD2 TYR2328 12.502 12.162 -24.043 393 HE1 TYR2328 HE1 TYR2328 14.915 8.320 -21.994 394 HE2 TYR2328 HE2 TYR2328 12.293 11.718 -21.612 395 HH TYR2328 HH TYR2328 12.933 10.400 -19.851 396 H GLU2329 H GLU2329 11.885 11.953 -26.188 397 HA GLU2329 HA GLU2329 9.327 10.961 -25.516 398 HB2 GLU2329 HB2 GLU2329 10.723 13.461 -25.632 399 HB3 GLU2329 HB3 GLU2329 9.254 13.673 -26.548 400 HG2 GLU2329 HG2 GLU2329 9.342 12.553 -23.724 401 HG3 GLU2329 HG3 GLU2329 9.143 14.263 -24.100 402 H ASP2330 H ASP2330 10.628 11.974 -28.655 403 HA ASP2330 HA ASP2330 8.134 11.963 -30.085 404 HB2 ASP2330 HB2 ASP2330 10.276 13.167 -30.695 405 HB3 ASP2330 HB3 ASP2330 10.941 11.611 -31.191 406 H CYS2331 H CYS2331 10.047 9.313 -28.964 407 HA CYS2331 HA CYS2331 8.809 7.415 -30.927 408 HB2 CYS2331 HB2 CYS2331 11.277 7.322 -30.577 409 HB3 CYS2331 HB3 CYS2331 11.002 6.963 -28.864 410 HG CYS2331 HG CYS2331 10.011 5.269 -31.554 411 H ILE2332 H ILE2332 9.095 8.084 -27.403 412 HA ILE2332 HA ILE2332 7.335 5.865 -26.728 413 HB ILE2332 HB ILE2332 7.665 6.476 -24.436 414 HG12 ILE2332 HG12 ILE2332 9.659 8.635 -24.927 415 HG13 ILE2332 HG13 ILE2332 7.983 9.112 -25.195 416 HG21 ILE2332 HG21 ILE2332 9.343 5.099 -25.585 417 HG22 ILE2332 HG22 ILE2332 10.292 6.548 -25.972 418 HG23 ILE2332 HG23 ILE2332 10.059 6.063 -24.283 419 HD11 ILE2332 3HD1 ILE2332 8.719 9.555 -22.884 420 HD12 ILE2332 1HD1 ILE2332 7.380 8.391 -22.931 421 HD13 ILE2332 2HD1 ILE2332 9.044 7.824 -22.646 422 H LYS2333 H LYS2333 6.053 7.872 -28.403 423 HA LYS2333 HA LYS2333 3.702 8.533 -26.700 424 HB2 LYS2333 HB2 LYS2333 3.421 10.665 -27.650 425 HB3 LYS2333 HB3 LYS2333 5.067 10.586 -27.025 426 HG2 LYS2333 HG2 LYS2333 5.893 10.151 -29.352 427 HG3 LYS2333 HG3 LYS2333 4.251 10.334 -29.966 428 HD2 LYS2333 HD2 LYS2333 5.732 12.539 -28.463 429 HD3 LYS2333 HD3 LYS2333 5.788 12.316 -30.206 430 HE2 LYS2333 HE2 LYS2333 4.196 13.973 -29.943 431 HE3 LYS2333 HE3 LYS2333 3.260 12.517 -30.267 432 HZ1 LYS2333 HZ3 LYS2333 2.748 12.384 -27.903 433 HZ2 LYS2333 HZ1 LYS2333 3.722 13.651 -27.549 434 HZ3 LYS2333 HZ2 LYS2333 2.359 13.874 -28.427 Start of MODEL 5 1 H VAL 515 H VAL 515 35.875 8.593 -18.343 2 HA VAL 515 HA VAL 515 35.406 9.489 -16.171 3 HB VAL 515 HB VAL 515 37.476 8.688 -15.142 4 HG11 VAL 515 HG11 VAL 515 39.188 9.546 -16.759 5 HG12 VAL 515 HG12 VAL 515 38.868 11.196 -16.159 6 HG13 VAL 515 HG13 VAL 515 39.506 9.959 -15.075 7 HG21 VAL 515 HG23 VAL 515 37.697 10.496 -13.520 8 HG22 VAL 515 HG21 VAL 515 36.870 11.620 -14.616 9 HG23 VAL 515 HG22 VAL 515 36.008 10.209 -13.946 10 H SER 516 H SER 516 37.891 11.004 -18.325 11 HA SER 516 HA SER 516 37.578 13.534 -17.658 12 HB2 SER 516 HB2 SER 516 38.090 12.649 -20.506 13 HB3 SER 516 HB3 SER 516 38.731 14.088 -19.688 14 HG SER 516 HG SER 516 40.219 12.284 -19.770 15 H LEU 517 H LEU 517 35.246 12.066 -19.873 16 HA LEU 517 HA LEU 517 33.664 14.575 -19.725 17 HB2 LEU 517 HB2 LEU 517 33.025 14.541 -21.995 18 HB3 LEU 517 HB3 LEU 517 34.768 14.610 -21.920 19 HG LEU 517 HG LEU 517 33.619 11.844 -22.186 20 HD11 LEU 517 1HD1 LEU 517 32.085 13.093 -23.635 21 HD12 LEU 517 2HD1 LEU 517 33.460 13.847 -24.472 22 HD13 LEU 517 3HD1 LEU 517 33.186 12.092 -24.591 23 HD21 LEU 517 3HD2 LEU 517 35.442 11.583 -23.789 24 HD22 LEU 517 1HD2 LEU 517 35.796 13.323 -23.719 25 HD23 LEU 517 2HD2 LEU 517 36.065 12.298 -22.293 26 H ILE 518 H ILE 518 33.582 12.070 -18.268 27 HA ILE 518 HA ILE 518 30.719 11.349 -18.705 28 HB ILE 518 HB ILE 518 32.885 9.353 -17.933 29 HG12 ILE 518 HG12 ILE 518 31.965 8.372 -20.305 30 HG13 ILE 518 HG13 ILE 518 31.763 10.076 -20.642 31 HG21 ILE 518 HG21 ILE 518 30.705 8.706 -17.040 32 HG22 ILE 518 HG22 ILE 518 29.940 8.978 -18.624 33 HG23 ILE 518 HG23 ILE 518 31.109 7.660 -18.382 34 HD11 ILE 518 3HD1 ILE 518 33.918 9.277 -21.457 35 HD12 ILE 518 1HD1 ILE 518 34.249 10.366 -20.102 36 HD13 ILE 518 2HD1 ILE 518 34.326 8.608 -19.870 37 H ASN 519 H ASN 519 33.178 12.403 -16.546 38 HA ASN 519 HA ASN 519 31.360 12.151 -14.198 39 HB2 ASN 519 HB2 ASN 519 33.469 10.576 -14.450 40 HB3 ASN 519 HB3 ASN 519 34.372 12.008 -13.977 41 HD21 ASN 519 2HD2 ASN 519 32.305 9.411 -12.916 42 HD22 ASN 519 1HD2 ASN 519 32.318 9.853 -11.215 43 H GLU 520 H GLU 520 31.378 14.377 -15.955 44 HA GLU 520 HA GLU 520 32.851 16.611 -14.816 45 HB2 GLU 520 HB2 GLU 520 30.275 16.898 -16.370 46 HB3 GLU 520 HB3 GLU 520 31.658 17.973 -16.276 47 HG2 GLU 520 HG2 GLU 520 32.108 17.200 -18.323 48 HG3 GLU 520 HG3 GLU 520 32.877 15.862 -17.481 49 H GLY 521 H GLY 521 30.999 18.604 -14.456 50 HA2 GLY 521 HA2 GLY 521 29.809 18.322 -11.848 51 HA3 GLY 521 HA3 GLY 521 29.556 19.620 -13.010 52 HA PRO 522 HA PRO 522 25.670 17.046 -12.345 53 HB2 PRO 522 HB2 PRO 522 23.907 19.097 -11.838 54 HB3 PRO 522 HB3 PRO 522 24.958 18.349 -10.598 55 HG2 PRO 522 HG2 PRO 522 25.467 20.881 -12.188 56 HG3 PRO 522 HG3 PRO 522 25.606 20.642 -10.415 57 HD2 PRO 522 HD2 PRO 522 27.773 20.526 -12.038 58 HD3 PRO 522 HD3 PRO 522 27.614 19.404 -10.653 59 H LEU 523 H LEU 523 23.672 16.931 -13.565 60 HA LEU 523 HA LEU 523 24.200 17.126 -16.303 61 HB2 LEU 523 HB2 LEU 523 22.241 15.943 -16.631 62 HB3 LEU 523 HB3 LEU 523 22.757 15.470 -15.046 63 HG LEU 523 HG LEU 523 20.959 17.685 -14.642 64 HD11 LEU 523 1HD1 LEU 523 20.203 17.255 -16.999 65 HD12 LEU 523 2HD1 LEU 523 19.806 15.591 -16.537 66 HD13 LEU 523 3HD1 LEU 523 18.941 16.956 -15.793 67 HD21 LEU 523 3HD2 LEU 523 19.523 16.008 -13.593 68 HD22 LEU 523 1HD2 LEU 523 20.485 14.701 -14.319 69 HD23 LEU 523 2HD2 LEU 523 21.213 15.789 -13.114 70 HA PRO 524 HA PRO 524 23.033 21.104 -17.606 71 HB2 PRO 524 HB2 PRO 524 22.054 20.740 -20.182 72 HB3 PRO 524 HB3 PRO 524 23.774 20.647 -19.704 73 HG2 PRO 524 HG2 PRO 524 21.807 18.377 -20.036 74 HG3 PRO 524 HG3 PRO 524 23.483 18.485 -20.654 75 HD2 PRO 524 HD2 PRO 524 22.875 17.133 -18.386 76 HD3 PRO 524 HD3 PRO 524 24.381 18.088 -18.500 77 HA PRO 525 HA PRO 525 19.068 22.003 -16.316 78 HB2 PRO 525 HB2 PRO 525 18.499 24.496 -17.326 79 HB3 PRO 525 HB3 PRO 525 19.778 24.172 -16.120 80 HG2 PRO 525 HG2 PRO 525 20.090 24.424 -19.130 81 HG3 PRO 525 HG3 PRO 525 21.048 25.229 -17.847 82 HD2 PRO 525 HD2 PRO 525 21.928 22.969 -19.055 83 HD3 PRO 525 HD3 PRO 525 22.171 23.220 -17.300 84 H GLY 526 H GLY 526 17.368 20.771 -16.881 85 HA2 GLY 526 HA2 GLY 526 15.420 20.118 -17.908 86 HA3 GLY 526 HA3 GLY 526 15.442 21.629 -18.819 87 H TRP 527 H TRP 527 18.129 19.408 -19.116 88 HA TRP 527 HA TRP 527 17.292 18.602 -21.885 89 HB2 TRP 527 HB2 TRP 527 19.929 19.364 -20.635 90 HB3 TRP 527 HB3 TRP 527 19.906 18.275 -22.008 91 HD1 TRP 527 HD1 TRP 527 19.549 21.909 -21.118 92 HE1 TRP 527 HE1 TRP 527 19.483 23.333 -23.249 93 HE3 TRP 527 HE3 TRP 527 19.181 18.163 -24.574 94 HZ2 TRP 527 HZ2 TRP 527 19.281 22.901 -26.099 95 HZ3 TRP 527 HZ3 TRP 527 19.036 18.695 -27.003 96 HH2 TRP 527 HH2 TRP 527 19.095 21.054 -27.773 97 H GLU 528 H GLU 528 18.015 16.568 -22.628 98 HA GLU 528 HA GLU 528 18.876 14.532 -20.629 99 HB2 GLU 528 HB2 GLU 528 16.522 14.172 -20.934 100 HB3 GLU 528 HB3 GLU 528 16.632 14.357 -22.671 101 HG2 GLU 528 HG2 GLU 528 16.300 12.055 -22.205 102 HG3 GLU 528 HG3 GLU 528 17.944 12.216 -22.789 103 H ILE 529 H ILE 529 20.187 12.878 -21.524 104 HA ILE 529 HA ILE 529 21.514 13.471 -24.115 105 HB ILE 529 HB ILE 529 23.249 13.114 -21.655 106 HG12 ILE 529 HG12 ILE 529 23.660 15.708 -21.927 107 HG13 ILE 529 HG13 ILE 529 22.013 15.732 -22.531 108 HG21 ILE 529 HG21 ILE 529 24.190 12.761 -23.910 109 HG22 ILE 529 HG22 ILE 529 23.695 14.401 -24.380 110 HG23 ILE 529 HG23 ILE 529 24.919 14.159 -23.116 111 HD11 ILE 529 3HD1 ILE 529 21.785 16.134 -20.210 112 HD12 ILE 529 1HD1 ILE 529 21.475 14.403 -20.270 113 HD13 ILE 529 2HD1 ILE 529 23.071 14.982 -19.784 114 H ARG 530 H ARG 530 21.906 11.617 -25.150 115 HA ARG 530 HA ARG 530 21.977 9.038 -23.608 116 HB2 ARG 530 HB2 ARG 530 20.285 9.633 -26.072 117 HB3 ARG 530 HB3 ARG 530 20.479 8.052 -25.333 118 HG2 ARG 530 HG2 ARG 530 19.600 9.863 -23.246 119 HG3 ARG 530 HG3 ARG 530 18.614 10.156 -24.672 120 HD2 ARG 530 HD2 ARG 530 17.510 8.507 -23.346 121 HD3 ARG 530 HD3 ARG 530 18.142 7.690 -24.785 122 HE ARG 530 HE ARG 530 19.911 7.636 -22.427 123 HH11 ARG 530 HH11 ARG 530 17.302 5.880 -23.975 124 HH12 ARG 530 HH12 ARG 530 17.708 4.391 -23.165 125 HH21 ARG 530 HH21 ARG 530 20.381 5.699 -21.447 126 HH22 ARG 530 HH22 ARG 530 19.402 4.302 -21.774 127 H TYR 531 H TYR 531 22.719 7.225 -24.789 128 HA TYR 531 HA TYR 531 24.871 7.833 -26.772 129 HB2 TYR 531 HB2 TYR 531 25.045 6.032 -24.326 130 HB3 TYR 531 HB3 TYR 531 26.291 6.255 -25.537 131 HD1 TYR 531 HD2 TYR 531 24.463 7.876 -22.727 132 HD2 TYR 531 HD1 TYR 531 27.809 8.128 -25.443 133 HE1 TYR 531 HE2 TYR 531 25.458 9.674 -21.328 134 HE2 TYR 531 HE1 TYR 531 28.830 9.892 -24.007 135 HH TYR 531 HH TYR 531 27.240 11.073 -21.023 136 H THR 532 H THR 532 24.321 6.727 -28.617 137 HA THR 532 HA THR 532 22.526 4.394 -28.479 138 HB THR 532 HB THR 532 22.590 4.392 -30.891 139 HG1 THR 532 HG1 THR 532 23.834 5.957 -31.973 140 HG21 THR 532 HG23 THR 532 21.663 6.615 -31.364 141 HG22 THR 532 HG21 THR 532 21.064 5.999 -29.817 142 HG23 THR 532 HG22 THR 532 22.331 7.240 -29.844 143 H ALA 533 H ALA 533 22.999 2.353 -29.565 144 HA ALA 533 HA ALA 533 25.408 1.125 -28.726 145 HB1 ALA 533 HB3 ALA 533 24.565 -0.813 -29.978 146 HB2 ALA 533 HB1 ALA 533 23.262 -0.040 -29.061 147 HB3 ALA 533 HB2 ALA 533 23.386 0.215 -30.819 148 H ALA 534 H ALA 534 24.939 3.079 -31.544 149 HA ALA 534 HA ALA 534 27.119 2.011 -33.145 150 HB1 ALA 534 HB3 ALA 534 26.821 4.110 -34.411 151 HB2 ALA 534 HB1 ALA 534 25.270 3.310 -34.130 152 HB3 ALA 534 HB2 ALA 534 25.730 4.730 -33.156 153 H GLY 535 H GLY 535 27.119 3.744 -30.179 154 HA2 GLY 535 HA2 GLY 535 28.982 4.402 -28.938 155 HA3 GLY 535 HA3 GLY 535 30.016 4.299 -30.367 156 H GLU 536 H GLU 536 26.949 6.116 -30.097 157 HA GLU 536 HA GLU 536 28.420 8.690 -30.568 158 HB2 GLU 536 HB2 GLU 536 25.952 7.555 -31.928 159 HB3 GLU 536 HB3 GLU 536 26.476 9.223 -32.100 160 HG2 GLU 536 HG2 GLU 536 28.104 6.766 -32.904 161 HG3 GLU 536 HG3 GLU 536 27.120 7.732 -33.983 162 H ARG 537 H ARG 537 27.787 10.401 -29.454 163 HA ARG 537 HA ARG 537 25.587 10.159 -27.468 164 HB2 ARG 537 HB2 ARG 537 27.703 10.692 -26.534 165 HB3 ARG 537 HB3 ARG 537 28.012 11.971 -27.706 166 HG2 ARG 537 HG2 ARG 537 26.516 13.476 -26.683 167 HG3 ARG 537 HG3 ARG 537 25.686 12.202 -25.765 168 HD2 ARG 537 HD2 ARG 537 27.363 11.991 -24.209 169 HD3 ARG 537 HD3 ARG 537 28.635 12.570 -25.292 170 HE ARG 537 HE ARG 537 27.053 14.800 -24.852 171 HH11 ARG 537 HH11 ARG 537 28.659 12.611 -22.607 172 HH12 ARG 537 HH12 ARG 537 29.301 13.916 -21.653 173 HH21 ARG 537 HH21 ARG 537 27.810 16.414 -23.444 174 HH22 ARG 537 HH22 ARG 537 28.742 15.956 -22.049 175 H PHE 538 H PHE 538 23.855 11.397 -27.446 176 HA PHE 538 HA PHE 538 23.492 13.628 -29.407 177 HB2 PHE 538 HB2 PHE 538 21.523 11.365 -28.868 178 HB3 PHE 538 HB3 PHE 538 21.225 12.769 -29.876 179 HD1 PHE 538 HD1 PHE 538 23.017 9.546 -29.628 180 HD2 PHE 538 HD2 PHE 538 22.137 12.934 -32.141 181 HE1 PHE 538 HE1 PHE 538 23.815 8.288 -31.606 182 HE2 PHE 538 HE2 PHE 538 22.926 11.650 -34.132 183 HZ PHE 538 HZ PHE 538 23.771 9.335 -33.861 184 H PHE 539 H PHE 539 21.855 15.118 -28.822 185 HA PHE 539 HA PHE 539 21.142 15.140 -25.909 186 HB2 PHE 539 HB2 PHE 539 21.648 17.455 -27.795 187 HB3 PHE 539 HB3 PHE 539 21.172 17.580 -26.115 188 HD1 PHE 539 HD1 PHE 539 23.954 16.602 -28.387 189 HD2 PHE 539 HD2 PHE 539 22.763 17.435 -24.328 190 HE1 PHE 539 HE1 PHE 539 26.340 16.737 -27.716 191 HE2 PHE 539 HE2 PHE 539 25.148 17.601 -23.662 192 HZ PHE 539 HZ PHE 539 26.943 17.287 -25.371 193 H VAL 540 H VAL 540 19.156 15.806 -25.318 194 HA VAL 540 HA VAL 540 16.935 15.833 -27.328 195 HB VAL 540 HB VAL 540 17.231 14.234 -24.755 196 HG11 VAL 540 HG11 VAL 540 14.871 14.980 -25.132 197 HG12 VAL 540 HG12 VAL 540 14.908 14.179 -26.720 198 HG13 VAL 540 HG13 VAL 540 15.093 13.246 -25.209 199 HG21 VAL 540 HG23 VAL 540 17.084 12.213 -26.111 200 HG22 VAL 540 HG21 VAL 540 17.064 13.180 -27.597 201 HG23 VAL 540 HG22 VAL 540 18.501 13.163 -26.552 202 H ASP 541 H ASP 541 15.505 17.422 -26.976 203 HA ASP 541 HA ASP 541 15.453 18.822 -24.318 204 HB2 ASP 541 HB2 ASP 541 16.345 20.293 -25.964 205 HB3 ASP 541 HB3 ASP 541 15.120 19.826 -27.143 206 H HIS 542 H HIS 542 13.735 18.147 -23.206 207 HA HIS 542 HA HIS 542 11.298 17.136 -24.398 208 HB2 HIS 542 HB2 HIS 542 11.798 18.096 -21.559 209 HB3 HIS 542 HB3 HIS 542 10.497 17.039 -22.100 210 HD2 HIS 542 HD2 HIS 542 12.390 15.025 -23.894 211 HE1 HIS 542 HE1 HIS 542 14.224 14.157 -20.142 212 H ASN 543 H ASN 543 12.335 20.385 -23.663 213 HA ASN 543 HA ASN 543 9.765 21.546 -23.140 214 HB2 ASN 543 HB2 ASN 543 12.298 22.884 -24.180 215 HB3 ASN 543 HB3 ASN 543 10.926 23.684 -23.430 216 HD21 ASN 543 2HD2 ASN 543 13.882 21.996 -22.851 217 HD22 ASN 543 1HD2 ASN 543 13.762 21.966 -21.090 218 H THR 544 H THR 544 11.511 21.011 -26.182 219 HA THR 544 HA THR 544 9.044 21.791 -27.707 220 HB THR 544 HB THR 544 10.446 22.683 -29.473 221 HG1 THR 544 HG1 THR 544 12.599 22.093 -27.706 222 HG21 THR 544 HG23 THR 544 11.282 24.696 -28.452 223 HG22 THR 544 HG21 THR 544 9.758 24.244 -27.666 224 HG23 THR 544 HG22 THR 544 11.308 23.946 -26.843 225 H ARG 545 H ARG 545 10.599 19.168 -26.839 226 HA ARG 545 HA ARG 545 10.829 17.045 -27.492 227 HB2 ARG 545 HB2 ARG 545 8.427 17.710 -28.523 228 HB3 ARG 545 HB3 ARG 545 9.270 17.365 -30.031 229 HG2 ARG 545 HG2 ARG 545 9.969 15.124 -28.717 230 HG3 ARG 545 HG3 ARG 545 8.570 15.536 -27.724 231 HD2 ARG 545 HD2 ARG 545 8.646 15.076 -30.727 232 HD3 ARG 545 HD3 ARG 545 7.963 13.982 -29.513 233 HE ARG 545 HE ARG 545 6.507 16.261 -29.116 234 HH11 ARG 545 HH11 ARG 545 7.117 14.388 -32.064 235 HH12 ARG 545 HH12 ARG 545 5.625 14.936 -32.781 236 HH21 ARG 545 HH21 ARG 545 4.655 16.916 -30.153 237 HH22 ARG 545 HH22 ARG 545 4.280 16.307 -31.736 238 H ARG 546 H ARG 546 12.421 19.361 -29.052 239 HA ARG 546 HA ARG 546 13.372 17.991 -31.430 240 HB2 ARG 546 HB2 ARG 546 14.747 19.893 -31.804 241 HB3 ARG 546 HB3 ARG 546 13.210 20.482 -31.179 242 HG2 ARG 546 HG2 ARG 546 14.222 20.712 -28.924 243 HG3 ARG 546 HG3 ARG 546 15.782 20.165 -29.538 244 HD2 ARG 546 HD2 ARG 546 14.303 22.609 -30.579 245 HD3 ARG 546 HD3 ARG 546 15.527 22.652 -29.298 246 HE ARG 546 HE ARG 546 16.705 21.299 -31.473 247 HH11 ARG 546 HH11 ARG 546 15.556 24.542 -30.849 248 HH12 ARG 546 HH12 ARG 546 16.698 25.263 -31.952 249 HH21 ARG 546 HH21 ARG 546 18.129 22.269 -32.874 250 HH22 ARG 546 HH22 ARG 546 18.120 23.997 -33.064 251 H THR 547 H THR 547 15.735 17.844 -31.872 252 HA THR 547 HA THR 547 17.428 16.878 -29.646 253 HB THR 547 HB THR 547 18.093 14.880 -30.976 254 HG1 THR 547 HG1 THR 547 15.720 15.316 -32.456 255 HG21 THR 547 HG23 THR 547 16.209 13.465 -30.442 256 HG22 THR 547 HG21 THR 547 16.413 14.662 -29.159 257 HG23 THR 547 HG22 THR 547 15.109 14.851 -30.344 258 H THR 548 H THR 548 19.712 16.525 -30.363 259 HA THR 548 HA THR 548 20.581 17.608 -32.919 260 HB THR 548 HB THR 548 20.189 19.736 -31.914 261 HG1 THR 548 HG1 THR 548 21.975 20.157 -32.863 262 HG21 THR 548 HG23 THR 548 21.345 20.478 -29.843 263 HG22 THR 548 HG21 THR 548 20.101 19.254 -29.549 264 HG23 THR 548 HG22 THR 548 21.813 18.792 -29.546 265 H PHE 549 H PHE 549 22.860 17.519 -33.243 266 HA PHE 549 HA PHE 549 24.096 15.128 -32.098 267 HB2 PHE 549 HB2 PHE 549 25.257 17.091 -34.102 268 HB3 PHE 549 HB3 PHE 549 25.693 15.405 -33.881 269 HD1 PHE 549 HD1 PHE 549 23.207 13.928 -33.969 270 HD2 PHE 549 HD2 PHE 549 24.354 17.399 -36.242 271 HE1 PHE 549 HE1 PHE 549 21.617 13.272 -35.766 272 HE2 PHE 549 HE2 PHE 549 22.790 16.732 -38.049 273 HZ PHE 549 HZ PHE 549 21.415 14.672 -37.813 274 H GLU 550 H GLU 550 24.189 18.436 -31.266 275 HA GLU 550 HA GLU 550 26.690 18.208 -29.699 276 HB2 GLU 550 HB2 GLU 550 27.693 20.160 -30.731 277 HB3 GLU 550 HB3 GLU 550 27.429 18.904 -31.926 278 HG2 GLU 550 HG2 GLU 550 25.378 20.110 -32.724 279 HG3 GLU 550 HG3 GLU 550 25.706 21.392 -31.554 280 H ASP 551 H ASP 551 26.934 20.939 -29.025 281 HA ASP 551 HA ASP 551 24.346 21.526 -27.631 282 HB2 ASP 551 HB2 ASP 551 25.981 20.606 -26.095 283 HB3 ASP 551 HB3 ASP 551 27.157 21.835 -26.564 284 HA PRO 552 HA PRO 552 25.469 25.138 -30.332 285 HB2 PRO 552 HB2 PRO 552 23.124 25.456 -31.661 286 HB3 PRO 552 HB3 PRO 552 24.249 24.128 -32.054 287 HG2 PRO 552 HG2 PRO 552 21.807 24.012 -30.249 288 HG3 PRO 552 HG3 PRO 552 22.219 22.931 -31.622 289 HD2 PRO 552 HD2 PRO 552 22.822 22.313 -29.022 290 HD3 PRO 552 HD3 PRO 552 23.864 21.829 -30.389 291 H ARG 553 H ARG 553 23.984 27.236 -30.652 292 HA ARG 553 HA ARG 553 23.666 28.651 -28.283 293 HB2 ARG 553 HB2 ARG 553 22.505 30.317 -29.607 294 HB3 ARG 553 HB3 ARG 553 23.807 29.604 -30.552 295 HG2 ARG 553 HG2 ARG 553 21.961 28.048 -31.567 296 HG3 ARG 553 HG3 ARG 553 20.806 29.143 -30.807 297 HD2 ARG 553 HD2 ARG 553 21.064 29.845 -33.086 298 HD3 ARG 553 HD3 ARG 553 21.839 31.050 -32.064 299 HE ARG 553 HE ARG 553 23.894 30.540 -33.007 300 HH11 ARG 553 HH11 ARG 553 21.710 27.969 -33.975 301 HH12 ARG 553 HH12 ARG 553 22.892 27.249 -35.033 302 HH21 ARG 553 HH21 ARG 553 25.342 29.564 -34.369 303 HH22 ARG 553 HH22 ARG 553 24.887 28.134 -35.248 304 HA PRO 554 HA PRO 554 19.976 27.145 -26.368 305 HB2 PRO 554 HB2 PRO 554 19.214 29.240 -24.775 306 HB3 PRO 554 HB3 PRO 554 20.692 28.275 -24.482 307 HG2 PRO 554 HG2 PRO 554 20.466 30.932 -25.930 308 HG3 PRO 554 HG3 PRO 554 21.603 30.482 -24.618 309 HD2 PRO 554 HD2 PRO 554 22.325 30.375 -27.239 310 HD3 PRO 554 HD3 PRO 554 22.896 29.143 -26.074 311 H GLY 555 H GLY 555 17.645 27.532 -26.096 312 HA2 GLY 555 HA2 GLY 555 16.388 29.343 -28.135 313 HA3 GLY 555 HA3 GLY 555 15.883 27.667 -27.925 314 H ALA 556 H ALA 556 14.999 30.680 -27.246 315 HA ALA 556 HA ALA 556 13.993 31.886 -25.609 316 HB1 ALA 556 HB3 ALA 556 11.778 30.998 -25.095 317 HB2 ALA 556 HB1 ALA 556 12.221 30.674 -26.780 318 HB3 ALA 556 HB2 ALA 556 12.299 29.367 -25.577 319 HA PRO 557 HA PRO 557 15.975 29.761 -21.870 320 HB2 PRO 557 HB2 PRO 557 17.900 31.629 -21.294 321 HB3 PRO 557 HB3 PRO 557 18.138 30.279 -22.443 322 HG2 PRO 557 HG2 PRO 557 17.369 33.146 -23.069 323 HG3 PRO 557 HG3 PRO 557 18.635 32.144 -23.847 324 HD2 PRO 557 HD2 PRO 557 16.165 32.432 -24.946 325 HD3 PRO 557 HD3 PRO 557 17.041 30.875 -25.023 326 H ASN2319 H ASN2319 28.324 13.208 -32.752 327 HA ASN2319 HA ASN2319 29.926 14.182 -34.295 328 HB2 ASN2319 HB2 ASN2319 30.218 11.282 -35.212 329 HB3 ASN2319 HB3 ASN2319 30.783 12.673 -36.132 330 HD21 ASN2319 2HD2 ASN2319 32.604 13.983 -35.268 331 HD22 ASN2319 1HD2 ASN2319 33.611 13.291 -34.013 332 H THR2320 H THR2320 29.345 14.713 -36.512 333 HA THR2320 HA THR2320 26.446 14.766 -36.862 334 HB THR2320 HB THR2320 27.086 16.210 -38.837 335 HG1 THR2320 HG1 THR2320 29.248 16.791 -39.014 336 HG21 THR2320 HG23 THR2320 27.883 18.094 -37.522 337 HG22 THR2320 HG21 THR2320 26.705 17.181 -36.569 338 HG23 THR2320 HG22 THR2320 28.436 17.019 -36.223 339 H GLY2321 H GLY2321 25.469 14.452 -39.011 340 HA2 GLY2321 HA2 GLY2321 25.655 13.573 -41.281 341 HA3 GLY2321 HA3 GLY2321 26.664 12.264 -40.683 342 H ALA2322 H ALA2322 24.741 11.402 -42.182 343 HA ALA2322 HA ALA2322 22.269 10.709 -40.843 344 HB1 ALA2322 HB3 ALA2322 22.011 9.129 -42.711 345 HB2 ALA2322 HB1 ALA2322 22.455 10.747 -43.282 346 HB3 ALA2322 HB2 ALA2322 23.677 9.455 -43.237 347 H LYS2323 H LYS2323 22.366 9.686 -38.979 348 HA LYS2323 HA LYS2323 23.803 7.100 -38.639 349 HB2 LYS2323 HB2 LYS2323 24.960 9.394 -37.711 350 HB3 LYS2323 HB3 LYS2323 23.851 9.104 -36.387 351 HG2 LYS2323 HG2 LYS2323 25.713 7.983 -35.647 352 HG3 LYS2323 HG3 LYS2323 24.895 6.640 -36.450 353 HD2 LYS2323 HD2 LYS2323 26.308 7.076 -38.498 354 HD3 LYS2323 HD3 LYS2323 27.145 8.358 -37.596 355 HE2 LYS2323 HE2 LYS2323 27.799 6.659 -35.864 356 HE3 LYS2323 HE3 LYS2323 27.046 5.400 -36.849 357 HZ1 LYS2323 HZ3 LYS2323 29.427 5.526 -37.269 358 HZ2 LYS2323 HZ1 LYS2323 28.637 5.958 -38.627 359 HZ3 LYS2323 HZ2 LYS2323 29.339 7.096 -37.687 360 H GLN2324 H GLN2324 23.082 6.527 -36.029 361 HA GLN2324 HA GLN2324 20.355 5.780 -36.116 362 HB2 GLN2324 HB2 GLN2324 22.199 6.195 -33.734 363 HB3 GLN2324 HB3 GLN2324 20.544 5.597 -33.621 364 HG2 GLN2324 HG2 GLN2324 21.342 3.804 -35.402 365 HG3 GLN2324 HG3 GLN2324 22.957 4.263 -34.863 366 HE21 GLN2324 HE22 GLN2324 23.437 2.234 -33.807 367 HE22 GLN2324 HE21 GLN2324 22.481 1.663 -32.448 368 HA PRO2325 HA PRO2325 18.720 9.920 -35.417 369 HB2 PRO2325 HB2 PRO2325 16.039 9.435 -35.647 370 HB3 PRO2325 HB3 PRO2325 17.166 9.476 -37.035 371 HG2 PRO2325 HG2 PRO2325 16.124 7.047 -35.555 372 HG3 PRO2325 HG3 PRO2325 16.250 7.305 -37.323 373 HD2 PRO2325 HD2 PRO2325 18.127 5.920 -35.878 374 HD3 PRO2325 HD3 PRO2325 18.554 6.893 -37.318 375 HA PRO2326 HA PRO2326 17.789 9.298 -30.970 376 HB2 PRO2326 HB2 PRO2326 17.974 11.881 -30.121 377 HB3 PRO2326 HB3 PRO2326 19.405 10.884 -30.516 378 HG2 PRO2326 HG2 PRO2326 18.001 12.887 -32.308 379 HG3 PRO2326 HG3 PRO2326 19.748 12.772 -31.960 380 HD2 PRO2326 HD2 PRO2326 18.605 11.687 -34.185 381 HD3 PRO2326 HD3 PRO2326 19.968 10.875 -33.353 382 H SER2327 H SER2327 15.778 9.027 -30.232 383 HA SER2327 HA SER2327 13.609 10.992 -30.674 384 HB2 SER2327 HB2 SER2327 13.350 8.104 -31.622 385 HB3 SER2327 HB3 SER2327 12.066 9.323 -31.584 386 HG SER2327 HG SER2327 13.654 10.564 -32.990 387 H TYR2328 H TYR2328 13.798 11.253 -28.398 388 HA TYR2328 HA TYR2328 13.219 8.971 -26.622 389 HB2 TYR2328 HB2 TYR2328 14.832 10.795 -26.082 390 HB3 TYR2328 HB3 TYR2328 13.497 11.928 -26.012 391 HD1 TYR2328 HD1 TYR2328 14.955 8.858 -24.460 392 HD2 TYR2328 HD2 TYR2328 12.190 12.131 -23.989 393 HE1 TYR2328 HE1 TYR2328 14.696 8.297 -22.047 394 HE2 TYR2328 HE2 TYR2328 11.914 11.557 -21.584 395 HH TYR2328 HH TYR2328 13.680 8.838 -20.061 396 H GLU2329 H GLU2329 11.567 12.124 -26.235 397 HA GLU2329 HA GLU2329 9.003 10.918 -25.813 398 HB2 GLU2329 HB2 GLU2329 9.781 13.778 -26.454 399 HB3 GLU2329 HB3 GLU2329 8.114 13.246 -26.200 400 HG2 GLU2329 HG2 GLU2329 9.016 12.229 -23.955 401 HG3 GLU2329 HG3 GLU2329 10.370 13.337 -24.200 402 H ASP2330 H ASP2330 10.557 12.052 -28.779 403 HA ASP2330 HA ASP2330 8.196 11.955 -30.409 404 HB2 ASP2330 HB2 ASP2330 10.447 13.179 -30.791 405 HB3 ASP2330 HB3 ASP2330 11.039 11.638 -31.415 406 H CYS2331 H CYS2331 9.768 9.363 -28.989 407 HA CYS2331 HA CYS2331 8.639 7.446 -31.012 408 HB2 CYS2331 HB2 CYS2331 11.115 7.330 -30.701 409 HB3 CYS2331 HB3 CYS2331 10.859 6.965 -28.984 410 HG CYS2331 HG CYS2331 11.493 4.769 -30.282 411 H ILE2332 H ILE2332 9.007 8.123 -27.485 412 HA ILE2332 HA ILE2332 7.067 6.020 -26.841 413 HB ILE2332 HB ILE2332 7.565 6.424 -24.547 414 HG12 ILE2332 HG12 ILE2332 9.753 8.388 -24.872 415 HG13 ILE2332 HG13 ILE2332 8.163 9.070 -25.235 416 HG21 ILE2332 HG21 ILE2332 9.071 4.996 -25.863 417 HG22 ILE2332 HG22 ILE2332 10.136 6.383 -26.175 418 HG23 ILE2332 HG23 ILE2332 9.908 5.791 -24.520 419 HD11 ILE2332 3HD1 ILE2332 8.775 9.371 -22.874 420 HD12 ILE2332 1HD1 ILE2332 7.317 8.377 -23.047 421 HD13 ILE2332 2HD1 ILE2332 8.878 7.609 -22.664 422 H LYS2333 H LYS2333 6.213 8.603 -28.233 423 HA LYS2333 HA LYS2333 4.566 10.316 -26.914 424 HB2 LYS2333 HB2 LYS2333 3.982 8.786 -29.481 425 HB3 LYS2333 HB3 LYS2333 3.002 10.129 -28.941 426 HG2 LYS2333 HG2 LYS2333 5.946 10.255 -29.686 427 HG3 LYS2333 HG3 LYS2333 4.606 10.761 -30.689 428 HD2 LYS2333 HD2 LYS2333 5.409 12.104 -28.063 429 HD3 LYS2333 HD3 LYS2333 5.793 12.645 -29.687 430 HE2 LYS2333 HE2 LYS2333 4.007 13.990 -29.276 431 HE3 LYS2333 HE3 LYS2333 3.199 12.644 -30.083 432 HZ1 LYS2333 HZ3 LYS2333 2.033 13.323 -28.060 433 HZ2 LYS2333 HZ1 LYS2333 2.592 11.809 -27.841 434 HZ3 LYS2333 HZ2 LYS2333 3.350 13.076 -27.135 Start of MODEL 6 1 H VAL 515 H VAL 515 28.458 4.293 -16.684 2 HA VAL 515 HA VAL 515 27.727 6.569 -16.956 3 HB VAL 515 HB VAL 515 25.357 6.082 -16.529 4 HG11 VAL 515 HG11 VAL 515 25.503 4.835 -14.362 5 HG12 VAL 515 HG12 VAL 515 25.951 6.361 -13.555 6 HG13 VAL 515 HG13 VAL 515 24.377 6.191 -14.336 7 HG21 VAL 515 HG23 VAL 515 24.826 8.259 -15.560 8 HG22 VAL 515 HG21 VAL 515 26.486 8.426 -14.958 9 HG23 VAL 515 HG22 VAL 515 26.159 8.370 -16.711 10 H SER 516 H SER 516 27.957 4.957 -13.722 11 HA SER 516 HA SER 516 28.607 7.037 -12.213 12 HB2 SER 516 HB2 SER 516 29.740 4.237 -11.902 13 HB3 SER 516 HB3 SER 516 29.432 5.409 -10.587 14 HG SER 516 HG SER 516 27.769 3.661 -11.178 15 H LEU 517 H LEU 517 31.112 5.539 -14.216 16 HA LEU 517 HA LEU 517 33.016 7.610 -13.221 17 HB2 LEU 517 HB2 LEU 517 34.855 6.166 -13.304 18 HB3 LEU 517 HB3 LEU 517 33.655 5.429 -12.270 19 HG LEU 517 HG LEU 517 33.855 4.567 -15.182 20 HD11 LEU 517 1HD1 LEU 517 36.153 4.487 -14.336 21 HD12 LEU 517 2HD1 LEU 517 35.617 3.570 -12.910 22 HD13 LEU 517 3HD1 LEU 517 35.501 2.856 -14.536 23 HD21 LEU 517 3HD2 LEU 517 33.155 2.390 -14.270 24 HD22 LEU 517 1HD2 LEU 517 33.177 3.050 -12.621 25 HD23 LEU 517 2HD2 LEU 517 31.994 3.636 -13.808 26 H ILE 518 H ILE 518 31.161 7.340 -15.616 27 HA ILE 518 HA ILE 518 33.110 8.068 -17.749 28 HB ILE 518 HB ILE 518 30.573 6.516 -18.298 29 HG12 ILE 518 HG12 ILE 518 32.451 4.639 -18.832 30 HG13 ILE 518 HG13 ILE 518 33.264 5.425 -17.526 31 HG21 ILE 518 HG21 ILE 518 31.481 7.688 -20.266 32 HG22 ILE 518 HG22 ILE 518 33.083 6.978 -19.954 33 HG23 ILE 518 HG23 ILE 518 31.705 5.962 -20.441 34 HD11 ILE 518 3HD1 ILE 518 31.974 3.507 -16.733 35 HD12 ILE 518 1HD1 ILE 518 31.202 4.976 -16.092 36 HD13 ILE 518 2HD1 ILE 518 30.501 4.142 -17.501 37 H ASN 519 H ASN 519 30.816 9.280 -15.743 38 HA ASN 519 HA ASN 519 30.052 11.452 -17.581 39 HB2 ASN 519 HB2 ASN 519 28.418 9.200 -17.308 40 HB3 ASN 519 HB3 ASN 519 27.710 10.298 -16.136 41 HD21 ASN 519 2HD2 ASN 519 29.069 10.294 -19.446 42 HD22 ASN 519 1HD2 ASN 519 27.782 11.255 -20.163 43 H GLU 520 H GLU 520 31.800 11.577 -15.425 44 HA GLU 520 HA GLU 520 30.757 12.359 -12.927 45 HB2 GLU 520 HB2 GLU 520 33.274 13.379 -14.304 46 HB3 GLU 520 HB3 GLU 520 32.910 13.475 -12.577 47 HG2 GLU 520 HG2 GLU 520 32.811 10.963 -12.497 48 HG3 GLU 520 HG3 GLU 520 33.343 10.918 -14.182 49 H GLY 521 H GLY 521 30.153 14.254 -11.963 50 HA2 GLY 521 HA2 GLY 521 29.915 16.606 -11.753 51 HA3 GLY 521 HA3 GLY 521 30.042 16.808 -13.494 52 HA PRO 522 HA PRO 522 25.495 16.879 -12.161 53 HB2 PRO 522 HB2 PRO 522 24.918 19.527 -12.447 54 HB3 PRO 522 HB3 PRO 522 25.687 18.868 -10.971 55 HG2 PRO 522 HG2 PRO 522 27.047 20.193 -13.341 56 HG3 PRO 522 HG3 PRO 522 27.265 20.555 -11.598 57 HD2 PRO 522 HD2 PRO 522 28.958 18.905 -12.974 58 HD3 PRO 522 HD3 PRO 522 28.546 18.610 -11.259 59 H LEU 523 H LEU 523 23.625 17.349 -13.555 60 HA LEU 523 HA LEU 523 24.307 17.055 -16.397 61 HB2 LEU 523 HB2 LEU 523 22.284 16.046 -16.692 62 HB3 LEU 523 HB3 LEU 523 22.711 15.558 -15.091 63 HG LEU 523 HG LEU 523 21.079 17.986 -14.910 64 HD11 LEU 523 1HD1 LEU 523 20.270 17.279 -17.161 65 HD12 LEU 523 2HD1 LEU 523 19.834 15.697 -16.489 66 HD13 LEU 523 3HD1 LEU 523 19.017 17.170 -15.916 67 HD21 LEU 523 3HD2 LEU 523 19.600 16.549 -13.606 68 HD22 LEU 523 1HD2 LEU 523 20.472 15.103 -14.160 69 HD23 LEU 523 2HD2 LEU 523 21.287 16.300 -13.126 70 HA PRO 524 HA PRO 524 23.282 21.168 -17.654 71 HB2 PRO 524 HB2 PRO 524 22.202 20.843 -20.182 72 HB3 PRO 524 HB3 PRO 524 23.932 20.634 -19.781 73 HG2 PRO 524 HG2 PRO 524 21.796 18.499 -19.989 74 HG3 PRO 524 HG3 PRO 524 23.431 18.500 -20.723 75 HD2 PRO 524 HD2 PRO 524 22.884 17.195 -18.416 76 HD3 PRO 524 HD3 PRO 524 24.442 18.042 -18.633 77 HA PRO 525 HA PRO 525 19.272 22.198 -16.398 78 HB2 PRO 525 HB2 PRO 525 18.771 24.661 -17.494 79 HB3 PRO 525 HB3 PRO 525 20.045 24.359 -16.276 80 HG2 PRO 525 HG2 PRO 525 20.361 24.495 -19.294 81 HG3 PRO 525 HG3 PRO 525 21.331 25.331 -18.041 82 HD2 PRO 525 HD2 PRO 525 22.162 23.007 -19.168 83 HD3 PRO 525 HD3 PRO 525 22.435 23.335 -17.431 84 H GLY 526 H GLY 526 17.541 20.990 -16.968 85 HA2 GLY 526 HA2 GLY 526 15.601 20.363 -18.028 86 HA3 GLY 526 HA3 GLY 526 15.666 21.887 -18.917 87 H TRP 527 H TRP 527 18.201 19.462 -19.171 88 HA TRP 527 HA TRP 527 17.384 18.706 -21.965 89 HB2 TRP 527 HB2 TRP 527 20.024 19.548 -20.759 90 HB3 TRP 527 HB3 TRP 527 20.018 18.408 -22.093 91 HD1 TRP 527 HD1 TRP 527 19.698 22.059 -21.338 92 HE1 TRP 527 HE1 TRP 527 19.610 23.408 -23.515 93 HE3 TRP 527 HE3 TRP 527 19.193 18.200 -24.646 94 HZ2 TRP 527 HZ2 TRP 527 19.369 22.878 -26.346 95 HZ3 TRP 527 HZ3 TRP 527 19.034 18.646 -27.092 96 HH2 TRP 527 HH2 TRP 527 19.129 20.975 -27.948 97 H GLU 528 H GLU 528 18.081 16.638 -22.666 98 HA GLU 528 HA GLU 528 19.037 14.682 -20.631 99 HB2 GLU 528 HB2 GLU 528 16.747 14.149 -20.802 100 HB3 GLU 528 HB3 GLU 528 16.694 14.477 -22.517 101 HG2 GLU 528 HG2 GLU 528 16.426 12.162 -22.259 102 HG3 GLU 528 HG3 GLU 528 18.016 12.404 -22.965 103 H ILE 529 H ILE 529 20.325 13.005 -21.490 104 HA ILE 529 HA ILE 529 21.631 13.526 -24.113 105 HB ILE 529 HB ILE 529 23.338 13.153 -21.635 106 HG12 ILE 529 HG12 ILE 529 23.842 15.722 -22.015 107 HG13 ILE 529 HG13 ILE 529 22.203 15.762 -22.618 108 HG21 ILE 529 HG21 ILE 529 24.293 12.668 -23.859 109 HG22 ILE 529 HG22 ILE 529 23.864 14.310 -24.401 110 HG23 ILE 529 HG23 ILE 529 25.069 14.072 -23.111 111 HD11 ILE 529 3HD1 ILE 529 21.910 16.241 -20.344 112 HD12 ILE 529 1HD1 ILE 529 21.674 14.494 -20.299 113 HD13 ILE 529 2HD1 ILE 529 23.244 15.167 -19.845 114 H ARG 530 H ARG 530 21.938 11.643 -25.145 115 HA ARG 530 HA ARG 530 22.027 9.097 -23.558 116 HB2 ARG 530 HB2 ARG 530 20.282 9.517 -26.018 117 HB3 ARG 530 HB3 ARG 530 20.442 8.050 -25.055 118 HG2 ARG 530 HG2 ARG 530 19.695 9.930 -23.130 119 HG3 ARG 530 HG3 ARG 530 18.859 10.516 -24.553 120 HD2 ARG 530 HD2 ARG 530 17.230 9.073 -24.039 121 HD3 ARG 530 HD3 ARG 530 18.274 7.755 -24.546 122 HE ARG 530 HE ARG 530 17.736 8.737 -21.778 123 HH11 ARG 530 HH11 ARG 530 19.657 6.444 -23.641 124 HH12 ARG 530 HH12 ARG 530 20.187 5.614 -22.206 125 HH21 ARG 530 HH21 ARG 530 18.328 7.539 -20.054 126 HH22 ARG 530 HH22 ARG 530 19.417 6.190 -20.231 127 H TYR 531 H TYR 531 22.767 7.269 -24.690 128 HA TYR 531 HA TYR 531 24.965 7.878 -26.633 129 HB2 TYR 531 HB2 TYR 531 25.047 6.270 -24.044 130 HB3 TYR 531 HB3 TYR 531 26.340 6.340 -25.231 131 HD1 TYR 531 HD1 TYR 531 24.409 8.373 -22.748 132 HD2 TYR 531 HD2 TYR 531 27.920 8.129 -25.249 133 HE1 TYR 531 HE1 TYR 531 25.362 10.372 -21.608 134 HE2 TYR 531 HE2 TYR 531 28.896 10.084 -24.062 135 HH TYR 531 HH TYR 531 28.575 11.706 -22.478 136 H THR 532 H THR 532 24.238 6.869 -28.425 137 HA THR 532 HA THR 532 22.553 4.501 -28.371 138 HB THR 532 HB THR 532 22.772 4.496 -30.810 139 HG1 THR 532 HG1 THR 532 24.538 6.675 -30.421 140 HG21 THR 532 HG23 THR 532 21.812 6.707 -31.298 141 HG22 THR 532 HG21 THR 532 21.094 5.973 -29.854 142 HG23 THR 532 HG22 THR 532 22.283 7.276 -29.680 143 H ALA 533 H ALA 533 22.983 2.438 -29.309 144 HA ALA 533 HA ALA 533 25.401 1.181 -28.536 145 HB1 ALA 533 HB3 ALA 533 24.448 -0.770 -29.694 146 HB2 ALA 533 HB1 ALA 533 23.212 0.063 -28.737 147 HB3 ALA 533 HB2 ALA 533 23.257 0.269 -30.505 148 H ALA 534 H ALA 534 24.895 3.110 -31.333 149 HA ALA 534 HA ALA 534 26.938 1.897 -33.039 150 HB1 ALA 534 HB3 ALA 534 26.614 3.976 -34.360 151 HB2 ALA 534 HB1 ALA 534 25.085 3.164 -34.014 152 HB3 ALA 534 HB2 ALA 534 25.553 4.619 -33.091 153 H GLY 535 H GLY 535 27.133 3.693 -30.135 154 HA2 GLY 535 HA2 GLY 535 29.059 4.410 -29.033 155 HA3 GLY 535 HA3 GLY 535 30.008 4.254 -30.515 156 H GLU 536 H GLU 536 26.951 6.062 -30.277 157 HA GLU 536 HA GLU 536 28.411 8.653 -30.626 158 HB2 GLU 536 HB2 GLU 536 26.045 7.585 -32.206 159 HB3 GLU 536 HB3 GLU 536 26.569 9.261 -32.249 160 HG2 GLU 536 HG2 GLU 536 28.249 6.856 -33.090 161 HG3 GLU 536 HG3 GLU 536 27.360 7.914 -34.170 162 H ARG 537 H ARG 537 27.750 10.279 -29.487 163 HA ARG 537 HA ARG 537 25.484 10.027 -27.601 164 HB2 ARG 537 HB2 ARG 537 27.456 10.706 -26.544 165 HB3 ARG 537 HB3 ARG 537 27.907 11.824 -27.835 166 HG2 ARG 537 HG2 ARG 537 26.351 13.467 -27.161 167 HG3 ARG 537 HG3 ARG 537 25.441 12.335 -26.148 168 HD2 ARG 537 HD2 ARG 537 26.867 14.020 -24.915 169 HD3 ARG 537 HD3 ARG 537 26.995 12.341 -24.451 170 HE ARG 537 HE ARG 537 29.154 12.159 -25.464 171 HH11 ARG 537 HH11 ARG 537 28.056 15.464 -25.527 172 HH12 ARG 537 HH12 ARG 537 29.679 16.104 -25.610 173 HH21 ARG 537 HH21 ARG 537 31.189 13.014 -25.553 174 HH22 ARG 537 HH22 ARG 537 31.403 14.736 -25.638 175 H PHE 538 H PHE 538 23.777 11.315 -27.526 176 HA PHE 538 HA PHE 538 23.379 13.520 -29.493 177 HB2 PHE 538 HB2 PHE 538 21.413 11.256 -28.938 178 HB3 PHE 538 HB3 PHE 538 21.087 12.684 -29.909 179 HD1 PHE 538 HD2 PHE 538 22.921 9.470 -29.781 180 HD2 PHE 538 HD1 PHE 538 21.973 12.922 -32.166 181 HE1 PHE 538 HE2 PHE 538 23.766 8.302 -31.808 182 HE2 PHE 538 HE1 PHE 538 22.812 11.741 -34.202 183 HZ PHE 538 HZ PHE 538 23.717 9.437 -34.007 184 H PHE 539 H PHE 539 21.745 15.004 -28.865 185 HA PHE 539 HA PHE 539 21.107 15.039 -25.933 186 HB2 PHE 539 HB2 PHE 539 21.690 17.321 -27.844 187 HB3 PHE 539 HB3 PHE 539 21.155 17.502 -26.186 188 HD1 PHE 539 HD2 PHE 539 24.002 16.335 -28.304 189 HD2 PHE 539 HD1 PHE 539 22.667 17.442 -24.356 190 HE1 PHE 539 HE2 PHE 539 26.362 16.471 -27.547 191 HE2 PHE 539 HE1 PHE 539 25.028 17.589 -23.601 192 HZ PHE 539 HZ PHE 539 26.874 17.151 -25.196 193 H VAL 540 H VAL 540 19.138 15.800 -25.317 194 HA VAL 540 HA VAL 540 16.905 15.806 -27.317 195 HB VAL 540 HB VAL 540 17.138 14.337 -24.664 196 HG11 VAL 540 HG11 VAL 540 14.806 15.120 -25.119 197 HG12 VAL 540 HG12 VAL 540 14.848 14.254 -26.672 198 HG13 VAL 540 HG13 VAL 540 14.974 13.376 -25.122 199 HG21 VAL 540 HG23 VAL 540 16.974 12.255 -25.916 200 HG22 VAL 540 HG21 VAL 540 16.964 13.140 -27.452 201 HG23 VAL 540 HG22 VAL 540 18.406 13.154 -26.413 202 H ASP 541 H ASP 541 15.572 17.465 -27.093 203 HA ASP 541 HA ASP 541 15.564 19.078 -24.575 204 HB2 ASP 541 HB2 ASP 541 16.353 20.315 -26.505 205 HB3 ASP 541 HB3 ASP 541 14.947 19.825 -27.456 206 H HIS 542 H HIS 542 13.964 18.138 -23.349 207 HA HIS 542 HA HIS 542 11.446 17.191 -24.334 208 HB2 HIS 542 HB2 HIS 542 12.117 18.241 -21.562 209 HB3 HIS 542 HB3 HIS 542 10.763 17.197 -21.987 210 HD2 HIS 542 HD2 HIS 542 12.556 15.105 -23.830 211 HE1 HIS 542 HE1 HIS 542 14.442 14.248 -20.101 212 H ASN 543 H ASN 543 12.512 20.450 -23.859 213 HA ASN 543 HA ASN 543 9.954 21.644 -23.275 214 HB2 ASN 543 HB2 ASN 543 12.446 22.948 -24.446 215 HB3 ASN 543 HB3 ASN 543 11.114 23.754 -23.630 216 HD21 ASN 543 2HD2 ASN 543 14.123 22.130 -23.208 217 HD22 ASN 543 1HD2 ASN 543 14.095 22.060 -21.447 218 H THR 544 H THR 544 11.598 20.909 -26.336 219 HA THR 544 HA THR 544 9.116 21.711 -27.826 220 HB THR 544 HB THR 544 10.494 22.451 -29.689 221 HG1 THR 544 HG1 THR 544 12.697 21.992 -27.940 222 HG21 THR 544 HG23 THR 544 11.390 24.500 -28.779 223 HG22 THR 544 HG21 THR 544 9.850 24.115 -27.986 224 HG23 THR 544 HG22 THR 544 11.383 23.823 -27.135 225 H ARG 545 H ARG 545 10.721 19.076 -26.933 226 HA ARG 545 HA ARG 545 10.902 16.935 -27.553 227 HB2 ARG 545 HB2 ARG 545 8.471 17.580 -28.580 228 HB3 ARG 545 HB3 ARG 545 9.308 17.170 -30.076 229 HG2 ARG 545 HG2 ARG 545 10.010 14.978 -28.773 230 HG3 ARG 545 HG3 ARG 545 8.720 15.435 -27.653 231 HD2 ARG 545 HD2 ARG 545 8.475 14.911 -30.639 232 HD3 ARG 545 HD3 ARG 545 7.924 13.843 -29.338 233 HE ARG 545 HE ARG 545 6.583 16.257 -28.919 234 HH11 ARG 545 HH11 ARG 545 6.729 13.988 -31.631 235 HH12 ARG 545 HH12 ARG 545 5.078 14.333 -32.081 236 HH21 ARG 545 HH21 ARG 545 4.524 16.699 -29.660 237 HH22 ARG 545 HH22 ARG 545 3.891 15.831 -31.024 238 H ARG 546 H ARG 546 12.406 19.285 -29.117 239 HA ARG 546 HA ARG 546 13.436 17.968 -31.506 240 HB2 ARG 546 HB2 ARG 546 14.283 20.472 -29.988 241 HB3 ARG 546 HB3 ARG 546 15.053 19.927 -31.478 242 HG2 ARG 546 HG2 ARG 546 12.791 19.974 -32.613 243 HG3 ARG 546 HG3 ARG 546 12.146 20.783 -31.182 244 HD2 ARG 546 HD2 ARG 546 14.408 21.744 -32.976 245 HD3 ARG 546 HD3 ARG 546 12.765 22.402 -32.933 246 HE ARG 546 HE ARG 546 13.529 22.732 -30.344 247 HH11 ARG 546 HH11 ARG 546 15.111 23.696 -33.330 248 HH12 ARG 546 HH12 ARG 546 15.998 24.982 -32.564 249 HH21 ARG 546 HH21 ARG 546 14.721 24.371 -29.425 250 HH22 ARG 546 HH22 ARG 546 15.772 25.358 -30.405 251 H THR 547 H THR 547 15.775 17.830 -31.890 252 HA THR 547 HA THR 547 17.436 16.830 -29.661 253 HB THR 547 HB THR 547 18.027 14.808 -31.035 254 HG1 THR 547 HG1 THR 547 15.575 15.292 -32.365 255 HG21 THR 547 HG23 THR 547 16.117 13.434 -30.417 256 HG22 THR 547 HG21 THR 547 16.505 14.576 -29.124 257 HG23 THR 547 HG22 THR 547 15.103 14.868 -30.173 258 H THR 548 H THR 548 19.700 16.462 -30.330 259 HA THR 548 HA THR 548 20.615 17.499 -32.903 260 HB THR 548 HB THR 548 20.187 19.618 -31.903 261 HG1 THR 548 HG1 THR 548 22.174 20.491 -32.069 262 HG21 THR 548 HG23 THR 548 21.294 20.392 -29.832 263 HG22 THR 548 HG21 THR 548 20.133 19.099 -29.519 264 HG23 THR 548 HG22 THR 548 21.869 18.738 -29.542 265 H PHE 549 H PHE 549 22.933 17.497 -33.130 266 HA PHE 549 HA PHE 549 24.114 15.044 -32.008 267 HB2 PHE 549 HB2 PHE 549 25.323 16.958 -34.025 268 HB3 PHE 549 HB3 PHE 549 25.684 15.253 -33.806 269 HD1 PHE 549 HD2 PHE 549 22.901 14.085 -33.810 270 HD2 PHE 549 HD1 PHE 549 24.695 17.110 -36.289 271 HE1 PHE 549 HE2 PHE 549 21.304 13.529 -35.630 272 HE2 PHE 549 HE1 PHE 549 23.107 16.553 -38.114 273 HZ PHE 549 HZ PHE 549 21.405 14.767 -37.787 274 H GLU 550 H GLU 550 24.231 18.344 -31.190 275 HA GLU 550 HA GLU 550 26.792 18.104 -29.701 276 HB2 GLU 550 HB2 GLU 550 27.683 20.121 -30.647 277 HB3 GLU 550 HB3 GLU 550 27.319 18.999 -31.948 278 HG2 GLU 550 HG2 GLU 550 25.161 20.268 -32.360 279 HG3 GLU 550 HG3 GLU 550 25.686 21.447 -31.155 280 H ASP 551 H ASP 551 27.002 20.695 -28.753 281 HA ASP 551 HA ASP 551 24.482 21.059 -27.172 282 HB2 ASP 551 HB2 ASP 551 26.282 20.086 -25.867 283 HB3 ASP 551 HB3 ASP 551 27.358 21.419 -26.304 284 HA PRO 552 HA PRO 552 25.206 25.016 -29.521 285 HB2 PRO 552 HB2 PRO 552 22.775 25.308 -30.686 286 HB3 PRO 552 HB3 PRO 552 23.952 24.105 -31.285 287 HG2 PRO 552 HG2 PRO 552 21.646 23.634 -29.355 288 HG3 PRO 552 HG3 PRO 552 22.010 22.751 -30.875 289 HD2 PRO 552 HD2 PRO 552 22.846 21.855 -28.431 290 HD3 PRO 552 HD3 PRO 552 23.822 21.640 -29.913 291 H ARG 553 H ARG 553 23.562 27.011 -29.509 292 HA ARG 553 HA ARG 553 23.197 28.125 -27.000 293 HB2 ARG 553 HB2 ARG 553 21.713 29.743 -28.096 294 HB3 ARG 553 HB3 ARG 553 23.138 29.388 -29.050 295 HG2 ARG 553 HG2 ARG 553 21.695 29.229 -30.778 296 HG3 ARG 553 HG3 ARG 553 21.433 27.597 -30.202 297 HD2 ARG 553 HD2 ARG 553 19.302 28.479 -30.595 298 HD3 ARG 553 HD3 ARG 553 19.465 28.517 -28.834 299 HE ARG 553 HE ARG 553 20.356 31.019 -29.660 300 HH11 ARG 553 HH11 ARG 553 17.334 29.323 -30.185 301 HH12 ARG 553 HH12 ARG 553 16.441 30.803 -30.399 302 HH21 ARG 553 HH21 ARG 553 19.157 32.860 -29.951 303 HH22 ARG 553 HH22 ARG 553 17.449 32.749 -30.254 304 HA PRO 554 HA PRO 554 19.905 25.845 -25.170 305 HB2 PRO 554 HB2 PRO 554 19.159 27.452 -23.081 306 HB3 PRO 554 HB3 PRO 554 20.736 26.611 -23.159 307 HG2 PRO 554 HG2 PRO 554 20.123 29.484 -23.926 308 HG3 PRO 554 HG3 PRO 554 21.447 28.875 -22.881 309 HD2 PRO 554 HD2 PRO 554 21.844 29.428 -25.517 310 HD3 PRO 554 HD3 PRO 554 22.649 28.037 -24.728 311 H GLY 555 H GLY 555 19.182 29.143 -26.237 312 HA2 GLY 555 HA2 GLY 555 17.315 30.024 -27.274 313 HA3 GLY 555 HA3 GLY 555 16.588 28.425 -27.301 314 H ALA 556 H ALA 556 14.787 30.115 -26.974 315 HA ALA 556 HA ALA 556 13.863 29.896 -24.188 316 HB1 ALA 556 HB3 ALA 556 13.284 32.290 -24.042 317 HB2 ALA 556 HB1 ALA 556 15.032 32.058 -24.204 318 HB3 ALA 556 HB2 ALA 556 14.076 32.587 -25.606 319 HA PRO 557 HA PRO 557 10.800 29.173 -27.724 320 HB2 PRO 557 HB2 PRO 557 10.053 26.604 -27.136 321 HB3 PRO 557 HB3 PRO 557 11.492 27.023 -28.113 322 HG2 PRO 557 HG2 PRO 557 11.380 26.350 -25.158 323 HG3 PRO 557 HG3 PRO 557 12.508 25.714 -26.395 324 HD2 PRO 557 HD2 PRO 557 13.205 27.754 -24.748 325 HD3 PRO 557 HD3 PRO 557 13.739 27.699 -26.454 326 H ASN2319 H ASN2319 30.784 18.994 -41.467 327 HA ASN2319 HA ASN2319 31.253 17.852 -39.423 328 HB2 ASN2319 HB2 ASN2319 29.692 19.501 -38.113 329 HB3 ASN2319 HB3 ASN2319 28.387 18.399 -38.547 330 HD21 ASN2319 2HD2 ASN2319 28.471 16.140 -37.581 331 HD22 ASN2319 1HD2 ASN2319 29.514 15.895 -36.194 332 H THR2320 H THR2320 30.765 15.586 -39.295 333 HA THR2320 HA THR2320 29.241 14.404 -41.475 334 HB THR2320 HB THR2320 29.705 12.267 -40.238 335 HG1 THR2320 HG1 THR2320 31.249 12.478 -38.528 336 HG21 THR2320 HG23 THR2320 32.103 12.253 -40.661 337 HG22 THR2320 HG21 THR2320 31.281 13.155 -41.941 338 HG23 THR2320 HG22 THR2320 32.158 14.028 -40.667 339 H GLY2321 H GLY2321 27.563 12.689 -40.983 340 HA2 GLY2321 HA2 GLY2321 25.685 13.112 -38.789 341 HA3 GLY2321 HA3 GLY2321 25.186 13.871 -40.299 342 H ALA2322 H ALA2322 23.457 12.555 -40.738 343 HA ALA2322 HA ALA2322 22.215 10.742 -41.301 344 HB1 ALA2322 HB3 ALA2322 23.054 9.611 -43.295 345 HB2 ALA2322 HB1 ALA2322 23.428 11.343 -43.343 346 HB3 ALA2322 HB2 ALA2322 24.705 10.171 -42.946 347 H LYS2323 H LYS2323 22.820 10.193 -38.897 348 HA LYS2323 HA LYS2323 23.848 7.388 -38.680 349 HB2 LYS2323 HB2 LYS2323 24.846 9.731 -37.498 350 HB3 LYS2323 HB3 LYS2323 23.827 9.082 -36.243 351 HG2 LYS2323 HG2 LYS2323 25.740 7.929 -35.720 352 HG3 LYS2323 HG3 LYS2323 25.101 6.781 -36.888 353 HD2 LYS2323 HD2 LYS2323 27.375 7.088 -37.511 354 HD3 LYS2323 HD3 LYS2323 26.458 8.059 -38.678 355 HE2 LYS2323 HE2 LYS2323 26.861 10.069 -37.130 356 HE3 LYS2323 HE3 LYS2323 27.927 9.033 -36.178 357 HZ1 LYS2323 HZ3 LYS2323 29.177 10.320 -37.797 358 HZ2 LYS2323 HZ1 LYS2323 29.294 8.739 -38.185 359 HZ3 LYS2323 HZ2 LYS2323 28.300 9.719 -39.044 360 H GLN2324 H GLN2324 23.055 6.722 -36.168 361 HA GLN2324 HA GLN2324 20.352 5.944 -36.258 362 HB2 GLN2324 HB2 GLN2324 22.167 6.465 -33.871 363 HB3 GLN2324 HB3 GLN2324 20.553 5.787 -33.755 364 HG2 GLN2324 HG2 GLN2324 21.736 4.151 -35.694 365 HG3 GLN2324 HG3 GLN2324 23.082 4.522 -34.625 366 HE21 GLN2324 HE22 GLN2324 23.308 2.720 -33.245 367 HE22 GLN2324 HE21 GLN2324 21.942 1.923 -32.474 368 HA PRO2325 HA PRO2325 18.604 10.057 -35.578 369 HB2 PRO2325 HB2 PRO2325 15.937 9.494 -35.803 370 HB3 PRO2325 HB3 PRO2325 17.057 9.589 -37.195 371 HG2 PRO2325 HG2 PRO2325 16.093 7.110 -35.746 372 HG3 PRO2325 HG3 PRO2325 16.211 7.394 -37.510 373 HD2 PRO2325 HD2 PRO2325 18.127 6.046 -36.079 374 HD3 PRO2325 HD3 PRO2325 18.528 7.046 -37.508 375 HA PRO2326 HA PRO2326 17.773 9.311 -31.131 376 HB2 PRO2326 HB2 PRO2326 17.927 11.877 -30.222 377 HB3 PRO2326 HB3 PRO2326 19.366 10.911 -30.664 378 HG2 PRO2326 HG2 PRO2326 17.893 12.918 -32.396 379 HG3 PRO2326 HG3 PRO2326 19.646 12.848 -32.067 380 HD2 PRO2326 HD2 PRO2326 18.523 11.782 -34.301 381 HD3 PRO2326 HD3 PRO2326 19.894 10.967 -33.486 382 H SER2327 H SER2327 15.797 9.017 -30.323 383 HA SER2327 HA SER2327 13.596 10.963 -30.652 384 HB2 SER2327 HB2 SER2327 13.344 8.097 -31.670 385 HB3 SER2327 HB3 SER2327 12.029 9.273 -31.512 386 HG SER2327 HG SER2327 13.739 10.557 -32.918 387 H TYR2328 H TYR2328 13.842 11.193 -28.399 388 HA TYR2328 HA TYR2328 13.359 8.877 -26.632 389 HB2 TYR2328 HB2 TYR2328 14.981 10.652 -26.081 390 HB3 TYR2328 HB3 TYR2328 13.685 11.835 -26.058 391 HD1 TYR2328 HD1 TYR2328 14.831 8.633 -24.452 392 HD2 TYR2328 HD2 TYR2328 12.553 12.267 -24.005 393 HE1 TYR2328 HE1 TYR2328 14.534 8.150 -22.027 394 HE2 TYR2328 HE2 TYR2328 12.224 11.763 -21.586 395 HH TYR2328 HH TYR2328 13.626 8.856 -20.036 396 H GLU2329 H GLU2329 11.701 12.019 -26.203 397 HA GLU2329 HA GLU2329 9.147 10.856 -25.657 398 HB2 GLU2329 HB2 GLU2329 9.974 13.659 -26.451 399 HB3 GLU2329 HB3 GLU2329 8.289 13.193 -26.189 400 HG2 GLU2329 HG2 GLU2329 8.986 12.329 -23.885 401 HG3 GLU2329 HG3 GLU2329 10.530 13.156 -24.148 402 H ASP2330 H ASP2330 10.552 11.972 -28.727 403 HA ASP2330 HA ASP2330 8.102 11.784 -30.207 404 HB2 ASP2330 HB2 ASP2330 10.269 13.109 -30.731 405 HB3 ASP2330 HB3 ASP2330 10.877 11.591 -31.413 406 H CYS2331 H CYS2331 9.943 9.265 -28.946 407 HA CYS2331 HA CYS2331 8.784 7.303 -30.895 408 HB2 CYS2331 HB2 CYS2331 11.256 7.217 -30.528 409 HB3 CYS2331 HB3 CYS2331 10.960 6.864 -28.810 410 HG CYS2331 HG CYS2331 9.460 4.706 -29.288 411 H ILE2332 H ILE2332 9.006 8.116 -27.367 412 HA ILE2332 HA ILE2332 7.234 5.899 -26.718 413 HB ILE2332 HB ILE2332 7.359 6.578 -24.436 414 HG12 ILE2332 HG12 ILE2332 9.310 8.788 -25.002 415 HG13 ILE2332 HG13 ILE2332 7.593 9.159 -25.051 416 HG21 ILE2332 HG21 ILE2332 9.136 5.181 -25.434 417 HG22 ILE2332 HG22 ILE2332 10.100 6.629 -25.772 418 HG23 ILE2332 HG23 ILE2332 9.751 6.165 -24.101 419 HD11 ILE2332 3HD1 ILE2332 8.554 9.625 -22.840 420 HD12 ILE2332 1HD1 ILE2332 7.311 8.358 -22.754 421 HD13 ILE2332 2HD1 ILE2332 9.039 7.924 -22.675 422 H LYS2333 H LYS2333 6.557 9.210 -27.565 423 HA LYS2333 HA LYS2333 3.829 9.295 -26.503 424 HB2 LYS2333 HB2 LYS2333 5.348 10.830 -28.658 425 HB3 LYS2333 HB3 LYS2333 3.605 10.963 -28.516 426 HG2 LYS2333 HG2 LYS2333 3.760 11.670 -26.193 427 HG3 LYS2333 HG3 LYS2333 5.512 11.538 -26.225 428 HD2 LYS2333 HD2 LYS2333 5.765 13.395 -27.690 429 HD3 LYS2333 HD3 LYS2333 4.083 13.285 -28.240 430 HE2 LYS2333 HE2 LYS2333 4.247 15.224 -26.844 431 HE3 LYS2333 HE3 LYS2333 3.247 14.007 -26.037 432 HZ1 LYS2333 HZ3 LYS2333 4.806 15.012 -24.489 433 HZ2 LYS2333 HZ1 LYS2333 5.202 13.449 -24.656 434 HZ3 LYS2333 HZ2 LYS2333 6.099 14.603 -25.373 Start of MODEL 7 1 H VAL 515 H VAL 515 28.697 6.331 -19.770 2 HA VAL 515 HA VAL 515 27.659 8.374 -19.003 3 HB VAL 515 HB VAL 515 26.155 6.581 -17.063 4 HG11 VAL 515 HG11 VAL 515 26.787 8.736 -15.986 5 HG12 VAL 515 HG12 VAL 515 26.089 9.622 -17.368 6 HG13 VAL 515 HG13 VAL 515 25.055 8.649 -16.305 7 HG21 VAL 515 HG23 VAL 515 24.136 7.541 -18.174 8 HG22 VAL 515 HG21 VAL 515 25.177 8.330 -19.376 9 HG23 VAL 515 HG22 VAL 515 25.081 6.551 -19.278 10 H SER 516 H SER 516 28.416 5.812 -16.547 11 HA SER 516 HA SER 516 29.139 7.337 -14.555 12 HB2 SER 516 HB2 SER 516 30.603 4.758 -15.198 13 HB3 SER 516 HB3 SER 516 30.249 5.439 -13.592 14 HG SER 516 HG SER 516 28.714 3.821 -14.219 15 H LEU 517 H LEU 517 31.493 6.843 -17.140 16 HA LEU 517 HA LEU 517 33.322 8.714 -15.724 17 HB2 LEU 517 HB2 LEU 517 35.263 7.523 -16.295 18 HB3 LEU 517 HB3 LEU 517 34.219 6.438 -15.407 19 HG LEU 517 HG LEU 517 34.232 6.359 -18.454 20 HD11 LEU 517 1HD1 LEU 517 36.592 6.279 -17.800 21 HD12 LEU 517 2HD1 LEU 517 36.244 4.987 -16.624 22 HD13 LEU 517 3HD1 LEU 517 36.044 4.695 -18.372 23 HD21 LEU 517 3HD2 LEU 517 33.771 3.965 -18.088 24 HD22 LEU 517 1HD2 LEU 517 33.865 4.199 -16.328 25 HD23 LEU 517 2HD2 LEU 517 32.559 4.951 -17.268 26 H ILE 518 H ILE 518 31.317 8.901 -17.990 27 HA ILE 518 HA ILE 518 33.083 10.220 -20.018 28 HB ILE 518 HB ILE 518 30.486 8.764 -20.631 29 HG12 ILE 518 HG12 ILE 518 32.363 7.287 -21.960 30 HG13 ILE 518 HG13 ILE 518 33.317 7.737 -20.567 31 HG21 ILE 518 HG21 ILE 518 30.986 10.516 -22.266 32 HG22 ILE 518 HG22 ILE 518 32.644 9.902 -22.456 33 HG23 ILE 518 HG23 ILE 518 31.248 8.943 -22.987 34 HD11 ILE 518 3HD1 ILE 518 30.656 6.252 -20.607 35 HD12 ILE 518 1HD1 ILE 518 32.239 5.578 -20.218 36 HD13 ILE 518 2HD1 ILE 518 31.479 6.724 -19.113 37 H ASN 519 H ASN 519 30.343 10.480 -17.912 38 HA ASN 519 HA ASN 519 29.754 13.229 -18.892 39 HB2 ASN 519 HB2 ASN 519 28.129 11.379 -19.626 40 HB3 ASN 519 HB3 ASN 519 27.691 11.220 -17.925 41 HD21 ASN 519 2HD2 ASN 519 25.558 11.738 -19.157 42 HD22 ASN 519 1HD2 ASN 519 25.148 13.442 -19.245 43 H GLU 520 H GLU 520 31.589 12.880 -16.931 44 HA GLU 520 HA GLU 520 30.668 12.865 -14.221 45 HB2 GLU 520 HB2 GLU 520 33.114 14.196 -15.461 46 HB3 GLU 520 HB3 GLU 520 32.849 13.945 -13.734 47 HG2 GLU 520 HG2 GLU 520 32.767 11.477 -14.122 48 HG3 GLU 520 HG3 GLU 520 33.145 11.745 -15.825 49 H GLY 521 H GLY 521 30.399 14.561 -12.704 50 HA2 GLY 521 HA2 GLY 521 30.025 16.757 -11.952 51 HA3 GLY 521 HA3 GLY 521 30.118 17.361 -13.600 52 HA PRO 522 HA PRO 522 25.616 17.220 -12.193 53 HB2 PRO 522 HB2 PRO 522 25.025 19.883 -12.355 54 HB3 PRO 522 HB3 PRO 522 25.811 19.148 -10.923 55 HG2 PRO 522 HG2 PRO 522 27.141 20.598 -13.234 56 HG3 PRO 522 HG3 PRO 522 27.389 20.856 -11.477 57 HD2 PRO 522 HD2 PRO 522 29.057 19.295 -12.969 58 HD3 PRO 522 HD3 PRO 522 28.663 18.882 -11.274 59 H LEU 523 H LEU 523 23.742 17.503 -13.532 60 HA LEU 523 HA LEU 523 24.373 17.339 -16.366 61 HB2 LEU 523 HB2 LEU 523 22.347 16.312 -16.654 62 HB3 LEU 523 HB3 LEU 523 22.826 15.801 -15.075 63 HG LEU 523 HG LEU 523 21.146 18.196 -14.823 64 HD11 LEU 523 1HD1 LEU 523 20.283 17.479 -17.047 65 HD12 LEU 523 2HD1 LEU 523 19.917 15.879 -16.374 66 HD13 LEU 523 3HD1 LEU 523 19.075 17.323 -15.764 67 HD21 LEU 523 3HD2 LEU 523 19.748 16.714 -13.477 68 HD22 LEU 523 1HD2 LEU 523 20.641 15.294 -14.067 69 HD23 LEU 523 2HD2 LEU 523 21.456 16.508 -13.053 70 HA PRO 524 HA PRO 524 23.274 21.418 -17.671 71 HB2 PRO 524 HB2 PRO 524 22.155 21.012 -20.178 72 HB3 PRO 524 HB3 PRO 524 23.897 20.878 -19.801 73 HG2 PRO 524 HG2 PRO 524 21.850 18.642 -19.935 74 HG3 PRO 524 HG3 PRO 524 23.473 18.707 -20.692 75 HD2 PRO 524 HD2 PRO 524 23.038 17.429 -18.349 76 HD3 PRO 524 HD3 PRO 524 24.536 18.367 -18.601 77 HA PRO 525 HA PRO 525 19.239 22.347 -16.380 78 HB2 PRO 525 HB2 PRO 525 18.703 24.816 -17.444 79 HB3 PRO 525 HB3 PRO 525 19.973 24.520 -16.221 80 HG2 PRO 525 HG2 PRO 525 20.307 24.709 -19.233 81 HG3 PRO 525 HG3 PRO 525 21.258 25.536 -17.960 82 HD2 PRO 525 HD2 PRO 525 22.123 23.241 -19.129 83 HD3 PRO 525 HD3 PRO 525 22.394 23.550 -17.388 84 H GLY 526 H GLY 526 17.525 21.128 -16.981 85 HA2 GLY 526 HA2 GLY 526 15.607 20.489 -18.076 86 HA3 GLY 526 HA3 GLY 526 15.686 22.000 -18.984 87 H TRP 527 H TRP 527 18.247 19.590 -19.138 88 HA TRP 527 HA TRP 527 17.486 18.781 -21.927 89 HB2 TRP 527 HB2 TRP 527 20.091 19.744 -20.751 90 HB3 TRP 527 HB3 TRP 527 20.119 18.600 -22.075 91 HD1 TRP 527 HD1 TRP 527 19.685 22.236 -21.349 92 HE1 TRP 527 HE1 TRP 527 19.511 23.562 -23.535 93 HE3 TRP 527 HE3 TRP 527 19.185 18.334 -24.613 94 HZ2 TRP 527 HZ2 TRP 527 19.240 22.998 -26.357 95 HZ3 TRP 527 HZ3 TRP 527 18.984 18.755 -27.058 96 HH2 TRP 527 HH2 TRP 527 19.026 21.075 -27.939 97 H GLU 528 H GLU 528 18.366 16.792 -22.625 98 HA GLU 528 HA GLU 528 19.075 14.733 -20.580 99 HB2 GLU 528 HB2 GLU 528 16.746 14.532 -20.892 100 HB3 GLU 528 HB3 GLU 528 16.828 14.834 -22.606 101 HG2 GLU 528 HG2 GLU 528 16.266 12.552 -22.313 102 HG3 GLU 528 HG3 GLU 528 17.905 12.599 -22.940 103 H ILE 529 H ILE 529 20.338 12.980 -21.446 104 HA ILE 529 HA ILE 529 21.723 13.519 -24.017 105 HB ILE 529 HB ILE 529 23.380 12.988 -21.532 106 HG12 ILE 529 HG12 ILE 529 24.074 15.497 -21.803 107 HG13 ILE 529 HG13 ILE 529 22.458 15.720 -22.461 108 HG21 ILE 529 HG21 ILE 529 24.306 12.547 -23.798 109 HG22 ILE 529 HG22 ILE 529 23.995 14.245 -24.232 110 HG23 ILE 529 HG23 ILE 529 25.173 13.838 -22.967 111 HD11 ILE 529 3HD1 ILE 529 22.601 16.220 -20.056 112 HD12 ILE 529 1HD1 ILE 529 21.513 14.862 -20.287 113 HD13 ILE 529 2HD1 ILE 529 23.167 14.580 -19.708 114 H ARG 530 H ARG 530 21.940 11.707 -25.097 115 HA ARG 530 HA ARG 530 21.760 9.061 -23.681 116 HB2 ARG 530 HB2 ARG 530 20.170 10.056 -26.080 117 HB3 ARG 530 HB3 ARG 530 20.159 8.387 -25.526 118 HG2 ARG 530 HG2 ARG 530 19.426 10.538 -23.520 119 HG3 ARG 530 HG3 ARG 530 18.301 10.197 -24.806 120 HD2 ARG 530 HD2 ARG 530 17.841 8.985 -22.675 121 HD3 ARG 530 HD3 ARG 530 17.934 7.986 -24.117 122 HE ARG 530 HE ARG 530 19.782 6.887 -23.307 123 HH11 ARG 530 HH11 ARG 530 19.347 9.635 -21.072 124 HH12 ARG 530 HH12 ARG 530 20.161 8.761 -19.816 125 HH21 ARG 530 HH21 ARG 530 20.867 5.964 -21.636 126 HH22 ARG 530 HH22 ARG 530 21.028 6.812 -20.129 127 H TYR 531 H TYR 531 22.712 7.354 -24.644 128 HA TYR 531 HA TYR 531 24.818 7.944 -26.698 129 HB2 TYR 531 HB2 TYR 531 24.998 6.411 -24.073 130 HB3 TYR 531 HB3 TYR 531 26.231 6.397 -25.324 131 HD1 TYR 531 HD2 TYR 531 24.424 8.689 -22.945 132 HD2 TYR 531 HD1 TYR 531 27.932 8.026 -25.375 133 HE1 TYR 531 HE2 TYR 531 25.496 10.691 -21.941 134 HE2 TYR 531 HE1 TYR 531 29.023 10.006 -24.324 135 HH TYR 531 HH TYR 531 27.344 12.034 -21.894 136 H THR 532 H THR 532 24.159 6.909 -28.452 137 HA THR 532 HA THR 532 22.399 4.590 -28.403 138 HB THR 532 HB THR 532 22.618 4.593 -30.817 139 HG1 THR 532 HG1 THR 532 24.481 6.682 -30.530 140 HG21 THR 532 HG23 THR 532 21.762 6.807 -31.360 141 HG22 THR 532 HG21 THR 532 21.050 6.197 -29.848 142 HG23 THR 532 HG22 THR 532 22.330 7.430 -29.788 143 H ALA 533 H ALA 533 22.791 2.490 -29.261 144 HA ALA 533 HA ALA 533 25.182 1.202 -28.443 145 HB1 ALA 533 HB3 ALA 533 24.173 -0.763 -29.525 146 HB2 ALA 533 HB1 ALA 533 22.959 0.141 -28.607 147 HB3 ALA 533 HB2 ALA 533 23.014 0.276 -30.382 148 H ALA 534 H ALA 534 24.733 3.056 -31.288 149 HA ALA 534 HA ALA 534 26.768 1.714 -32.929 150 HB1 ALA 534 HB3 ALA 534 26.397 3.646 -34.426 151 HB2 ALA 534 HB1 ALA 534 24.878 2.861 -33.985 152 HB3 ALA 534 HB2 ALA 534 25.347 4.403 -33.208 153 H GLY 535 H GLY 535 26.971 3.616 -30.139 154 HA2 GLY 535 HA2 GLY 535 28.923 4.296 -29.076 155 HA3 GLY 535 HA3 GLY 535 29.839 4.138 -30.577 156 H GLU 536 H GLU 536 26.833 6.033 -30.247 157 HA GLU 536 HA GLU 536 28.377 8.583 -30.593 158 HB2 GLU 536 HB2 GLU 536 25.883 7.717 -32.096 159 HB3 GLU 536 HB3 GLU 536 26.649 9.290 -32.229 160 HG2 GLU 536 HG2 GLU 536 27.969 6.647 -33.015 161 HG3 GLU 536 HG3 GLU 536 27.060 7.685 -34.087 162 H ARG 537 H ARG 537 27.716 10.261 -29.454 163 HA ARG 537 HA ARG 537 25.405 9.993 -27.616 164 HB2 ARG 537 HB2 ARG 537 27.575 10.612 -26.692 165 HB3 ARG 537 HB3 ARG 537 27.698 12.010 -27.751 166 HG2 ARG 537 HG2 ARG 537 25.288 11.772 -25.936 167 HG3 ARG 537 HG3 ARG 537 26.830 12.176 -25.210 168 HD2 ARG 537 HD2 ARG 537 25.964 13.788 -27.613 169 HD3 ARG 537 HD3 ARG 537 25.172 14.069 -26.077 170 HE ARG 537 HE ARG 537 27.291 14.609 -25.052 171 HH11 ARG 537 HH11 ARG 537 27.405 14.699 -28.575 172 HH12 ARG 537 HH12 ARG 537 28.870 15.631 -28.565 173 HH21 ARG 537 HH21 ARG 537 29.109 15.825 -25.145 174 HH22 ARG 537 HH22 ARG 537 29.781 16.288 -26.677 175 H PHE 538 H PHE 538 23.689 11.309 -27.580 176 HA PHE 538 HA PHE 538 23.530 13.676 -29.381 177 HB2 PHE 538 HB2 PHE 538 21.379 11.544 -29.087 178 HB3 PHE 538 HB3 PHE 538 21.203 13.062 -29.952 179 HD1 PHE 538 HD2 PHE 538 22.735 9.701 -30.025 180 HD2 PHE 538 HD1 PHE 538 22.215 13.405 -32.166 181 HE1 PHE 538 HE2 PHE 538 23.524 8.605 -32.111 182 HE2 PHE 538 HE1 PHE 538 22.978 12.300 -34.258 183 HZ PHE 538 HZ PHE 538 23.645 9.905 -34.226 184 H PHE 539 H PHE 539 21.881 15.163 -28.748 185 HA PHE 539 HA PHE 539 21.201 15.145 -25.836 186 HB2 PHE 539 HB2 PHE 539 21.607 17.455 -27.766 187 HB3 PHE 539 HB3 PHE 539 21.067 17.604 -26.106 188 HD1 PHE 539 HD2 PHE 539 22.567 17.285 -24.210 189 HD2 PHE 539 HD1 PHE 539 23.975 17.033 -28.275 190 HE1 PHE 539 HE2 PHE 539 24.903 17.607 -23.420 191 HE2 PHE 539 HE1 PHE 539 26.303 17.387 -27.491 192 HZ PHE 539 HZ PHE 539 26.771 17.678 -25.063 193 H VAL 540 H VAL 540 19.191 15.832 -25.235 194 HA VAL 540 HA VAL 540 16.988 15.846 -27.264 195 HB VAL 540 HB VAL 540 17.210 14.298 -24.660 196 HG11 VAL 540 HG11 VAL 540 14.880 15.121 -25.042 197 HG12 VAL 540 HG12 VAL 540 14.884 14.308 -26.625 198 HG13 VAL 540 HG13 VAL 540 15.030 13.375 -25.110 199 HG21 VAL 540 HG23 VAL 540 16.983 12.269 -26.012 200 HG22 VAL 540 HG21 VAL 540 17.031 13.237 -27.500 201 HG23 VAL 540 HG22 VAL 540 18.445 13.159 -26.426 202 H ASP 541 H ASP 541 15.699 17.527 -27.065 203 HA ASP 541 HA ASP 541 15.688 19.158 -24.568 204 HB2 ASP 541 HB2 ASP 541 16.322 20.391 -26.552 205 HB3 ASP 541 HB3 ASP 541 14.911 19.802 -27.437 206 H HIS 542 H HIS 542 14.166 18.308 -23.230 207 HA HIS 542 HA HIS 542 11.655 17.175 -24.059 208 HB2 HIS 542 HB2 HIS 542 12.461 18.395 -21.391 209 HB3 HIS 542 HB3 HIS 542 11.062 17.365 -21.674 210 HD2 HIS 542 HD2 HIS 542 12.817 15.196 -23.552 211 HE1 HIS 542 HE1 HIS 542 14.563 14.305 -19.769 212 H ASN 543 H ASN 543 12.598 20.505 -23.829 213 HA ASN 543 HA ASN 543 10.015 21.589 -23.122 214 HB2 ASN 543 HB2 ASN 543 12.415 22.980 -24.383 215 HB3 ASN 543 HB3 ASN 543 11.077 23.746 -23.539 216 HD21 ASN 543 2HD2 ASN 543 14.136 22.175 -23.181 217 HD22 ASN 543 1HD2 ASN 543 14.165 22.154 -21.420 218 H THR 544 H THR 544 11.630 21.060 -26.253 219 HA THR 544 HA THR 544 9.061 21.717 -27.665 220 HB THR 544 HB THR 544 10.337 22.579 -29.524 221 HG1 THR 544 HG1 THR 544 12.618 22.051 -27.901 222 HG21 THR 544 HG23 THR 544 11.203 24.625 -28.613 223 HG22 THR 544 HG21 THR 544 9.763 24.165 -27.690 224 HG23 THR 544 HG22 THR 544 11.381 23.908 -26.997 225 H ARG 545 H ARG 545 10.752 19.144 -26.815 226 HA ARG 545 HA ARG 545 10.969 17.009 -27.424 227 HB2 ARG 545 HB2 ARG 545 8.496 17.623 -28.372 228 HB3 ARG 545 HB3 ARG 545 9.276 17.158 -29.885 229 HG2 ARG 545 HG2 ARG 545 10.018 15.008 -28.598 230 HG3 ARG 545 HG3 ARG 545 8.879 15.523 -27.350 231 HD2 ARG 545 HD2 ARG 545 8.280 14.836 -30.254 232 HD3 ARG 545 HD3 ARG 545 7.831 13.887 -28.846 233 HE ARG 545 HE ARG 545 6.511 16.288 -29.904 234 HH11 ARG 545 HH11 ARG 545 6.681 14.258 -27.045 235 HH12 ARG 545 HH12 ARG 545 5.116 14.781 -26.488 236 HH21 ARG 545 HH21 ARG 545 4.539 16.895 -29.130 237 HH22 ARG 545 HH22 ARG 545 3.943 16.230 -27.639 238 H ARG 546 H ARG 546 12.418 19.323 -29.054 239 HA ARG 546 HA ARG 546 13.412 17.945 -31.436 240 HB2 ARG 546 HB2 ARG 546 14.205 20.535 -30.034 241 HB3 ARG 546 HB3 ARG 546 14.981 19.949 -31.508 242 HG2 ARG 546 HG2 ARG 546 12.761 19.896 -32.658 243 HG3 ARG 546 HG3 ARG 546 12.025 20.644 -31.234 244 HD2 ARG 546 HD2 ARG 546 14.295 21.831 -32.883 245 HD3 ARG 546 HD3 ARG 546 12.584 22.266 -33.047 246 HE ARG 546 HE ARG 546 13.067 22.667 -30.368 247 HH11 ARG 546 HH11 ARG 546 14.586 23.994 -33.243 248 HH12 ARG 546 HH12 ARG 546 15.049 25.461 -32.428 249 HH21 ARG 546 HH21 ARG 546 13.689 24.515 -29.402 250 HH22 ARG 546 HH22 ARG 546 14.530 25.759 -30.291 251 H THR 547 H THR 547 15.756 17.803 -31.858 252 HA THR 547 HA THR 547 17.435 16.849 -29.608 253 HB THR 547 HB THR 547 17.918 14.750 -30.872 254 HG1 THR 547 HG1 THR 547 16.223 14.161 -32.401 255 HG21 THR 547 HG23 THR 547 16.009 13.490 -30.174 256 HG22 THR 547 HG21 THR 547 16.215 14.794 -29.006 257 HG23 THR 547 HG22 THR 547 14.946 14.909 -30.238 258 H THR 548 H THR 548 19.681 16.437 -30.259 259 HA THR 548 HA THR 548 20.621 17.267 -32.891 260 HB THR 548 HB THR 548 20.261 19.480 -32.017 261 HG1 THR 548 HG1 THR 548 22.055 20.025 -32.846 262 HG21 THR 548 HG23 THR 548 21.488 20.344 -30.048 263 HG22 THR 548 HG21 THR 548 20.271 19.139 -29.605 264 HG23 THR 548 HG22 THR 548 21.987 18.688 -29.650 265 H PHE 549 H PHE 549 22.964 17.075 -33.122 266 HA PHE 549 HA PHE 549 24.105 14.862 -31.523 267 HB2 PHE 549 HB2 PHE 549 24.183 14.847 -33.984 268 HB3 PHE 549 HB3 PHE 549 25.058 16.372 -33.987 269 HD1 PHE 549 HD2 PHE 549 25.302 12.837 -32.706 270 HD2 PHE 549 HD1 PHE 549 27.431 16.357 -33.997 271 HE1 PHE 549 HE2 PHE 549 27.433 11.579 -32.612 272 HE2 PHE 549 HE1 PHE 549 29.574 15.096 -33.865 273 HZ PHE 549 HZ PHE 549 29.572 12.701 -33.194 274 H GLU 550 H GLU 550 24.298 18.329 -31.555 275 HA GLU 550 HA GLU 550 26.857 18.325 -29.997 276 HB2 GLU 550 HB2 GLU 550 27.658 20.187 -31.259 277 HB3 GLU 550 HB3 GLU 550 27.252 18.884 -32.364 278 HG2 GLU 550 HG2 GLU 550 25.098 20.037 -32.916 279 HG3 GLU 550 HG3 GLU 550 25.546 21.357 -31.833 280 H ASP 551 H ASP 551 27.124 20.959 -29.405 281 HA ASP 551 HA ASP 551 24.722 21.560 -27.720 282 HB2 ASP 551 HB2 ASP 551 26.593 20.709 -26.432 283 HB3 ASP 551 HB3 ASP 551 27.653 21.956 -27.090 284 HA PRO 552 HA PRO 552 25.303 25.215 -30.549 285 HB2 PRO 552 HB2 PRO 552 22.760 25.463 -31.466 286 HB3 PRO 552 HB3 PRO 552 23.849 24.186 -32.073 287 HG2 PRO 552 HG2 PRO 552 21.755 23.942 -29.883 288 HG3 PRO 552 HG3 PRO 552 21.956 22.910 -31.337 289 HD2 PRO 552 HD2 PRO 552 23.019 22.238 -28.913 290 HD3 PRO 552 HD3 PRO 552 23.843 21.859 -30.454 291 H ARG 553 H ARG 553 23.673 27.259 -30.549 292 HA ARG 553 HA ARG 553 23.581 28.541 -28.061 293 HB2 ARG 553 HB2 ARG 553 22.108 30.161 -29.120 294 HB3 ARG 553 HB3 ARG 553 23.373 29.659 -30.236 295 HG2 ARG 553 HG2 ARG 553 21.678 28.064 -31.299 296 HG3 ARG 553 HG3 ARG 553 20.452 28.763 -30.238 297 HD2 ARG 553 HD2 ARG 553 20.280 29.833 -32.388 298 HD3 ARG 553 HD3 ARG 553 20.874 31.002 -31.217 299 HE ARG 553 HE ARG 553 22.869 31.173 -32.376 300 HH11 ARG 553 HH11 ARG 553 21.234 28.348 -33.663 301 HH12 ARG 553 HH12 ARG 553 22.412 28.140 -34.930 302 HH21 ARG 553 HH21 ARG 553 24.321 30.846 -34.012 303 HH22 ARG 553 HH22 ARG 553 24.105 29.523 -35.120 304 HA PRO 554 HA PRO 554 20.303 26.632 -25.811 305 HB2 PRO 554 HB2 PRO 554 19.480 28.613 -24.097 306 HB3 PRO 554 HB3 PRO 554 21.064 27.788 -23.967 307 HG2 PRO 554 HG2 PRO 554 20.450 30.442 -25.309 308 HG3 PRO 554 HG3 PRO 554 21.751 30.072 -24.126 309 HD2 PRO 554 HD2 PRO 554 22.223 30.100 -26.800 310 HD3 PRO 554 HD3 PRO 554 23.006 28.886 -25.743 311 H GLY 555 H GLY 555 17.984 26.707 -25.311 312 HA2 GLY 555 HA2 GLY 555 16.314 27.516 -27.513 313 HA3 GLY 555 HA3 GLY 555 15.774 26.868 -25.971 314 H ALA 556 H ALA 556 14.240 28.721 -27.131 315 HA ALA 556 HA ALA 556 14.460 31.119 -25.414 316 HB1 ALA 556 HB3 ALA 556 14.094 32.574 -27.407 317 HB2 ALA 556 HB1 ALA 556 15.610 31.680 -27.525 318 HB3 ALA 556 HB2 ALA 556 14.196 31.158 -28.455 319 HA PRO 557 HA PRO 557 10.064 30.549 -25.071 320 HB2 PRO 557 HB2 PRO 557 9.144 33.076 -24.527 321 HB3 PRO 557 HB3 PRO 557 10.101 32.095 -23.378 322 HG2 PRO 557 HG2 PRO 557 11.096 34.260 -25.249 323 HG3 PRO 557 HG3 PRO 557 11.454 34.052 -23.506 324 HD2 PRO 557 HD2 PRO 557 13.161 33.185 -25.433 325 HD3 PRO 557 HD3 PRO 557 12.917 32.251 -23.928 326 H ASN2319 H ASN2319 30.362 17.290 -37.213 327 HA ASN2319 HA ASN2319 31.421 15.532 -38.394 328 HB2 ASN2319 HB2 ASN2319 30.299 13.697 -36.219 329 HB3 ASN2319 HB3 ASN2319 31.023 13.168 -37.735 330 HD21 ASN2319 2HD2 ASN2319 32.936 12.148 -36.985 331 HD22 ASN2319 1HD2 ASN2319 34.141 13.015 -36.049 332 H THR2320 H THR2320 30.304 15.394 -40.220 333 HA THR2320 HA THR2320 27.377 15.540 -40.260 334 HB THR2320 HB THR2320 27.834 15.533 -42.790 335 HG1 THR2320 HG1 THR2320 29.952 16.084 -43.345 336 HG21 THR2320 HG23 THR2320 28.579 17.855 -42.792 337 HG22 THR2320 HG21 THR2320 27.474 17.609 -41.428 338 HG23 THR2320 HG22 THR2320 29.226 17.699 -41.143 339 H GLY2321 H GLY2321 25.998 14.105 -41.355 340 HA2 GLY2321 HA2 GLY2321 25.986 12.053 -42.850 341 HA3 GLY2321 HA3 GLY2321 26.892 11.245 -41.577 342 H ALA2322 H ALA2322 24.282 10.580 -42.717 343 HA ALA2322 HA ALA2322 22.267 11.137 -40.671 344 HB1 ALA2322 HB3 ALA2322 20.784 9.899 -42.177 345 HB2 ALA2322 HB1 ALA2322 21.691 11.142 -43.051 346 HB3 ALA2322 HB2 ALA2322 22.167 9.433 -43.193 347 H LYS2323 H LYS2323 23.897 10.126 -39.078 348 HA LYS2323 HA LYS2323 23.907 7.241 -38.727 349 HB2 LYS2323 HB2 LYS2323 25.209 9.464 -37.515 350 HB3 LYS2323 HB3 LYS2323 24.188 8.822 -36.252 351 HG2 LYS2323 HG2 LYS2323 25.929 7.432 -35.878 352 HG3 LYS2323 HG3 LYS2323 25.251 6.467 -37.177 353 HD2 LYS2323 HD2 LYS2323 26.719 7.785 -38.793 354 HD3 LYS2323 HD3 LYS2323 27.485 8.546 -37.396 355 HE2 LYS2323 HE2 LYS2323 27.463 5.559 -38.032 356 HE3 LYS2323 HE3 LYS2323 28.799 6.668 -38.336 357 HZ1 LYS2323 HZ3 LYS2323 29.195 5.501 -36.294 358 HZ2 LYS2323 HZ1 LYS2323 28.924 7.063 -35.898 359 HZ3 LYS2323 HZ2 LYS2323 27.758 5.933 -35.660 360 H GLN2324 H GLN2324 23.076 6.553 -36.296 361 HA GLN2324 HA GLN2324 20.354 6.054 -36.481 362 HB2 GLN2324 HB2 GLN2324 22.050 6.244 -33.960 363 HB3 GLN2324 HB3 GLN2324 20.404 5.619 -34.027 364 HG2 GLN2324 HG2 GLN2324 21.516 4.092 -35.993 365 HG3 GLN2324 HG3 GLN2324 22.944 4.374 -34.997 366 HE21 GLN2324 HE22 GLN2324 23.073 3.222 -32.981 367 HE22 GLN2324 HE21 GLN2324 21.797 2.120 -32.464 368 HA PRO2325 HA PRO2325 18.729 10.125 -35.556 369 HB2 PRO2325 HB2 PRO2325 16.038 9.647 -35.718 370 HB3 PRO2325 HB3 PRO2325 17.126 9.733 -37.135 371 HG2 PRO2325 HG2 PRO2325 16.137 7.257 -35.696 372 HG3 PRO2325 HG3 PRO2325 16.199 7.569 -37.459 373 HD2 PRO2325 HD2 PRO2325 18.129 6.144 -36.138 374 HD3 PRO2325 HD3 PRO2325 18.515 7.187 -37.541 375 HA PRO2326 HA PRO2326 17.886 9.455 -31.098 376 HB2 PRO2326 HB2 PRO2326 18.065 12.043 -30.243 377 HB3 PRO2326 HB3 PRO2326 19.490 11.041 -30.649 378 HG2 PRO2326 HG2 PRO2326 18.078 13.049 -32.431 379 HG3 PRO2326 HG3 PRO2326 19.824 12.933 -32.095 380 HD2 PRO2326 HD2 PRO2326 18.670 11.858 -34.311 381 HD3 PRO2326 HD3 PRO2326 20.025 11.027 -33.485 382 H SER2327 H SER2327 15.890 9.101 -30.402 383 HA SER2327 HA SER2327 13.683 11.063 -30.731 384 HB2 SER2327 HB2 SER2327 13.503 8.173 -31.688 385 HB3 SER2327 HB3 SER2327 12.162 9.323 -31.596 386 HG SER2327 HG SER2327 13.341 10.637 -33.121 387 H TYR2328 H TYR2328 13.661 11.360 -28.500 388 HA TYR2328 HA TYR2328 13.349 9.023 -26.706 389 HB2 TYR2328 HB2 TYR2328 14.901 10.924 -26.240 390 HB3 TYR2328 HB3 TYR2328 13.516 11.982 -26.063 391 HD1 TYR2328 HD1 TYR2328 15.070 8.830 -24.742 392 HD2 TYR2328 HD2 TYR2328 12.498 12.194 -23.894 393 HE1 TYR2328 HE1 TYR2328 14.994 8.171 -22.343 394 HE2 TYR2328 HE2 TYR2328 12.419 11.525 -21.502 395 HH TYR2328 HH TYR2328 14.167 8.650 -20.261 396 H GLU2329 H GLU2329 11.572 12.039 -26.099 397 HA GLU2329 HA GLU2329 9.036 10.769 -25.713 398 HB2 GLU2329 HB2 GLU2329 9.991 13.596 -26.046 399 HB3 GLU2329 HB3 GLU2329 8.292 13.282 -26.323 400 HG2 GLU2329 HG2 GLU2329 7.849 13.369 -24.182 401 HG3 GLU2329 HG3 GLU2329 8.789 11.916 -23.913 402 H ASP2330 H ASP2330 10.536 11.952 -28.688 403 HA ASP2330 HA ASP2330 8.148 11.899 -30.274 404 HB2 ASP2330 HB2 ASP2330 10.309 13.086 -30.798 405 HB3 ASP2330 HB3 ASP2330 11.011 11.518 -31.203 406 H CYS2331 H CYS2331 10.052 9.295 -29.021 407 HA CYS2331 HA CYS2331 8.909 7.323 -30.955 408 HB2 CYS2331 HB2 CYS2331 11.346 7.279 -30.481 409 HB3 CYS2331 HB3 CYS2331 11.005 6.996 -28.765 410 HG CYS2331 HG CYS2331 11.778 4.757 -29.905 411 H ILE2332 H ILE2332 9.027 8.044 -27.417 412 HA ILE2332 HA ILE2332 7.250 5.818 -26.830 413 HB ILE2332 HB ILE2332 7.493 6.376 -24.516 414 HG12 ILE2332 HG12 ILE2332 9.345 8.682 -25.134 415 HG13 ILE2332 HG13 ILE2332 7.616 8.975 -24.958 416 HG21 ILE2332 HG21 ILE2332 9.241 5.068 -25.690 417 HG22 ILE2332 HG22 ILE2332 10.183 6.552 -25.940 418 HG23 ILE2332 HG23 ILE2332 9.877 5.954 -24.301 419 HD11 ILE2332 3HD1 ILE2332 8.774 9.375 -22.850 420 HD12 ILE2332 1HD1 ILE2332 7.666 7.997 -22.688 421 HD13 ILE2332 2HD1 ILE2332 9.419 7.723 -22.846 422 H LYS2333 H LYS2333 6.021 7.880 -28.509 423 HA LYS2333 HA LYS2333 3.636 8.557 -26.846 424 HB2 LYS2333 HB2 LYS2333 3.360 10.639 -27.923 425 HB3 LYS2333 HB3 LYS2333 5.017 10.570 -27.329 426 HG2 LYS2333 HG2 LYS2333 5.791 9.997 -29.657 427 HG3 LYS2333 HG3 LYS2333 4.109 10.124 -30.213 428 HD2 LYS2333 HD2 LYS2333 4.073 12.520 -29.418 429 HD3 LYS2333 HD3 LYS2333 5.768 12.352 -28.965 430 HE2 LYS2333 HE2 LYS2333 5.791 13.420 -31.077 431 HE3 LYS2333 HE3 LYS2333 6.291 11.752 -31.373 432 HZ1 LYS2333 HZ3 LYS2333 4.661 12.517 -33.001 433 HZ2 LYS2333 HZ1 LYS2333 4.023 11.283 -32.145 434 HZ3 LYS2333 HZ2 LYS2333 3.553 12.824 -31.842 Start of MODEL 8 1 H VAL 515 H VAL 515 32.967 4.301 -11.135 2 HA VAL 515 HA VAL 515 31.881 6.165 -10.077 3 HB VAL 515 HB VAL 515 32.859 5.757 -7.863 4 HG11 VAL 515 HG11 VAL 515 35.294 5.596 -8.426 5 HG12 VAL 515 HG12 VAL 515 35.299 7.352 -8.745 6 HG13 VAL 515 HG13 VAL 515 34.923 6.737 -7.134 7 HG21 VAL 515 HG23 VAL 515 32.885 8.091 -7.156 8 HG22 VAL 515 HG21 VAL 515 33.083 8.628 -8.836 9 HG23 VAL 515 HG22 VAL 515 31.596 7.785 -8.323 10 H SER 516 H SER 516 35.408 6.197 -10.866 11 HA SER 516 HA SER 516 35.760 8.750 -11.376 12 HB2 SER 516 HB2 SER 516 37.061 6.533 -12.958 13 HB3 SER 516 HB3 SER 516 37.768 8.107 -12.520 14 HG SER 516 HG SER 516 38.367 6.271 -11.163 15 H LEU 517 H LEU 517 34.276 6.731 -13.895 16 HA LEU 517 HA LEU 517 33.915 9.215 -15.517 17 HB2 LEU 517 HB2 LEU 517 34.241 8.103 -17.552 18 HB3 LEU 517 HB3 LEU 517 35.642 7.784 -16.564 19 HG LEU 517 HG LEU 517 33.551 5.674 -16.328 20 HD11 LEU 517 1HD1 LEU 517 33.164 6.269 -18.674 21 HD12 LEU 517 2HD1 LEU 517 34.901 6.099 -19.019 22 HD13 LEU 517 3HD1 LEU 517 33.938 4.683 -18.530 23 HD21 LEU 517 3HD2 LEU 517 35.443 4.181 -16.663 24 HD22 LEU 517 1HD2 LEU 517 36.479 5.544 -17.140 25 HD23 LEU 517 2HD2 LEU 517 35.868 5.426 -15.474 26 H ILE 518 H ILE 518 32.232 7.605 -13.542 27 HA ILE 518 HA ILE 518 29.753 7.305 -15.205 28 HB ILE 518 HB ILE 518 30.479 5.656 -12.756 29 HG12 ILE 518 HG12 ILE 518 30.374 3.828 -14.796 30 HG13 ILE 518 HG13 ILE 518 31.042 5.186 -15.676 31 HG21 ILE 518 HG21 ILE 518 28.052 5.849 -13.075 32 HG22 ILE 518 HG22 ILE 518 28.216 5.390 -14.786 33 HG23 ILE 518 HG23 ILE 518 28.578 4.228 -13.491 34 HD11 ILE 518 3HD1 ILE 518 32.816 3.741 -14.800 35 HD12 ILE 518 1HD1 ILE 518 32.899 5.267 -13.902 36 HD13 ILE 518 2HD1 ILE 518 32.144 3.838 -13.166 37 H ASN 519 H ASN 519 31.254 8.770 -12.440 38 HA ASN 519 HA ASN 519 28.703 10.131 -11.712 39 HB2 ASN 519 HB2 ASN 519 29.758 8.340 -10.110 40 HB3 ASN 519 HB3 ASN 519 30.923 9.604 -9.729 41 HD21 ASN 519 2HD2 ASN 519 27.922 8.284 -8.900 42 HD22 ASN 519 1HD2 ASN 519 27.304 9.659 -7.997 43 H GLU 520 H GLU 520 29.947 11.157 -13.720 44 HA GLU 520 HA GLU 520 31.932 13.212 -13.233 45 HB2 GLU 520 HB2 GLU 520 29.871 12.735 -15.419 46 HB3 GLU 520 HB3 GLU 520 31.074 14.017 -15.500 47 HG2 GLU 520 HG2 GLU 520 31.917 11.112 -15.173 48 HG3 GLU 520 HG3 GLU 520 31.505 11.814 -16.729 49 H GLY 521 H GLY 521 31.147 15.561 -14.082 50 HA2 GLY 521 HA2 GLY 521 29.832 16.873 -11.980 51 HA3 GLY 521 HA3 GLY 521 30.099 17.544 -13.584 52 HA PRO 522 HA PRO 522 25.564 16.690 -12.331 53 HB2 PRO 522 HB2 PRO 522 24.594 19.260 -12.068 54 HB3 PRO 522 HB3 PRO 522 25.401 18.349 -10.756 55 HG2 PRO 522 HG2 PRO 522 26.633 20.375 -12.645 56 HG3 PRO 522 HG3 PRO 522 26.779 20.293 -10.858 57 HD2 PRO 522 HD2 PRO 522 28.702 19.283 -12.482 58 HD3 PRO 522 HD3 PRO 522 28.241 18.433 -10.975 59 H LEU 523 H LEU 523 23.700 16.766 -13.604 60 HA LEU 523 HA LEU 523 24.241 16.912 -16.381 61 HB2 LEU 523 HB2 LEU 523 22.240 15.838 -16.701 62 HB3 LEU 523 HB3 LEU 523 22.708 15.320 -15.119 63 HG LEU 523 HG LEU 523 21.008 17.655 -14.781 64 HD11 LEU 523 1HD1 LEU 523 20.232 17.122 -17.102 65 HD12 LEU 523 2HD1 LEU 523 19.792 15.496 -16.553 66 HD13 LEU 523 3HD1 LEU 523 18.970 16.922 -15.879 67 HD21 LEU 523 3HD2 LEU 523 19.534 16.080 -13.629 68 HD22 LEU 523 1HD2 LEU 523 20.445 14.707 -14.295 69 HD23 LEU 523 2HD2 LEU 523 21.220 15.827 -13.150 70 HA PRO 524 HA PRO 524 23.158 21.007 -17.536 71 HB2 PRO 524 HB2 PRO 524 22.119 20.713 -20.101 72 HB3 PRO 524 HB3 PRO 524 23.850 20.595 -19.669 73 HG2 PRO 524 HG2 PRO 524 21.856 18.352 -20.022 74 HG3 PRO 524 HG3 PRO 524 23.523 18.458 -20.661 75 HD2 PRO 524 HD2 PRO 524 22.923 17.058 -18.416 76 HD3 PRO 524 HD3 PRO 524 24.448 17.980 -18.547 77 HA PRO 525 HA PRO 525 19.179 21.916 -16.220 78 HB2 PRO 525 HB2 PRO 525 18.618 24.417 -17.219 79 HB3 PRO 525 HB3 PRO 525 19.900 24.087 -16.017 80 HG2 PRO 525 HG2 PRO 525 20.198 24.350 -19.025 81 HG3 PRO 525 HG3 PRO 525 21.162 25.149 -17.741 82 HD2 PRO 525 HD2 PRO 525 22.033 22.892 -18.967 83 HD3 PRO 525 HD3 PRO 525 22.291 23.138 -17.214 84 H GLY 526 H GLY 526 17.419 20.759 -16.768 85 HA2 GLY 526 HA2 GLY 526 15.472 20.135 -17.818 86 HA3 GLY 526 HA3 GLY 526 15.534 21.656 -18.715 87 H TRP 527 H TRP 527 18.034 19.180 -18.919 88 HA TRP 527 HA TRP 527 17.308 18.535 -21.762 89 HB2 TRP 527 HB2 TRP 527 19.893 19.277 -20.405 90 HB3 TRP 527 HB3 TRP 527 19.943 18.176 -21.766 91 HD1 TRP 527 HD1 TRP 527 19.751 21.797 -20.958 92 HE1 TRP 527 HE1 TRP 527 19.713 23.193 -23.108 93 HE3 TRP 527 HE3 TRP 527 19.046 18.035 -24.349 94 HZ2 TRP 527 HZ2 TRP 527 19.426 22.731 -25.934 95 HZ3 TRP 527 HZ3 TRP 527 18.879 18.547 -26.782 96 HH2 TRP 527 HH2 TRP 527 19.076 20.884 -27.586 97 H GLU 528 H GLU 528 18.059 16.517 -22.546 98 HA GLU 528 HA GLU 528 18.925 14.449 -20.585 99 HB2 GLU 528 HB2 GLU 528 16.582 14.062 -20.926 100 HB3 GLU 528 HB3 GLU 528 16.726 14.242 -22.664 101 HG2 GLU 528 HG2 GLU 528 16.420 11.939 -22.180 102 HG3 GLU 528 HG3 GLU 528 18.065 12.128 -22.753 103 H ILE 529 H ILE 529 20.270 12.825 -21.496 104 HA ILE 529 HA ILE 529 21.585 13.462 -24.086 105 HB ILE 529 HB ILE 529 23.291 13.030 -21.618 106 HG12 ILE 529 HG12 ILE 529 23.754 15.632 -21.910 107 HG13 ILE 529 HG13 ILE 529 22.101 15.662 -22.499 108 HG21 ILE 529 HG21 ILE 529 24.260 12.658 -23.854 109 HG22 ILE 529 HG22 ILE 529 23.805 14.308 -24.338 110 HG23 ILE 529 HG23 ILE 529 25.002 14.047 -23.050 111 HD11 ILE 529 3HD1 ILE 529 21.867 16.080 -20.202 112 HD12 ILE 529 1HD1 ILE 529 21.567 14.347 -20.240 113 HD13 ILE 529 2HD1 ILE 529 23.157 14.940 -19.749 114 H ARG 530 H ARG 530 21.942 11.634 -25.163 115 HA ARG 530 HA ARG 530 21.982 9.008 -23.707 116 HB2 ARG 530 HB2 ARG 530 20.325 9.683 -26.174 117 HB3 ARG 530 HB3 ARG 530 20.464 8.091 -25.451 118 HG2 ARG 530 HG2 ARG 530 19.577 9.997 -23.407 119 HG3 ARG 530 HG3 ARG 530 18.594 10.162 -24.851 120 HD2 ARG 530 HD2 ARG 530 17.523 8.600 -23.412 121 HD3 ARG 530 HD3 ARG 530 18.166 7.683 -24.786 122 HE ARG 530 HE ARG 530 20.099 7.683 -22.676 123 HH11 ARG 530 HH11 ARG 530 16.927 6.306 -23.242 124 HH12 ARG 530 HH12 ARG 530 17.208 4.980 -22.148 125 HH21 ARG 530 HH21 ARG 530 20.408 5.932 -21.332 126 HH22 ARG 530 HH22 ARG 530 19.129 4.778 -21.108 127 H TYR 531 H TYR 531 22.772 7.246 -24.942 128 HA TYR 531 HA TYR 531 24.949 7.959 -26.871 129 HB2 TYR 531 HB2 TYR 531 25.135 6.170 -24.412 130 HB3 TYR 531 HB3 TYR 531 26.397 6.418 -25.601 131 HD1 TYR 531 HD2 TYR 531 24.394 8.117 -22.931 132 HD2 TYR 531 HD1 TYR 531 27.950 8.210 -25.376 133 HE1 TYR 531 HE2 TYR 531 25.321 9.943 -21.515 134 HE2 TYR 531 HE1 TYR 531 28.902 9.985 -23.916 135 HH TYR 531 HH TYR 531 28.580 11.322 -22.072 136 H THR 532 H THR 532 24.293 6.954 -28.727 137 HA THR 532 HA THR 532 22.543 4.635 -28.679 138 HB THR 532 HB THR 532 22.681 4.703 -31.106 139 HG1 THR 532 HG1 THR 532 23.998 6.333 -32.062 140 HG21 THR 532 HG23 THR 532 21.848 6.991 -31.519 141 HG22 THR 532 HG21 THR 532 21.172 6.329 -30.025 142 HG23 THR 532 HG22 THR 532 22.486 7.520 -29.955 143 H ALA 533 H ALA 533 22.952 2.560 -29.699 144 HA ALA 533 HA ALA 533 25.350 1.292 -28.844 145 HB1 ALA 533 HB3 ALA 533 24.497 -0.636 -30.001 146 HB2 ALA 533 HB1 ALA 533 23.209 0.183 -29.094 147 HB3 ALA 533 HB2 ALA 533 23.297 0.353 -30.869 148 H ALA 534 H ALA 534 24.808 3.128 -31.744 149 HA ALA 534 HA ALA 534 26.981 2.070 -33.342 150 HB1 ALA 534 HB3 ALA 534 26.652 4.139 -34.621 151 HB2 ALA 534 HB1 ALA 534 25.097 3.360 -34.274 152 HB3 ALA 534 HB2 ALA 534 25.607 4.794 -33.347 153 H GLY 535 H GLY 535 26.981 3.899 -30.431 154 HA2 GLY 535 HA2 GLY 535 28.907 4.416 -29.197 155 HA3 GLY 535 HA3 GLY 535 29.884 4.475 -30.666 156 H GLU 536 H GLU 536 26.808 6.217 -30.606 157 HA GLU 536 HA GLU 536 28.350 8.780 -30.740 158 HB2 GLU 536 HB2 GLU 536 25.760 8.084 -32.140 159 HB3 GLU 536 HB3 GLU 536 26.725 9.528 -32.370 160 HG2 GLU 536 HG2 GLU 536 27.547 6.685 -33.140 161 HG3 GLU 536 HG3 GLU 536 26.842 7.870 -34.216 162 H ARG 537 H ARG 537 27.839 10.393 -29.459 163 HA ARG 537 HA ARG 537 25.572 10.181 -27.578 164 HB2 ARG 537 HB2 ARG 537 27.636 10.815 -26.613 165 HB3 ARG 537 HB3 ARG 537 27.937 12.065 -27.826 166 HG2 ARG 537 HG2 ARG 537 26.371 13.550 -26.911 167 HG3 ARG 537 HG3 ARG 537 25.514 12.282 -26.025 168 HD2 ARG 537 HD2 ARG 537 26.892 13.843 -24.597 169 HD3 ARG 537 HD3 ARG 537 27.137 12.128 -24.361 170 HE ARG 537 HE ARG 537 29.287 12.223 -25.294 171 HH11 ARG 537 HH11 ARG 537 27.894 15.415 -25.409 172 HH12 ARG 537 HH12 ARG 537 29.452 16.193 -25.564 173 HH21 ARG 537 HH21 ARG 537 31.233 13.251 -25.496 174 HH22 ARG 537 HH22 ARG 537 31.291 14.982 -25.626 175 H PHE 538 H PHE 538 23.818 11.415 -27.533 176 HA PHE 538 HA PHE 538 23.493 13.746 -29.354 177 HB2 PHE 538 HB2 PHE 538 21.518 11.440 -29.066 178 HB3 PHE 538 HB3 PHE 538 21.148 12.976 -29.824 179 HD1 PHE 538 HD2 PHE 538 22.023 13.578 -32.033 180 HD2 PHE 538 HD1 PHE 538 22.913 9.771 -30.222 181 HE1 PHE 538 HE2 PHE 538 22.688 12.678 -34.253 182 HE2 PHE 538 HE1 PHE 538 23.558 8.867 -32.442 183 HZ PHE 538 HZ PHE 538 23.440 10.319 -34.459 184 H PHE 539 H PHE 539 21.774 15.150 -28.694 185 HA PHE 539 HA PHE 539 21.057 15.015 -25.791 186 HB2 PHE 539 HB2 PHE 539 21.504 17.441 -27.552 187 HB3 PHE 539 HB3 PHE 539 21.064 17.454 -25.859 188 HD1 PHE 539 HD1 PHE 539 23.833 16.719 -28.241 189 HD2 PHE 539 HD2 PHE 539 22.690 17.297 -24.125 190 HE1 PHE 539 HE1 PHE 539 26.220 16.947 -27.613 191 HE2 PHE 539 HE2 PHE 539 25.080 17.535 -23.495 192 HZ PHE 539 HZ PHE 539 26.844 17.398 -25.239 193 H VAL 540 H VAL 540 19.006 15.673 -25.221 194 HA VAL 540 HA VAL 540 16.913 15.949 -27.350 195 HB VAL 540 HB VAL 540 16.667 14.287 -24.829 196 HG11 VAL 540 HG11 VAL 540 14.560 15.253 -25.894 197 HG12 VAL 540 HG12 VAL 540 14.925 14.255 -27.316 198 HG13 VAL 540 HG13 VAL 540 14.623 13.516 -25.722 199 HG21 VAL 540 HG23 VAL 540 16.716 12.266 -26.240 200 HG22 VAL 540 HG21 VAL 540 17.230 13.246 -27.628 201 HG23 VAL 540 HG22 VAL 540 18.273 13.093 -26.199 202 H ASP 541 H ASP 541 15.644 17.631 -27.044 203 HA ASP 541 HA ASP 541 15.543 19.044 -24.419 204 HB2 ASP 541 HB2 ASP 541 16.255 20.415 -26.296 205 HB3 ASP 541 HB3 ASP 541 14.862 19.908 -27.255 206 H HIS 542 H HIS 542 13.941 18.165 -23.189 207 HA HIS 542 HA HIS 542 11.479 17.070 -24.237 208 HB2 HIS 542 HB2 HIS 542 12.115 18.065 -21.441 209 HB3 HIS 542 HB3 HIS 542 10.762 17.041 -21.902 210 HD2 HIS 542 HD2 HIS 542 12.715 15.066 -23.854 211 HE1 HIS 542 HE1 HIS 542 14.314 13.938 -20.070 212 H ASN 543 H ASN 543 12.415 20.354 -23.610 213 HA ASN 543 HA ASN 543 9.846 21.435 -22.929 214 HB2 ASN 543 HB2 ASN 543 12.263 22.863 -24.116 215 HB3 ASN 543 HB3 ASN 543 10.938 23.597 -23.226 216 HD21 ASN 543 2HD2 ASN 543 14.011 22.056 -22.965 217 HD22 ASN 543 1HD2 ASN 543 14.030 21.901 -21.210 218 H THR 544 H THR 544 11.466 20.994 -26.053 219 HA THR 544 HA THR 544 8.953 21.780 -27.500 220 HB THR 544 HB THR 544 10.325 22.752 -29.248 221 HG1 THR 544 HG1 THR 544 12.521 22.101 -27.555 222 HG21 THR 544 HG23 THR 544 11.188 24.721 -28.167 223 HG22 THR 544 HG21 THR 544 9.687 24.238 -27.358 224 HG23 THR 544 HG22 THR 544 11.258 23.905 -26.593 225 H ARG 545 H ARG 545 10.642 19.149 -26.788 226 HA ARG 545 HA ARG 545 10.981 17.092 -27.576 227 HB2 ARG 545 HB2 ARG 545 8.520 17.861 -28.786 228 HB3 ARG 545 HB3 ARG 545 9.432 17.045 -30.050 229 HG2 ARG 545 HG2 ARG 545 9.856 15.163 -28.386 230 HG3 ARG 545 HG3 ARG 545 8.751 15.990 -27.276 231 HD2 ARG 545 HD2 ARG 545 8.135 14.718 -29.960 232 HD3 ARG 545 HD3 ARG 545 7.534 14.225 -28.381 233 HE ARG 545 HE ARG 545 6.526 16.342 -30.124 234 HH11 ARG 545 HH11 ARG 545 6.338 15.203 -26.749 235 HH12 ARG 545 HH12 ARG 545 5.050 16.325 -26.422 236 HH21 ARG 545 HH21 ARG 545 4.816 17.605 -29.584 237 HH22 ARG 545 HH22 ARG 545 4.158 17.552 -27.978 238 H ARG 546 H ARG 546 12.429 19.537 -28.900 239 HA ARG 546 HA ARG 546 13.523 18.517 -31.391 240 HB2 ARG 546 HB2 ARG 546 14.319 20.756 -29.484 241 HB3 ARG 546 HB3 ARG 546 15.248 20.373 -30.934 242 HG2 ARG 546 HG2 ARG 546 13.250 20.751 -32.356 243 HG3 ARG 546 HG3 ARG 546 12.297 21.141 -30.921 244 HD2 ARG 546 HD2 ARG 546 12.989 23.202 -31.966 245 HD3 ARG 546 HD3 ARG 546 13.835 23.026 -30.419 246 HE ARG 546 HE ARG 546 15.321 22.007 -32.740 247 HH11 ARG 546 HH11 ARG 546 14.736 24.923 -30.901 248 HH12 ARG 546 HH12 ARG 546 16.239 25.651 -31.401 249 HH21 ARG 546 HH21 ARG 546 17.243 22.959 -33.296 250 HH22 ARG 546 HH22 ARG 546 17.627 24.551 -32.716 251 H THR 547 H THR 547 15.796 18.184 -31.780 252 HA THR 547 HA THR 547 17.418 16.922 -29.641 253 HB THR 547 HB THR 547 17.881 15.013 -31.267 254 HG1 THR 547 HG1 THR 547 16.808 15.909 -33.107 255 HG21 THR 547 HG23 THR 547 16.021 13.672 -30.548 256 HG22 THR 547 HG21 THR 547 16.582 14.710 -29.236 257 HG23 THR 547 HG22 THR 547 15.077 15.102 -30.098 258 H THR 548 H THR 548 19.641 16.610 -30.202 259 HA THR 548 HA THR 548 20.686 17.609 -32.747 260 HB THR 548 HB THR 548 20.433 19.745 -31.825 261 HG1 THR 548 HG1 THR 548 22.976 19.497 -30.873 262 HG21 THR 548 HG23 THR 548 21.235 20.494 -29.640 263 HG22 THR 548 HG21 THR 548 19.995 19.257 -29.448 264 HG23 THR 548 HG22 THR 548 21.705 18.835 -29.222 265 H PHE 549 H PHE 549 22.807 17.006 -33.137 266 HA PHE 549 HA PHE 549 23.949 14.829 -31.529 267 HB2 PHE 549 HB2 PHE 549 24.109 14.744 -33.949 268 HB3 PHE 549 HB3 PHE 549 24.827 16.349 -34.013 269 HD1 PHE 549 HD1 PHE 549 25.449 12.922 -32.585 270 HD2 PHE 549 HD2 PHE 549 27.181 16.594 -34.042 271 HE1 PHE 549 HE1 PHE 549 27.716 11.954 -32.339 272 HE2 PHE 549 HE2 PHE 549 29.453 15.602 -33.831 273 HZ PHE 549 HZ PHE 549 29.721 13.282 -32.974 274 H GLU 550 H GLU 550 24.605 18.264 -32.057 275 HA GLU 550 HA GLU 550 26.923 18.209 -30.170 276 HB2 GLU 550 HB2 GLU 550 27.701 20.202 -31.278 277 HB3 GLU 550 HB3 GLU 550 27.436 18.919 -32.448 278 HG2 GLU 550 HG2 GLU 550 25.188 20.003 -33.000 279 HG3 GLU 550 HG3 GLU 550 25.665 21.347 -31.959 280 H ASP 551 H ASP 551 27.081 20.728 -29.284 281 HA ASP 551 HA ASP 551 24.538 21.172 -27.765 282 HB2 ASP 551 HB2 ASP 551 26.309 20.168 -26.442 283 HB3 ASP 551 HB3 ASP 551 27.417 21.476 -26.873 284 HA PRO 552 HA PRO 552 25.328 25.090 -30.162 285 HB2 PRO 552 HB2 PRO 552 22.882 25.396 -31.309 286 HB3 PRO 552 HB3 PRO 552 24.057 24.195 -31.895 287 HG2 PRO 552 HG2 PRO 552 21.740 23.718 -29.985 288 HG3 PRO 552 HG3 PRO 552 22.133 22.825 -31.486 289 HD2 PRO 552 HD2 PRO 552 22.938 21.976 -29.022 290 HD3 PRO 552 HD3 PRO 552 23.926 21.739 -30.496 291 H ARG 553 H ARG 553 23.348 26.999 -30.203 292 HA ARG 553 HA ARG 553 22.783 27.620 -27.317 293 HB2 ARG 553 HB2 ARG 553 23.642 29.440 -29.596 294 HB3 ARG 553 HB3 ARG 553 23.046 30.018 -28.032 295 HG2 ARG 553 HG2 ARG 553 24.864 28.896 -26.850 296 HG3 ARG 553 HG3 ARG 553 25.502 28.250 -28.375 297 HD2 ARG 553 HD2 ARG 553 25.963 30.501 -29.206 298 HD3 ARG 553 HD3 ARG 553 25.127 31.223 -27.833 299 HE ARG 553 HE ARG 553 26.969 30.935 -26.493 300 HH11 ARG 553 HH11 ARG 553 27.577 29.027 -29.374 301 HH12 ARG 553 HH12 ARG 553 29.224 28.699 -28.908 302 HH21 ARG 553 HH21 ARG 553 29.065 30.486 -25.975 303 HH22 ARG 553 HH22 ARG 553 30.040 29.512 -27.036 304 HA PRO 554 HA PRO 554 18.716 27.627 -29.644 305 HB2 PRO 554 HB2 PRO 554 17.278 25.891 -28.097 306 HB3 PRO 554 HB3 PRO 554 18.366 25.361 -29.416 307 HG2 PRO 554 HG2 PRO 554 18.957 25.470 -26.449 308 HG3 PRO 554 HG3 PRO 554 19.274 24.143 -27.618 309 HD2 PRO 554 HD2 PRO 554 21.197 25.952 -26.874 310 HD3 PRO 554 HD3 PRO 554 21.129 25.230 -28.508 311 H GLY 555 H GLY 555 19.752 28.299 -26.390 312 HA2 GLY 555 HA2 GLY 555 17.359 29.708 -25.497 313 HA3 GLY 555 HA3 GLY 555 18.966 29.749 -24.774 314 H ALA 556 H ALA 556 19.871 30.558 -27.752 315 HA ALA 556 HA ALA 556 19.864 33.430 -27.353 316 HB1 ALA 556 HB3 ALA 556 21.049 33.435 -29.501 317 HB2 ALA 556 HB1 ALA 556 21.708 32.187 -28.430 318 HB3 ALA 556 HB2 ALA 556 20.623 31.739 -29.771 319 HA PRO 557 HA PRO 557 16.059 34.457 -29.461 320 HB2 PRO 557 HB2 PRO 557 16.635 36.864 -30.666 321 HB3 PRO 557 HB3 PRO 557 16.410 36.654 -28.902 322 HG2 PRO 557 HG2 PRO 557 19.013 36.726 -30.455 323 HG3 PRO 557 HG3 PRO 557 18.595 37.607 -28.950 324 HD2 PRO 557 HD2 PRO 557 20.009 35.307 -28.903 325 HD3 PRO 557 HD3 PRO 557 18.788 35.654 -27.644 326 H ASN2319 H ASN2319 27.260 16.942 -36.677 327 HA ASN2319 HA ASN2319 29.213 17.528 -38.791 328 HB2 ASN2319 HB2 ASN2319 29.607 18.391 -36.313 329 HB3 ASN2319 HB3 ASN2319 30.022 16.714 -35.987 330 HD21 ASN2319 2HD2 ASN2319 31.093 19.735 -37.462 331 HD22 ASN2319 1HD2 ASN2319 32.630 19.105 -38.020 332 H THR2320 H THR2320 30.947 15.571 -38.753 333 HA THR2320 HA THR2320 29.439 13.253 -39.655 334 HB THR2320 HB THR2320 31.734 12.325 -40.111 335 HG1 THR2320 HG1 THR2320 32.898 13.611 -38.636 336 HG21 THR2320 HG23 THR2320 32.146 13.812 -42.014 337 HG22 THR2320 HG21 THR2320 30.417 13.475 -41.837 338 HG23 THR2320 HG22 THR2320 31.071 15.045 -41.321 339 H GLY2321 H GLY2321 28.368 12.520 -37.772 340 HA2 GLY2321 HA2 GLY2321 29.762 10.386 -36.393 341 HA3 GLY2321 HA3 GLY2321 29.506 11.778 -35.338 342 H ALA2322 H ALA2322 27.323 10.360 -37.866 343 HA ALA2322 HA ALA2322 25.362 9.692 -35.721 344 HB1 ALA2322 HB3 ALA2322 23.581 10.834 -36.992 345 HB2 ALA2322 HB1 ALA2322 24.847 11.966 -36.478 346 HB3 ALA2322 HB2 ALA2322 24.782 11.411 -38.168 347 H LYS2323 H LYS2323 24.339 7.887 -35.978 348 HA LYS2323 HA LYS2323 24.082 6.523 -38.623 349 HB2 LYS2323 HB2 LYS2323 26.163 5.882 -37.057 350 HB3 LYS2323 HB3 LYS2323 24.944 4.985 -36.175 351 HG2 LYS2323 HG2 LYS2323 25.957 3.446 -37.671 352 HG3 LYS2323 HG3 LYS2323 24.389 3.796 -38.393 353 HD2 LYS2323 HD2 LYS2323 25.501 5.420 -39.963 354 HD3 LYS2323 HD3 LYS2323 27.038 5.108 -39.163 355 HE2 LYS2323 HE2 LYS2323 27.103 3.785 -41.138 356 HE3 LYS2323 HE3 LYS2323 26.817 2.669 -39.808 357 HZ1 LYS2323 HZ3 LYS2323 25.339 2.197 -41.663 358 HZ2 LYS2323 HZ1 LYS2323 24.465 2.659 -40.368 359 HZ3 LYS2323 HZ2 LYS2323 24.690 3.693 -41.618 360 H GLN2324 H GLN2324 22.614 7.344 -35.677 361 HA GLN2324 HA GLN2324 20.202 5.741 -36.295 362 HB2 GLN2324 HB2 GLN2324 21.536 5.935 -33.557 363 HB3 GLN2324 HB3 GLN2324 19.898 5.339 -33.843 364 HG2 GLN2324 HG2 GLN2324 20.841 3.498 -35.255 365 HG3 GLN2324 HG3 GLN2324 22.467 4.085 -34.895 366 HE21 GLN2324 HE22 GLN2324 22.946 1.950 -33.957 367 HE22 GLN2324 HE21 GLN2324 22.308 1.558 -32.367 368 HA PRO2325 HA PRO2325 18.691 9.905 -35.505 369 HB2 PRO2325 HB2 PRO2325 15.986 9.527 -35.623 370 HB3 PRO2325 HB3 PRO2325 17.053 9.490 -37.058 371 HG2 PRO2325 HG2 PRO2325 15.979 7.139 -35.476 372 HG3 PRO2325 HG3 PRO2325 16.035 7.351 -37.253 373 HD2 PRO2325 HD2 PRO2325 17.922 5.920 -35.861 374 HD3 PRO2325 HD3 PRO2325 18.323 6.845 -37.339 375 HA PRO2326 HA PRO2326 17.857 9.467 -31.022 376 HB2 PRO2326 HB2 PRO2326 17.943 12.097 -30.293 377 HB3 PRO2326 HB3 PRO2326 19.406 11.139 -30.671 378 HG2 PRO2326 HG2 PRO2326 17.889 13.011 -32.515 379 HG3 PRO2326 HG3 PRO2326 19.646 12.966 -32.202 380 HD2 PRO2326 HD2 PRO2326 18.505 11.742 -34.356 381 HD3 PRO2326 HD3 PRO2326 19.908 11.012 -33.514 382 H SER2327 H SER2327 15.849 8.966 -30.449 383 HA SER2327 HA SER2327 13.613 10.900 -30.698 384 HB2 SER2327 HB2 SER2327 13.454 8.057 -31.781 385 HB3 SER2327 HB3 SER2327 12.092 9.177 -31.578 386 HG SER2327 HG SER2327 12.849 9.206 -33.712 387 H TYR2328 H TYR2328 13.784 11.097 -28.439 388 HA TYR2328 HA TYR2328 13.238 8.723 -26.727 389 HB2 TYR2328 HB2 TYR2328 14.958 10.377 -26.102 390 HB3 TYR2328 HB3 TYR2328 13.748 11.637 -26.099 391 HD1 TYR2328 HD1 TYR2328 14.835 8.495 -24.418 392 HD2 TYR2328 HD2 TYR2328 12.410 12.056 -24.103 393 HE1 TYR2328 HE1 TYR2328 14.486 8.059 -21.984 394 HE2 TYR2328 HE2 TYR2328 12.050 11.600 -21.692 395 HH TYR2328 HH TYR2328 12.507 10.220 -19.924 396 H GLU2329 H GLU2329 11.864 11.951 -26.282 397 HA GLU2329 HA GLU2329 9.271 11.063 -25.572 398 HB2 GLU2329 HB2 GLU2329 10.765 13.479 -25.607 399 HB3 GLU2329 HB3 GLU2329 9.357 13.803 -26.583 400 HG2 GLU2329 HG2 GLU2329 9.279 12.641 -23.776 401 HG3 GLU2329 HG3 GLU2329 9.154 14.357 -24.140 402 H ASP2330 H ASP2330 10.568 12.077 -28.703 403 HA ASP2330 HA ASP2330 8.078 12.134 -30.143 404 HB2 ASP2330 HB2 ASP2330 10.218 13.266 -30.761 405 HB3 ASP2330 HB3 ASP2330 10.886 11.691 -31.207 406 H CYS2331 H CYS2331 9.941 9.440 -29.007 407 HA CYS2331 HA CYS2331 8.714 7.561 -30.984 408 HB2 CYS2331 HB2 CYS2331 11.164 7.432 -30.555 409 HB3 CYS2331 HB3 CYS2331 10.836 7.091 -28.847 410 HG CYS2331 HG CYS2331 11.546 4.889 -30.105 411 H ILE2332 H ILE2332 8.910 8.208 -27.450 412 HA ILE2332 HA ILE2332 7.084 6.035 -26.818 413 HB ILE2332 HB ILE2332 7.301 6.662 -24.519 414 HG12 ILE2332 HG12 ILE2332 9.279 8.849 -25.116 415 HG13 ILE2332 HG13 ILE2332 7.565 9.263 -25.126 416 HG21 ILE2332 HG21 ILE2332 9.000 5.252 -25.594 417 HG22 ILE2332 HG22 ILE2332 9.992 6.687 -25.933 418 HG23 ILE2332 HG23 ILE2332 9.677 6.196 -24.259 419 HD11 ILE2332 3HD1 ILE2332 8.593 9.680 -22.947 420 HD12 ILE2332 1HD1 ILE2332 7.331 8.434 -22.825 421 HD13 ILE2332 2HD1 ILE2332 9.051 7.968 -22.808 422 H LYS2333 H LYS2333 5.906 8.033 -28.568 423 HA LYS2333 HA LYS2333 3.431 8.655 -27.045 424 HB2 LYS2333 HB2 LYS2333 3.219 10.839 -27.892 425 HB3 LYS2333 HB3 LYS2333 4.796 10.734 -27.116 426 HG2 LYS2333 HG2 LYS2333 5.815 10.400 -29.409 427 HG3 LYS2333 HG3 LYS2333 4.218 10.642 -30.112 428 HD2 LYS2333 HD2 LYS2333 5.631 12.741 -28.401 429 HD3 LYS2333 HD3 LYS2333 5.764 12.631 -30.147 430 HE2 LYS2333 HE2 LYS2333 4.152 14.270 -29.864 431 HE3 LYS2333 HE3 LYS2333 3.204 12.843 -30.263 432 HZ1 LYS2333 HZ3 LYS2333 2.297 14.133 -28.376 433 HZ2 LYS2333 HZ1 LYS2333 2.676 12.630 -27.883 434 HZ3 LYS2333 HZ2 LYS2333 3.655 13.885 -27.503 Start of MODEL 9 1 H VAL 515 H VAL 515 29.342 6.229 -19.297 2 HA VAL 515 HA VAL 515 28.033 8.037 -18.380 3 HB VAL 515 HB VAL 515 27.093 5.991 -16.339 4 HG11 VAL 515 HG11 VAL 515 27.433 8.233 -15.296 5 HG12 VAL 515 HG12 VAL 515 26.445 8.967 -16.584 6 HG13 VAL 515 HG13 VAL 515 25.725 7.828 -15.434 7 HG21 VAL 515 HG23 VAL 515 24.832 6.576 -17.226 8 HG22 VAL 515 HG21 VAL 515 25.589 7.549 -18.500 9 HG23 VAL 515 HG22 VAL 515 25.821 5.782 -18.443 10 H SER 516 H SER 516 29.483 5.664 -16.047 11 HA SER 516 HA SER 516 30.136 7.324 -14.127 12 HB2 SER 516 HB2 SER 516 31.904 4.992 -14.912 13 HB3 SER 516 HB3 SER 516 31.618 5.632 -13.280 14 HG SER 516 HG SER 516 30.326 3.777 -13.746 15 H LEU 517 H LEU 517 32.222 7.233 -16.957 16 HA LEU 517 HA LEU 517 33.830 9.420 -15.756 17 HB2 LEU 517 HB2 LEU 517 35.900 8.561 -16.494 18 HB3 LEU 517 HB3 LEU 517 35.151 7.369 -15.461 19 HG LEU 517 HG LEU 517 34.892 7.110 -18.481 20 HD11 LEU 517 1HD1 LEU 517 37.281 7.467 -18.063 21 HD12 LEU 517 2HD1 LEU 517 37.269 6.207 -16.808 22 HD13 LEU 517 3HD1 LEU 517 36.967 5.786 -18.511 23 HD21 LEU 517 3HD2 LEU 517 34.900 4.695 -17.966 24 HD22 LEU 517 1HD2 LEU 517 35.112 5.048 -16.239 25 HD23 LEU 517 2HD2 LEU 517 33.612 5.501 -17.073 26 H ILE 518 H ILE 518 31.634 9.142 -17.835 27 HA ILE 518 HA ILE 518 32.913 10.729 -20.028 28 HB ILE 518 HB ILE 518 30.682 8.717 -20.493 29 HG12 ILE 518 HG12 ILE 518 32.765 7.551 -21.798 30 HG13 ILE 518 HG13 ILE 518 33.668 8.260 -20.480 31 HG21 ILE 518 HG21 ILE 518 30.843 10.464 -22.222 32 HG22 ILE 518 HG22 ILE 518 32.583 10.147 -22.403 33 HG23 ILE 518 HG23 ILE 518 31.374 8.929 -22.868 34 HD11 ILE 518 3HD1 ILE 518 33.041 5.954 -19.974 35 HD12 ILE 518 1HD1 ILE 518 32.115 6.997 -18.884 36 HD13 ILE 518 2HD1 ILE 518 31.338 6.292 -20.317 37 H ASN 519 H ASN 519 30.561 10.626 -17.605 38 HA ASN 519 HA ASN 519 29.123 13.003 -18.681 39 HB2 ASN 519 HB2 ASN 519 27.970 10.638 -18.780 40 HB3 ASN 519 HB3 ASN 519 27.795 10.826 -17.038 41 HD21 ASN 519 2HD2 ASN 519 26.818 11.987 -20.217 42 HD22 ASN 519 1HD2 ASN 519 25.472 12.966 -19.634 43 H GLU 520 H GLU 520 31.419 13.075 -17.007 44 HA GLU 520 HA GLU 520 30.930 13.246 -14.211 45 HB2 GLU 520 HB2 GLU 520 32.962 14.569 -16.044 46 HB3 GLU 520 HB3 GLU 520 33.016 14.766 -14.298 47 HG2 GLU 520 HG2 GLU 520 33.025 11.985 -15.532 48 HG3 GLU 520 HG3 GLU 520 34.486 12.957 -15.435 49 H GLY 521 H GLY 521 30.621 14.952 -12.788 50 HA2 GLY 521 HA2 GLY 521 29.955 17.048 -12.026 51 HA3 GLY 521 HA3 GLY 521 29.961 17.665 -13.673 52 HA PRO 522 HA PRO 522 25.503 17.073 -12.238 53 HB2 PRO 522 HB2 PRO 522 24.673 19.677 -12.318 54 HB3 PRO 522 HB3 PRO 522 25.502 18.964 -10.901 55 HG2 PRO 522 HG2 PRO 522 26.723 20.619 -13.131 56 HG3 PRO 522 HG3 PRO 522 26.930 20.821 -11.362 57 HD2 PRO 522 HD2 PRO 522 28.744 19.481 -12.903 58 HD3 PRO 522 HD3 PRO 522 28.381 18.969 -11.228 59 H LEU 523 H LEU 523 23.656 17.146 -13.613 60 HA LEU 523 HA LEU 523 24.285 17.124 -16.426 61 HB2 LEU 523 HB2 LEU 523 22.242 16.115 -16.756 62 HB3 LEU 523 HB3 LEU 523 22.738 15.551 -15.198 63 HG LEU 523 HG LEU 523 21.064 17.932 -14.837 64 HD11 LEU 523 1HD1 LEU 523 20.181 17.314 -17.085 65 HD12 LEU 523 2HD1 LEU 523 19.810 15.691 -16.476 66 HD13 LEU 523 3HD1 LEU 523 18.981 17.113 -15.801 67 HD21 LEU 523 3HD2 LEU 523 19.667 16.399 -13.548 68 HD22 LEU 523 1HD2 LEU 523 20.550 15.003 -14.203 69 HD23 LEU 523 2HD2 LEU 523 21.376 16.170 -13.144 70 HA PRO 524 HA PRO 524 23.212 21.221 -17.645 71 HB2 PRO 524 HB2 PRO 524 22.139 20.912 -20.183 72 HB3 PRO 524 HB3 PRO 524 23.874 20.747 -19.777 73 HG2 PRO 524 HG2 PRO 524 21.803 18.556 -20.033 74 HG3 PRO 524 HG3 PRO 524 23.445 18.611 -20.748 75 HD2 PRO 524 HD2 PRO 524 22.923 17.258 -18.462 76 HD3 PRO 524 HD3 PRO 524 24.450 18.164 -18.649 77 HA PRO 525 HA PRO 525 19.203 22.131 -16.329 78 HB2 PRO 525 HB2 PRO 525 18.684 24.646 -17.290 79 HB3 PRO 525 HB3 PRO 525 19.960 24.287 -16.090 80 HG2 PRO 525 HG2 PRO 525 20.275 24.591 -19.095 81 HG3 PRO 525 HG3 PRO 525 21.242 25.360 -17.797 82 HD2 PRO 525 HD2 PRO 525 22.080 23.104 -19.056 83 HD3 PRO 525 HD3 PRO 525 22.357 23.340 -17.305 84 H GLY 526 H GLY 526 17.483 20.939 -16.961 85 HA2 GLY 526 HA2 GLY 526 15.515 20.408 -18.028 86 HA3 GLY 526 HA3 GLY 526 15.632 21.929 -18.915 87 H TRP 527 H TRP 527 18.099 19.419 -19.127 88 HA TRP 527 HA TRP 527 17.279 18.672 -21.918 89 HB2 TRP 527 HB2 TRP 527 19.938 19.507 -20.753 90 HB3 TRP 527 HB3 TRP 527 19.896 18.398 -22.106 91 HD1 TRP 527 HD1 TRP 527 19.509 22.039 -21.263 92 HE1 TRP 527 HE1 TRP 527 19.383 23.430 -23.412 93 HE3 TRP 527 HE3 TRP 527 19.138 18.235 -24.653 94 HZ2 TRP 527 HZ2 TRP 527 19.152 22.951 -26.252 95 HZ3 TRP 527 HZ3 TRP 527 18.967 18.728 -27.089 96 HH2 TRP 527 HH2 TRP 527 18.979 21.077 -27.895 97 H GLU 528 H GLU 528 18.003 16.623 -22.634 98 HA GLU 528 HA GLU 528 19.018 14.676 -20.615 99 HB2 GLU 528 HB2 GLU 528 16.758 14.061 -20.798 100 HB3 GLU 528 HB3 GLU 528 16.687 14.421 -22.509 101 HG2 GLU 528 HG2 GLU 528 16.492 12.095 -22.284 102 HG3 GLU 528 HG3 GLU 528 18.062 12.395 -22.998 103 H ILE 529 H ILE 529 20.338 13.035 -21.497 104 HA ILE 529 HA ILE 529 21.646 13.629 -24.105 105 HB ILE 529 HB ILE 529 23.345 13.242 -21.618 106 HG12 ILE 529 HG12 ILE 529 23.804 15.831 -21.942 107 HG13 ILE 529 HG13 ILE 529 22.160 15.856 -22.556 108 HG21 ILE 529 HG21 ILE 529 24.343 12.815 -23.819 109 HG22 ILE 529 HG22 ILE 529 23.863 14.432 -24.373 110 HG23 ILE 529 HG23 ILE 529 25.060 14.249 -23.073 111 HD11 ILE 529 3HD1 ILE 529 23.198 15.187 -19.789 112 HD12 ILE 529 1HD1 ILE 529 21.878 16.284 -20.261 113 HD13 ILE 529 2HD1 ILE 529 21.627 14.543 -20.268 114 H ARG 530 H ARG 530 22.018 11.775 -25.161 115 HA ARG 530 HA ARG 530 22.102 9.200 -23.621 116 HB2 ARG 530 HB2 ARG 530 20.415 9.591 -26.118 117 HB3 ARG 530 HB3 ARG 530 20.523 8.165 -25.098 118 HG2 ARG 530 HG2 ARG 530 19.675 10.223 -23.332 119 HG3 ARG 530 HG3 ARG 530 18.854 10.572 -24.838 120 HD2 ARG 530 HD2 ARG 530 17.295 9.167 -24.041 121 HD3 ARG 530 HD3 ARG 530 18.338 7.871 -24.611 122 HE ARG 530 HE ARG 530 18.060 8.941 -21.822 123 HH11 ARG 530 HH11 ARG 530 19.557 6.420 -23.783 124 HH12 ARG 530 HH12 ARG 530 20.105 5.557 -22.375 125 HH21 ARG 530 HH21 ARG 530 18.676 7.740 -20.131 126 HH22 ARG 530 HH22 ARG 530 19.588 6.269 -20.348 127 H TYR 531 H TYR 531 22.805 7.381 -24.851 128 HA TYR 531 HA TYR 531 24.925 8.040 -26.848 129 HB2 TYR 531 HB2 TYR 531 25.155 6.162 -24.470 130 HB3 TYR 531 HB3 TYR 531 26.392 6.491 -25.667 131 HD1 TYR 531 HD1 TYR 531 24.463 7.947 -22.819 132 HD2 TYR 531 HD2 TYR 531 27.880 8.372 -25.422 133 HE1 TYR 531 HE1 TYR 531 25.394 9.699 -21.314 134 HE2 TYR 531 HE2 TYR 531 28.832 10.082 -23.885 135 HH TYR 531 HH TYR 531 28.592 11.193 -21.894 136 H THR 532 H THR 532 24.185 7.070 -28.711 137 HA THR 532 HA THR 532 22.388 4.763 -28.655 138 HB THR 532 HB THR 532 22.658 4.787 -31.133 139 HG1 THR 532 HG1 THR 532 24.778 5.690 -31.174 140 HG21 THR 532 HG23 THR 532 21.555 6.952 -31.528 141 HG22 THR 532 HG21 THR 532 20.882 6.131 -30.108 142 HG23 THR 532 HG22 THR 532 22.003 7.492 -29.898 143 H ALA 533 H ALA 533 22.819 2.632 -29.215 144 HA ALA 533 HA ALA 533 25.225 1.506 -28.379 145 HB1 ALA 533 HB3 ALA 533 24.294 -0.590 -29.281 146 HB2 ALA 533 HB1 ALA 533 23.045 0.360 -28.458 147 HB3 ALA 533 HB2 ALA 533 23.112 0.328 -30.237 148 H ALA 534 H ALA 534 24.586 2.791 -31.540 149 HA ALA 534 HA ALA 534 26.694 1.444 -32.991 150 HB1 ALA 534 HB3 ALA 534 26.187 3.145 -34.700 151 HB2 ALA 534 HB1 ALA 534 24.711 2.404 -34.076 152 HB3 ALA 534 HB2 ALA 534 25.183 4.035 -33.529 153 H GLY 535 H GLY 535 26.905 3.855 -30.549 154 HA2 GLY 535 HA2 GLY 535 29.014 4.297 -29.611 155 HA3 GLY 535 HA3 GLY 535 29.795 4.171 -31.180 156 H GLU 536 H GLU 536 26.970 6.254 -30.330 157 HA GLU 536 HA GLU 536 28.659 8.699 -30.564 158 HB2 GLU 536 HB2 GLU 536 26.179 8.078 -32.219 159 HB3 GLU 536 HB3 GLU 536 26.843 9.693 -32.046 160 HG2 GLU 536 HG2 GLU 536 28.254 7.309 -33.308 161 HG3 GLU 536 HG3 GLU 536 27.492 8.646 -34.158 162 H ARG 537 H ARG 537 27.755 10.592 -29.712 163 HA ARG 537 HA ARG 537 25.608 10.187 -27.669 164 HB2 ARG 537 HB2 ARG 537 27.613 10.770 -26.579 165 HB3 ARG 537 HB3 ARG 537 28.024 12.012 -27.765 166 HG2 ARG 537 HG2 ARG 537 26.439 13.546 -26.925 167 HG3 ARG 537 HG3 ARG 537 25.533 12.298 -26.066 168 HD2 ARG 537 HD2 ARG 537 26.820 13.852 -24.607 169 HD3 ARG 537 HD3 ARG 537 27.090 12.127 -24.339 170 HE ARG 537 HE ARG 537 29.092 13.197 -26.119 171 HH11 ARG 537 HH11 ARG 537 28.254 13.300 -22.721 172 HH12 ARG 537 HH12 ARG 537 29.920 13.306 -22.201 173 HH21 ARG 537 HH21 ARG 537 31.210 13.318 -25.391 174 HH22 ARG 537 HH22 ARG 537 31.529 13.419 -23.685 175 H PHE 538 H PHE 538 23.908 11.478 -27.540 176 HA PHE 538 HA PHE 538 23.481 13.711 -29.473 177 HB2 PHE 538 HB2 PHE 538 21.622 11.346 -28.971 178 HB3 PHE 538 HB3 PHE 538 21.171 12.804 -29.837 179 HD1 PHE 538 HD2 PHE 538 22.084 13.328 -32.051 180 HD2 PHE 538 HD1 PHE 538 23.046 9.638 -30.048 181 HE1 PHE 538 HE2 PHE 538 22.833 12.336 -34.220 182 HE2 PHE 538 HE1 PHE 538 23.795 8.662 -32.205 183 HZ PHE 538 HZ PHE 538 23.684 10.022 -34.290 184 H PHE 539 H PHE 539 21.735 15.113 -28.870 185 HA PHE 539 HA PHE 539 21.130 15.160 -25.933 186 HB2 PHE 539 HB2 PHE 539 21.674 17.458 -27.838 187 HB3 PHE 539 HB3 PHE 539 21.196 17.617 -26.158 188 HD1 PHE 539 HD2 PHE 539 23.958 16.532 -28.414 189 HD2 PHE 539 HD1 PHE 539 22.778 17.417 -24.362 190 HE1 PHE 539 HE2 PHE 539 26.338 16.460 -27.705 191 HE2 PHE 539 HE1 PHE 539 25.162 17.377 -23.662 192 HZ PHE 539 HZ PHE 539 26.944 16.891 -25.330 193 H VAL 540 H VAL 540 19.156 15.862 -25.298 194 HA VAL 540 HA VAL 540 16.913 15.846 -27.287 195 HB VAL 540 HB VAL 540 17.210 14.325 -24.668 196 HG11 VAL 540 HG11 VAL 540 14.856 15.044 -25.046 197 HG12 VAL 540 HG12 VAL 540 14.892 14.263 -26.644 198 HG13 VAL 540 HG13 VAL 540 15.063 13.306 -25.148 199 HG21 VAL 540 HG23 VAL 540 17.057 12.275 -26.007 200 HG22 VAL 540 HG21 VAL 540 17.060 13.233 -27.501 201 HG23 VAL 540 HG22 VAL 540 18.485 13.213 -26.439 202 H ASP 541 H ASP 541 15.567 17.483 -27.044 203 HA ASP 541 HA ASP 541 15.505 19.067 -24.512 204 HB2 ASP 541 HB2 ASP 541 16.188 20.342 -26.455 205 HB3 ASP 541 HB3 ASP 541 14.798 19.770 -27.384 206 H HIS 542 H HIS 542 13.932 18.211 -23.224 207 HA HIS 542 HA HIS 542 11.456 17.089 -24.205 208 HB2 HIS 542 HB2 HIS 542 12.142 18.139 -21.435 209 HB3 HIS 542 HB3 HIS 542 10.792 17.083 -21.842 210 HD2 HIS 542 HD2 HIS 542 12.535 15.012 -23.727 211 HE1 HIS 542 HE1 HIS 542 14.526 14.154 -20.054 212 H ASN 543 H ASN 543 12.394 20.378 -23.774 213 HA ASN 543 HA ASN 543 9.834 21.469 -23.026 214 HB2 ASN 543 HB2 ASN 543 12.212 22.867 -24.322 215 HB3 ASN 543 HB3 ASN 543 10.905 23.624 -23.422 216 HD21 ASN 543 2HD2 ASN 543 13.990 22.109 -23.188 217 HD22 ASN 543 1HD2 ASN 543 14.055 21.995 -21.432 218 H THR 544 H THR 544 11.382 20.929 -26.169 219 HA THR 544 HA THR 544 8.815 21.598 -27.575 220 HB THR 544 HB THR 544 10.096 22.581 -29.381 221 HG1 THR 544 HG1 THR 544 12.356 22.040 -27.732 222 HG21 THR 544 HG23 THR 544 10.879 24.618 -28.375 223 HG22 THR 544 HG21 THR 544 9.423 24.082 -27.517 224 HG23 THR 544 HG22 THR 544 11.028 23.853 -26.781 225 H ARG 545 H ARG 545 10.570 19.053 -26.814 226 HA ARG 545 HA ARG 545 10.878 16.956 -27.512 227 HB2 ARG 545 HB2 ARG 545 8.415 17.520 -28.474 228 HB3 ARG 545 HB3 ARG 545 9.235 17.211 -30.004 229 HG2 ARG 545 HG2 ARG 545 10.071 15.004 -28.803 230 HG3 ARG 545 HG3 ARG 545 8.789 15.352 -27.639 231 HD2 ARG 545 HD2 ARG 545 8.508 14.924 -30.636 232 HD3 ARG 545 HD3 ARG 545 8.020 13.794 -29.360 233 HE ARG 545 HE ARG 545 6.575 16.092 -28.813 234 HH11 ARG 545 HH11 ARG 545 6.803 14.019 -31.674 235 HH12 ARG 545 HH12 ARG 545 5.163 14.388 -32.140 236 HH21 ARG 545 HH21 ARG 545 4.523 16.547 -29.553 237 HH22 ARG 545 HH22 ARG 545 3.922 15.766 -30.983 238 H ARG 546 H ARG 546 12.437 19.303 -28.823 239 HA ARG 546 HA ARG 546 13.418 18.197 -31.363 240 HB2 ARG 546 HB2 ARG 546 13.877 20.692 -29.737 241 HB3 ARG 546 HB3 ARG 546 15.185 20.190 -30.788 242 HG2 ARG 546 HG2 ARG 546 13.750 21.763 -31.952 243 HG3 ARG 546 HG3 ARG 546 13.743 20.185 -32.748 244 HD2 ARG 546 HD2 ARG 546 11.558 19.668 -31.636 245 HD3 ARG 546 HD3 ARG 546 11.576 21.293 -30.925 246 HE ARG 546 HE ARG 546 11.869 21.565 -33.729 247 HH11 ARG 546 HH11 ARG 546 9.401 20.534 -31.452 248 HH12 ARG 546 HH12 ARG 546 8.101 20.906 -32.561 249 HH21 ARG 546 HH21 ARG 546 10.161 22.027 -35.084 250 HH22 ARG 546 HH22 ARG 546 8.528 21.743 -34.559 251 H THR 547 H THR 547 15.706 17.995 -31.805 252 HA THR 547 HA THR 547 17.402 16.879 -29.656 253 HB THR 547 HB THR 547 17.942 14.911 -31.146 254 HG1 THR 547 HG1 THR 547 16.975 15.699 -33.071 255 HG21 THR 547 HG23 THR 547 16.083 13.536 -30.462 256 HG22 THR 547 HG21 THR 547 16.445 14.685 -29.168 257 HG23 THR 547 HG22 THR 547 15.041 14.949 -30.225 258 H THR 548 H THR 548 19.649 16.651 -30.276 259 HA THR 548 HA THR 548 20.548 17.679 -32.864 260 HB THR 548 HB THR 548 20.064 19.790 -31.854 261 HG1 THR 548 HG1 THR 548 22.041 20.714 -32.028 262 HG21 THR 548 HG23 THR 548 21.241 20.585 -29.805 263 HG22 THR 548 HG21 THR 548 20.058 19.309 -29.481 264 HG23 THR 548 HG22 THR 548 21.787 18.919 -29.520 265 H PHE 549 H PHE 549 22.889 17.773 -33.045 266 HA PHE 549 HA PHE 549 24.053 15.274 -32.023 267 HB2 PHE 549 HB2 PHE 549 25.285 17.275 -33.933 268 HB3 PHE 549 HB3 PHE 549 25.637 15.560 -33.797 269 HD1 PHE 549 HD1 PHE 549 22.647 14.607 -33.823 270 HD2 PHE 549 HD2 PHE 549 24.872 17.362 -36.274 271 HE1 PHE 549 HE1 PHE 549 21.103 14.165 -35.709 272 HE2 PHE 549 HE2 PHE 549 23.319 16.929 -38.160 273 HZ PHE 549 HZ PHE 549 21.432 15.329 -37.884 274 H GLU 550 H GLU 550 24.205 18.558 -31.104 275 HA GLU 550 HA GLU 550 26.608 18.232 -29.428 276 HB2 GLU 550 HB2 GLU 550 27.788 20.105 -30.404 277 HB3 GLU 550 HB3 GLU 550 27.511 18.874 -31.622 278 HG2 GLU 550 HG2 GLU 550 25.574 20.214 -32.507 279 HG3 GLU 550 HG3 GLU 550 25.944 21.471 -31.326 280 H ASP 551 H ASP 551 26.968 20.931 -28.741 281 HA ASP 551 HA ASP 551 24.338 21.709 -27.532 282 HB2 ASP 551 HB2 ASP 551 25.792 20.699 -25.880 283 HB3 ASP 551 HB3 ASP 551 27.092 21.819 -26.289 284 HA PRO 552 HA PRO 552 25.876 25.228 -30.155 285 HB2 PRO 552 HB2 PRO 552 23.606 25.762 -31.550 286 HB3 PRO 552 HB3 PRO 552 24.644 24.360 -31.940 287 HG2 PRO 552 HG2 PRO 552 22.133 24.391 -30.230 288 HG3 PRO 552 HG3 PRO 552 22.520 23.305 -31.605 289 HD2 PRO 552 HD2 PRO 552 22.963 22.597 -28.999 290 HD3 PRO 552 HD3 PRO 552 24.036 22.066 -30.324 291 H ARG 553 H ARG 553 24.811 27.494 -30.430 292 HA ARG 553 HA ARG 553 24.169 28.747 -27.952 293 HB2 ARG 553 HB2 ARG 553 23.921 29.531 -30.875 294 HB3 ARG 553 HB3 ARG 553 23.185 30.552 -29.641 295 HG2 ARG 553 HG2 ARG 553 25.326 30.786 -28.467 296 HG3 ARG 553 HG3 ARG 553 26.131 29.768 -29.680 297 HD2 ARG 553 HD2 ARG 553 25.706 31.380 -31.426 298 HD3 ARG 553 HD3 ARG 553 24.624 32.321 -30.380 299 HE ARG 553 HE ARG 553 27.114 32.243 -29.073 300 HH11 ARG 553 HH11 ARG 553 25.904 33.600 -32.070 301 HH12 ARG 553 HH12 ARG 553 27.010 34.945 -32.014 302 HH21 ARG 553 HH21 ARG 553 28.478 33.998 -29.050 303 HH22 ARG 553 HH22 ARG 553 28.426 35.158 -30.344 304 HA PRO 554 HA PRO 554 20.007 27.773 -27.197 305 HB2 PRO 554 HB2 PRO 554 19.053 29.922 -25.781 306 HB3 PRO 554 HB3 PRO 554 20.306 28.805 -25.162 307 HG2 PRO 554 HG2 PRO 554 20.719 31.487 -26.526 308 HG3 PRO 554 HG3 PRO 554 21.429 30.911 -24.982 309 HD2 PRO 554 HD2 PRO 554 22.805 30.747 -27.308 310 HD3 PRO 554 HD3 PRO 554 22.892 29.429 -26.102 311 H GLY 555 H GLY 555 20.542 30.539 -29.247 312 HA2 GLY 555 HA2 GLY 555 19.270 31.009 -31.189 313 HA3 GLY 555 HA3 GLY 555 17.879 30.169 -30.515 314 H ALA 556 H ALA 556 19.710 33.168 -30.552 315 HA ALA 556 HA ALA 556 17.420 34.662 -29.351 316 HB1 ALA 556 HB3 ALA 556 19.024 35.999 -28.070 317 HB2 ALA 556 HB1 ALA 556 19.143 34.283 -27.643 318 HB3 ALA 556 HB2 ALA 556 20.370 35.020 -28.697 319 HA PRO 557 HA PRO 557 18.831 36.510 -33.469 320 HB2 PRO 557 HB2 PRO 557 16.456 36.380 -34.824 321 HB3 PRO 557 HB3 PRO 557 17.633 35.033 -34.765 322 HG2 PRO 557 HG2 PRO 557 15.157 35.419 -33.054 323 HG3 PRO 557 HG3 PRO 557 15.679 33.946 -33.933 324 HD2 PRO 557 HD2 PRO 557 16.188 34.297 -31.282 325 HD3 PRO 557 HD3 PRO 557 17.362 33.487 -32.362 326 H ASN2319 H ASN2319 34.533 16.182 -37.177 327 HA ASN2319 HA ASN2319 31.938 17.315 -37.985 328 HB2 ASN2319 HB2 ASN2319 33.827 15.494 -39.558 329 HB3 ASN2319 HB3 ASN2319 32.148 15.791 -39.986 330 HD21 ASN2319 2HD2 ASN2319 32.313 17.018 -41.894 331 HD22 ASN2319 1HD2 ASN2319 33.204 18.527 -41.962 332 H THR2320 H THR2320 30.276 15.677 -38.344 333 HA THR2320 HA THR2320 30.587 13.088 -36.900 334 HB THR2320 HB THR2320 28.268 13.417 -35.971 335 HG1 THR2320 HG1 THR2320 27.543 15.133 -37.191 336 HG21 THR2320 HG23 THR2320 30.274 15.464 -34.955 337 HG22 THR2320 HG21 THR2320 28.912 14.757 -34.065 338 HG23 THR2320 HG22 THR2320 30.273 13.730 -34.550 339 H GLY2321 H GLY2321 28.773 11.573 -37.436 340 HA2 GLY2321 HA2 GLY2321 27.979 11.853 -40.323 341 HA3 GLY2321 HA3 GLY2321 28.524 10.362 -39.576 342 H ALA2322 H ALA2322 26.245 10.393 -40.989 343 HA ALA2322 HA ALA2322 23.853 10.853 -39.439 344 HB1 ALA2322 HB3 ALA2322 22.731 10.003 -41.449 345 HB2 ALA2322 HB1 ALA2322 23.972 11.197 -41.865 346 HB3 ALA2322 HB2 ALA2322 24.290 9.463 -42.114 347 H LYS2323 H LYS2323 24.953 9.431 -37.676 348 HA LYS2323 HA LYS2323 24.432 6.565 -37.674 349 HB2 LYS2323 HB2 LYS2323 25.824 8.355 -36.040 350 HB3 LYS2323 HB3 LYS2323 24.369 8.082 -35.108 351 HG2 LYS2323 HG2 LYS2323 25.775 6.492 -34.262 352 HG3 LYS2323 HG3 LYS2323 24.874 5.535 -35.431 353 HD2 LYS2323 HD2 LYS2323 27.621 6.778 -35.956 354 HD3 LYS2323 HD3 LYS2323 27.378 5.150 -35.330 355 HE2 LYS2323 HE2 LYS2323 26.057 4.581 -37.389 356 HE3 LYS2323 HE3 LYS2323 26.442 6.184 -38.040 357 HZ1 LYS2323 HZ3 LYS2323 27.997 4.495 -38.838 358 HZ2 LYS2323 HZ1 LYS2323 28.801 5.589 -37.934 359 HZ3 LYS2323 HZ2 LYS2323 28.452 4.115 -37.320 360 H GLN2324 H GLN2324 22.931 5.844 -35.647 361 HA GLN2324 HA GLN2324 20.295 5.878 -36.543 362 HB2 GLN2324 HB2 GLN2324 21.372 5.459 -33.727 363 HB3 GLN2324 HB3 GLN2324 19.692 5.174 -34.192 364 HG2 GLN2324 HG2 GLN2324 20.444 3.515 -35.897 365 HG3 GLN2324 HG3 GLN2324 22.112 3.727 -35.350 366 HE21 GLN2324 HE22 GLN2324 22.668 2.990 -33.156 367 HE22 GLN2324 HE21 GLN2324 21.625 1.817 -32.353 368 HA PRO2325 HA PRO2325 18.956 9.971 -35.479 369 HB2 PRO2325 HB2 PRO2325 16.227 9.762 -35.741 370 HB3 PRO2325 HB3 PRO2325 17.369 9.793 -37.118 371 HG2 PRO2325 HG2 PRO2325 16.114 7.373 -35.793 372 HG3 PRO2325 HG3 PRO2325 16.256 7.733 -37.542 373 HD2 PRO2325 HD2 PRO2325 18.009 6.091 -36.247 374 HD3 PRO2325 HD3 PRO2325 18.545 7.176 -37.566 375 HA PRO2326 HA PRO2326 17.926 9.396 -31.081 376 HB2 PRO2326 HB2 PRO2326 17.976 11.995 -30.248 377 HB3 PRO2326 HB3 PRO2326 19.452 11.062 -30.633 378 HG2 PRO2326 HG2 PRO2326 17.959 12.987 -32.444 379 HG3 PRO2326 HG3 PRO2326 19.710 12.951 -32.091 380 HD2 PRO2326 HD2 PRO2326 18.635 11.796 -34.311 381 HD3 PRO2326 HD3 PRO2326 20.017 11.040 -33.458 382 H SER2327 H SER2327 15.938 8.937 -30.435 383 HA SER2327 HA SER2327 13.651 10.802 -30.781 384 HB2 SER2327 HB2 SER2327 13.636 7.922 -31.777 385 HB3 SER2327 HB3 SER2327 12.204 8.952 -31.587 386 HG SER2327 HG SER2327 12.977 8.968 -33.734 387 H TYR2328 H TYR2328 13.972 11.060 -28.493 388 HA TYR2328 HA TYR2328 13.487 8.749 -26.723 389 HB2 TYR2328 HB2 TYR2328 15.118 10.503 -26.159 390 HB3 TYR2328 HB3 TYR2328 13.839 11.703 -26.141 391 HD1 TYR2328 HD1 TYR2328 14.873 8.448 -24.551 392 HD2 TYR2328 HD2 TYR2328 12.759 12.177 -24.081 393 HE1 TYR2328 HE1 TYR2328 14.516 7.943 -22.140 394 HE2 TYR2328 HE2 TYR2328 12.358 11.644 -21.675 395 HH TYR2328 HH TYR2328 13.594 8.645 -20.159 396 H GLU2329 H GLU2329 11.828 11.887 -26.262 397 HA GLU2329 HA GLU2329 9.293 10.691 -25.696 398 HB2 GLU2329 HB2 GLU2329 10.128 13.509 -26.382 399 HB3 GLU2329 HB3 GLU2329 8.428 13.067 -26.161 400 HG2 GLU2329 HG2 GLU2329 8.961 12.121 -23.919 401 HG3 GLU2329 HG3 GLU2329 10.615 12.710 -24.080 402 H ASP2330 H ASP2330 10.603 11.940 -28.773 403 HA ASP2330 HA ASP2330 8.143 11.731 -30.206 404 HB2 ASP2330 HB2 ASP2330 10.304 13.026 -30.784 405 HB3 ASP2330 HB3 ASP2330 10.896 11.506 -31.457 406 H CYS2331 H CYS2331 10.052 9.185 -29.033 407 HA CYS2331 HA CYS2331 8.848 7.223 -30.946 408 HB2 CYS2331 HB2 CYS2331 11.296 7.082 -30.493 409 HB3 CYS2331 HB3 CYS2331 10.947 6.817 -28.777 410 HG CYS2331 HG CYS2331 9.990 5.028 -31.419 411 H ILE2332 H ILE2332 9.017 8.044 -27.419 412 HA ILE2332 HA ILE2332 7.162 5.878 -26.807 413 HB ILE2332 HB ILE2332 7.398 6.444 -24.501 414 HG12 ILE2332 HG12 ILE2332 9.357 8.650 -25.121 415 HG13 ILE2332 HG13 ILE2332 7.638 9.021 -24.954 416 HG21 ILE2332 HG21 ILE2332 9.096 5.040 -25.642 417 HG22 ILE2332 HG22 ILE2332 10.108 6.477 -25.896 418 HG23 ILE2332 HG23 ILE2332 9.763 5.909 -24.254 419 HD11 ILE2332 3HD1 ILE2332 8.804 9.389 -22.843 420 HD12 ILE2332 1HD1 ILE2332 7.640 8.059 -22.677 421 HD13 ILE2332 2HD1 ILE2332 9.379 7.712 -22.823 422 H LYS2333 H LYS2333 6.496 9.060 -27.805 423 HA LYS2333 HA LYS2333 3.658 8.649 -26.982 424 HB2 LYS2333 HB2 LYS2333 3.283 10.932 -26.545 425 HB3 LYS2333 HB3 LYS2333 4.611 10.405 -25.527 426 HG2 LYS2333 HG2 LYS2333 6.099 11.856 -26.472 427 HG3 LYS2333 HG3 LYS2333 5.490 11.607 -28.109 428 HD2 LYS2333 HD2 LYS2333 5.135 13.903 -27.468 429 HD3 LYS2333 HD3 LYS2333 3.578 13.086 -27.661 430 HE2 LYS2333 HE2 LYS2333 3.495 12.772 -25.157 431 HE3 LYS2333 HE3 LYS2333 4.997 13.695 -25.023 432 HZ1 LYS2333 HZ3 LYS2333 3.042 15.102 -24.674 433 HZ2 LYS2333 HZ1 LYS2333 3.829 15.600 -26.012 434 HZ3 LYS2333 HZ2 LYS2333 2.445 14.737 -26.146 Start of MODEL 10 1 H VAL 515 H VAL 515 36.268 14.326 -23.213 2 HA VAL 515 HA VAL 515 34.527 15.797 -22.394 3 HB VAL 515 HB VAL 515 32.608 13.925 -23.826 4 HG11 VAL 515 HG11 VAL 515 31.677 14.755 -21.666 5 HG12 VAL 515 HG12 VAL 515 32.071 16.423 -22.150 6 HG13 VAL 515 HG13 VAL 515 30.863 15.484 -23.046 7 HG21 VAL 515 HG23 VAL 515 31.959 15.995 -25.071 8 HG22 VAL 515 HG21 VAL 515 33.317 16.856 -24.328 9 HG23 VAL 515 HG22 VAL 515 33.602 15.492 -25.441 10 H SER 516 H SER 516 33.862 12.242 -22.596 11 HA SER 516 HA SER 516 32.412 11.963 -20.425 12 HB2 SER 516 HB2 SER 516 34.409 9.869 -21.323 13 HB3 SER 516 HB3 SER 516 32.821 9.601 -20.576 14 HG SER 516 HG SER 516 32.746 9.374 -22.862 15 H LEU 517 H LEU 517 35.870 12.301 -20.015 16 HA LEU 517 HA LEU 517 35.485 12.079 -17.079 17 HB2 LEU 517 HB2 LEU 517 37.471 10.848 -16.726 18 HB3 LEU 517 HB3 LEU 517 36.438 9.930 -17.794 19 HG LEU 517 HG LEU 517 38.661 11.640 -18.972 20 HD11 LEU 517 1HD1 LEU 517 39.733 10.349 -17.191 21 HD12 LEU 517 2HD1 LEU 517 38.996 8.851 -17.803 22 HD13 LEU 517 3HD1 LEU 517 40.199 9.729 -18.780 23 HD21 LEU 517 3HD2 LEU 517 38.719 9.852 -20.670 24 HD22 LEU 517 1HD2 LEU 517 37.458 8.958 -19.795 25 HD23 LEU 517 2HD2 LEU 517 37.092 10.520 -20.553 26 H ILE 518 H ILE 518 35.845 14.279 -19.145 27 HA ILE 518 HA ILE 518 38.054 15.795 -17.799 28 HB ILE 518 HB ILE 518 37.325 15.943 -20.751 29 HG12 ILE 518 HG12 ILE 518 39.930 15.064 -20.732 30 HG13 ILE 518 HG13 ILE 518 39.344 14.246 -19.299 31 HG21 ILE 518 HG21 ILE 518 38.247 18.061 -19.953 32 HG22 ILE 518 HG22 ILE 518 39.605 17.212 -19.176 33 HG23 ILE 518 HG23 ILE 518 39.438 17.244 -20.946 34 HD11 ILE 518 3HD1 ILE 518 39.138 12.814 -21.268 35 HD12 ILE 518 1HD1 ILE 518 37.499 13.240 -20.745 36 HD13 ILE 518 2HD1 ILE 518 38.234 14.063 -22.138 37 H ASN 519 H ASN 519 34.733 15.736 -18.807 38 HA ASN 519 HA ASN 519 34.357 18.583 -17.983 39 HB2 ASN 519 HB2 ASN 519 34.059 17.759 -20.474 40 HB3 ASN 519 HB3 ASN 519 32.546 17.074 -19.884 41 HD21 ASN 519 2HD2 ASN 519 34.434 20.112 -20.151 42 HD22 ASN 519 1HD2 ASN 519 33.019 21.151 -20.207 43 H GLU 520 H GLU 520 34.332 16.178 -16.255 44 HA GLU 520 HA GLU 520 31.755 15.269 -15.538 45 HB2 GLU 520 HB2 GLU 520 34.329 15.612 -13.958 46 HB3 GLU 520 HB3 GLU 520 32.905 14.838 -13.272 47 HG2 GLU 520 HG2 GLU 520 34.094 13.827 -15.883 48 HG3 GLU 520 HG3 GLU 520 34.783 13.382 -14.329 49 H GLY 521 H GLY 521 30.149 15.918 -14.225 50 HA2 GLY 521 HA2 GLY 521 30.068 17.800 -12.171 51 HA3 GLY 521 HA3 GLY 521 29.833 18.722 -13.660 52 HA PRO 522 HA PRO 522 25.660 16.984 -12.314 53 HB2 PRO 522 HB2 PRO 522 24.315 19.359 -12.066 54 HB3 PRO 522 HB3 PRO 522 25.281 18.636 -10.744 55 HG2 PRO 522 HG2 PRO 522 26.127 20.790 -12.704 56 HG3 PRO 522 HG3 PRO 522 26.310 20.783 -10.921 57 HD2 PRO 522 HD2 PRO 522 28.340 20.063 -12.590 58 HD3 PRO 522 HD3 PRO 522 28.095 19.243 -11.019 59 H LEU 523 H LEU 523 23.723 16.975 -13.616 60 HA LEU 523 HA LEU 523 24.297 17.105 -16.399 61 HB2 LEU 523 HB2 LEU 523 22.251 16.054 -16.741 62 HB3 LEU 523 HB3 LEU 523 22.824 15.455 -15.220 63 HG LEU 523 HG LEU 523 21.110 17.744 -14.666 64 HD11 LEU 523 1HD1 LEU 523 20.174 17.294 -16.938 65 HD12 LEU 523 2HD1 LEU 523 19.831 15.625 -16.446 66 HD13 LEU 523 3HD1 LEU 523 19.009 16.983 -15.643 67 HD21 LEU 523 3HD2 LEU 523 19.757 16.089 -13.477 68 HD22 LEU 523 1HD2 LEU 523 20.650 14.766 -14.258 69 HD23 LEU 523 2HD2 LEU 523 21.479 15.863 -13.128 70 HA PRO 524 HA PRO 524 23.164 21.158 -17.605 71 HB2 PRO 524 HB2 PRO 524 22.111 20.844 -20.157 72 HB3 PRO 524 HB3 PRO 524 23.844 20.730 -19.732 73 HG2 PRO 524 HG2 PRO 524 21.848 18.475 -20.039 74 HG3 PRO 524 HG3 PRO 524 23.504 18.587 -20.714 75 HD2 PRO 524 HD2 PRO 524 22.978 17.200 -18.450 76 HD3 PRO 524 HD3 PRO 524 24.475 18.161 -18.596 77 HA PRO 525 HA PRO 525 19.174 22.000 -16.247 78 HB2 PRO 525 HB2 PRO 525 18.634 24.542 -17.133 79 HB3 PRO 525 HB3 PRO 525 19.911 24.151 -15.944 80 HG2 PRO 525 HG2 PRO 525 20.225 24.551 -18.938 81 HG3 PRO 525 HG3 PRO 525 21.189 25.282 -17.616 82 HD2 PRO 525 HD2 PRO 525 22.041 23.072 -18.944 83 HD3 PRO 525 HD3 PRO 525 22.308 23.249 -17.183 84 H GLY 526 H GLY 526 17.461 20.819 -16.892 85 HA2 GLY 526 HA2 GLY 526 15.471 20.327 -17.939 86 HA3 GLY 526 HA3 GLY 526 15.605 21.836 -18.845 87 H TRP 527 H TRP 527 18.135 19.418 -19.089 88 HA TRP 527 HA TRP 527 17.253 18.611 -21.846 89 HB2 TRP 527 HB2 TRP 527 19.943 19.407 -20.719 90 HB3 TRP 527 HB3 TRP 527 19.847 18.335 -22.099 91 HD1 TRP 527 HD1 TRP 527 19.464 21.960 -21.143 92 HE1 TRP 527 HE1 TRP 527 19.330 23.408 -23.255 93 HE3 TRP 527 HE3 TRP 527 19.084 18.247 -24.632 94 HZ2 TRP 527 HZ2 TRP 527 19.126 23.002 -26.110 95 HZ3 TRP 527 HZ3 TRP 527 18.932 18.800 -27.054 96 HH2 TRP 527 HH2 TRP 527 18.962 21.169 -27.802 97 H GLU 528 H GLU 528 18.033 16.579 -22.575 98 HA GLU 528 HA GLU 528 19.004 14.613 -20.563 99 HB2 GLU 528 HB2 GLU 528 16.674 14.155 -20.738 100 HB3 GLU 528 HB3 GLU 528 16.667 14.356 -22.477 101 HG2 GLU 528 HG2 GLU 528 16.404 12.056 -22.034 102 HG3 GLU 528 HG3 GLU 528 18.012 12.242 -22.700 103 H ILE 529 H ILE 529 20.242 12.899 -21.497 104 HA ILE 529 HA ILE 529 21.501 13.471 -24.129 105 HB ILE 529 HB ILE 529 23.264 13.019 -21.703 106 HG12 ILE 529 HG12 ILE 529 23.774 15.605 -22.000 107 HG13 ILE 529 HG13 ILE 529 22.117 15.685 -22.566 108 HG21 ILE 529 HG21 ILE 529 24.169 12.660 -23.990 109 HG22 ILE 529 HG22 ILE 529 23.743 14.333 -24.414 110 HG23 ILE 529 HG23 ILE 529 24.964 14.004 -23.167 111 HD11 ILE 529 3HD1 ILE 529 22.075 16.160 -20.226 112 HD12 ILE 529 1HD1 ILE 529 21.502 14.498 -20.301 113 HD13 ILE 529 2HD1 ILE 529 23.180 14.822 -19.843 114 H ARG 530 H ARG 530 22.090 11.654 -25.179 115 HA ARG 530 HA ARG 530 21.884 8.997 -23.783 116 HB2 ARG 530 HB2 ARG 530 20.538 9.895 -26.365 117 HB3 ARG 530 HB3 ARG 530 20.577 8.229 -25.818 118 HG2 ARG 530 HG2 ARG 530 19.401 10.243 -23.893 119 HG3 ARG 530 HG3 ARG 530 18.523 9.929 -25.376 120 HD2 ARG 530 HD2 ARG 530 17.652 8.500 -23.675 121 HD3 ARG 530 HD3 ARG 530 18.473 7.522 -24.899 122 HE ARG 530 HE ARG 530 20.112 8.226 -22.552 123 HH11 ARG 530 HH11 ARG 530 17.807 5.862 -23.734 124 HH12 ARG 530 HH12 ARG 530 18.362 4.632 -22.635 125 HH21 ARG 530 HH21 ARG 530 20.803 6.574 -21.201 126 HH22 ARG 530 HH22 ARG 530 20.005 5.031 -21.249 127 H TYR 531 H TYR 531 22.932 7.288 -24.762 128 HA TYR 531 HA TYR 531 25.155 7.968 -26.657 129 HB2 TYR 531 HB2 TYR 531 25.218 6.238 -24.154 130 HB3 TYR 531 HB3 TYR 531 26.508 6.348 -25.336 131 HD1 TYR 531 HD2 TYR 531 24.663 8.210 -22.693 132 HD2 TYR 531 HD1 TYR 531 28.066 8.184 -25.349 133 HE1 TYR 531 HE2 TYR 531 25.687 10.066 -21.394 134 HE2 TYR 531 HE1 TYR 531 29.109 10.015 -24.016 135 HH TYR 531 HH TYR 531 27.504 11.443 -21.148 136 H THR 532 H THR 532 24.421 7.057 -28.505 137 HA THR 532 HA THR 532 22.725 4.686 -28.493 138 HB THR 532 HB THR 532 22.663 4.918 -30.897 139 HG1 THR 532 HG1 THR 532 24.508 7.041 -30.591 140 HG21 THR 532 HG23 THR 532 21.801 7.245 -31.096 141 HG22 THR 532 HG21 THR 532 21.163 6.383 -29.686 142 HG23 THR 532 HG22 THR 532 22.432 7.605 -29.482 143 H ALA 533 H ALA 533 23.102 2.708 -29.658 144 HA ALA 533 HA ALA 533 25.502 1.425 -28.936 145 HB1 ALA 533 HB3 ALA 533 24.548 -0.494 -30.143 146 HB2 ALA 533 HB1 ALA 533 23.313 0.327 -29.175 147 HB3 ALA 533 HB2 ALA 533 23.368 0.571 -30.938 148 H ALA 534 H ALA 534 24.995 3.342 -31.773 149 HA ALA 534 HA ALA 534 27.100 2.157 -33.413 150 HB1 ALA 534 HB3 ALA 534 26.794 4.223 -34.748 151 HB2 ALA 534 HB1 ALA 534 25.253 3.423 -34.410 152 HB3 ALA 534 HB2 ALA 534 25.724 4.882 -33.493 153 H GLY 535 H GLY 535 27.214 3.950 -30.510 154 HA2 GLY 535 HA2 GLY 535 29.113 4.670 -29.358 155 HA3 GLY 535 HA3 GLY 535 30.082 4.609 -30.834 156 H GLU 536 H GLU 536 26.940 6.267 -30.604 157 HA GLU 536 HA GLU 536 28.311 8.906 -30.994 158 HB2 GLU 536 HB2 GLU 536 25.842 7.860 -32.431 159 HB3 GLU 536 HB3 GLU 536 26.535 9.477 -32.575 160 HG2 GLU 536 HG2 GLU 536 28.706 8.321 -33.325 161 HG3 GLU 536 HG3 GLU 536 27.759 6.838 -33.465 162 H ARG 537 H ARG 537 27.824 10.379 -29.559 163 HA ARG 537 HA ARG 537 25.562 10.087 -27.704 164 HB2 ARG 537 HB2 ARG 537 27.834 10.783 -26.949 165 HB3 ARG 537 HB3 ARG 537 27.683 12.274 -27.896 166 HG2 ARG 537 HG2 ARG 537 25.801 13.020 -26.488 167 HG3 ARG 537 HG3 ARG 537 25.752 11.443 -25.696 168 HD2 ARG 537 HD2 ARG 537 26.905 12.447 -24.089 169 HD3 ARG 537 HD3 ARG 537 28.305 12.091 -25.081 170 HE ARG 537 HE ARG 537 27.035 14.693 -24.532 171 HH11 ARG 537 HH11 ARG 537 29.369 13.173 -26.660 172 HH12 ARG 537 HH12 ARG 537 30.271 14.649 -26.856 173 HH21 ARG 537 HH21 ARG 537 28.350 16.459 -24.664 174 HH22 ARG 537 HH22 ARG 537 29.666 16.478 -25.796 175 H PHE 538 H PHE 538 23.812 11.391 -27.559 176 HA PHE 538 HA PHE 538 23.461 13.709 -29.393 177 HB2 PHE 538 HB2 PHE 538 21.483 11.413 -29.097 178 HB3 PHE 538 HB3 PHE 538 21.143 12.936 -29.898 179 HD1 PHE 538 HD1 PHE 538 22.939 9.729 -30.165 180 HD2 PHE 538 HD2 PHE 538 22.049 13.465 -32.118 181 HE1 PHE 538 HE1 PHE 538 23.687 8.774 -32.329 182 HE2 PHE 538 HE2 PHE 538 22.804 12.508 -34.286 183 HZ PHE 538 HZ PHE 538 23.627 10.161 -34.387 184 H PHE 539 H PHE 539 21.655 15.051 -28.784 185 HA PHE 539 HA PHE 539 21.035 15.042 -25.853 186 HB2 PHE 539 HB2 PHE 539 21.425 17.380 -27.748 187 HB3 PHE 539 HB3 PHE 539 20.960 17.495 -26.066 188 HD1 PHE 539 HD1 PHE 539 23.768 16.641 -28.352 189 HD2 PHE 539 HD2 PHE 539 22.552 17.438 -24.292 190 HE1 PHE 539 HE1 PHE 539 26.142 16.972 -27.707 191 HE2 PHE 539 HE2 PHE 539 24.925 17.788 -23.651 192 HZ PHE 539 HZ PHE 539 26.713 17.609 -25.370 193 H VAL 540 H VAL 540 19.053 15.843 -25.232 194 HA VAL 540 HA VAL 540 16.799 15.846 -27.203 195 HB VAL 540 HB VAL 540 17.098 14.255 -24.624 196 HG11 VAL 540 HG11 VAL 540 14.754 15.036 -24.947 197 HG12 VAL 540 HG12 VAL 540 14.748 14.281 -26.560 198 HG13 VAL 540 HG13 VAL 540 14.926 13.296 -25.082 199 HG21 VAL 540 HG23 VAL 540 16.845 12.247 -26.051 200 HG22 VAL 540 HG21 VAL 540 16.932 13.279 -27.496 201 HG23 VAL 540 HG22 VAL 540 18.322 13.140 -26.397 202 H ASP 541 H ASP 541 15.441 17.485 -26.879 203 HA ASP 541 HA ASP 541 15.465 18.988 -24.292 204 HB2 ASP 541 HB2 ASP 541 16.185 20.333 -26.163 205 HB3 ASP 541 HB3 ASP 541 14.793 19.832 -27.129 206 H HIS 542 H HIS 542 13.876 18.156 -23.031 207 HA HIS 542 HA HIS 542 11.372 17.118 -24.024 208 HB2 HIS 542 HB2 HIS 542 12.133 18.055 -21.233 209 HB3 HIS 542 HB3 HIS 542 10.740 17.059 -21.645 210 HD2 HIS 542 HD2 HIS 542 12.321 14.984 -23.636 211 HE1 HIS 542 HE1 HIS 542 14.449 13.953 -20.088 212 H ASN 543 H ASN 543 12.363 20.384 -23.574 213 HA ASN 543 HA ASN 543 9.788 21.491 -22.838 214 HB2 ASN 543 HB2 ASN 543 12.211 22.878 -24.062 215 HB3 ASN 543 HB3 ASN 543 10.874 23.644 -23.217 216 HD21 ASN 543 2HD2 ASN 543 13.933 22.087 -22.858 217 HD22 ASN 543 1HD2 ASN 543 13.936 22.021 -21.098 218 H THR 544 H THR 544 11.397 20.927 -25.947 219 HA THR 544 HA THR 544 8.884 21.691 -27.406 220 HB THR 544 HB THR 544 10.238 22.639 -29.171 221 HG1 THR 544 HG1 THR 544 12.456 22.027 -27.491 222 HG21 THR 544 HG23 THR 544 11.117 24.621 -28.132 223 HG22 THR 544 HG21 THR 544 9.625 24.154 -27.295 224 HG23 THR 544 HG22 THR 544 11.207 23.830 -26.546 225 H ARG 545 H ARG 545 10.700 19.087 -26.699 226 HA ARG 545 HA ARG 545 10.987 17.015 -27.463 227 HB2 ARG 545 HB2 ARG 545 8.504 17.704 -28.559 228 HB3 ARG 545 HB3 ARG 545 9.393 17.074 -29.941 229 HG2 ARG 545 HG2 ARG 545 9.983 15.056 -28.422 230 HG3 ARG 545 HG3 ARG 545 8.785 15.707 -27.291 231 HD2 ARG 545 HD2 ARG 545 8.373 14.704 -30.114 232 HD3 ARG 545 HD3 ARG 545 7.722 14.004 -28.634 233 HE ARG 545 HE ARG 545 6.358 16.133 -28.411 234 HH11 ARG 545 HH11 ARG 545 7.222 14.981 -31.661 235 HH12 ARG 545 HH12 ARG 545 6.032 16.027 -32.386 236 HH21 ARG 545 HH21 ARG 545 4.851 17.352 -29.457 237 HH22 ARG 545 HH22 ARG 545 4.711 17.278 -31.187 238 H ARG 546 H ARG 546 12.361 19.491 -28.843 239 HA ARG 546 HA ARG 546 13.504 18.489 -31.309 240 HB2 ARG 546 HB2 ARG 546 14.262 20.684 -29.337 241 HB3 ARG 546 HB3 ARG 546 15.225 20.372 -30.768 242 HG2 ARG 546 HG2 ARG 546 12.239 20.953 -30.937 243 HG3 ARG 546 HG3 ARG 546 13.449 22.229 -30.902 244 HD2 ARG 546 HD2 ARG 546 13.372 20.002 -32.985 245 HD3 ARG 546 HD3 ARG 546 12.663 21.593 -33.210 246 HE ARG 546 HE ARG 546 15.495 20.887 -33.336 247 HH11 ARG 546 HH11 ARG 546 13.326 23.608 -32.909 248 HH12 ARG 546 HH12 ARG 546 14.553 24.767 -33.338 249 HH21 ARG 546 HH21 ARG 546 17.015 22.418 -33.840 250 HH22 ARG 546 HH22 ARG 546 16.585 24.102 -33.850 251 H THR 547 H THR 547 15.772 18.098 -31.670 252 HA THR 547 HA THR 547 17.372 16.928 -29.483 253 HB THR 547 HB THR 547 17.814 14.862 -30.738 254 HG1 THR 547 HG1 THR 547 15.637 15.614 -32.393 255 HG21 THR 547 HG23 THR 547 15.800 13.634 -30.320 256 HG22 THR 547 HG21 THR 547 15.956 14.849 -29.044 257 HG23 THR 547 HG22 THR 547 14.800 15.098 -30.369 258 H THR 548 H THR 548 19.617 16.395 -30.229 259 HA THR 548 HA THR 548 20.525 17.322 -32.825 260 HB THR 548 HB THR 548 20.265 19.512 -31.864 261 HG1 THR 548 HG1 THR 548 22.135 20.186 -32.492 262 HG21 THR 548 HG23 THR 548 21.605 20.261 -29.913 263 HG22 THR 548 HG21 THR 548 20.352 19.094 -29.472 264 HG23 THR 548 HG22 THR 548 22.045 18.570 -29.595 265 H PHE 549 H PHE 549 22.854 17.166 -33.098 266 HA PHE 549 HA PHE 549 24.076 14.890 -31.623 267 HB2 PHE 549 HB2 PHE 549 23.878 14.784 -34.070 268 HB3 PHE 549 HB3 PHE 549 24.724 16.312 -34.232 269 HD1 PHE 549 HD1 PHE 549 25.286 12.919 -32.644 270 HD2 PHE 549 HD2 PHE 549 26.969 16.207 -34.873 271 HE1 PHE 549 HE1 PHE 549 27.426 11.686 -32.852 272 HE2 PHE 549 HE2 PHE 549 29.111 14.969 -35.074 273 HZ PHE 549 HZ PHE 549 29.343 12.705 -34.065 274 H GLU 550 H GLU 550 24.157 18.303 -31.492 275 HA GLU 550 HA GLU 550 26.861 18.319 -30.217 276 HB2 GLU 550 HB2 GLU 550 27.525 20.264 -31.431 277 HB3 GLU 550 HB3 GLU 550 27.089 18.999 -32.568 278 HG2 GLU 550 HG2 GLU 550 24.882 20.102 -32.949 279 HG3 GLU 550 HG3 GLU 550 25.337 21.382 -31.822 280 H ASP 551 H ASP 551 27.091 20.955 -29.548 281 HA ASP 551 HA ASP 551 24.875 21.327 -27.567 282 HB2 ASP 551 HB2 ASP 551 26.899 20.412 -26.581 283 HB3 ASP 551 HB3 ASP 551 27.853 21.743 -27.234 284 HA PRO 552 HA PRO 552 25.135 25.239 -30.096 285 HB2 PRO 552 HB2 PRO 552 22.533 25.481 -30.828 286 HB3 PRO 552 HB3 PRO 552 23.627 24.318 -31.632 287 HG2 PRO 552 HG2 PRO 552 21.673 23.765 -29.369 288 HG3 PRO 552 HG3 PRO 552 21.836 22.889 -30.927 289 HD2 PRO 552 HD2 PRO 552 23.055 22.036 -28.632 290 HD3 PRO 552 HD3 PRO 552 23.804 21.836 -30.242 291 H ARG 553 H ARG 553 23.696 27.277 -29.805 292 HA ARG 553 HA ARG 553 23.569 28.158 -27.092 293 HB2 ARG 553 HB2 ARG 553 22.291 29.196 -29.661 294 HB3 ARG 553 HB3 ARG 553 22.140 30.030 -28.114 295 HG2 ARG 553 HG2 ARG 553 24.609 30.233 -27.946 296 HG3 ARG 553 HG3 ARG 553 24.789 29.375 -29.481 297 HD2 ARG 553 HD2 ARG 553 25.033 31.730 -29.886 298 HD3 ARG 553 HD3 ARG 553 23.530 31.169 -30.640 299 HE ARG 553 HE ARG 553 22.980 32.160 -27.999 300 HH11 ARG 553 HH11 ARG 553 23.875 33.450 -31.128 301 HH12 ARG 553 HH12 ARG 553 23.085 34.975 -30.829 302 HH21 ARG 553 HH21 ARG 553 21.963 34.114 -27.692 303 HH22 ARG 553 HH22 ARG 553 22.034 35.333 -28.930 304 HA PRO 554 HA PRO 554 19.795 26.472 -25.626 305 HB2 PRO 554 HB2 PRO 554 19.039 28.200 -23.643 306 HB3 PRO 554 HB3 PRO 554 20.507 27.183 -23.552 307 HG2 PRO 554 HG2 PRO 554 20.310 30.082 -24.436 308 HG3 PRO 554 HG3 PRO 554 21.429 29.370 -23.227 309 HD2 PRO 554 HD2 PRO 554 22.196 29.775 -25.797 310 HD3 PRO 554 HD3 PRO 554 22.717 28.317 -24.902 311 H GLY 555 H GLY 555 19.624 29.490 -27.293 312 HA2 GLY 555 HA2 GLY 555 16.627 29.485 -27.346 313 HA3 GLY 555 HA3 GLY 555 17.658 30.853 -27.733 314 H ALA 556 H ALA 556 15.595 29.967 -29.389 315 HA ALA 556 HA ALA 556 16.410 28.236 -31.498 316 HB1 ALA 556 HB3 ALA 556 14.395 29.158 -32.630 317 HB2 ALA 556 HB1 ALA 556 14.066 28.734 -30.941 318 HB3 ALA 556 HB2 ALA 556 14.298 30.437 -31.406 319 HA PRO 557 HA PRO 557 18.907 30.910 -34.095 320 HB2 PRO 557 HB2 PRO 557 18.438 29.898 -36.602 321 HB3 PRO 557 HB3 PRO 557 19.409 29.059 -35.356 322 HG2 PRO 557 HG2 PRO 557 16.491 28.622 -36.051 323 HG3 PRO 557 HG3 PRO 557 17.772 27.391 -35.821 324 HD2 PRO 557 HD2 PRO 557 16.021 28.035 -33.842 325 HD3 PRO 557 HD3 PRO 557 17.728 27.647 -33.478 326 H ASN2319 H ASN2319 34.537 15.438 -38.824 327 HA ASN2319 HA ASN2319 34.671 13.072 -38.721 328 HB2 ASN2319 HB2 ASN2319 34.006 13.425 -35.755 329 HB3 ASN2319 HB3 ASN2319 33.973 11.894 -36.622 330 HD21 ASN2319 2HD2 ASN2319 35.742 10.752 -35.740 331 HD22 ASN2319 1HD2 ASN2319 37.369 11.407 -35.734 332 H THR2320 H THR2320 32.810 11.706 -39.015 333 HA THR2320 HA THR2320 30.122 12.966 -38.746 334 HB THR2320 HB THR2320 29.635 12.315 -41.112 335 HG1 THR2320 HG1 THR2320 31.388 11.960 -42.483 336 HG21 THR2320 HG23 THR2320 30.651 14.211 -42.196 337 HG22 THR2320 HG21 THR2320 30.228 14.676 -40.541 338 HG23 THR2320 HG22 THR2320 31.920 14.321 -40.960 339 H GLY2321 H GLY2321 28.358 11.475 -39.227 340 HA2 GLY2321 HA2 GLY2321 28.539 8.758 -39.833 341 HA3 GLY2321 HA3 GLY2321 28.627 8.842 -38.069 342 H ALA2322 H ALA2322 26.905 10.027 -36.959 343 HA ALA2322 HA ALA2322 24.786 10.246 -36.333 344 HB1 ALA2322 HB3 ALA2322 23.460 11.863 -37.595 345 HB2 ALA2322 HB1 ALA2322 25.164 12.345 -37.548 346 HB3 ALA2322 HB2 ALA2322 24.486 11.620 -39.026 347 H LYS2323 H LYS2323 25.153 7.663 -37.196 348 HA LYS2323 HA LYS2323 22.935 6.942 -39.032 349 HB2 LYS2323 HB2 LYS2323 25.276 6.150 -39.348 350 HB3 LYS2323 HB3 LYS2323 25.116 5.147 -37.901 351 HG2 LYS2323 HG2 LYS2323 23.605 3.673 -38.957 352 HG3 LYS2323 HG3 LYS2323 23.052 4.897 -40.105 353 HD2 LYS2323 HD2 LYS2323 24.321 3.180 -41.246 354 HD3 LYS2323 HD3 LYS2323 25.138 4.744 -41.361 355 HE2 LYS2323 HE2 LYS2323 26.677 4.058 -39.515 356 HE3 LYS2323 HE3 LYS2323 25.857 2.492 -39.426 357 HZ1 LYS2323 HZ3 LYS2323 27.862 2.373 -40.801 358 HZ2 LYS2323 HZ1 LYS2323 26.553 2.074 -41.726 359 HZ3 LYS2323 HZ2 LYS2323 27.302 3.522 -41.813 360 H GLN2324 H GLN2324 22.706 7.669 -36.022 361 HA GLN2324 HA GLN2324 20.577 5.669 -35.431 362 HB2 GLN2324 HB2 GLN2324 22.755 6.642 -33.563 363 HB3 GLN2324 HB3 GLN2324 21.236 5.966 -32.976 364 HG2 GLN2324 HG2 GLN2324 23.086 4.436 -34.853 365 HG3 GLN2324 HG3 GLN2324 23.214 4.389 -33.103 366 HE21 GLN2324 HE22 GLN2324 22.864 1.993 -33.496 367 HE22 GLN2324 HE21 GLN2324 21.189 1.466 -33.544 368 HA PRO2325 HA PRO2325 18.902 9.915 -35.399 369 HB2 PRO2325 HB2 PRO2325 16.246 9.325 -35.793 370 HB3 PRO2325 HB3 PRO2325 17.473 9.390 -37.092 371 HG2 PRO2325 HG2 PRO2325 16.432 6.949 -35.635 372 HG3 PRO2325 HG3 PRO2325 16.675 7.173 -37.395 373 HD2 PRO2325 HD2 PRO2325 18.490 5.891 -35.817 374 HD3 PRO2325 HD3 PRO2325 19.009 6.903 -37.199 375 HA PRO2326 HA PRO2326 17.775 9.512 -30.999 376 HB2 PRO2326 HB2 PRO2326 17.837 12.142 -30.270 377 HB3 PRO2326 HB3 PRO2326 19.310 11.174 -30.578 378 HG2 PRO2326 HG2 PRO2326 17.897 13.053 -32.495 379 HG3 PRO2326 HG3 PRO2326 19.637 12.993 -32.101 380 HD2 PRO2326 HD2 PRO2326 18.575 11.779 -34.301 381 HD3 PRO2326 HD3 PRO2326 19.938 11.045 -33.401 382 H SER2327 H SER2327 15.763 9.056 -30.434 383 HA SER2327 HA SER2327 13.516 10.965 -30.806 384 HB2 SER2327 HB2 SER2327 13.455 8.088 -31.809 385 HB3 SER2327 HB3 SER2327 12.047 9.156 -31.651 386 HG SER2327 HG SER2327 12.876 9.139 -33.781 387 H TYR2328 H TYR2328 13.663 11.232 -28.528 388 HA TYR2328 HA TYR2328 13.157 8.881 -26.792 389 HB2 TYR2328 HB2 TYR2328 14.861 10.588 -26.229 390 HB3 TYR2328 HB3 TYR2328 13.598 11.797 -26.098 391 HD1 TYR2328 HD1 TYR2328 14.814 8.539 -24.695 392 HD2 TYR2328 HD2 TYR2328 12.426 12.063 -24.021 393 HE1 TYR2328 HE1 TYR2328 14.518 7.889 -22.303 394 HE2 TYR2328 HE2 TYR2328 12.104 11.400 -21.644 395 HH TYR2328 HH TYR2328 12.578 9.857 -20.018 396 H GLU2329 H GLU2329 11.619 12.072 -26.248 397 HA GLU2329 HA GLU2329 9.032 10.927 -25.746 398 HB2 GLU2329 HB2 GLU2329 9.934 13.764 -26.265 399 HB3 GLU2329 HB3 GLU2329 8.232 13.324 -26.053 400 HG2 GLU2329 HG2 GLU2329 8.917 12.188 -23.859 401 HG3 GLU2329 HG3 GLU2329 10.462 13.027 -24.027 402 H ASP2330 H ASP2330 10.498 12.091 -28.744 403 HA ASP2330 HA ASP2330 8.046 12.119 -30.254 404 HB2 ASP2330 HB2 ASP2330 10.342 13.267 -30.717 405 HB3 ASP2330 HB3 ASP2330 10.800 11.731 -31.452 406 H CYS2331 H CYS2331 9.712 9.467 -28.990 407 HA CYS2331 HA CYS2331 8.579 7.574 -31.020 408 HB2 CYS2331 HB2 CYS2331 11.017 7.433 -30.566 409 HB3 CYS2331 HB3 CYS2331 10.673 7.105 -28.858 410 HG CYS2331 HG CYS2331 11.363 4.882 -30.087 411 H ILE2332 H ILE2332 8.708 8.230 -27.461 412 HA ILE2332 HA ILE2332 6.740 6.142 -26.938 413 HB ILE2332 HB ILE2332 6.861 6.761 -24.616 414 HG12 ILE2332 HG12 ILE2332 8.883 8.899 -25.311 415 HG13 ILE2332 HG13 ILE2332 7.181 9.281 -25.021 416 HG21 ILE2332 HG21 ILE2332 8.552 5.259 -25.677 417 HG22 ILE2332 HG22 ILE2332 9.647 6.647 -25.847 418 HG23 ILE2332 HG23 ILE2332 9.157 6.084 -24.239 419 HD11 ILE2332 3HD1 ILE2332 8.454 9.680 -22.999 420 HD12 ILE2332 1HD1 ILE2332 7.377 8.293 -22.735 421 HD13 ILE2332 2HD1 ILE2332 9.117 8.038 -23.022 422 H LYS2333 H LYS2333 6.136 8.928 -28.409 423 HA LYS2333 HA LYS2333 3.360 9.194 -27.297 424 HB2 LYS2333 HB2 LYS2333 5.149 11.243 -28.660 425 HB3 LYS2333 HB3 LYS2333 3.408 11.446 -28.472 426 HG2 LYS2333 HG2 LYS2333 3.566 11.368 -26.052 427 HG3 LYS2333 HG3 LYS2333 5.307 11.035 -26.121 428 HD2 LYS2333 HD2 LYS2333 5.765 13.183 -27.135 429 HD3 LYS2333 HD3 LYS2333 4.047 13.555 -27.307 430 HE2 LYS2333 HE2 LYS2333 5.404 13.082 -24.613 431 HE3 LYS2333 HE3 LYS2333 5.295 14.673 -25.369 432 HZ1 LYS2333 HZ3 LYS2333 3.469 14.345 -23.830 433 HZ2 LYS2333 HZ1 LYS2333 2.867 14.468 -25.339 434 HZ3 LYS2333 HZ2 LYS2333 2.955 13.008 -24.608 Start of MODEL 11 1 H VAL 515 H VAL 515 30.521 3.540 -15.469 2 HA VAL 515 HA VAL 515 31.845 5.049 -14.130 3 HB VAL 515 HB VAL 515 34.162 4.204 -15.901 4 HG11 VAL 515 HG11 VAL 515 34.281 6.632 -15.342 5 HG12 VAL 515 HG12 VAL 515 34.050 6.237 -13.621 6 HG13 VAL 515 HG13 VAL 515 35.508 5.709 -14.479 7 HG21 VAL 515 HG23 VAL 515 35.180 3.495 -13.734 8 HG22 VAL 515 HG21 VAL 515 33.653 3.848 -12.905 9 HG23 VAL 515 HG22 VAL 515 33.752 2.543 -14.114 10 H SER 516 H SER 516 32.524 4.818 -17.695 11 HA SER 516 HA SER 516 33.142 7.319 -18.161 12 HB2 SER 516 HB2 SER 516 31.467 5.689 -20.091 13 HB3 SER 516 HB3 SER 516 32.667 6.936 -20.496 14 HG SER 516 HG SER 516 33.472 4.743 -20.629 15 H LEU 517 H LEU 517 29.685 6.504 -17.952 16 HA LEU 517 HA LEU 517 29.080 9.425 -18.107 17 HB2 LEU 517 HB2 LEU 517 27.120 9.062 -19.392 18 HB3 LEU 517 HB3 LEU 517 28.475 8.353 -20.233 19 HG LEU 517 HG LEU 517 27.258 6.310 -18.547 20 HD11 LEU 517 1HD1 LEU 517 25.205 7.673 -18.685 21 HD12 LEU 517 2HD1 LEU 517 25.315 7.650 -20.455 22 HD13 LEU 517 3HD1 LEU 517 25.049 6.140 -19.558 23 HD21 LEU 517 3HD2 LEU 517 26.987 5.121 -20.664 24 HD22 LEU 517 1HD2 LEU 517 27.320 6.615 -21.570 25 HD23 LEU 517 2HD2 LEU 517 28.590 5.871 -20.572 26 H ILE 518 H ILE 518 29.422 7.369 -15.874 27 HA ILE 518 HA ILE 518 26.859 7.869 -14.408 28 HB ILE 518 HB ILE 518 28.525 5.348 -14.104 29 HG12 ILE 518 HG12 ILE 518 26.246 4.420 -15.318 30 HG13 ILE 518 HG13 ILE 518 26.394 5.951 -16.148 31 HG21 ILE 518 HG21 ILE 518 27.054 5.798 -12.192 32 HG22 ILE 518 HG22 ILE 518 25.668 6.033 -13.282 33 HG23 ILE 518 HG23 ILE 518 26.436 4.440 -13.102 34 HD11 ILE 518 3HD1 ILE 518 27.497 4.165 -17.401 35 HD12 ILE 518 1HD1 ILE 518 28.765 5.247 -16.797 36 HD13 ILE 518 2HD1 ILE 518 28.450 3.698 -15.986 37 H ASN 519 H ASN 519 30.178 8.455 -14.465 38 HA ASN 519 HA ASN 519 30.272 9.087 -11.548 39 HB2 ASN 519 HB2 ASN 519 31.535 6.985 -12.534 40 HB3 ASN 519 HB3 ASN 519 32.678 8.177 -13.145 41 HD21 ASN 519 2HD2 ASN 519 31.151 6.837 -10.208 42 HD22 ASN 519 1HD2 ASN 519 32.447 7.329 -9.129 43 H GLU 520 H GLU 520 29.488 10.868 -13.697 44 HA GLU 520 HA GLU 520 31.759 12.803 -13.949 45 HB2 GLU 520 HB2 GLU 520 29.161 12.621 -15.519 46 HB3 GLU 520 HB3 GLU 520 30.489 13.751 -15.800 47 HG2 GLU 520 HG2 GLU 520 31.992 11.723 -16.188 48 HG3 GLU 520 HG3 GLU 520 30.515 10.752 -16.247 49 H GLY 521 H GLY 521 30.716 15.148 -14.326 50 HA2 GLY 521 HA2 GLY 521 29.703 16.129 -11.805 51 HA3 GLY 521 HA3 GLY 521 29.968 17.042 -13.286 52 HA PRO 522 HA PRO 522 25.393 16.626 -12.225 53 HB2 PRO 522 HB2 PRO 522 24.726 19.289 -12.154 54 HB3 PRO 522 HB3 PRO 522 25.444 18.410 -10.770 55 HG2 PRO 522 HG2 PRO 522 26.872 20.128 -12.824 56 HG3 PRO 522 HG3 PRO 522 27.016 20.192 -11.037 57 HD2 PRO 522 HD2 PRO 522 28.806 18.843 -12.570 58 HD3 PRO 522 HD3 PRO 522 28.292 18.200 -10.981 59 H LEU 523 H LEU 523 23.555 16.903 -13.556 60 HA LEU 523 HA LEU 523 24.184 16.945 -16.367 61 HB2 LEU 523 HB2 LEU 523 22.125 15.989 -16.720 62 HB3 LEU 523 HB3 LEU 523 22.590 15.380 -15.171 63 HG LEU 523 HG LEU 523 20.947 17.812 -14.840 64 HD11 LEU 523 1HD1 LEU 523 20.050 17.124 -17.053 65 HD12 LEU 523 2HD1 LEU 523 19.692 15.515 -16.396 66 HD13 LEU 523 3HD1 LEU 523 18.860 16.953 -15.756 67 HD21 LEU 523 3HD2 LEU 523 19.562 16.329 -13.486 68 HD22 LEU 523 1HD2 LEU 523 20.435 14.908 -14.098 69 HD23 LEU 523 2HD2 LEU 523 21.273 16.108 -13.086 70 HA PRO 524 HA PRO 524 23.118 21.092 -17.499 71 HB2 PRO 524 HB2 PRO 524 22.051 20.819 -20.041 72 HB3 PRO 524 HB3 PRO 524 23.785 20.645 -19.639 73 HG2 PRO 524 HG2 PRO 524 21.711 18.457 -19.927 74 HG3 PRO 524 HG3 PRO 524 23.350 18.527 -20.648 75 HD2 PRO 524 HD2 PRO 524 22.834 17.137 -18.386 76 HD3 PRO 524 HD3 PRO 524 24.362 18.043 -18.563 77 HA PRO 525 HA PRO 525 19.088 21.991 -16.214 78 HB2 PRO 525 HB2 PRO 525 18.542 24.484 -17.217 79 HB3 PRO 525 HB3 PRO 525 19.817 24.161 -16.006 80 HG2 PRO 525 HG2 PRO 525 20.142 24.419 -19.015 81 HG3 PRO 525 HG3 PRO 525 21.092 25.224 -17.726 82 HD2 PRO 525 HD2 PRO 525 21.971 22.961 -18.939 83 HD3 PRO 525 HD3 PRO 525 22.230 23.226 -17.189 84 H GLY 526 H GLY 526 17.359 20.801 -16.825 85 HA2 GLY 526 HA2 GLY 526 15.434 20.187 -17.919 86 HA3 GLY 526 HA3 GLY 526 15.496 21.730 -18.775 87 H TRP 527 H TRP 527 18.068 19.357 -19.056 88 HA TRP 527 HA TRP 527 17.277 18.629 -21.860 89 HB2 TRP 527 HB2 TRP 527 19.897 19.499 -20.641 90 HB3 TRP 527 HB3 TRP 527 19.913 18.377 -21.985 91 HD1 TRP 527 HD1 TRP 527 19.480 22.013 -21.188 92 HE1 TRP 527 HE1 TRP 527 19.373 23.384 -23.351 93 HE3 TRP 527 HE3 TRP 527 19.149 18.179 -24.550 94 HZ2 TRP 527 HZ2 TRP 527 19.206 22.880 -26.191 95 HZ3 TRP 527 HZ3 TRP 527 19.012 18.651 -26.991 96 HH2 TRP 527 HH2 TRP 527 19.053 20.990 -27.819 97 H GLU 528 H GLU 528 18.050 16.602 -22.599 98 HA GLU 528 HA GLU 528 18.947 14.598 -20.583 99 HB2 GLU 528 HB2 GLU 528 16.595 14.234 -20.863 100 HB3 GLU 528 HB3 GLU 528 16.689 14.392 -22.602 101 HG2 GLU 528 HG2 GLU 528 16.355 12.099 -22.102 102 HG3 GLU 528 HG3 GLU 528 17.997 12.245 -22.699 103 H ILE 529 H ILE 529 20.220 12.901 -21.481 104 HA ILE 529 HA ILE 529 21.571 13.497 -24.064 105 HB ILE 529 HB ILE 529 23.240 13.062 -21.566 106 HG12 ILE 529 HG12 ILE 529 23.751 15.644 -21.885 107 HG13 ILE 529 HG13 ILE 529 22.123 15.702 -22.517 108 HG21 ILE 529 HG21 ILE 529 24.239 12.643 -23.788 109 HG22 ILE 529 HG22 ILE 529 23.815 14.295 -24.295 110 HG23 ILE 529 HG23 ILE 529 24.993 14.027 -22.991 111 HD11 ILE 529 3HD1 ILE 529 21.846 16.170 -20.228 112 HD12 ILE 529 1HD1 ILE 529 21.510 14.440 -20.236 113 HD13 ILE 529 2HD1 ILE 529 23.106 15.011 -19.736 114 H ARG 530 H ARG 530 21.946 11.678 -25.141 115 HA ARG 530 HA ARG 530 21.874 9.038 -23.708 116 HB2 ARG 530 HB2 ARG 530 20.285 9.873 -26.166 117 HB3 ARG 530 HB3 ARG 530 20.408 8.219 -25.592 118 HG2 ARG 530 HG2 ARG 530 19.475 10.083 -23.465 119 HG3 ARG 530 HG3 ARG 530 18.461 10.097 -24.897 120 HD2 ARG 530 HD2 ARG 530 17.568 8.494 -23.375 121 HD3 ARG 530 HD3 ARG 530 18.234 7.631 -24.769 122 HE ARG 530 HE ARG 530 20.042 7.905 -22.449 123 HH11 ARG 530 HH11 ARG 530 17.580 5.837 -23.849 124 HH12 ARG 530 HH12 ARG 530 18.108 4.445 -22.948 125 HH21 ARG 530 HH21 ARG 530 20.678 6.067 -21.348 126 HH22 ARG 530 HH22 ARG 530 19.808 4.580 -21.577 127 H TYR 531 H TYR 531 22.685 7.277 -24.879 128 HA TYR 531 HA TYR 531 24.939 7.978 -26.710 129 HB2 TYR 531 HB2 TYR 531 24.973 6.186 -24.259 130 HB3 TYR 531 HB3 TYR 531 26.275 6.329 -25.426 131 HD1 TYR 531 HD2 TYR 531 24.293 8.276 -22.901 132 HD2 TYR 531 HD1 TYR 531 27.933 8.016 -25.206 133 HE1 TYR 531 HE2 TYR 531 25.279 10.124 -21.556 134 HE2 TYR 531 HE1 TYR 531 28.938 9.816 -23.813 135 HH TYR 531 HH TYR 531 28.632 11.272 -22.055 136 H THR 532 H THR 532 24.083 7.172 -28.587 137 HA THR 532 HA THR 532 22.441 4.784 -28.749 138 HB THR 532 HB THR 532 22.812 5.084 -31.235 139 HG1 THR 532 HG1 THR 532 24.854 6.189 -30.954 140 HG21 THR 532 HG23 THR 532 21.526 7.182 -31.408 141 HG22 THR 532 HG21 THR 532 20.882 6.139 -30.126 142 HG23 THR 532 HG22 THR 532 21.876 7.553 -29.708 143 H ALA 533 H ALA 533 22.952 2.736 -29.516 144 HA ALA 533 HA ALA 533 25.445 1.674 -28.781 145 HB1 ALA 533 HB3 ALA 533 24.591 -0.420 -29.721 146 HB2 ALA 533 HB1 ALA 533 23.320 0.429 -28.827 147 HB3 ALA 533 HB2 ALA 533 23.329 0.459 -30.605 148 H ALA 534 H ALA 534 24.729 3.230 -31.772 149 HA ALA 534 HA ALA 534 26.790 2.154 -33.445 150 HB1 ALA 534 HB3 ALA 534 26.442 4.238 -34.707 151 HB2 ALA 534 HB1 ALA 534 24.889 3.531 -34.237 152 HB3 ALA 534 HB2 ALA 534 25.531 4.936 -33.349 153 H GLY 535 H GLY 535 27.134 3.936 -30.518 154 HA2 GLY 535 HA2 GLY 535 29.171 4.371 -29.449 155 HA3 GLY 535 HA3 GLY 535 30.045 4.262 -30.979 156 H GLU 536 H GLU 536 27.204 6.276 -30.126 157 HA GLU 536 HA GLU 536 28.770 8.791 -30.497 158 HB2 GLU 536 HB2 GLU 536 26.149 8.093 -31.880 159 HB3 GLU 536 HB3 GLU 536 26.917 9.665 -31.932 160 HG2 GLU 536 HG2 GLU 536 28.091 7.101 -33.096 161 HG3 GLU 536 HG3 GLU 536 27.164 8.301 -33.975 162 H ARG 537 H ARG 537 27.703 10.674 -29.693 163 HA ARG 537 HA ARG 537 25.624 10.181 -27.589 164 HB2 ARG 537 HB2 ARG 537 27.604 10.761 -26.472 165 HB3 ARG 537 HB3 ARG 537 28.039 12.006 -27.647 166 HG2 ARG 537 HG2 ARG 537 26.436 13.542 -26.831 167 HG3 ARG 537 HG3 ARG 537 25.542 12.294 -25.950 168 HD2 ARG 537 HD2 ARG 537 26.893 13.852 -24.507 169 HD3 ARG 537 HD3 ARG 537 27.135 12.138 -24.254 170 HE ARG 537 HE ARG 537 29.304 12.233 -25.156 171 HH11 ARG 537 HH11 ARG 537 27.914 15.433 -25.254 172 HH12 ARG 537 HH12 ARG 537 29.475 16.208 -25.365 173 HH21 ARG 537 HH21 ARG 537 31.251 13.266 -25.297 174 HH22 ARG 537 HH22 ARG 537 31.311 14.999 -25.401 175 H PHE 538 H PHE 538 23.877 11.385 -27.537 176 HA PHE 538 HA PHE 538 23.515 13.698 -29.387 177 HB2 PHE 538 HB2 PHE 538 21.653 11.308 -29.062 178 HB3 PHE 538 HB3 PHE 538 21.198 12.819 -29.827 179 HD1 PHE 538 HD2 PHE 538 22.084 13.488 -32.020 180 HD2 PHE 538 HD1 PHE 538 23.109 9.693 -30.243 181 HE1 PHE 538 HE2 PHE 538 22.825 12.645 -34.238 182 HE2 PHE 538 HE1 PHE 538 23.856 8.863 -32.459 183 HZ PHE 538 HZ PHE 538 23.717 10.334 -34.457 184 H PHE 539 H PHE 539 21.818 15.095 -28.769 185 HA PHE 539 HA PHE 539 21.128 15.056 -25.856 186 HB2 PHE 539 HB2 PHE 539 21.677 17.389 -27.716 187 HB3 PHE 539 HB3 PHE 539 21.106 17.524 -26.067 188 HD1 PHE 539 HD2 PHE 539 24.030 16.529 -28.153 189 HD2 PHE 539 HD1 PHE 539 22.575 17.433 -24.197 190 HE1 PHE 539 HE2 PHE 539 26.366 16.729 -27.343 191 HE2 PHE 539 HE1 PHE 539 24.913 17.638 -23.385 192 HZ PHE 539 HZ PHE 539 26.808 17.327 -24.958 193 H VAL 540 H VAL 540 19.148 15.764 -25.264 194 HA VAL 540 HA VAL 540 16.926 15.763 -27.275 195 HB VAL 540 HB VAL 540 17.249 14.199 -24.686 196 HG11 VAL 540 HG11 VAL 540 14.884 14.983 -25.016 197 HG12 VAL 540 HG12 VAL 540 14.870 14.144 -26.584 198 HG13 VAL 540 HG13 VAL 540 15.084 13.245 -25.052 199 HG21 VAL 540 HG23 VAL 540 17.056 12.172 -26.012 200 HG22 VAL 540 HG21 VAL 540 16.967 13.119 -27.508 201 HG23 VAL 540 HG22 VAL 540 18.452 13.113 -26.532 202 H ASP 541 H ASP 541 15.557 17.397 -26.974 203 HA ASP 541 HA ASP 541 15.475 18.845 -24.353 204 HB2 ASP 541 HB2 ASP 541 16.263 20.239 -26.171 205 HB3 ASP 541 HB3 ASP 541 14.898 19.768 -27.189 206 H HIS 542 H HIS 542 13.764 18.278 -23.159 207 HA HIS 542 HA HIS 542 11.368 17.046 -24.295 208 HB2 HIS 542 HB2 HIS 542 11.926 18.051 -21.480 209 HB3 HIS 542 HB3 HIS 542 10.615 16.982 -21.964 210 HD2 HIS 542 HD2 HIS 542 12.526 14.992 -23.820 211 HE1 HIS 542 HE1 HIS 542 14.323 14.085 -20.061 212 H ASN 543 H ASN 543 12.283 20.325 -23.824 213 HA ASN 543 HA ASN 543 9.721 21.410 -23.053 214 HB2 ASN 543 HB2 ASN 543 12.136 22.840 -24.246 215 HB3 ASN 543 HB3 ASN 543 10.819 23.565 -23.337 216 HD21 ASN 543 2HD2 ASN 543 13.913 22.047 -23.107 217 HD22 ASN 543 1HD2 ASN 543 13.928 21.861 -21.357 218 H THR 544 H THR 544 11.366 21.083 -26.210 219 HA THR 544 HA THR 544 8.738 21.588 -27.577 220 HB THR 544 HB THR 544 9.894 22.642 -29.419 221 HG1 THR 544 HG1 THR 544 12.124 23.176 -29.129 222 HG21 THR 544 HG23 THR 544 10.574 24.729 -28.432 223 HG22 THR 544 HG21 THR 544 9.209 24.092 -27.499 224 HG23 THR 544 HG22 THR 544 10.863 23.964 -26.855 225 H ARG 545 H ARG 545 10.584 19.146 -26.803 226 HA ARG 545 HA ARG 545 10.894 17.028 -27.480 227 HB2 ARG 545 HB2 ARG 545 8.451 17.614 -28.518 228 HB3 ARG 545 HB3 ARG 545 9.314 17.236 -30.008 229 HG2 ARG 545 HG2 ARG 545 10.065 15.058 -28.750 230 HG3 ARG 545 HG3 ARG 545 8.808 15.473 -27.579 231 HD2 ARG 545 HD2 ARG 545 8.467 14.964 -30.559 232 HD3 ARG 545 HD3 ARG 545 7.975 13.886 -29.240 233 HE ARG 545 HE ARG 545 6.593 16.230 -28.737 234 HH11 ARG 545 HH11 ARG 545 6.729 14.113 -31.575 235 HH12 ARG 545 HH12 ARG 545 5.073 14.469 -31.984 236 HH21 ARG 545 HH21 ARG 545 4.506 16.645 -29.397 237 HH22 ARG 545 HH22 ARG 545 3.868 15.854 -30.805 238 H ARG 546 H ARG 546 12.405 19.416 -28.854 239 HA ARG 546 HA ARG 546 13.491 18.365 -31.326 240 HB2 ARG 546 HB2 ARG 546 14.225 20.633 -29.439 241 HB3 ARG 546 HB3 ARG 546 15.305 20.183 -30.758 242 HG2 ARG 546 HG2 ARG 546 13.448 20.470 -32.393 243 HG3 ARG 546 HG3 ARG 546 12.406 21.058 -31.081 244 HD2 ARG 546 HD2 ARG 546 13.970 22.916 -30.653 245 HD3 ARG 546 HD3 ARG 546 15.100 22.259 -31.851 246 HE ARG 546 HE ARG 546 12.422 22.857 -32.895 247 HH11 ARG 546 HH11 ARG 546 15.619 24.211 -32.409 248 HH12 ARG 546 HH12 ARG 546 15.419 25.379 -33.687 249 HH21 ARG 546 HH21 ARG 546 12.235 24.378 -34.509 250 HH22 ARG 546 HH22 ARG 546 13.548 25.472 -34.830 251 H THR 547 H THR 547 15.727 17.987 -31.748 252 HA THR 547 HA THR 547 17.387 16.746 -29.635 253 HB THR 547 HB THR 547 17.838 14.813 -31.232 254 HG1 THR 547 HG1 THR 547 16.774 15.685 -33.069 255 HG21 THR 547 HG23 THR 547 15.949 13.471 -30.505 256 HG22 THR 547 HG21 THR 547 16.502 14.521 -29.188 257 HG23 THR 547 HG22 THR 547 15.021 14.922 -30.086 258 H THR 548 H THR 548 19.615 16.455 -30.254 259 HA THR 548 HA THR 548 20.569 17.413 -32.849 260 HB THR 548 HB THR 548 20.192 19.563 -31.820 261 HG1 THR 548 HG1 THR 548 21.948 19.897 -32.873 262 HG21 THR 548 HG23 THR 548 21.344 20.306 -29.800 263 HG22 THR 548 HG21 THR 548 20.237 18.983 -29.428 264 HG23 THR 548 HG22 THR 548 21.982 18.672 -29.541 265 H PHE 549 H PHE 549 22.854 17.167 -33.140 266 HA PHE 549 HA PHE 549 24.037 14.928 -31.599 267 HB2 PHE 549 HB2 PHE 549 23.960 14.829 -34.047 268 HB3 PHE 549 HB3 PHE 549 24.806 16.365 -34.166 269 HD1 PHE 549 HD1 PHE 549 25.320 13.019 -32.461 270 HD2 PHE 549 HD2 PHE 549 27.070 16.243 -34.734 271 HE1 PHE 549 HE1 PHE 549 27.495 11.835 -32.474 272 HE2 PHE 549 HE2 PHE 549 29.245 15.044 -34.750 273 HZ PHE 549 HZ PHE 549 29.460 12.836 -33.617 274 H GLU 550 H GLU 550 24.267 18.377 -31.656 275 HA GLU 550 HA GLU 550 26.924 18.323 -30.266 276 HB2 GLU 550 HB2 GLU 550 27.523 20.374 -31.320 277 HB3 GLU 550 HB3 GLU 550 27.103 19.194 -32.551 278 HG2 GLU 550 HG2 GLU 550 24.835 20.280 -32.760 279 HG3 GLU 550 HG3 GLU 550 25.362 21.512 -31.609 280 H ASP 551 H ASP 551 27.034 20.922 -29.370 281 HA ASP 551 HA ASP 551 24.720 21.100 -27.473 282 HB2 ASP 551 HB2 ASP 551 26.708 20.222 -26.395 283 HB3 ASP 551 HB3 ASP 551 27.648 21.616 -26.927 284 HA PRO 552 HA PRO 552 24.958 25.065 -29.900 285 HB2 PRO 552 HB2 PRO 552 22.404 25.204 -30.798 286 HB3 PRO 552 HB3 PRO 552 23.577 24.063 -31.509 287 HG2 PRO 552 HG2 PRO 552 21.517 23.485 -29.349 288 HG3 PRO 552 HG3 PRO 552 21.780 22.602 -30.890 289 HD2 PRO 552 HD2 PRO 552 22.909 21.804 -28.527 290 HD3 PRO 552 HD3 PRO 552 23.730 21.604 -30.100 291 H ARG 553 H ARG 553 23.103 26.932 -29.718 292 HA ARG 553 HA ARG 553 23.067 28.073 -27.187 293 HB2 ARG 553 HB2 ARG 553 21.355 29.573 -28.036 294 HB3 ARG 553 HB3 ARG 553 22.539 29.237 -29.295 295 HG2 ARG 553 HG2 ARG 553 20.931 27.506 -30.245 296 HG3 ARG 553 HG3 ARG 553 19.726 28.051 -29.073 297 HD2 ARG 553 HD2 ARG 553 21.058 29.828 -31.152 298 HD3 ARG 553 HD3 ARG 553 19.489 29.030 -31.355 299 HE ARG 553 HE ARG 553 19.312 30.493 -28.952 300 HH11 ARG 553 HH11 ARG 553 19.656 31.248 -32.356 301 HH12 ARG 553 HH12 ARG 553 18.865 32.791 -32.183 302 HH21 ARG 553 HH21 ARG 553 18.296 32.404 -28.794 303 HH22 ARG 553 HH22 ARG 553 18.146 33.455 -30.185 304 HA PRO 554 HA PRO 554 20.072 25.773 -24.835 305 HB2 PRO 554 HB2 PRO 554 19.419 27.527 -22.839 306 HB3 PRO 554 HB3 PRO 554 21.027 26.753 -22.971 307 HG2 PRO 554 HG2 PRO 554 20.211 29.515 -23.929 308 HG3 PRO 554 HG3 PRO 554 21.640 29.063 -22.945 309 HD2 PRO 554 HD2 PRO 554 21.799 29.394 -25.645 310 HD3 PRO 554 HD3 PRO 554 22.745 28.129 -24.807 311 H GLY 555 H GLY 555 19.186 28.876 -26.235 312 HA2 GLY 555 HA2 GLY 555 16.957 28.476 -27.566 313 HA3 GLY 555 HA3 GLY 555 16.263 28.386 -25.947 314 H ALA 556 H ALA 556 15.490 30.189 -25.177 315 HA ALA 556 HA ALA 556 16.765 32.816 -25.564 316 HB1 ALA 556 HB3 ALA 556 14.650 33.844 -26.326 317 HB2 ALA 556 HB1 ALA 556 15.243 32.637 -27.481 318 HB3 ALA 556 HB2 ALA 556 13.890 32.238 -26.400 319 HA PRO 557 HA PRO 557 14.999 31.786 -21.301 320 HB2 PRO 557 HB2 PRO 557 17.240 32.322 -19.806 321 HB3 PRO 557 HB3 PRO 557 16.912 30.745 -20.584 322 HG2 PRO 557 HG2 PRO 557 18.638 33.012 -21.621 323 HG3 PRO 557 HG3 PRO 557 19.037 31.266 -21.534 324 HD2 PRO 557 HD2 PRO 557 18.140 32.414 -23.827 325 HD3 PRO 557 HD3 PRO 557 17.636 30.761 -23.363 326 H ASN2319 H ASN2319 29.594 5.165 -44.173 327 HA ASN2319 HA ASN2319 29.918 7.364 -43.316 328 HB2 ASN2319 HB2 ASN2319 31.636 8.846 -44.511 329 HB3 ASN2319 HB3 ASN2319 32.193 7.735 -43.275 330 HD21 ASN2319 2HD2 ASN2319 31.817 7.839 -46.905 331 HD22 ASN2319 1HD2 ASN2319 33.322 6.964 -47.180 332 H THR2320 H THR2320 27.841 7.429 -44.122 333 HA THR2320 HA THR2320 27.505 8.546 -46.879 334 HB THR2320 HB THR2320 25.446 7.083 -47.067 335 HG1 THR2320 HG1 THR2320 25.055 6.328 -45.086 336 HG21 THR2320 HG23 THR2320 26.599 5.102 -47.773 337 HG22 THR2320 HG21 THR2320 27.572 6.514 -48.219 338 HG23 THR2320 HG22 THR2320 28.038 5.516 -46.821 339 H GLY2321 H GLY2321 27.318 9.661 -43.970 340 HA2 GLY2321 HA2 GLY2321 26.124 11.382 -43.018 341 HA3 GLY2321 HA3 GLY2321 25.161 11.495 -44.492 342 H ALA2322 H ALA2322 25.372 8.583 -42.467 343 HA ALA2322 HA ALA2322 22.610 8.990 -41.425 344 HB1 ALA2322 HB3 ALA2322 22.051 6.686 -42.103 345 HB2 ALA2322 HB1 ALA2322 22.472 7.673 -43.516 346 HB3 ALA2322 HB2 ALA2322 23.646 6.506 -42.864 347 H LYS2323 H LYS2323 22.179 8.100 -39.490 348 HA LYS2323 HA LYS2323 23.910 6.219 -38.088 349 HB2 LYS2323 HB2 LYS2323 24.556 8.925 -37.720 350 HB3 LYS2323 HB3 LYS2323 23.391 8.663 -36.441 351 HG2 LYS2323 HG2 LYS2323 25.235 7.984 -35.283 352 HG3 LYS2323 HG3 LYS2323 24.922 6.436 -36.063 353 HD2 LYS2323 HD2 LYS2323 26.481 7.358 -37.983 354 HD3 LYS2323 HD3 LYS2323 26.950 8.578 -36.784 355 HE2 LYS2323 HE2 LYS2323 27.384 6.501 -35.224 356 HE3 LYS2323 HE3 LYS2323 27.322 5.564 -36.720 357 HZ1 LYS2323 HZ3 LYS2323 29.241 7.719 -36.010 358 HZ2 LYS2323 HZ1 LYS2323 29.585 6.160 -36.324 359 HZ3 LYS2323 HZ2 LYS2323 29.113 7.134 -37.549 360 H GLN2324 H GLN2324 22.881 6.020 -35.690 361 HA GLN2324 HA GLN2324 20.065 5.421 -35.877 362 HB2 GLN2324 HB2 GLN2324 21.920 5.786 -33.494 363 HB3 GLN2324 HB3 GLN2324 20.210 5.350 -33.358 364 HG2 GLN2324 HG2 GLN2324 20.626 3.333 -34.783 365 HG3 GLN2324 HG3 GLN2324 22.340 3.748 -34.830 366 HE21 GLN2324 HE22 GLN2324 22.889 1.700 -33.817 367 HE22 GLN2324 HE21 GLN2324 22.512 1.423 -32.124 368 HA PRO2325 HA PRO2325 18.907 9.777 -35.378 369 HB2 PRO2325 HB2 PRO2325 16.189 9.579 -35.613 370 HB3 PRO2325 HB3 PRO2325 17.310 9.460 -37.001 371 HG2 PRO2325 HG2 PRO2325 16.010 7.201 -35.458 372 HG3 PRO2325 HG3 PRO2325 16.162 7.395 -37.231 373 HD2 PRO2325 HD2 PRO2325 17.875 5.853 -35.735 374 HD3 PRO2325 HD3 PRO2325 18.401 6.718 -37.210 375 HA PRO2326 HA PRO2326 17.877 9.415 -30.928 376 HB2 PRO2326 HB2 PRO2326 17.929 12.057 -30.239 377 HB3 PRO2326 HB3 PRO2326 19.408 11.096 -30.532 378 HG2 PRO2326 HG2 PRO2326 17.972 12.918 -32.491 379 HG3 PRO2326 HG3 PRO2326 19.713 12.901 -32.084 380 HD2 PRO2326 HD2 PRO2326 18.711 11.625 -34.267 381 HD3 PRO2326 HD3 PRO2326 20.054 10.905 -33.323 382 H SER2327 H SER2327 15.877 9.194 -30.120 383 HA SER2327 HA SER2327 13.618 10.979 -30.707 384 HB2 SER2327 HB2 SER2327 13.727 8.146 -31.822 385 HB3 SER2327 HB3 SER2327 12.210 9.030 -31.558 386 HG SER2327 HG SER2327 14.222 10.359 -32.962 387 H TYR2328 H TYR2328 14.111 11.115 -28.361 388 HA TYR2328 HA TYR2328 13.453 8.834 -26.653 389 HB2 TYR2328 HB2 TYR2328 15.090 10.587 -26.054 390 HB3 TYR2328 HB3 TYR2328 13.800 11.775 -26.025 391 HD1 TYR2328 HD1 TYR2328 15.032 8.623 -24.429 392 HD2 TYR2328 HD2 TYR2328 12.493 12.087 -24.026 393 HE1 TYR2328 HE1 TYR2328 14.647 8.072 -22.025 394 HE2 TYR2328 HE2 TYR2328 12.094 11.524 -21.638 395 HH TYR2328 HH TYR2328 12.547 10.076 -19.921 396 H GLU2329 H GLU2329 11.848 12.043 -26.344 397 HA GLU2329 HA GLU2329 9.330 10.849 -25.654 398 HB2 GLU2329 HB2 GLU2329 10.240 13.662 -26.227 399 HB3 GLU2329 HB3 GLU2329 8.521 13.284 -26.295 400 HG2 GLU2329 HG2 GLU2329 8.827 12.145 -23.984 401 HG3 GLU2329 HG3 GLU2329 10.391 12.955 -23.930 402 H ASP2330 H ASP2330 10.562 12.006 -28.786 403 HA ASP2330 HA ASP2330 8.048 11.900 -30.118 404 HB2 ASP2330 HB2 ASP2330 10.226 13.080 -30.809 405 HB3 ASP2330 HB3 ASP2330 10.745 11.521 -31.454 406 H CYS2331 H CYS2331 10.088 9.266 -29.191 407 HA CYS2331 HA CYS2331 8.735 7.351 -31.019 408 HB2 CYS2331 HB2 CYS2331 11.167 7.149 -30.513 409 HB3 CYS2331 HB3 CYS2331 10.775 6.887 -28.804 410 HG CYS2331 HG CYS2331 9.846 5.129 -31.477 411 H ILE2332 H ILE2332 8.840 8.183 -27.496 412 HA ILE2332 HA ILE2332 6.976 6.026 -26.889 413 HB ILE2332 HB ILE2332 7.158 6.642 -24.590 414 HG12 ILE2332 HG12 ILE2332 9.175 8.802 -25.124 415 HG13 ILE2332 HG13 ILE2332 7.462 9.235 -25.165 416 HG21 ILE2332 HG21 ILE2332 8.886 5.215 -25.626 417 HG22 ILE2332 HG22 ILE2332 9.894 6.644 -25.933 418 HG23 ILE2332 HG23 ILE2332 9.531 6.153 -24.271 419 HD11 ILE2332 3HD1 ILE2332 8.427 9.633 -22.948 420 HD12 ILE2332 1HD1 ILE2332 7.166 8.387 -22.875 421 HD13 ILE2332 2HD1 ILE2332 8.884 7.924 -22.810 422 H LYS2333 H LYS2333 6.332 9.190 -27.957 423 HA LYS2333 HA LYS2333 3.527 8.979 -26.945 424 HB2 LYS2333 HB2 LYS2333 3.436 11.143 -26.242 425 HB3 LYS2333 HB3 LYS2333 5.092 10.729 -25.813 426 HG2 LYS2333 HG2 LYS2333 5.682 11.780 -28.170 427 HG3 LYS2333 HG3 LYS2333 4.073 12.485 -28.075 428 HD2 LYS2333 HD2 LYS2333 6.324 12.851 -26.062 429 HD3 LYS2333 HD3 LYS2333 5.814 14.028 -27.279 430 HE2 LYS2333 HE2 LYS2333 3.527 14.054 -26.144 431 HE3 LYS2333 HE3 LYS2333 4.230 13.041 -24.873 432 HZ1 LYS2333 HZ3 LYS2333 4.431 15.286 -24.151 433 HZ2 LYS2333 HZ1 LYS2333 5.950 14.864 -24.621 434 HZ3 LYS2333 HZ2 LYS2333 5.029 15.808 -25.577 Start of MODEL 12 1 H VAL 515 H VAL 515 30.687 5.250 -19.491 2 HA VAL 515 HA VAL 515 29.650 7.431 -19.245 3 HB VAL 515 HB VAL 515 27.398 5.911 -17.889 4 HG11 VAL 515 HG11 VAL 515 27.817 8.071 -16.746 5 HG12 VAL 515 HG12 VAL 515 27.801 8.907 -18.318 6 HG13 VAL 515 HG13 VAL 515 26.331 8.137 -17.690 7 HG21 VAL 515 HG23 VAL 515 26.012 6.950 -19.690 8 HG22 VAL 515 HG21 VAL 515 27.484 7.563 -20.461 9 HG23 VAL 515 HG22 VAL 515 27.178 5.812 -20.346 10 H SER 516 H SER 516 29.467 4.899 -16.659 11 HA SER 516 HA SER 516 29.542 6.411 -14.490 12 HB2 SER 516 HB2 SER 516 31.124 3.828 -14.699 13 HB3 SER 516 HB3 SER 516 30.319 4.469 -13.254 14 HG SER 516 HG SER 516 29.036 2.869 -14.353 15 H LEU 517 H LEU 517 32.575 5.872 -16.257 16 HA LEU 517 HA LEU 517 33.925 7.759 -14.379 17 HB2 LEU 517 HB2 LEU 517 35.955 6.550 -14.422 18 HB3 LEU 517 HB3 LEU 517 34.699 5.494 -13.836 19 HG LEU 517 HG LEU 517 35.408 5.362 -16.779 20 HD11 LEU 517 1HD1 LEU 517 37.592 5.394 -15.684 21 HD12 LEU 517 2HD1 LEU 517 37.073 4.112 -14.566 22 HD13 LEU 517 3HD1 LEU 517 37.229 3.780 -16.308 23 HD21 LEU 517 3HD2 LEU 517 34.737 3.210 -14.722 24 HD22 LEU 517 1HD2 LEU 517 33.585 3.908 -15.879 25 HD23 LEU 517 2HD2 LEU 517 34.958 2.964 -16.467 26 H ILE 518 H ILE 518 32.621 7.972 -17.109 27 HA ILE 518 HA ILE 518 34.861 9.316 -18.560 28 HB ILE 518 HB ILE 518 32.661 7.773 -19.975 29 HG12 ILE 518 HG12 ILE 518 34.841 6.237 -20.507 30 HG13 ILE 518 HG13 ILE 518 35.283 6.737 -18.895 31 HG21 ILE 518 HG21 ILE 518 33.771 9.458 -21.382 32 HG22 ILE 518 HG22 ILE 518 35.367 8.828 -20.913 33 HG23 ILE 518 HG23 ILE 518 34.246 7.855 -21.891 34 HD11 ILE 518 3HD1 ILE 518 34.107 4.595 -18.862 35 HD12 ILE 518 1HD1 ILE 518 33.034 5.788 -18.110 36 HD13 ILE 518 2HD1 ILE 518 32.754 5.269 -19.784 37 H ASN 519 H ASN 519 31.806 9.726 -17.111 38 HA ASN 519 HA ASN 519 31.615 12.415 -18.309 39 HB2 ASN 519 HB2 ASN 519 30.058 10.390 -19.358 40 HB3 ASN 519 HB3 ASN 519 28.968 11.044 -18.150 41 HD21 ASN 519 2HD2 ASN 519 31.093 11.905 -20.875 42 HD22 ASN 519 1HD2 ASN 519 30.171 13.317 -21.367 43 H GLU 520 H GLU 520 32.658 12.101 -15.927 44 HA GLU 520 HA GLU 520 30.969 12.195 -13.637 45 HB2 GLU 520 HB2 GLU 520 33.620 13.613 -14.127 46 HB3 GLU 520 HB3 GLU 520 32.863 13.334 -12.555 47 HG2 GLU 520 HG2 GLU 520 33.033 10.867 -12.937 48 HG3 GLU 520 HG3 GLU 520 33.891 11.177 -14.450 49 H GLY 521 H GLY 521 30.046 13.870 -12.454 50 HA2 GLY 521 HA2 GLY 521 29.894 16.235 -11.909 51 HA3 GLY 521 HA3 GLY 521 29.977 16.636 -13.615 52 HA PRO 522 HA PRO 522 25.456 16.464 -12.250 53 HB2 PRO 522 HB2 PRO 522 24.819 19.111 -12.377 54 HB3 PRO 522 HB3 PRO 522 25.610 18.382 -10.946 55 HG2 PRO 522 HG2 PRO 522 26.928 19.875 -13.239 56 HG3 PRO 522 HG3 PRO 522 27.146 20.139 -11.479 57 HD2 PRO 522 HD2 PRO 522 28.869 18.614 -12.954 58 HD3 PRO 522 HD3 PRO 522 28.469 18.204 -11.259 59 H LEU 523 H LEU 523 23.562 16.992 -13.602 60 HA LEU 523 HA LEU 523 24.233 16.815 -16.451 61 HB2 LEU 523 HB2 LEU 523 22.212 15.814 -16.777 62 HB3 LEU 523 HB3 LEU 523 22.642 15.273 -15.193 63 HG LEU 523 HG LEU 523 21.001 17.692 -14.939 64 HD11 LEU 523 1HD1 LEU 523 20.193 17.042 -17.205 65 HD12 LEU 523 2HD1 LEU 523 19.765 15.440 -16.575 66 HD13 LEU 523 3HD1 LEU 523 18.943 16.894 -15.963 67 HD21 LEU 523 3HD2 LEU 523 19.532 16.215 -13.671 68 HD22 LEU 523 1HD2 LEU 523 20.410 14.787 -14.264 69 HD23 LEU 523 2HD2 LEU 523 21.222 15.962 -13.202 70 HA PRO 524 HA PRO 524 23.189 20.961 -17.583 71 HB2 PRO 524 HB2 PRO 524 22.114 20.698 -20.123 72 HB3 PRO 524 HB3 PRO 524 23.846 20.504 -19.723 73 HG2 PRO 524 HG2 PRO 524 21.746 18.342 -20.006 74 HG3 PRO 524 HG3 PRO 524 23.386 18.391 -20.727 75 HD2 PRO 524 HD2 PRO 524 22.847 17.009 -18.463 76 HD3 PRO 524 HD3 PRO 524 24.390 17.890 -18.645 77 HA PRO 525 HA PRO 525 19.165 21.918 -16.307 78 HB2 PRO 525 HB2 PRO 525 18.653 24.414 -17.319 79 HB3 PRO 525 HB3 PRO 525 19.924 24.079 -16.106 80 HG2 PRO 525 HG2 PRO 525 20.251 24.322 -19.115 81 HG3 PRO 525 HG3 PRO 525 21.212 25.119 -17.830 82 HD2 PRO 525 HD2 PRO 525 22.061 22.842 -19.037 83 HD3 PRO 525 HD3 PRO 525 22.326 23.111 -17.288 84 H GLY 526 H GLY 526 17.396 20.782 -16.906 85 HA2 GLY 526 HA2 GLY 526 15.468 20.194 -18.005 86 HA3 GLY 526 HA3 GLY 526 15.567 21.727 -18.875 87 H TRP 527 H TRP 527 18.097 19.311 -19.133 88 HA TRP 527 HA TRP 527 17.297 18.583 -21.936 89 HB2 TRP 527 HB2 TRP 527 19.933 19.379 -20.701 90 HB3 TRP 527 HB3 TRP 527 19.921 18.264 -22.052 91 HD1 TRP 527 HD1 TRP 527 19.649 21.903 -21.240 92 HE1 TRP 527 HE1 TRP 527 19.569 23.291 -23.394 93 HE3 TRP 527 HE3 TRP 527 19.099 18.109 -24.615 94 HZ2 TRP 527 HZ2 TRP 527 19.298 22.815 -26.229 95 HZ3 TRP 527 HZ3 TRP 527 18.921 18.604 -27.052 96 HH2 TRP 527 HH2 TRP 527 19.030 20.946 -27.865 97 H GLU 528 H GLU 528 17.977 16.540 -22.662 98 HA GLU 528 HA GLU 528 18.886 14.522 -20.664 99 HB2 GLU 528 HB2 GLU 528 16.536 14.151 -20.922 100 HB3 GLU 528 HB3 GLU 528 16.607 14.342 -22.661 101 HG2 GLU 528 HG2 GLU 528 16.280 12.044 -22.204 102 HG3 GLU 528 HG3 GLU 528 17.915 12.202 -22.814 103 H ILE 529 H ILE 529 20.182 12.855 -21.583 104 HA ILE 529 HA ILE 529 21.423 13.423 -24.217 105 HB ILE 529 HB ILE 529 23.281 13.103 -21.853 106 HG12 ILE 529 HG12 ILE 529 23.627 15.699 -22.075 107 HG13 ILE 529 HG13 ILE 529 21.962 15.721 -22.619 108 HG21 ILE 529 HG21 ILE 529 24.091 12.817 -24.162 109 HG22 ILE 529 HG22 ILE 529 23.517 14.445 -24.578 110 HG23 ILE 529 HG23 ILE 529 24.821 14.235 -23.399 111 HD11 ILE 529 3HD1 ILE 529 21.786 16.066 -20.293 112 HD12 ILE 529 1HD1 ILE 529 21.534 14.326 -20.361 113 HD13 ILE 529 2HD1 ILE 529 23.125 14.955 -19.925 114 H ARG 530 H ARG 530 21.915 11.568 -25.232 115 HA ARG 530 HA ARG 530 22.085 9.026 -23.655 116 HB2 ARG 530 HB2 ARG 530 20.237 9.481 -26.038 117 HB3 ARG 530 HB3 ARG 530 20.536 7.936 -25.231 118 HG2 ARG 530 HG2 ARG 530 19.756 9.098 -23.056 119 HG3 ARG 530 HG3 ARG 530 19.126 10.379 -24.101 120 HD2 ARG 530 HD2 ARG 530 18.355 7.430 -24.149 121 HD3 ARG 530 HD3 ARG 530 17.408 8.740 -23.463 122 HE ARG 530 HE ARG 530 16.957 9.624 -25.631 123 HH11 ARG 530 HH11 ARG 530 18.590 6.531 -25.879 124 HH12 ARG 530 HH12 ARG 530 17.967 6.232 -27.477 125 HH21 ARG 530 HH21 ARG 530 16.127 9.117 -27.631 126 HH22 ARG 530 HH22 ARG 530 16.561 7.608 -28.387 127 H TYR 531 H TYR 531 22.747 7.192 -24.858 128 HA TYR 531 HA TYR 531 24.996 7.817 -26.725 129 HB2 TYR 531 HB2 TYR 531 25.009 6.041 -24.253 130 HB3 TYR 531 HB3 TYR 531 26.338 6.254 -25.376 131 HD1 TYR 531 HD1 TYR 531 24.263 7.965 -22.780 132 HD2 TYR 531 HD2 TYR 531 27.871 8.075 -25.150 133 HE1 TYR 531 HE1 TYR 531 25.147 9.807 -21.353 134 HE2 TYR 531 HE2 TYR 531 28.781 9.857 -23.672 135 HH TYR 531 HH TYR 531 28.449 11.116 -21.809 136 H THR 532 H THR 532 24.247 6.852 -28.603 137 HA THR 532 HA THR 532 22.623 4.406 -28.527 138 HB THR 532 HB THR 532 22.689 4.532 -30.979 139 HG1 THR 532 HG1 THR 532 24.863 5.581 -30.932 140 HG21 THR 532 HG23 THR 532 21.520 6.691 -31.258 141 HG22 THR 532 HG21 THR 532 20.973 5.839 -29.802 142 HG23 THR 532 HG22 THR 532 22.085 7.218 -29.666 143 H ALA 533 H ALA 533 23.179 2.373 -29.432 144 HA ALA 533 HA ALA 533 25.652 1.336 -28.657 145 HB1 ALA 533 HB3 ALA 533 24.882 -0.717 -29.767 146 HB2 ALA 533 HB1 ALA 533 23.559 0.059 -28.881 147 HB3 ALA 533 HB2 ALA 533 23.648 0.203 -30.654 148 H ALA 534 H ALA 534 25.034 2.979 -31.654 149 HA ALA 534 HA ALA 534 27.215 1.931 -33.218 150 HB1 ALA 534 HB3 ALA 534 26.844 3.981 -34.558 151 HB2 ALA 534 HB1 ALA 534 25.325 3.150 -34.201 152 HB3 ALA 534 HB2 ALA 534 25.772 4.621 -33.296 153 H GLY 535 H GLY 535 27.320 3.853 -30.354 154 HA2 GLY 535 HA2 GLY 535 29.267 4.521 -29.237 155 HA3 GLY 535 HA3 GLY 535 30.215 4.378 -30.718 156 H GLU 536 H GLU 536 27.197 6.225 -30.131 157 HA GLU 536 HA GLU 536 28.601 8.814 -30.661 158 HB2 GLU 536 HB2 GLU 536 26.053 7.797 -31.976 159 HB3 GLU 536 HB3 GLU 536 26.667 9.434 -32.128 160 HG2 GLU 536 HG2 GLU 536 28.042 6.899 -33.125 161 HG3 GLU 536 HG3 GLU 536 27.114 8.026 -34.094 162 H ARG 537 H ARG 537 27.671 10.618 -29.730 163 HA ARG 537 HA ARG 537 25.574 10.132 -27.653 164 HB2 ARG 537 HB2 ARG 537 27.737 10.708 -26.720 165 HB3 ARG 537 HB3 ARG 537 27.831 12.180 -27.699 166 HG2 ARG 537 HG2 ARG 537 26.041 13.229 -26.477 167 HG3 ARG 537 HG3 ARG 537 25.541 11.693 -25.769 168 HD2 ARG 537 HD2 ARG 537 26.712 12.107 -23.984 169 HD3 ARG 537 HD3 ARG 537 28.206 11.979 -24.911 170 HE ARG 537 HE ARG 537 27.746 14.532 -25.366 171 HH11 ARG 537 HH11 ARG 537 27.154 12.921 -22.286 172 HH12 ARG 537 HH12 ARG 537 27.587 14.327 -21.369 173 HH21 ARG 537 HH21 ARG 537 28.352 16.276 -24.086 174 HH22 ARG 537 HH22 ARG 537 28.163 16.183 -22.362 175 H PHE 538 H PHE 538 23.832 11.363 -27.527 176 HA PHE 538 HA PHE 538 23.372 13.583 -29.483 177 HB2 PHE 538 HB2 PHE 538 21.535 11.219 -28.902 178 HB3 PHE 538 HB3 PHE 538 21.105 12.632 -29.852 179 HD1 PHE 538 HD1 PHE 538 22.020 13.001 -32.094 180 HD2 PHE 538 HD2 PHE 538 23.002 9.468 -29.836 181 HE1 PHE 538 HE1 PHE 538 22.826 11.886 -34.180 182 HE2 PHE 538 HE2 PHE 538 23.799 8.371 -31.914 183 HZ PHE 538 HZ PHE 538 23.721 9.574 -34.077 184 H PHE 539 H PHE 539 21.790 15.070 -28.870 185 HA PHE 539 HA PHE 539 21.093 15.105 -25.955 186 HB2 PHE 539 HB2 PHE 539 21.565 17.395 -27.886 187 HB3 PHE 539 HB3 PHE 539 21.091 17.549 -26.206 188 HD1 PHE 539 HD1 PHE 539 23.880 16.523 -28.455 189 HD2 PHE 539 HD2 PHE 539 22.679 17.473 -24.423 190 HE1 PHE 539 HE1 PHE 539 26.264 16.653 -27.775 191 HE2 PHE 539 HE2 PHE 539 25.065 17.641 -23.754 192 HZ PHE 539 HZ PHE 539 26.857 17.265 -25.440 193 H VAL 540 H VAL 540 19.101 15.753 -25.353 194 HA VAL 540 HA VAL 540 16.880 15.833 -27.356 195 HB VAL 540 HB VAL 540 17.068 14.227 -24.782 196 HG11 VAL 540 HG11 VAL 540 14.743 15.044 -25.355 197 HG12 VAL 540 HG12 VAL 540 14.864 14.140 -26.879 198 HG13 VAL 540 HG13 VAL 540 14.939 13.307 -25.300 199 HG21 VAL 540 HG23 VAL 540 16.945 12.201 -26.153 200 HG22 VAL 540 HG21 VAL 540 17.074 13.176 -27.631 201 HG23 VAL 540 HG22 VAL 540 18.420 13.109 -26.473 202 H ASP 541 H ASP 541 15.550 17.475 -27.030 203 HA ASP 541 HA ASP 541 15.527 18.923 -24.412 204 HB2 ASP 541 HB2 ASP 541 16.279 20.292 -26.258 205 HB3 ASP 541 HB3 ASP 541 14.898 19.810 -27.249 206 H HIS 542 H HIS 542 13.818 18.494 -23.167 207 HA HIS 542 HA HIS 542 11.386 17.232 -24.195 208 HB2 HIS 542 HB2 HIS 542 12.029 18.342 -21.439 209 HB3 HIS 542 HB3 HIS 542 10.684 17.280 -21.848 210 HD2 HIS 542 HD2 HIS 542 12.546 15.210 -23.685 211 HE1 HIS 542 HE1 HIS 542 14.341 14.361 -19.910 212 H ASN 543 H ASN 543 12.343 20.516 -23.918 213 HA ASN 543 HA ASN 543 9.790 21.651 -23.155 214 HB2 ASN 543 HB2 ASN 543 12.217 23.006 -24.409 215 HB3 ASN 543 HB3 ASN 543 10.891 23.787 -23.562 216 HD21 ASN 543 2HD2 ASN 543 13.963 22.229 -23.194 217 HD22 ASN 543 1HD2 ASN 543 13.953 22.189 -21.433 218 H THR 544 H THR 544 11.388 21.112 -26.301 219 HA THR 544 HA THR 544 8.757 21.617 -27.664 220 HB THR 544 HB THR 544 9.923 22.555 -29.566 221 HG1 THR 544 HG1 THR 544 12.164 23.032 -29.339 222 HG21 THR 544 HG23 THR 544 10.662 24.668 -28.682 223 HG22 THR 544 HG21 THR 544 9.286 24.111 -27.716 224 HG23 THR 544 HG22 THR 544 10.939 23.972 -27.072 225 H ARG 545 H ARG 545 10.550 19.146 -26.818 226 HA ARG 545 HA ARG 545 10.883 17.021 -27.452 227 HB2 ARG 545 HB2 ARG 545 8.393 17.499 -28.295 228 HB3 ARG 545 HB3 ARG 545 9.111 17.202 -29.881 229 HG2 ARG 545 HG2 ARG 545 9.890 14.954 -29.055 230 HG3 ARG 545 HG3 ARG 545 9.225 15.353 -27.464 231 HD2 ARG 545 HD2 ARG 545 7.628 13.943 -28.501 232 HD3 ARG 545 HD3 ARG 545 6.955 15.577 -28.515 233 HE ARG 545 HE ARG 545 8.410 14.642 -30.952 234 HH11 ARG 545 HH11 ARG 545 5.215 15.208 -29.578 235 HH12 ARG 545 HH12 ARG 545 4.461 15.053 -31.140 236 HH21 ARG 545 HH21 ARG 545 7.434 14.395 -32.764 237 HH22 ARG 545 HH22 ARG 545 5.698 14.650 -32.955 238 H ARG 546 H ARG 546 12.354 19.335 -28.852 239 HA ARG 546 HA ARG 546 13.393 18.238 -31.344 240 HB2 ARG 546 HB2 ARG 546 13.977 20.627 -29.564 241 HB3 ARG 546 HB3 ARG 546 15.142 20.208 -30.795 242 HG2 ARG 546 HG2 ARG 546 12.197 20.778 -31.341 243 HG3 ARG 546 HG3 ARG 546 13.514 21.933 -31.537 244 HD2 ARG 546 HD2 ARG 546 13.112 19.360 -33.116 245 HD3 ARG 546 HD3 ARG 546 12.894 21.010 -33.696 246 HE ARG 546 HE ARG 546 15.487 21.084 -32.904 247 HH11 ARG 546 HH11 ARG 546 13.806 19.025 -35.177 248 HH12 ARG 546 HH12 ARG 546 15.249 18.730 -36.107 249 HH21 ARG 546 HH21 ARG 546 17.301 20.568 -34.063 250 HH22 ARG 546 HH22 ARG 546 17.166 19.609 -35.504 251 H THR 547 H THR 547 15.697 18.043 -31.763 252 HA THR 547 HA THR 547 17.381 16.927 -29.613 253 HB THR 547 HB THR 547 17.939 14.938 -31.024 254 HG1 THR 547 HG1 THR 547 15.514 15.466 -32.374 255 HG21 THR 547 HG23 THR 547 16.041 13.569 -30.426 256 HG22 THR 547 HG21 THR 547 16.360 14.721 -29.134 257 HG23 THR 547 HG22 THR 547 14.997 14.986 -30.239 258 H THR 548 H THR 548 19.630 16.539 -30.349 259 HA THR 548 HA THR 548 20.520 17.565 -32.913 260 HB THR 548 HB THR 548 20.141 19.719 -31.979 261 HG1 THR 548 HG1 THR 548 22.150 20.558 -32.126 262 HG21 THR 548 HG23 THR 548 21.304 20.517 -29.920 263 HG22 THR 548 HG21 THR 548 20.046 19.316 -29.598 264 HG23 THR 548 HG22 THR 548 21.751 18.833 -29.572 265 H PHE 549 H PHE 549 22.861 17.554 -33.142 266 HA PHE 549 HA PHE 549 24.007 15.096 -32.007 267 HB2 PHE 549 HB2 PHE 549 25.263 17.013 -33.989 268 HB3 PHE 549 HB3 PHE 549 25.610 15.305 -33.776 269 HD1 PHE 549 HD1 PHE 549 22.765 14.205 -33.817 270 HD2 PHE 549 HD2 PHE 549 24.723 17.142 -36.282 271 HE1 PHE 549 HE1 PHE 549 21.212 13.668 -35.678 272 HE2 PHE 549 HE2 PHE 549 23.171 16.608 -38.144 273 HZ PHE 549 HZ PHE 549 21.413 14.873 -37.847 274 H GLU 550 H GLU 550 24.194 18.427 -31.245 275 HA GLU 550 HA GLU 550 26.599 18.129 -29.554 276 HB2 GLU 550 HB2 GLU 550 27.777 19.971 -30.566 277 HB3 GLU 550 HB3 GLU 550 27.484 18.723 -31.763 278 HG2 GLU 550 HG2 GLU 550 25.539 20.071 -32.642 279 HG3 GLU 550 HG3 GLU 550 25.963 21.350 -31.501 280 H ASP 551 H ASP 551 26.954 20.834 -28.895 281 HA ASP 551 HA ASP 551 24.318 21.595 -27.685 282 HB2 ASP 551 HB2 ASP 551 25.812 20.628 -26.037 283 HB3 ASP 551 HB3 ASP 551 27.077 21.783 -26.463 284 HA PRO 552 HA PRO 552 25.765 25.106 -30.369 285 HB2 PRO 552 HB2 PRO 552 23.479 25.564 -31.766 286 HB3 PRO 552 HB3 PRO 552 24.558 24.191 -32.144 287 HG2 PRO 552 HG2 PRO 552 22.049 24.160 -30.431 288 HG3 PRO 552 HG3 PRO 552 22.467 23.077 -31.799 289 HD2 PRO 552 HD2 PRO 552 22.937 22.396 -29.192 290 HD3 PRO 552 HD3 PRO 552 24.028 21.899 -30.517 291 H ARG 553 H ARG 553 24.556 27.319 -30.696 292 HA ARG 553 HA ARG 553 24.063 28.641 -28.243 293 HB2 ARG 553 HB2 ARG 553 23.289 29.277 -31.122 294 HB3 ARG 553 HB3 ARG 553 22.949 30.393 -29.814 295 HG2 ARG 553 HG2 ARG 553 25.753 29.382 -30.471 296 HG3 ARG 553 HG3 ARG 553 25.064 30.861 -31.129 297 HD2 ARG 553 HD2 ARG 553 25.468 30.319 -28.157 298 HD3 ARG 553 HD3 ARG 553 26.562 31.248 -29.189 299 HE ARG 553 HE ARG 553 24.044 32.431 -29.521 300 HH11 ARG 553 HH11 ARG 553 26.299 32.066 -26.865 301 HH12 ARG 553 HH12 ARG 553 25.746 33.520 -26.080 302 HH21 ARG 553 HH21 ARG 553 23.378 34.261 -28.462 303 HH22 ARG 553 HH22 ARG 553 24.137 34.728 -26.970 304 HA PRO 554 HA PRO 554 20.000 27.490 -27.064 305 HB2 PRO 554 HB2 PRO 554 19.101 29.673 -25.654 306 HB3 PRO 554 HB3 PRO 554 20.365 28.549 -25.075 307 HG2 PRO 554 HG2 PRO 554 20.747 31.227 -26.445 308 HG3 PRO 554 HG3 PRO 554 21.549 30.612 -24.964 309 HD2 PRO 554 HD2 PRO 554 22.746 30.483 -27.399 310 HD3 PRO 554 HD3 PRO 554 22.936 29.163 -26.206 311 H GLY 555 H GLY 555 18.684 27.179 -28.735 312 HA2 GLY 555 HA2 GLY 555 16.461 28.273 -29.548 313 HA3 GLY 555 HA3 GLY 555 17.528 29.471 -30.283 314 H ALA 556 H ALA 556 17.959 25.889 -30.113 315 HA ALA 556 HA ALA 556 18.855 25.622 -32.770 316 HB1 ALA 556 HB3 ALA 556 18.536 23.196 -32.357 317 HB2 ALA 556 HB1 ALA 556 19.303 24.001 -30.978 318 HB3 ALA 556 HB2 ALA 556 17.577 23.569 -30.909 319 HA PRO 557 HA PRO 557 15.353 26.157 -35.222 320 HB2 PRO 557 HB2 PRO 557 15.844 24.680 -37.491 321 HB3 PRO 557 HB3 PRO 557 16.757 26.144 -37.022 322 HG2 PRO 557 HG2 PRO 557 17.512 23.246 -36.538 323 HG3 PRO 557 HG3 PRO 557 18.534 24.562 -37.198 324 HD2 PRO 557 HD2 PRO 557 18.649 23.856 -34.582 325 HD3 PRO 557 HD3 PRO 557 18.768 25.571 -35.076 326 H ASN2319 H ASN2319 30.717 13.874 -36.245 327 HA ASN2319 HA ASN2319 31.750 12.416 -37.815 328 HB2 ASN2319 HB2 ASN2319 30.061 10.252 -36.479 329 HB3 ASN2319 HB3 ASN2319 30.871 10.075 -38.033 330 HD21 ASN2319 2HD2 ASN2319 32.410 8.446 -37.397 331 HD22 ASN2319 1HD2 ASN2319 33.658 8.805 -36.218 332 H THR2320 H THR2320 30.966 12.960 -39.756 333 HA THR2320 HA THR2320 28.297 14.017 -40.054 334 HB THR2320 HB THR2320 29.100 14.213 -42.514 335 HG1 THR2320 HG1 THR2320 30.758 12.712 -42.498 336 HG21 THR2320 HG23 THR2320 30.576 16.092 -41.973 337 HG22 THR2320 HG21 THR2320 29.146 16.083 -40.928 338 HG23 THR2320 HG22 THR2320 30.712 15.531 -40.291 339 H GLY2321 H GLY2321 26.887 13.540 -41.869 340 HA2 GLY2321 HA2 GLY2321 25.760 12.097 -43.358 341 HA3 GLY2321 HA3 GLY2321 26.670 10.713 -42.761 342 H ALA2322 H ALA2322 23.964 10.477 -43.089 343 HA ALA2322 HA ALA2322 22.453 10.878 -40.663 344 HB1 ALA2322 HB3 ALA2322 20.885 9.274 -41.678 345 HB2 ALA2322 HB1 ALA2322 21.388 10.506 -42.848 346 HB3 ALA2322 HB2 ALA2322 22.082 8.868 -42.927 347 H LYS2323 H LYS2323 22.075 9.522 -38.968 348 HA LYS2323 HA LYS2323 23.565 6.981 -38.606 349 HB2 LYS2323 HB2 LYS2323 24.794 9.285 -37.801 350 HB3 LYS2323 HB3 LYS2323 23.762 9.033 -36.410 351 HG2 LYS2323 HG2 LYS2323 25.597 7.857 -35.720 352 HG3 LYS2323 HG3 LYS2323 24.786 6.531 -36.554 353 HD2 LYS2323 HD2 LYS2323 26.159 7.038 -38.600 354 HD3 LYS2323 HD3 LYS2323 26.989 8.313 -37.681 355 HE2 LYS2323 HE2 LYS2323 27.707 6.590 -36.002 356 HE3 LYS2323 HE3 LYS2323 26.942 5.339 -36.987 357 HZ1 LYS2323 HZ3 LYS2323 29.322 5.499 -37.465 358 HZ2 LYS2323 HZ1 LYS2323 28.485 5.929 -38.798 359 HZ3 LYS2323 HZ2 LYS2323 29.193 7.073 -37.869 360 H GLN2324 H GLN2324 23.006 6.500 -35.957 361 HA GLN2324 HA GLN2324 20.323 5.679 -35.824 362 HB2 GLN2324 HB2 GLN2324 22.281 6.329 -33.592 363 HB3 GLN2324 HB3 GLN2324 20.685 5.633 -33.346 364 HG2 GLN2324 HG2 GLN2324 21.745 3.932 -35.290 365 HG3 GLN2324 HG3 GLN2324 23.178 4.392 -34.383 366 HE21 GLN2324 HE22 GLN2324 23.396 2.151 -33.615 367 HE22 GLN2324 HE21 GLN2324 22.268 1.532 -32.419 368 HA PRO2325 HA PRO2325 18.635 9.826 -35.402 369 HB2 PRO2325 HB2 PRO2325 15.959 9.305 -35.626 370 HB3 PRO2325 HB3 PRO2325 17.102 9.266 -37.002 371 HG2 PRO2325 HG2 PRO2325 16.067 6.928 -35.378 372 HG3 PRO2325 HG3 PRO2325 16.207 7.073 -37.158 373 HD2 PRO2325 HD2 PRO2325 18.083 5.800 -35.615 374 HD3 PRO2325 HD3 PRO2325 18.516 6.690 -37.104 375 HA PRO2326 HA PRO2326 17.753 9.468 -30.940 376 HB2 PRO2326 HB2 PRO2326 17.893 12.096 -30.231 377 HB3 PRO2326 HB3 PRO2326 19.328 11.096 -30.592 378 HG2 PRO2326 HG2 PRO2326 17.886 12.994 -32.468 379 HG3 PRO2326 HG3 PRO2326 19.639 12.900 -32.138 380 HD2 PRO2326 HD2 PRO2326 18.472 11.690 -34.288 381 HD3 PRO2326 HD3 PRO2326 19.851 10.934 -33.430 382 H SER2327 H SER2327 15.749 8.956 -30.453 383 HA SER2327 HA SER2327 13.521 10.925 -30.617 384 HB2 SER2327 HB2 SER2327 13.414 8.088 -31.721 385 HB3 SER2327 HB3 SER2327 12.001 9.117 -31.423 386 HG SER2327 HG SER2327 12.692 9.231 -33.599 387 H TYR2328 H TYR2328 13.783 11.134 -28.350 388 HA TYR2328 HA TYR2328 13.312 8.774 -26.607 389 HB2 TYR2328 HB2 TYR2328 14.946 10.521 -25.985 390 HB3 TYR2328 HB3 TYR2328 13.673 11.721 -26.011 391 HD1 TYR2328 HD1 TYR2328 14.547 8.434 -24.373 392 HD2 TYR2328 HD2 TYR2328 12.647 12.290 -23.964 393 HE1 TYR2328 HE1 TYR2328 14.141 7.982 -21.962 394 HE2 TYR2328 HE2 TYR2328 12.216 11.816 -21.555 395 HH TYR2328 HH TYR2328 13.262 8.768 -19.994 396 H GLU2329 H GLU2329 11.732 11.939 -26.150 397 HA GLU2329 HA GLU2329 9.140 10.841 -25.670 398 HB2 GLU2329 HB2 GLU2329 10.164 13.617 -26.248 399 HB3 GLU2329 HB3 GLU2329 8.431 13.282 -26.196 400 HG2 GLU2329 HG2 GLU2329 8.819 12.196 -23.909 401 HG3 GLU2329 HG3 GLU2329 10.430 12.920 -23.945 402 H ASP2330 H ASP2330 10.597 12.047 -28.691 403 HA ASP2330 HA ASP2330 8.233 11.994 -30.261 404 HB2 ASP2330 HB2 ASP2330 10.615 12.977 -30.718 405 HB3 ASP2330 HB3 ASP2330 10.981 11.388 -31.383 406 H CYS2331 H CYS2331 10.072 9.309 -29.050 407 HA CYS2331 HA CYS2331 8.809 7.376 -30.936 408 HB2 CYS2331 HB2 CYS2331 11.223 7.156 -30.365 409 HB3 CYS2331 HB3 CYS2331 10.792 6.946 -28.660 410 HG CYS2331 HG CYS2331 9.910 5.119 -31.300 411 H ILE2332 H ILE2332 8.874 8.192 -27.406 412 HA ILE2332 HA ILE2332 6.987 6.056 -26.844 413 HB ILE2332 HB ILE2332 7.122 6.669 -24.540 414 HG12 ILE2332 HG12 ILE2332 9.163 8.818 -24.989 415 HG13 ILE2332 HG13 ILE2332 7.462 9.272 -25.145 416 HG21 ILE2332 HG21 ILE2332 8.869 5.246 -25.531 417 HG22 ILE2332 HG22 ILE2332 9.879 6.675 -25.834 418 HG23 ILE2332 HG23 ILE2332 9.490 6.197 -24.173 419 HD11 ILE2332 3HD1 ILE2332 8.284 9.679 -22.875 420 HD12 ILE2332 1HD1 ILE2332 7.002 8.452 -22.880 421 HD13 ILE2332 2HD1 ILE2332 8.706 7.963 -22.697 422 H LYS2333 H LYS2333 6.339 9.278 -27.840 423 HA LYS2333 HA LYS2333 3.516 8.990 -26.907 424 HB2 LYS2333 HB2 LYS2333 3.402 11.034 -25.936 425 HB3 LYS2333 HB3 LYS2333 5.056 10.594 -25.533 426 HG2 LYS2333 HG2 LYS2333 5.658 11.947 -27.733 427 HG3 LYS2333 HG3 LYS2333 4.040 12.611 -27.563 428 HD2 LYS2333 HD2 LYS2333 6.283 12.749 -25.507 429 HD3 LYS2333 HD3 LYS2333 5.737 14.069 -26.553 430 HE2 LYS2333 HE2 LYS2333 3.469 13.919 -25.435 431 HE3 LYS2333 HE3 LYS2333 4.152 12.713 -24.332 432 HZ1 LYS2333 HZ3 LYS2333 4.315 14.839 -23.281 433 HZ2 LYS2333 HZ1 LYS2333 5.851 14.451 -23.727 434 HZ3 LYS2333 HZ2 LYS2333 4.999 15.544 -24.585 Start of MODEL 13 1 H VAL 515 H VAL 515 28.946 5.430 -18.342 2 HA VAL 515 HA VAL 515 27.874 7.579 -18.016 3 HB VAL 515 HB VAL 515 26.060 6.088 -16.089 4 HG11 VAL 515 HG11 VAL 515 26.619 8.388 -15.267 5 HG12 VAL 515 HG12 VAL 515 26.105 9.047 -16.840 6 HG13 VAL 515 HG13 VAL 515 24.938 8.248 -15.776 7 HG21 VAL 515 HG23 VAL 515 24.250 6.917 -17.604 8 HG22 VAL 515 HG21 VAL 515 25.479 7.509 -18.736 9 HG23 VAL 515 HG22 VAL 515 25.302 5.765 -18.414 10 H SER 516 H SER 516 28.254 5.322 -15.201 11 HA SER 516 HA SER 516 28.715 7.032 -13.290 12 HB2 SER 516 HB2 SER 516 30.258 4.435 -13.494 13 HB3 SER 516 HB3 SER 516 29.714 5.255 -12.018 14 HG SER 516 HG SER 516 28.293 3.555 -12.640 15 H LEU 517 H LEU 517 31.450 6.236 -15.428 16 HA LEU 517 HA LEU 517 33.038 8.340 -14.014 17 HB2 LEU 517 HB2 LEU 517 35.027 7.094 -14.157 18 HB3 LEU 517 HB3 LEU 517 33.826 6.072 -13.411 19 HG LEU 517 HG LEU 517 33.774 5.582 -16.280 20 HD11 LEU 517 1HD1 LEU 517 36.083 6.456 -16.308 21 HD12 LEU 517 2HD1 LEU 517 36.535 5.307 -15.030 22 HD13 LEU 517 3HD1 LEU 517 36.035 4.717 -16.633 23 HD21 LEU 517 3HD2 LEU 517 34.321 3.294 -15.626 24 HD22 LEU 517 1HD2 LEU 517 34.778 3.842 -13.998 25 HD23 LEU 517 2HD2 LEU 517 33.090 3.968 -14.544 26 H ILE 518 H ILE 518 31.351 8.169 -16.584 27 HA ILE 518 HA ILE 518 33.352 9.322 -18.496 28 HB ILE 518 HB ILE 518 30.866 7.746 -19.258 29 HG12 ILE 518 HG12 ILE 518 32.947 6.145 -20.094 30 HG13 ILE 518 HG13 ILE 518 33.636 6.766 -18.608 31 HG21 ILE 518 HG21 ILE 518 31.609 9.268 -21.027 32 HG22 ILE 518 HG22 ILE 518 33.276 8.656 -20.889 33 HG23 ILE 518 HG23 ILE 518 31.963 7.612 -21.483 34 HD11 ILE 518 3HD1 ILE 518 32.481 4.647 -18.217 35 HD12 ILE 518 1HD1 ILE 518 31.550 5.920 -17.404 36 HD13 ILE 518 2HD1 ILE 518 30.999 5.265 -18.963 37 H ASN 519 H ASN 519 30.454 9.845 -16.728 38 HA ASN 519 HA ASN 519 29.921 12.418 -18.142 39 HB2 ASN 519 HB2 ASN 519 28.364 10.403 -18.655 40 HB3 ASN 519 HB3 ASN 519 27.787 10.585 -17.002 41 HD21 ASN 519 2HD2 ASN 519 27.709 11.894 -20.275 42 HD22 ASN 519 1HD2 ASN 519 26.530 13.137 -19.911 43 H GLU 520 H GLU 520 31.654 12.377 -16.052 44 HA GLU 520 HA GLU 520 30.565 12.639 -13.422 45 HB2 GLU 520 HB2 GLU 520 33.085 13.878 -14.600 46 HB3 GLU 520 HB3 GLU 520 32.698 13.746 -12.881 47 HG2 GLU 520 HG2 GLU 520 32.617 11.241 -13.140 48 HG3 GLU 520 HG3 GLU 520 33.197 11.428 -14.797 49 H GLY 521 H GLY 521 30.120 14.442 -12.124 50 HA2 GLY 521 HA2 GLY 521 29.761 16.718 -11.617 51 HA3 GLY 521 HA3 GLY 521 29.881 17.149 -13.316 52 HA PRO 522 HA PRO 522 25.343 17.005 -11.991 53 HB2 PRO 522 HB2 PRO 522 24.710 19.652 -12.173 54 HB3 PRO 522 HB3 PRO 522 25.483 18.944 -10.723 55 HG2 PRO 522 HG2 PRO 522 26.829 20.401 -13.021 56 HG3 PRO 522 HG3 PRO 522 27.035 20.683 -11.263 57 HD2 PRO 522 HD2 PRO 522 28.764 19.136 -12.706 58 HD3 PRO 522 HD3 PRO 522 28.348 18.743 -11.011 59 H LEU 523 H LEU 523 23.477 17.375 -13.364 60 HA LEU 523 HA LEU 523 24.164 17.210 -16.202 61 HB2 LEU 523 HB2 LEU 523 22.183 16.121 -16.515 62 HB3 LEU 523 HB3 LEU 523 22.625 15.636 -14.919 63 HG LEU 523 HG LEU 523 20.908 17.988 -14.686 64 HD11 LEU 523 1HD1 LEU 523 20.144 17.348 -16.975 65 HD12 LEU 523 2HD1 LEU 523 19.748 15.728 -16.371 66 HD13 LEU 523 3HD1 LEU 523 18.882 17.153 -15.752 67 HD21 LEU 523 3HD2 LEU 523 19.456 16.454 -13.461 68 HD22 LEU 523 1HD2 LEU 523 20.381 15.059 -14.062 69 HD23 LEU 523 2HD2 LEU 523 21.145 16.239 -12.971 70 HA PRO 524 HA PRO 524 23.035 21.295 -17.426 71 HB2 PRO 524 HB2 PRO 524 21.958 20.959 -19.955 72 HB3 PRO 524 HB3 PRO 524 23.692 20.786 -19.555 73 HG2 PRO 524 HG2 PRO 524 21.613 18.589 -19.788 74 HG3 PRO 524 HG3 PRO 524 23.255 18.648 -20.503 75 HD2 PRO 524 HD2 PRO 524 22.706 17.328 -18.198 76 HD3 PRO 524 HD3 PRO 524 24.255 18.195 -18.411 77 HA PRO 525 HA PRO 525 18.967 22.209 -16.198 78 HB2 PRO 525 HB2 PRO 525 18.454 24.692 -17.236 79 HB3 PRO 525 HB3 PRO 525 19.700 24.380 -15.993 80 HG2 PRO 525 HG2 PRO 525 20.094 24.612 -18.995 81 HG3 PRO 525 HG3 PRO 525 21.017 25.423 -17.691 82 HD2 PRO 525 HD2 PRO 525 21.910 23.144 -18.873 83 HD3 PRO 525 HD3 PRO 525 22.145 23.431 -17.123 84 H GLY 526 H GLY 526 17.257 21.013 -16.850 85 HA2 GLY 526 HA2 GLY 526 15.362 20.393 -17.992 86 HA3 GLY 526 HA3 GLY 526 15.452 21.930 -18.857 87 H TRP 527 H TRP 527 18.014 19.536 -19.052 88 HA TRP 527 HA TRP 527 17.285 18.760 -21.860 89 HB2 TRP 527 HB2 TRP 527 19.880 19.701 -20.631 90 HB3 TRP 527 HB3 TRP 527 19.921 18.578 -21.971 91 HD1 TRP 527 HD1 TRP 527 19.503 22.205 -21.196 92 HE1 TRP 527 HE1 TRP 527 19.413 23.564 -23.367 93 HE3 TRP 527 HE3 TRP 527 19.081 18.356 -24.532 94 HZ2 TRP 527 HZ2 TRP 527 19.228 23.044 -26.203 95 HZ3 TRP 527 HZ3 TRP 527 18.953 18.813 -26.975 96 HH2 TRP 527 HH2 TRP 527 19.040 21.146 -27.820 97 H GLU 528 H GLU 528 18.170 16.744 -22.553 98 HA GLU 528 HA GLU 528 19.125 14.827 -20.482 99 HB2 GLU 528 HB2 GLU 528 16.837 14.266 -20.741 100 HB3 GLU 528 HB3 GLU 528 16.862 14.532 -22.467 101 HG2 GLU 528 HG2 GLU 528 16.645 12.220 -22.136 102 HG3 GLU 528 HG3 GLU 528 18.267 12.463 -22.744 103 H ILE 529 H ILE 529 20.414 13.123 -21.336 104 HA ILE 529 HA ILE 529 21.729 13.626 -23.963 105 HB ILE 529 HB ILE 529 23.378 12.892 -21.522 106 HG12 ILE 529 HG12 ILE 529 24.268 15.359 -21.805 107 HG13 ILE 529 HG13 ILE 529 22.646 15.698 -22.400 108 HG21 ILE 529 HG21 ILE 529 24.252 12.413 -23.801 109 HG22 ILE 529 HG22 ILE 529 24.062 14.137 -24.208 110 HG23 ILE 529 HG23 ILE 529 25.222 13.622 -22.963 111 HD11 ILE 529 3HD1 ILE 529 23.016 16.128 -19.968 112 HD12 ILE 529 1HD1 ILE 529 21.701 14.980 -20.225 113 HD13 ILE 529 2HD1 ILE 529 23.304 14.407 -19.703 114 H ARG 530 H ARG 530 21.951 11.800 -25.099 115 HA ARG 530 HA ARG 530 21.817 9.137 -23.729 116 HB2 ARG 530 HB2 ARG 530 20.162 10.052 -26.117 117 HB3 ARG 530 HB3 ARG 530 20.310 8.376 -25.619 118 HG2 ARG 530 HG2 ARG 530 19.437 10.109 -23.374 119 HG3 ARG 530 HG3 ARG 530 18.388 10.235 -24.772 120 HD2 ARG 530 HD2 ARG 530 17.526 8.542 -23.319 121 HD3 ARG 530 HD3 ARG 530 18.113 7.777 -24.804 122 HE ARG 530 HE ARG 530 20.047 7.835 -22.584 123 HH11 ARG 530 HH11 ARG 530 17.397 5.955 -23.901 124 HH12 ARG 530 HH12 ARG 530 17.932 4.491 -23.127 125 HH21 ARG 530 HH21 ARG 530 20.694 5.906 -21.657 126 HH22 ARG 530 HH22 ARG 530 19.741 4.473 -21.897 127 H TYR 531 H TYR 531 22.637 7.409 -24.935 128 HA TYR 531 HA TYR 531 24.710 8.108 -26.979 129 HB2 TYR 531 HB2 TYR 531 25.020 6.352 -24.510 130 HB3 TYR 531 HB3 TYR 531 26.199 6.519 -25.795 131 HD1 TYR 531 HD1 TYR 531 24.482 8.373 -23.026 132 HD2 TYR 531 HD2 TYR 531 27.813 8.273 -25.769 133 HE1 TYR 531 HE1 TYR 531 25.589 10.206 -21.752 134 HE2 TYR 531 HE2 TYR 531 28.934 10.072 -24.467 135 HH TYR 531 HH TYR 531 28.814 11.477 -22.670 136 H THR 532 H THR 532 24.116 7.029 -28.799 137 HA THR 532 HA THR 532 22.200 4.848 -28.702 138 HB THR 532 HB THR 532 22.391 4.756 -31.101 139 HG1 THR 532 HG1 THR 532 23.892 6.260 -32.102 140 HG21 THR 532 HG23 THR 532 21.787 7.031 -31.721 141 HG22 THR 532 HG21 THR 532 21.074 6.631 -30.150 142 HG23 THR 532 HG22 THR 532 22.513 7.669 -30.232 143 H ALA 533 H ALA 533 22.483 2.673 -29.431 144 HA ALA 533 HA ALA 533 24.832 1.330 -28.563 145 HB1 ALA 533 HB3 ALA 533 23.764 -0.648 -29.554 146 HB2 ALA 533 HB1 ALA 533 22.579 0.327 -28.668 147 HB3 ALA 533 HB2 ALA 533 22.627 0.384 -30.447 148 H ALA 534 H ALA 534 24.400 3.079 -31.465 149 HA ALA 534 HA ALA 534 26.385 1.630 -33.077 150 HB1 ALA 534 HB3 ALA 534 25.983 3.449 -34.676 151 HB2 ALA 534 HB1 ALA 534 24.459 2.736 -34.144 152 HB3 ALA 534 HB2 ALA 534 24.986 4.311 -33.487 153 H GLY 535 H GLY 535 26.563 3.829 -30.459 154 HA2 GLY 535 HA2 GLY 535 28.605 4.274 -29.411 155 HA3 GLY 535 HA3 GLY 535 29.469 4.160 -30.940 156 H GLU 536 H GLU 536 26.577 6.231 -30.635 157 HA GLU 536 HA GLU 536 28.347 8.655 -30.669 158 HB2 GLU 536 HB2 GLU 536 25.914 8.072 -32.393 159 HB3 GLU 536 HB3 GLU 536 26.702 9.639 -32.281 160 HG2 GLU 536 HG2 GLU 536 27.924 7.066 -33.357 161 HG3 GLU 536 HG3 GLU 536 27.371 8.442 -34.301 162 H ARG 537 H ARG 537 27.785 10.358 -29.518 163 HA ARG 537 HA ARG 537 25.515 10.153 -27.632 164 HB2 ARG 537 HB2 ARG 537 27.775 10.745 -26.839 165 HB3 ARG 537 HB3 ARG 537 27.791 12.185 -27.844 166 HG2 ARG 537 HG2 ARG 537 25.538 11.773 -25.857 167 HG3 ARG 537 HG3 ARG 537 27.111 12.258 -25.260 168 HD2 ARG 537 HD2 ARG 537 26.105 13.899 -27.551 169 HD3 ARG 537 HD3 ARG 537 25.160 13.998 -26.084 170 HE ARG 537 HE ARG 537 27.050 14.797 -24.860 171 HH11 ARG 537 HH11 ARG 537 27.663 14.789 -28.321 172 HH12 ARG 537 HH12 ARG 537 29.043 15.834 -28.154 173 HH21 ARG 537 HH21 ARG 537 28.809 16.113 -24.737 174 HH22 ARG 537 HH22 ARG 537 29.650 16.588 -26.181 175 H PHE 538 H PHE 538 23.787 11.457 -27.583 176 HA PHE 538 HA PHE 538 23.602 13.848 -29.348 177 HB2 PHE 538 HB2 PHE 538 21.512 11.643 -29.155 178 HB3 PHE 538 HB3 PHE 538 21.258 13.204 -29.912 179 HD1 PHE 538 HD2 PHE 538 22.945 9.932 -30.245 180 HD2 PHE 538 HD1 PHE 538 22.183 13.740 -32.113 181 HE1 PHE 538 HE2 PHE 538 23.692 9.012 -32.427 182 HE2 PHE 538 HE1 PHE 538 22.929 12.816 -34.297 183 HZ PHE 538 HZ PHE 538 23.689 10.454 -34.455 184 H PHE 539 H PHE 539 21.943 15.317 -28.688 185 HA PHE 539 HA PHE 539 21.221 15.185 -25.784 186 HB2 PHE 539 HB2 PHE 539 21.609 17.549 -27.647 187 HB3 PHE 539 HB3 PHE 539 20.980 17.652 -26.016 188 HD1 PHE 539 HD2 PHE 539 22.376 17.384 -24.050 189 HD2 PHE 539 HD1 PHE 539 24.020 17.149 -28.026 190 HE1 PHE 539 HE2 PHE 539 24.655 17.763 -23.129 191 HE2 PHE 539 HE1 PHE 539 26.289 17.571 -27.114 192 HZ PHE 539 HZ PHE 539 26.611 17.881 -24.663 193 H VAL 540 H VAL 540 19.201 15.821 -25.168 194 HA VAL 540 HA VAL 540 16.983 15.780 -27.185 195 HB VAL 540 HB VAL 540 17.261 14.224 -24.586 196 HG11 VAL 540 HG11 VAL 540 14.910 14.998 -24.960 197 HG12 VAL 540 HG12 VAL 540 14.929 14.194 -26.546 198 HG13 VAL 540 HG13 VAL 540 15.098 13.257 -25.035 199 HG21 VAL 540 HG23 VAL 540 17.082 12.196 -25.938 200 HG22 VAL 540 HG21 VAL 540 17.063 13.162 -27.426 201 HG23 VAL 540 HG22 VAL 540 18.507 13.128 -26.391 202 H ASP 541 H ASP 541 15.614 17.410 -26.928 203 HA ASP 541 HA ASP 541 15.482 18.881 -24.324 204 HB2 ASP 541 HB2 ASP 541 16.267 20.246 -26.184 205 HB3 ASP 541 HB3 ASP 541 14.877 19.778 -27.166 206 H HIS 542 H HIS 542 13.765 18.304 -23.139 207 HA HIS 542 HA HIS 542 11.401 17.023 -24.300 208 HB2 HIS 542 HB2 HIS 542 11.911 18.002 -21.467 209 HB3 HIS 542 HB3 HIS 542 10.643 16.892 -21.979 210 HD2 HIS 542 HD2 HIS 542 12.537 14.937 -23.809 211 HE1 HIS 542 HE1 HIS 542 14.502 14.148 -20.107 212 H ASN 543 H ASN 543 12.259 20.299 -23.864 213 HA ASN 543 HA ASN 543 9.685 21.357 -23.044 214 HB2 ASN 543 HB2 ASN 543 12.061 22.850 -24.237 215 HB3 ASN 543 HB3 ASN 543 10.771 23.508 -23.245 216 HD21 ASN 543 2HD2 ASN 543 13.908 22.066 -23.211 217 HD22 ASN 543 1HD2 ASN 543 14.000 21.772 -21.481 218 H THR 544 H THR 544 11.365 21.033 -26.171 219 HA THR 544 HA THR 544 8.772 21.563 -27.595 220 HB THR 544 HB THR 544 10.024 22.571 -29.425 221 HG1 THR 544 HG1 THR 544 12.251 23.118 -28.960 222 HG21 THR 544 HG23 THR 544 10.662 24.668 -28.431 223 HG22 THR 544 HG21 THR 544 9.246 24.051 -27.563 224 HG23 THR 544 HG22 THR 544 10.862 23.923 -26.831 225 H ARG 545 H ARG 545 10.625 19.104 -26.790 226 HA ARG 545 HA ARG 545 10.884 16.968 -27.442 227 HB2 ARG 545 HB2 ARG 545 8.468 17.572 -28.509 228 HB3 ARG 545 HB3 ARG 545 9.345 17.220 -29.997 229 HG2 ARG 545 HG2 ARG 545 10.070 15.011 -28.724 230 HG3 ARG 545 HG3 ARG 545 8.740 15.417 -27.634 231 HD2 ARG 545 HD2 ARG 545 8.616 14.902 -30.625 232 HD3 ARG 545 HD3 ARG 545 7.978 13.856 -29.343 233 HE ARG 545 HE ARG 545 6.628 16.228 -28.960 234 HH11 ARG 545 HH11 ARG 545 6.949 14.134 -31.802 235 HH12 ARG 545 HH12 ARG 545 5.405 14.651 -32.420 236 HH21 ARG 545 HH21 ARG 545 4.785 16.961 -29.966 237 HH22 ARG 545 HH22 ARG 545 4.229 16.195 -31.421 238 H ARG 546 H ARG 546 12.389 19.358 -28.913 239 HA ARG 546 HA ARG 546 13.447 18.156 -31.343 240 HB2 ARG 546 HB2 ARG 546 14.299 20.576 -29.693 241 HB3 ARG 546 HB3 ARG 546 15.044 20.120 -31.230 242 HG2 ARG 546 HG2 ARG 546 12.841 20.311 -32.373 243 HG3 ARG 546 HG3 ARG 546 12.107 20.837 -30.849 244 HD2 ARG 546 HD2 ARG 546 13.770 22.738 -30.783 245 HD3 ARG 546 HD3 ARG 546 14.328 22.232 -32.391 246 HE ARG 546 HE ARG 546 11.458 22.635 -32.323 247 HH11 ARG 546 HH11 ARG 546 14.443 24.451 -32.581 248 HH12 ARG 546 HH12 ARG 546 13.665 25.795 -33.372 249 HH21 ARG 546 HH21 ARG 546 10.525 24.394 -33.315 250 HH22 ARG 546 HH22 ARG 546 11.502 25.761 -33.760 251 H THR 547 H THR 547 15.743 17.926 -31.761 252 HA THR 547 HA THR 547 17.437 16.855 -29.570 253 HB THR 547 HB THR 547 17.943 14.855 -31.039 254 HG1 THR 547 HG1 THR 547 16.958 15.615 -32.963 255 HG21 THR 547 HG23 THR 547 16.070 13.520 -30.300 256 HG22 THR 547 HG21 THR 547 16.490 14.679 -29.035 257 HG23 THR 547 HG22 THR 547 15.063 14.958 -30.057 258 H THR 548 H THR 548 19.680 16.568 -30.188 259 HA THR 548 HA THR 548 20.604 17.534 -32.792 260 HB THR 548 HB THR 548 20.144 19.672 -31.761 261 HG1 THR 548 HG1 THR 548 21.860 20.063 -32.858 262 HG21 THR 548 HG23 THR 548 21.311 20.467 -29.765 263 HG22 THR 548 HG21 THR 548 20.244 19.117 -29.374 264 HG23 THR 548 HG22 THR 548 21.995 18.851 -29.502 265 H PHE 549 H PHE 549 22.882 17.360 -33.095 266 HA PHE 549 HA PHE 549 24.120 15.143 -31.564 267 HB2 PHE 549 HB2 PHE 549 23.939 15.054 -34.024 268 HB3 PHE 549 HB3 PHE 549 24.832 16.560 -34.159 269 HD1 PHE 549 HD1 PHE 549 25.323 13.254 -32.371 270 HD2 PHE 549 HD2 PHE 549 27.014 16.277 -34.943 271 HE1 PHE 549 HE1 PHE 549 27.435 11.968 -32.494 272 HE2 PHE 549 HE2 PHE 549 29.118 14.971 -35.084 273 HZ PHE 549 HZ PHE 549 29.337 12.816 -33.852 274 H GLU 550 H GLU 550 24.384 18.594 -31.815 275 HA GLU 550 HA GLU 550 27.026 18.611 -30.403 276 HB2 GLU 550 HB2 GLU 550 27.522 20.710 -31.436 277 HB3 GLU 550 HB3 GLU 550 27.154 19.524 -32.679 278 HG2 GLU 550 HG2 GLU 550 24.840 20.494 -32.876 279 HG3 GLU 550 HG3 GLU 550 25.287 21.723 -31.690 280 H ASP 551 H ASP 551 27.070 21.162 -29.424 281 HA ASP 551 HA ASP 551 24.740 21.236 -27.537 282 HB2 ASP 551 HB2 ASP 551 26.744 20.376 -26.485 283 HB3 ASP 551 HB3 ASP 551 27.656 21.800 -26.983 284 HA PRO 552 HA PRO 552 24.869 25.272 -29.852 285 HB2 PRO 552 HB2 PRO 552 22.246 25.454 -30.554 286 HB3 PRO 552 HB3 PRO 552 23.385 24.377 -31.414 287 HG2 PRO 552 HG2 PRO 552 21.461 23.637 -29.182 288 HG3 PRO 552 HG3 PRO 552 21.665 22.840 -30.777 289 HD2 PRO 552 HD2 PRO 552 22.912 21.936 -28.521 290 HD3 PRO 552 HD3 PRO 552 23.678 21.846 -30.132 291 H ARG 553 H ARG 553 23.362 27.262 -29.490 292 HA ARG 553 HA ARG 553 23.277 28.062 -26.755 293 HB2 ARG 553 HB2 ARG 553 21.928 29.120 -29.282 294 HB3 ARG 553 HB3 ARG 553 21.619 29.838 -27.717 295 HG2 ARG 553 HG2 ARG 553 23.354 31.156 -28.018 296 HG3 ARG 553 HG3 ARG 553 24.401 29.770 -27.726 297 HD2 ARG 553 HD2 ARG 553 24.547 29.335 -30.138 298 HD3 ARG 553 HD3 ARG 553 23.366 30.625 -30.463 299 HE ARG 553 HE ARG 553 25.476 31.773 -28.973 300 HH11 ARG 553 HH11 ARG 553 25.097 30.434 -32.188 301 HH12 ARG 553 HH12 ARG 553 26.331 31.466 -32.857 302 HH21 ARG 553 HH21 ARG 553 27.017 33.067 -29.890 303 HH22 ARG 553 HH22 ARG 553 27.386 32.918 -31.583 304 HA PRO 554 HA PRO 554 19.596 26.272 -25.135 305 HB2 PRO 554 HB2 PRO 554 18.815 28.061 -23.206 306 HB3 PRO 554 HB3 PRO 554 20.293 27.062 -23.088 307 HG2 PRO 554 HG2 PRO 554 20.064 29.928 -24.062 308 HG3 PRO 554 HG3 PRO 554 21.198 29.264 -22.841 309 HD2 PRO 554 HD2 PRO 554 21.945 29.602 -25.421 310 HD3 PRO 554 HD3 PRO 554 22.482 28.170 -24.497 311 H GLY 555 H GLY 555 19.358 29.180 -26.936 312 HA2 GLY 555 HA2 GLY 555 16.557 28.546 -27.636 313 HA3 GLY 555 HA3 GLY 555 16.888 30.188 -27.071 314 H ALA 556 H ALA 556 16.723 28.220 -29.769 315 HA ALA 556 HA ALA 556 18.737 29.285 -31.477 316 HB1 ALA 556 HB3 ALA 556 17.393 28.263 -33.274 317 HB2 ALA 556 HB1 ALA 556 17.629 27.167 -31.900 318 HB3 ALA 556 HB2 ALA 556 16.065 27.978 -32.129 319 HA PRO 557 HA PRO 557 15.642 32.564 -33.106 320 HB2 PRO 557 HB2 PRO 557 13.441 33.317 -31.665 321 HB3 PRO 557 HB3 PRO 557 13.437 31.988 -32.864 322 HG2 PRO 557 HG2 PRO 557 13.719 31.782 -29.853 323 HG3 PRO 557 HG3 PRO 557 12.660 30.826 -30.938 324 HD2 PRO 557 HD2 PRO 557 15.047 29.901 -30.068 325 HD3 PRO 557 HD3 PRO 557 14.459 29.535 -31.716 326 H ASN2319 H ASN2319 31.901 17.956 -37.059 327 HA ASN2319 HA ASN2319 33.251 15.404 -37.647 328 HB2 ASN2319 HB2 ASN2319 31.330 16.050 -35.357 329 HB3 ASN2319 HB3 ASN2319 31.973 14.456 -35.746 330 HD21 ASN2319 2HD2 ASN2319 34.027 13.880 -34.843 331 HD22 ASN2319 1HD2 ASN2319 35.021 15.046 -33.992 332 H THR2320 H THR2320 32.081 13.954 -38.859 333 HA THR2320 HA THR2320 29.259 14.587 -39.605 334 HB THR2320 HB THR2320 29.888 14.152 -42.005 335 HG1 THR2320 HG1 THR2320 31.919 13.228 -41.732 336 HG21 THR2320 HG23 THR2320 30.693 16.371 -42.495 337 HG22 THR2320 HG21 THR2320 29.539 16.469 -41.152 338 HG23 THR2320 HG22 THR2320 31.287 16.590 -40.838 339 H GLY2321 H GLY2321 28.115 12.892 -40.610 340 HA2 GLY2321 HA2 GLY2321 28.342 10.529 -41.541 341 HA3 GLY2321 HA3 GLY2321 29.122 10.123 -40.013 342 H ALA2322 H ALA2322 26.093 10.632 -41.627 343 HA ALA2322 HA ALA2322 24.314 10.923 -39.440 344 HB1 ALA2322 HB3 ALA2322 22.627 10.023 -41.000 345 HB2 ALA2322 HB1 ALA2322 23.663 11.222 -41.794 346 HB3 ALA2322 HB2 ALA2322 23.913 9.487 -42.101 347 H LYS2323 H LYS2323 23.412 9.563 -38.017 348 HA LYS2323 HA LYS2323 24.015 6.646 -38.025 349 HB2 LYS2323 HB2 LYS2323 25.436 8.477 -36.428 350 HB3 LYS2323 HB3 LYS2323 24.158 7.948 -35.352 351 HG2 LYS2323 HG2 LYS2323 25.947 6.445 -34.975 352 HG3 LYS2323 HG3 LYS2323 24.827 5.530 -35.988 353 HD2 LYS2323 HD2 LYS2323 26.230 6.199 -38.004 354 HD3 LYS2323 HD3 LYS2323 27.371 6.969 -36.888 355 HE2 LYS2323 HE2 LYS2323 27.739 4.784 -35.765 356 HE3 LYS2323 HE3 LYS2323 26.564 4.025 -36.851 357 HZ1 LYS2323 HZ3 LYS2323 28.819 3.666 -37.645 358 HZ2 LYS2323 HZ1 LYS2323 28.026 4.601 -38.721 359 HZ3 LYS2323 HZ2 LYS2323 29.124 5.267 -37.709 360 H GLN2324 H GLN2324 22.777 5.856 -35.743 361 HA GLN2324 HA GLN2324 20.050 5.752 -36.409 362 HB2 GLN2324 HB2 GLN2324 21.389 5.402 -33.699 363 HB3 GLN2324 HB3 GLN2324 19.687 5.055 -34.026 364 HG2 GLN2324 HG2 GLN2324 20.410 3.442 -35.829 365 HG3 GLN2324 HG3 GLN2324 22.083 3.673 -35.303 366 HE21 GLN2324 HE22 GLN2324 22.582 3.077 -32.986 367 HE22 GLN2324 HE21 GLN2324 21.608 1.800 -32.253 368 HA PRO2325 HA PRO2325 18.984 9.941 -35.420 369 HB2 PRO2325 HB2 PRO2325 16.238 9.885 -35.680 370 HB3 PRO2325 HB3 PRO2325 17.388 9.872 -37.050 371 HG2 PRO2325 HG2 PRO2325 16.001 7.508 -35.760 372 HG3 PRO2325 HG3 PRO2325 16.179 7.875 -37.505 373 HD2 PRO2325 HD2 PRO2325 17.829 6.130 -36.221 374 HD3 PRO2325 HD3 PRO2325 18.445 7.214 -37.507 375 HA PRO2326 HA PRO2326 17.982 9.474 -31.014 376 HB2 PRO2326 HB2 PRO2326 18.074 12.092 -30.228 377 HB3 PRO2326 HB3 PRO2326 19.531 11.124 -30.600 378 HG2 PRO2326 HG2 PRO2326 18.063 13.031 -32.451 379 HG3 PRO2326 HG3 PRO2326 19.811 12.983 -32.096 380 HD2 PRO2326 HD2 PRO2326 18.745 11.792 -34.291 381 HD3 PRO2326 HD3 PRO2326 20.091 11.015 -33.399 382 H SER2327 H SER2327 15.996 9.027 -30.377 383 HA SER2327 HA SER2327 13.732 10.925 -30.683 384 HB2 SER2327 HB2 SER2327 13.672 8.056 -31.711 385 HB3 SER2327 HB3 SER2327 12.253 9.097 -31.487 386 HG SER2327 HG SER2327 12.998 9.129 -33.646 387 H TYR2328 H TYR2328 13.845 11.202 -28.442 388 HA TYR2328 HA TYR2328 13.484 8.861 -26.657 389 HB2 TYR2328 HB2 TYR2328 15.066 10.702 -26.142 390 HB3 TYR2328 HB3 TYR2328 13.724 11.824 -26.057 391 HD1 TYR2328 HD1 TYR2328 15.191 8.743 -24.528 392 HD2 TYR2328 HD2 TYR2328 12.498 12.070 -23.990 393 HE1 TYR2328 HE1 TYR2328 14.981 8.193 -22.100 394 HE2 TYR2328 HE2 TYR2328 12.270 11.504 -21.583 395 HH TYR2328 HH TYR2328 12.906 10.103 -19.887 396 H GLU2329 H GLU2329 11.786 11.951 -26.204 397 HA GLU2329 HA GLU2329 9.209 10.866 -25.669 398 HB2 GLU2329 HB2 GLU2329 10.242 13.568 -26.555 399 HB3 GLU2329 HB3 GLU2329 8.509 13.283 -26.457 400 HG2 GLU2329 HG2 GLU2329 10.310 12.713 -24.084 401 HG3 GLU2329 HG3 GLU2329 9.717 14.333 -24.426 402 H ASP2330 H ASP2330 10.614 12.007 -28.764 403 HA ASP2330 HA ASP2330 8.203 11.744 -30.258 404 HB2 ASP2330 HB2 ASP2330 10.362 13.067 -30.783 405 HB3 ASP2330 HB3 ASP2330 10.992 11.553 -31.433 406 H CYS2331 H CYS2331 10.216 9.239 -29.083 407 HA CYS2331 HA CYS2331 9.127 7.251 -31.033 408 HB2 CYS2331 HB2 CYS2331 11.549 7.161 -30.465 409 HB3 CYS2331 HB3 CYS2331 11.130 6.903 -28.763 410 HG CYS2331 HG CYS2331 10.333 5.072 -31.430 411 H ILE2332 H ILE2332 9.148 8.017 -27.485 412 HA ILE2332 HA ILE2332 7.372 5.770 -26.989 413 HB ILE2332 HB ILE2332 7.492 6.291 -24.669 414 HG12 ILE2332 HG12 ILE2332 9.337 8.635 -25.181 415 HG13 ILE2332 HG13 ILE2332 7.602 8.874 -24.986 416 HG21 ILE2332 HG21 ILE2332 9.285 4.999 -25.802 417 HG22 ILE2332 HG22 ILE2332 10.243 6.484 -25.970 418 HG23 ILE2332 HG23 ILE2332 9.869 5.838 -24.363 419 HD11 ILE2332 3HD1 ILE2332 8.806 9.200 -22.864 420 HD12 ILE2332 1HD1 ILE2332 7.663 7.847 -22.760 421 HD13 ILE2332 2HD1 ILE2332 9.408 7.538 -22.923 422 H LYS2333 H LYS2333 6.647 9.112 -27.663 423 HA LYS2333 HA LYS2333 3.995 9.168 -26.495 424 HB2 LYS2333 HB2 LYS2333 5.270 10.691 -28.800 425 HB3 LYS2333 HB3 LYS2333 3.573 10.867 -28.359 426 HG2 LYS2333 HG2 LYS2333 4.340 11.426 -25.976 427 HG3 LYS2333 HG3 LYS2333 5.980 11.507 -26.608 428 HD2 LYS2333 HD2 LYS2333 5.189 13.742 -26.596 429 HD3 LYS2333 HD3 LYS2333 5.122 13.243 -28.296 430 HE2 LYS2333 HE2 LYS2333 2.680 12.717 -28.007 431 HE3 LYS2333 HE3 LYS2333 2.786 13.217 -26.317 432 HZ1 LYS2333 HZ3 LYS2333 1.918 14.999 -27.683 433 HZ2 LYS2333 HZ1 LYS2333 3.366 15.460 -27.098 434 HZ3 LYS2333 HZ2 LYS2333 3.218 14.985 -28.663 Start of MODEL 14 1 H VAL 515 H VAL 515 29.002 6.915 -14.961 2 HA VAL 515 HA VAL 515 30.841 7.529 -13.501 3 HB VAL 515 HB VAL 515 30.537 4.716 -12.406 4 HG11 VAL 515 HG11 VAL 515 32.940 5.230 -12.624 5 HG12 VAL 515 HG12 VAL 515 32.691 6.820 -11.862 6 HG13 VAL 515 HG13 VAL 515 32.452 5.324 -10.936 7 HG21 VAL 515 HG23 VAL 515 30.287 5.917 -10.241 8 HG22 VAL 515 HG21 VAL 515 30.334 7.472 -11.091 9 HG23 VAL 515 HG22 VAL 515 28.987 6.336 -11.348 10 H SER 516 H SER 516 30.696 4.168 -14.837 11 HA SER 516 HA SER 516 33.186 3.636 -15.221 12 HB2 SER 516 HB2 SER 516 31.139 2.957 -17.343 13 HB3 SER 516 HB3 SER 516 32.556 2.002 -16.860 14 HG SER 516 HG SER 516 30.586 1.269 -15.878 15 H LEU 517 H LEU 517 31.664 5.743 -17.666 16 HA LEU 517 HA LEU 517 34.384 6.365 -18.672 17 HB2 LEU 517 HB2 LEU 517 33.817 6.172 -20.966 18 HB3 LEU 517 HB3 LEU 517 33.457 4.653 -20.191 19 HG LEU 517 HG LEU 517 31.056 6.322 -20.171 20 HD11 LEU 517 1HD1 LEU 517 32.047 7.443 -22.132 21 HD12 LEU 517 2HD1 LEU 517 32.270 5.868 -22.924 22 HD13 LEU 517 3HD1 LEU 517 30.634 6.476 -22.575 23 HD21 LEU 517 3HD2 LEU 517 30.074 4.430 -21.359 24 HD22 LEU 517 1HD2 LEU 517 31.690 3.764 -21.687 25 HD23 LEU 517 2HD2 LEU 517 31.081 3.857 -20.018 26 H ILE 518 H ILE 518 32.358 7.766 -16.941 27 HA ILE 518 HA ILE 518 32.107 10.299 -18.513 28 HB ILE 518 HB ILE 518 29.879 9.313 -16.696 29 HG12 ILE 518 HG12 ILE 518 28.675 9.319 -19.115 30 HG13 ILE 518 HG13 ILE 518 30.272 8.817 -19.639 31 HG21 ILE 518 HG21 ILE 518 30.075 11.763 -16.958 32 HG22 ILE 518 HG22 ILE 518 30.044 11.579 -18.726 33 HG23 ILE 518 HG23 ILE 518 28.627 11.150 -17.745 34 HD11 ILE 518 3HD1 ILE 518 28.836 6.879 -19.179 35 HD12 ILE 518 1HD1 ILE 518 30.120 6.908 -17.957 36 HD13 ILE 518 2HD1 ILE 518 28.489 7.471 -17.546 37 H ASN 519 H ASN 519 31.140 9.490 -15.172 38 HA ASN 519 HA ASN 519 31.533 10.535 -13.209 39 HB2 ASN 519 HB2 ASN 519 33.386 8.886 -13.522 40 HB3 ASN 519 HB3 ASN 519 34.420 10.189 -14.103 41 HD21 ASN 519 2HD2 ASN 519 32.245 9.584 -11.232 42 HD22 ASN 519 1HD2 ASN 519 33.445 10.157 -10.090 43 H GLU 520 H GLU 520 30.974 12.443 -15.258 44 HA GLU 520 HA GLU 520 32.588 14.852 -14.705 45 HB2 GLU 520 HB2 GLU 520 30.079 14.462 -16.390 46 HB3 GLU 520 HB3 GLU 520 31.061 15.929 -16.303 47 HG2 GLU 520 HG2 GLU 520 33.039 14.553 -17.111 48 HG3 GLU 520 HG3 GLU 520 31.895 13.256 -17.466 49 H GLY 521 H GLY 521 30.975 16.906 -14.531 50 HA2 GLY 521 HA2 GLY 521 29.830 16.970 -11.879 51 HA3 GLY 521 HA3 GLY 521 29.801 18.237 -13.100 52 HA PRO 522 HA PRO 522 25.500 16.529 -12.286 53 HB2 PRO 522 HB2 PRO 522 24.191 18.924 -11.933 54 HB3 PRO 522 HB3 PRO 522 25.079 18.069 -10.636 55 HG2 PRO 522 HG2 PRO 522 26.074 20.333 -12.392 56 HG3 PRO 522 HG3 PRO 522 26.179 20.188 -10.607 57 HD2 PRO 522 HD2 PRO 522 28.261 19.532 -12.213 58 HD3 PRO 522 HD3 PRO 522 27.896 18.562 -10.753 59 H LEU 523 H LEU 523 23.582 16.608 -13.563 60 HA LEU 523 HA LEU 523 24.173 16.753 -16.325 61 HB2 LEU 523 HB2 LEU 523 22.192 15.640 -16.658 62 HB3 LEU 523 HB3 LEU 523 22.630 15.169 -15.054 63 HG LEU 523 HG LEU 523 20.922 17.481 -14.757 64 HD11 LEU 523 1HD1 LEU 523 20.222 17.012 -17.121 65 HD12 LEU 523 2HD1 LEU 523 19.746 15.378 -16.628 66 HD13 LEU 523 3HD1 LEU 523 18.913 16.795 -15.950 67 HD21 LEU 523 3HD2 LEU 523 19.389 15.895 -13.704 68 HD22 LEU 523 1HD2 LEU 523 20.315 14.528 -14.366 69 HD23 LEU 523 2HD2 LEU 523 21.054 15.618 -13.169 70 HA PRO 524 HA PRO 524 23.140 20.805 -17.579 71 HB2 PRO 524 HB2 PRO 524 22.092 20.507 -20.131 72 HB3 PRO 524 HB3 PRO 524 23.816 20.316 -19.696 73 HG2 PRO 524 HG2 PRO 524 21.719 18.154 -19.983 74 HG3 PRO 524 HG3 PRO 524 23.377 18.182 -20.659 75 HD2 PRO 524 HD2 PRO 524 22.770 16.848 -18.382 76 HD3 PRO 524 HD3 PRO 524 24.323 17.720 -18.538 77 HA PRO 525 HA PRO 525 19.189 21.853 -16.262 78 HB2 PRO 525 HB2 PRO 525 18.725 24.369 -17.258 79 HB3 PRO 525 HB3 PRO 525 19.995 23.991 -16.057 80 HG2 PRO 525 HG2 PRO 525 20.308 24.243 -19.067 81 HG3 PRO 525 HG3 PRO 525 21.300 25.005 -17.783 82 HD2 PRO 525 HD2 PRO 525 22.083 22.715 -19.006 83 HD3 PRO 525 HD3 PRO 525 22.353 22.958 -17.253 84 H GLY 526 H GLY 526 17.426 20.710 -16.846 85 HA2 GLY 526 HA2 GLY 526 15.473 20.136 -17.911 86 HA3 GLY 526 HA3 GLY 526 15.559 21.666 -18.790 87 H TRP 527 H TRP 527 18.120 19.288 -19.070 88 HA TRP 527 HA TRP 527 17.293 18.545 -21.861 89 HB2 TRP 527 HB2 TRP 527 19.940 19.299 -20.624 90 HB3 TRP 527 HB3 TRP 527 19.909 18.199 -21.986 91 HD1 TRP 527 HD1 TRP 527 19.653 21.838 -21.133 92 HE1 TRP 527 HE1 TRP 527 19.610 23.244 -23.277 93 HE3 TRP 527 HE3 TRP 527 19.114 18.074 -24.546 94 HZ2 TRP 527 HZ2 TRP 527 19.379 22.791 -26.122 95 HZ3 TRP 527 HZ3 TRP 527 18.977 18.588 -26.981 96 HH2 TRP 527 HH2 TRP 527 19.120 20.934 -27.776 97 H GLU 528 H GLU 528 17.947 16.501 -22.592 98 HA GLU 528 HA GLU 528 18.881 14.479 -20.615 99 HB2 GLU 528 HB2 GLU 528 16.583 13.969 -20.855 100 HB3 GLU 528 HB3 GLU 528 16.576 14.340 -22.566 101 HG2 GLU 528 HG2 GLU 528 16.307 12.016 -22.352 102 HG3 GLU 528 HG3 GLU 528 17.904 12.272 -23.021 103 H ILE 529 H ILE 529 20.145 12.807 -21.552 104 HA ILE 529 HA ILE 529 21.375 13.349 -24.199 105 HB ILE 529 HB ILE 529 23.200 12.875 -21.823 106 HG12 ILE 529 HG12 ILE 529 23.757 15.439 -22.097 107 HG13 ILE 529 HG13 ILE 529 22.099 15.569 -22.655 108 HG21 ILE 529 HG21 ILE 529 24.012 12.493 -24.130 109 HG22 ILE 529 HG22 ILE 529 23.617 14.178 -24.545 110 HG23 ILE 529 HG23 ILE 529 24.861 13.814 -23.330 111 HD11 ILE 529 3HD1 ILE 529 21.762 15.902 -20.389 112 HD12 ILE 529 1HD1 ILE 529 21.701 14.140 -20.330 113 HD13 ILE 529 2HD1 ILE 529 23.208 14.969 -19.932 114 H ARG 530 H ARG 530 21.873 11.482 -25.236 115 HA ARG 530 HA ARG 530 21.988 8.928 -23.680 116 HB2 ARG 530 HB2 ARG 530 20.250 9.360 -26.151 117 HB3 ARG 530 HB3 ARG 530 20.561 7.814 -25.353 118 HG2 ARG 530 HG2 ARG 530 19.650 8.978 -23.196 119 HG3 ARG 530 HG3 ARG 530 18.967 10.176 -24.300 120 HD2 ARG 530 HD2 ARG 530 18.464 7.170 -24.342 121 HD3 ARG 530 HD3 ARG 530 17.380 8.381 -23.642 122 HE ARG 530 HE ARG 530 17.659 9.245 -26.239 123 HH11 ARG 530 HH11 ARG 530 16.652 6.167 -24.893 124 HH12 ARG 530 HH12 ARG 530 15.567 5.837 -26.214 125 HH21 ARG 530 HH21 ARG 530 16.238 8.771 -27.872 126 HH22 ARG 530 HH22 ARG 530 15.295 7.308 -27.830 127 H TYR 531 H TYR 531 22.966 7.209 -24.672 128 HA TYR 531 HA TYR 531 25.089 7.895 -26.677 129 HB2 TYR 531 HB2 TYR 531 25.160 6.262 -24.115 130 HB3 TYR 531 HB3 TYR 531 26.344 6.060 -25.388 131 HD1 TYR 531 HD2 TYR 531 24.957 8.619 -23.008 132 HD2 TYR 531 HD1 TYR 531 28.234 7.431 -25.557 133 HE1 TYR 531 HE2 TYR 531 26.402 10.376 -21.984 134 HE2 TYR 531 HE1 TYR 531 29.677 9.164 -24.513 135 HH TYR 531 HH TYR 531 29.848 10.765 -22.907 136 H THR 532 H THR 532 24.294 7.033 -28.507 137 HA THR 532 HA THR 532 22.689 4.583 -28.532 138 HB THR 532 HB THR 532 22.563 4.880 -30.922 139 HG1 THR 532 HG1 THR 532 24.367 7.036 -30.564 140 HG21 THR 532 HG23 THR 532 21.584 7.160 -31.053 141 HG22 THR 532 HG21 THR 532 21.033 6.267 -29.625 142 HG23 THR 532 HG22 THR 532 22.256 7.543 -29.464 143 H ALA 533 H ALA 533 23.200 2.626 -29.642 144 HA ALA 533 HA ALA 533 25.677 1.553 -28.881 145 HB1 ALA 533 HB3 ALA 533 24.873 -0.481 -29.999 146 HB2 ALA 533 HB1 ALA 533 23.569 0.296 -29.085 147 HB3 ALA 533 HB2 ALA 533 23.633 0.458 -30.858 148 H ALA 534 H ALA 534 25.124 3.364 -31.744 149 HA ALA 534 HA ALA 534 27.231 2.218 -33.397 150 HB1 ALA 534 HB3 ALA 534 26.871 4.272 -34.729 151 HB2 ALA 534 HB1 ALA 534 25.339 3.471 -34.352 152 HB3 ALA 534 HB2 ALA 534 25.829 4.930 -33.452 153 H GLY 535 H GLY 535 27.364 4.010 -30.492 154 HA2 GLY 535 HA2 GLY 535 29.284 4.769 -29.373 155 HA3 GLY 535 HA3 GLY 535 30.219 4.729 -30.873 156 H GLU 536 H GLU 536 27.043 6.288 -30.349 157 HA GLU 536 HA GLU 536 28.253 8.969 -30.920 158 HB2 GLU 536 HB2 GLU 536 25.777 7.782 -32.220 159 HB3 GLU 536 HB3 GLU 536 26.394 9.419 -32.436 160 HG2 GLU 536 HG2 GLU 536 28.556 8.338 -33.288 161 HG3 GLU 536 HG3 GLU 536 27.671 6.809 -33.331 162 H ARG 537 H ARG 537 27.802 10.363 -29.428 163 HA ARG 537 HA ARG 537 25.541 10.115 -27.553 164 HB2 ARG 537 HB2 ARG 537 27.631 10.711 -26.605 165 HB3 ARG 537 HB3 ARG 537 27.942 11.959 -27.812 166 HG2 ARG 537 HG2 ARG 537 26.382 13.468 -26.859 167 HG3 ARG 537 HG3 ARG 537 25.630 12.207 -25.856 168 HD2 ARG 537 HD2 ARG 537 27.479 12.050 -24.423 169 HD3 ARG 537 HD3 ARG 537 28.570 12.884 -25.539 170 HE ARG 537 HE ARG 537 26.813 14.857 -25.008 171 HH11 ARG 537 HH11 ARG 537 28.401 12.711 -22.691 172 HH12 ARG 537 HH12 ARG 537 28.591 13.994 -21.531 173 HH21 ARG 537 HH21 ARG 537 27.106 16.416 -23.423 174 HH22 ARG 537 HH22 ARG 537 27.839 15.981 -21.910 175 H PHE 538 H PHE 538 23.737 11.270 -27.586 176 HA PHE 538 HA PHE 538 23.418 13.612 -29.418 177 HB2 PHE 538 HB2 PHE 538 21.515 11.251 -29.134 178 HB3 PHE 538 HB3 PHE 538 21.099 12.774 -29.896 179 HD1 PHE 538 HD2 PHE 538 21.965 13.409 -32.100 180 HD2 PHE 538 HD1 PHE 538 23.001 9.641 -30.278 181 HE1 PHE 538 HE2 PHE 538 22.708 12.541 -34.309 182 HE2 PHE 538 HE1 PHE 538 23.726 8.775 -32.488 183 HZ PHE 538 HZ PHE 538 23.603 10.227 -34.499 184 H PHE 539 H PHE 539 21.762 15.045 -28.807 185 HA PHE 539 HA PHE 539 21.073 15.013 -25.894 186 HB2 PHE 539 HB2 PHE 539 21.535 17.359 -27.760 187 HB3 PHE 539 HB3 PHE 539 21.118 17.452 -26.063 188 HD1 PHE 539 HD1 PHE 539 23.829 16.514 -28.442 189 HD2 PHE 539 HD2 PHE 539 22.768 17.330 -24.344 190 HE1 PHE 539 HE1 PHE 539 26.232 16.705 -27.861 191 HE2 PHE 539 HE2 PHE 539 25.163 17.566 -23.769 192 HZ PHE 539 HZ PHE 539 26.911 17.277 -25.542 193 H VAL 540 H VAL 540 19.089 15.703 -25.277 194 HA VAL 540 HA VAL 540 16.863 15.816 -27.278 195 HB VAL 540 HB VAL 540 17.076 14.179 -24.720 196 HG11 VAL 540 HG11 VAL 540 14.750 15.022 -25.172 197 HG12 VAL 540 HG12 VAL 540 14.805 14.200 -26.747 198 HG13 VAL 540 HG13 VAL 540 14.915 13.279 -25.220 199 HG21 VAL 540 HG23 VAL 540 16.889 12.180 -26.117 200 HG22 VAL 540 HG21 VAL 540 16.946 13.175 -27.585 201 HG23 VAL 540 HG22 VAL 540 18.352 13.084 -26.503 202 H ASP 541 H ASP 541 15.575 17.503 -26.941 203 HA ASP 541 HA ASP 541 15.538 18.883 -24.286 204 HB2 ASP 541 HB2 ASP 541 16.336 20.286 -26.090 205 HB3 ASP 541 HB3 ASP 541 14.955 19.858 -27.105 206 H HIS 542 H HIS 542 13.793 18.481 -23.076 207 HA HIS 542 HA HIS 542 11.357 17.295 -24.211 208 HB2 HIS 542 HB2 HIS 542 11.957 18.189 -21.371 209 HB3 HIS 542 HB3 HIS 542 10.635 17.146 -21.887 210 HD2 HIS 542 HD2 HIS 542 12.497 15.200 -23.808 211 HE1 HIS 542 HE1 HIS 542 14.334 14.168 -20.099 212 H ASN 543 H ASN 543 12.369 20.514 -23.856 213 HA ASN 543 HA ASN 543 9.851 21.684 -22.975 214 HB2 ASN 543 HB2 ASN 543 12.303 23.026 -24.196 215 HB3 ASN 543 HB3 ASN 543 11.007 23.805 -23.303 216 HD21 ASN 543 2HD2 ASN 543 14.056 22.221 -23.036 217 HD22 ASN 543 1HD2 ASN 543 14.056 22.064 -21.282 218 H THR 544 H THR 544 11.445 21.199 -26.127 219 HA THR 544 HA THR 544 8.833 21.777 -27.492 220 HB THR 544 HB THR 544 10.021 22.786 -29.345 221 HG1 THR 544 HG1 THR 544 12.262 23.245 -29.075 222 HG21 THR 544 HG23 THR 544 10.753 24.863 -28.377 223 HG22 THR 544 HG21 THR 544 9.374 24.272 -27.437 224 HG23 THR 544 HG22 THR 544 11.024 24.107 -26.793 225 H ARG 545 H ARG 545 10.627 19.270 -26.731 226 HA ARG 545 HA ARG 545 10.861 17.138 -27.429 227 HB2 ARG 545 HB2 ARG 545 8.479 17.778 -28.515 228 HB3 ARG 545 HB3 ARG 545 9.380 17.514 -30.008 229 HG2 ARG 545 HG2 ARG 545 10.070 15.225 -28.812 230 HG3 ARG 545 HG3 ARG 545 8.669 15.575 -27.796 231 HD2 ARG 545 HD2 ARG 545 8.760 15.177 -30.807 232 HD3 ARG 545 HD3 ARG 545 7.978 14.133 -29.608 233 HE ARG 545 HE ARG 545 6.765 16.654 -29.365 234 HH11 ARG 545 HH11 ARG 545 7.021 14.292 -31.994 235 HH12 ARG 545 HH12 ARG 545 5.488 14.786 -32.655 236 HH21 ARG 545 HH21 ARG 545 4.974 17.375 -30.476 237 HH22 ARG 545 HH22 ARG 545 4.379 16.469 -31.830 238 H ARG 546 H ARG 546 12.398 19.566 -28.812 239 HA ARG 546 HA ARG 546 13.478 18.499 -31.271 240 HB2 ARG 546 HB2 ARG 546 14.162 20.807 -29.415 241 HB3 ARG 546 HB3 ARG 546 15.211 20.439 -30.771 242 HG2 ARG 546 HG2 ARG 546 12.220 20.925 -31.108 243 HG3 ARG 546 HG3 ARG 546 13.415 22.218 -31.168 244 HD2 ARG 546 HD2 ARG 546 13.406 19.798 -33.018 245 HD3 ARG 546 HD3 ARG 546 12.738 21.383 -33.416 246 HE ARG 546 HE ARG 546 15.218 22.132 -32.757 247 HH11 ARG 546 HH11 ARG 546 14.274 19.519 -34.898 248 HH12 ARG 546 HH12 ARG 546 15.765 19.607 -35.795 249 HH21 ARG 546 HH21 ARG 546 17.075 22.193 -33.950 250 HH22 ARG 546 HH22 ARG 546 17.297 21.091 -35.275 251 H THR 547 H THR 547 15.739 18.207 -31.726 252 HA THR 547 HA THR 547 17.401 16.924 -29.634 253 HB THR 547 HB THR 547 17.774 14.986 -31.259 254 HG1 THR 547 HG1 THR 547 16.705 15.872 -33.069 255 HG21 THR 547 HG23 THR 547 15.880 13.693 -30.481 256 HG22 THR 547 HG21 THR 547 16.481 14.726 -29.181 257 HG23 THR 547 HG22 THR 547 14.989 15.161 -30.046 258 H THR 548 H THR 548 19.598 16.535 -30.284 259 HA THR 548 HA THR 548 20.572 17.450 -32.878 260 HB THR 548 HB THR 548 20.294 19.621 -31.910 261 HG1 THR 548 HG1 THR 548 22.324 20.338 -32.156 262 HG21 THR 548 HG23 THR 548 21.483 20.353 -29.874 263 HG22 THR 548 HG21 THR 548 20.254 19.139 -29.510 264 HG23 THR 548 HG22 THR 548 21.966 18.673 -29.561 265 H PHE 549 H PHE 549 22.871 17.194 -33.134 266 HA PHE 549 HA PHE 549 23.991 14.913 -31.593 267 HB2 PHE 549 HB2 PHE 549 23.843 14.799 -34.058 268 HB3 PHE 549 HB3 PHE 549 24.806 16.264 -34.195 269 HD1 PHE 549 HD1 PHE 549 25.073 12.948 -32.385 270 HD2 PHE 549 HD2 PHE 549 27.037 15.905 -34.838 271 HE1 PHE 549 HE1 PHE 549 27.130 11.580 -32.384 272 HE2 PHE 549 HE2 PHE 549 29.101 14.518 -34.840 273 HZ PHE 549 HZ PHE 549 29.140 12.349 -33.617 274 H GLU 550 H GLU 550 24.226 18.321 -31.586 275 HA GLU 550 HA GLU 550 26.889 18.264 -30.225 276 HB2 GLU 550 HB2 GLU 550 27.609 20.210 -31.395 277 HB3 GLU 550 HB3 GLU 550 27.154 18.981 -32.565 278 HG2 GLU 550 HG2 GLU 550 24.939 20.162 -32.871 279 HG3 GLU 550 HG3 GLU 550 25.522 21.438 -31.800 280 H ASP 551 H ASP 551 27.091 20.908 -29.488 281 HA ASP 551 HA ASP 551 24.760 21.253 -27.637 282 HB2 ASP 551 HB2 ASP 551 26.788 20.304 -26.596 283 HB3 ASP 551 HB3 ASP 551 27.682 21.756 -27.039 284 HA PRO 552 HA PRO 552 25.249 25.092 -30.236 285 HB2 PRO 552 HB2 PRO 552 22.700 25.364 -31.134 286 HB3 PRO 552 HB3 PRO 552 23.815 24.149 -31.828 287 HG2 PRO 552 HG2 PRO 552 21.716 23.721 -29.671 288 HG3 PRO 552 HG3 PRO 552 21.954 22.783 -31.182 289 HD2 PRO 552 HD2 PRO 552 23.011 21.991 -28.789 290 HD3 PRO 552 HD3 PRO 552 23.858 21.724 -30.339 291 H ARG 553 H ARG 553 23.963 27.194 -30.097 292 HA ARG 553 HA ARG 553 23.656 28.148 -27.424 293 HB2 ARG 553 HB2 ARG 553 22.715 29.223 -30.119 294 HB3 ARG 553 HB3 ARG 553 22.488 30.103 -28.607 295 HG2 ARG 553 HG2 ARG 553 24.932 30.128 -28.207 296 HG3 ARG 553 HG3 ARG 553 25.197 29.196 -29.685 297 HD2 ARG 553 HD2 ARG 553 25.667 31.512 -30.137 298 HD3 ARG 553 HD3 ARG 553 24.217 31.024 -31.031 299 HE ARG 553 HE ARG 553 23.521 32.185 -28.474 300 HH11 ARG 553 HH11 ARG 553 24.612 33.195 -31.645 301 HH12 ARG 553 HH12 ARG 553 23.862 34.762 -31.505 302 HH21 ARG 553 HH21 ARG 553 22.569 34.191 -28.368 303 HH22 ARG 553 HH22 ARG 553 22.741 35.305 -29.692 304 HA PRO 554 HA PRO 554 19.574 26.843 -26.299 305 HB2 PRO 554 HB2 PRO 554 18.810 28.750 -24.481 306 HB3 PRO 554 HB3 PRO 554 20.113 27.565 -24.169 307 HG2 PRO 554 HG2 PRO 554 20.397 30.420 -25.164 308 HG3 PRO 554 HG3 PRO 554 21.263 29.634 -23.803 309 HD2 PRO 554 HD2 PRO 554 22.373 29.827 -26.270 310 HD3 PRO 554 HD3 PRO 554 22.603 28.359 -25.275 311 H GLY 555 H GLY 555 17.268 27.545 -26.202 312 HA2 GLY 555 HA2 GLY 555 16.547 29.802 -28.051 313 HA3 GLY 555 HA3 GLY 555 15.928 28.176 -28.326 314 H ALA 556 H ALA 556 14.944 27.216 -26.086 315 HA ALA 556 HA ALA 556 13.506 29.237 -24.497 316 HB1 ALA 556 HB3 ALA 556 11.285 28.385 -25.133 317 HB2 ALA 556 HB1 ALA 556 12.136 29.059 -26.530 318 HB3 ALA 556 HB2 ALA 556 12.029 27.296 -26.326 319 HA PRO 557 HA PRO 557 14.405 25.261 -22.123 320 HB2 PRO 557 HB2 PRO 557 16.066 26.267 -20.215 321 HB3 PRO 557 HB3 PRO 557 16.654 25.727 -21.818 322 HG2 PRO 557 HG2 PRO 557 15.998 28.555 -20.930 323 HG3 PRO 557 HG3 PRO 557 17.466 27.975 -21.778 324 HD2 PRO 557 HD2 PRO 557 15.362 29.113 -23.103 325 HD3 PRO 557 HD3 PRO 557 16.330 27.793 -23.823 326 H ASN2319 H ASN2319 33.424 12.604 -32.674 327 HA ASN2319 HA ASN2319 33.972 10.852 -34.193 328 HB2 ASN2319 HB2 ASN2319 31.588 9.393 -32.945 329 HB3 ASN2319 HB3 ASN2319 32.448 8.874 -34.389 330 HD21 ASN2319 2HD2 ASN2319 34.090 7.347 -34.034 331 HD22 ASN2319 1HD2 ASN2319 34.933 7.198 -32.505 332 H THR2320 H THR2320 32.378 10.164 -36.149 333 HA THR2320 HA THR2320 30.250 12.183 -36.614 334 HB THR2320 HB THR2320 31.265 12.659 -38.879 335 HG1 THR2320 HG1 THR2320 33.480 12.285 -39.096 336 HG21 THR2320 HG23 THR2320 32.802 14.365 -38.156 337 HG22 THR2320 HG21 THR2320 31.462 14.287 -37.001 338 HG23 THR2320 HG22 THR2320 33.038 13.575 -36.583 339 H GLY2321 H GLY2321 29.101 11.766 -38.701 340 HA2 GLY2321 HA2 GLY2321 28.445 10.365 -40.487 341 HA3 GLY2321 HA3 GLY2321 29.297 8.999 -39.777 342 H ALA2322 H ALA2322 26.756 11.209 -38.531 343 HA ALA2322 HA ALA2322 25.488 9.677 -36.744 344 HB1 ALA2322 HB3 ALA2322 23.504 11.078 -37.090 345 HB2 ALA2322 HB1 ALA2322 25.004 12.021 -37.135 346 HB3 ALA2322 HB2 ALA2322 24.157 11.622 -38.649 347 H LYS2323 H LYS2323 24.756 7.703 -36.712 348 HA LYS2323 HA LYS2323 23.223 6.578 -39.040 349 HB2 LYS2323 HB2 LYS2323 25.607 5.766 -38.395 350 HB3 LYS2323 HB3 LYS2323 24.854 5.052 -36.980 351 HG2 LYS2323 HG2 LYS2323 25.134 3.344 -38.610 352 HG3 LYS2323 HG3 LYS2323 23.408 3.660 -38.539 353 HD2 LYS2323 HD2 LYS2323 23.613 5.070 -40.616 354 HD3 LYS2323 HD3 LYS2323 25.353 4.708 -40.647 355 HE2 LYS2323 HE2 LYS2323 24.771 2.253 -40.745 356 HE3 LYS2323 HE3 LYS2323 23.062 2.698 -40.846 357 HZ1 LYS2323 HZ3 LYS2323 23.994 2.322 -43.049 358 HZ2 LYS2323 HZ1 LYS2323 23.582 3.895 -42.920 359 HZ3 LYS2323 HZ2 LYS2323 25.152 3.448 -42.825 360 H GLN2324 H GLN2324 22.721 7.566 -35.906 361 HA GLN2324 HA GLN2324 20.465 5.657 -35.394 362 HB2 GLN2324 HB2 GLN2324 22.618 6.727 -33.551 363 HB3 GLN2324 HB3 GLN2324 21.138 5.975 -32.963 364 HG2 GLN2324 HG2 GLN2324 22.970 4.489 -34.890 365 HG3 GLN2324 HG3 GLN2324 23.297 4.561 -33.171 366 HE21 GLN2324 HE22 GLN2324 23.065 2.162 -33.251 367 HE22 GLN2324 HE21 GLN2324 21.435 1.521 -33.117 368 HA PRO2325 HA PRO2325 18.752 9.905 -35.429 369 HB2 PRO2325 HB2 PRO2325 16.097 9.285 -35.785 370 HB3 PRO2325 HB3 PRO2325 17.307 9.352 -37.100 371 HG2 PRO2325 HG2 PRO2325 16.309 6.914 -35.609 372 HG3 PRO2325 HG3 PRO2325 16.531 7.124 -37.374 373 HD2 PRO2325 HD2 PRO2325 18.375 5.872 -35.805 374 HD3 PRO2325 HD3 PRO2325 18.871 6.879 -37.200 375 HA PRO2326 HA PRO2326 17.730 9.486 -31.014 376 HB2 PRO2326 HB2 PRO2326 17.807 12.109 -30.263 377 HB3 PRO2326 HB3 PRO2326 19.272 11.145 -30.616 378 HG2 PRO2326 HG2 PRO2326 17.811 13.038 -32.487 379 HG3 PRO2326 HG3 PRO2326 19.562 12.977 -32.130 380 HD2 PRO2326 HD2 PRO2326 18.464 11.772 -34.316 381 HD3 PRO2326 HD3 PRO2326 19.839 11.033 -33.439 382 H SER2327 H SER2327 15.717 8.947 -30.534 383 HA SER2327 HA SER2327 13.493 10.926 -30.714 384 HB2 SER2327 HB2 SER2327 13.336 8.058 -31.726 385 HB3 SER2327 HB3 SER2327 11.962 9.160 -31.513 386 HG SER2327 HG SER2327 12.706 9.148 -33.672 387 H TYR2328 H TYR2328 13.563 11.219 -28.493 388 HA TYR2328 HA TYR2328 13.153 8.884 -26.690 389 HB2 TYR2328 HB2 TYR2328 14.807 10.641 -26.139 390 HB3 TYR2328 HB3 TYR2328 13.523 11.833 -26.114 391 HD1 TYR2328 HD1 TYR2328 14.620 8.611 -24.507 392 HD2 TYR2328 HD2 TYR2328 12.440 12.301 -24.050 393 HE1 TYR2328 HE1 TYR2328 14.334 8.147 -22.075 394 HE2 TYR2328 HE2 TYR2328 12.114 11.814 -21.633 395 HH TYR2328 HH TYR2328 12.549 10.374 -19.905 396 H GLU2329 H GLU2329 11.550 12.051 -26.253 397 HA GLU2329 HA GLU2329 8.956 10.937 -25.801 398 HB2 GLU2329 HB2 GLU2329 9.851 13.732 -26.553 399 HB3 GLU2329 HB3 GLU2329 8.158 13.298 -26.275 400 HG2 GLU2329 HG2 GLU2329 8.813 12.418 -24.000 401 HG3 GLU2329 HG3 GLU2329 10.414 13.116 -24.253 402 H ASP2330 H ASP2330 10.465 12.107 -28.814 403 HA ASP2330 HA ASP2330 8.098 11.968 -30.399 404 HB2 ASP2330 HB2 ASP2330 10.356 13.135 -30.870 405 HB3 ASP2330 HB3 ASP2330 10.913 11.565 -31.454 406 H CYS2331 H CYS2331 9.898 9.379 -29.083 407 HA CYS2331 HA CYS2331 8.734 7.405 -31.006 408 HB2 CYS2331 HB2 CYS2331 11.172 7.263 -30.478 409 HB3 CYS2331 HB3 CYS2331 10.771 7.012 -28.772 410 HG CYS2331 HG CYS2331 9.860 5.211 -31.423 411 H ILE2332 H ILE2332 8.796 8.281 -27.490 412 HA ILE2332 HA ILE2332 6.951 6.096 -26.908 413 HB ILE2332 HB ILE2332 7.126 6.679 -24.605 414 HG12 ILE2332 HG12 ILE2332 9.142 8.857 -25.096 415 HG13 ILE2332 HG13 ILE2332 7.428 9.279 -25.126 416 HG21 ILE2332 HG21 ILE2332 8.851 5.270 -25.671 417 HG22 ILE2332 HG22 ILE2332 9.860 6.703 -25.956 418 HG23 ILE2332 HG23 ILE2332 9.502 6.181 -24.301 419 HD11 ILE2332 3HD1 ILE2332 8.401 9.631 -22.904 420 HD12 ILE2332 1HD1 ILE2332 7.130 8.395 -22.862 421 HD13 ILE2332 2HD1 ILE2332 8.843 7.915 -22.801 422 H LYS2333 H LYS2333 6.361 9.453 -27.652 423 HA LYS2333 HA LYS2333 3.791 9.714 -26.354 424 HB2 LYS2333 HB2 LYS2333 5.051 11.080 -28.759 425 HB3 LYS2333 HB3 LYS2333 3.386 11.383 -28.263 426 HG2 LYS2333 HG2 LYS2333 4.201 12.021 -25.968 427 HG3 LYS2333 HG3 LYS2333 5.857 11.840 -26.533 428 HD2 LYS2333 HD2 LYS2333 5.327 14.169 -26.623 429 HD3 LYS2333 HD3 LYS2333 5.376 13.600 -28.302 430 HE2 LYS2333 HE2 LYS2333 2.901 13.432 -28.328 431 HE3 LYS2333 HE3 LYS2333 2.836 13.874 -26.618 432 HZ1 LYS2333 HZ3 LYS2333 2.365 15.781 -28.007 433 HZ2 LYS2333 HZ1 LYS2333 3.769 16.051 -27.225 434 HZ3 LYS2333 HZ2 LYS2333 3.772 15.637 -28.815 Start of MODEL 15 1 H VAL 515 H VAL 515 28.432 2.828 -13.776 2 HA VAL 515 HA VAL 515 29.666 4.294 -12.307 3 HB VAL 515 HB VAL 515 32.138 2.858 -13.330 4 HG11 VAL 515 HG11 VAL 515 32.564 5.291 -12.993 5 HG12 VAL 515 HG12 VAL 515 31.855 5.182 -11.363 6 HG13 VAL 515 HG13 VAL 515 33.356 4.323 -11.753 7 HG21 VAL 515 HG23 VAL 515 32.469 2.307 -10.919 8 HG22 VAL 515 HG21 VAL 515 30.879 2.998 -10.545 9 HG23 VAL 515 HG22 VAL 515 31.023 1.539 -11.560 10 H SER 516 H SER 516 31.085 3.423 -15.537 11 HA SER 516 HA SER 516 32.295 5.684 -16.074 12 HB2 SER 516 HB2 SER 516 30.837 4.098 -18.207 13 HB3 SER 516 HB3 SER 516 32.324 5.052 -18.401 14 HG SER 516 HG SER 516 32.750 2.808 -18.138 15 H LEU 517 H LEU 517 28.792 5.528 -16.669 16 HA LEU 517 HA LEU 517 28.865 8.453 -17.248 17 HB2 LEU 517 HB2 LEU 517 27.245 8.300 -18.956 18 HB3 LEU 517 HB3 LEU 517 28.567 7.239 -19.369 19 HG LEU 517 HG LEU 517 26.468 5.788 -17.878 20 HD11 LEU 517 1HD1 LEU 517 24.976 7.452 -18.898 21 HD12 LEU 517 2HD1 LEU 517 25.650 7.082 -20.501 22 HD13 LEU 517 3HD1 LEU 517 24.736 5.846 -19.604 23 HD21 LEU 517 3HD2 LEU 517 26.601 4.255 -19.771 24 HD22 LEU 517 1HD2 LEU 517 27.538 5.442 -20.705 25 HD23 LEU 517 2HD2 LEU 517 28.232 4.706 -19.242 26 H ILE 518 H ILE 518 28.248 6.731 -14.835 27 HA ILE 518 HA ILE 518 25.540 7.825 -14.148 28 HB ILE 518 HB ILE 518 26.698 5.171 -13.217 29 HG12 ILE 518 HG12 ILE 518 24.455 4.500 -14.688 30 HG13 ILE 518 HG13 ILE 518 25.045 5.850 -15.631 31 HG21 ILE 518 HG21 ILE 518 25.101 6.067 -11.600 32 HG22 ILE 518 HG22 ILE 518 23.920 6.380 -12.894 33 HG23 ILE 518 HG23 ILE 518 24.374 4.719 -12.452 34 HD11 ILE 518 3HD1 ILE 518 25.940 3.749 -16.488 35 HD12 ILE 518 1HD1 ILE 518 27.291 4.645 -15.769 36 HD13 ILE 518 2HD1 ILE 518 26.543 3.297 -14.886 37 H ASN 519 H ASN 519 28.882 7.626 -13.266 38 HA ASN 519 HA ASN 519 28.338 8.849 -10.595 39 HB2 ASN 519 HB2 ASN 519 29.501 6.520 -10.950 40 HB3 ASN 519 HB3 ASN 519 30.902 7.472 -11.443 41 HD21 ASN 519 2HD2 ASN 519 28.505 7.076 -8.782 42 HD22 ASN 519 1HD2 ASN 519 29.650 7.473 -7.511 43 H GLU 520 H GLU 520 28.808 10.049 -13.474 44 HA GLU 520 HA GLU 520 31.140 11.790 -13.183 45 HB2 GLU 520 HB2 GLU 520 28.826 11.874 -15.163 46 HB3 GLU 520 HB3 GLU 520 30.344 12.772 -15.282 47 HG2 GLU 520 HG2 GLU 520 31.560 10.536 -15.291 48 HG3 GLU 520 HG3 GLU 520 29.982 9.769 -15.511 49 H GLY 521 H GLY 521 30.507 14.237 -13.912 50 HA2 GLY 521 HA2 GLY 521 29.453 15.593 -11.622 51 HA3 GLY 521 HA3 GLY 521 29.897 16.305 -13.168 52 HA PRO 522 HA PRO 522 25.271 16.512 -12.235 53 HB2 PRO 522 HB2 PRO 522 24.916 19.236 -12.303 54 HB3 PRO 522 HB3 PRO 522 25.497 18.347 -10.863 55 HG2 PRO 522 HG2 PRO 522 27.160 19.788 -12.952 56 HG3 PRO 522 HG3 PRO 522 27.270 19.922 -11.167 57 HD2 PRO 522 HD2 PRO 522 28.926 18.301 -12.581 58 HD3 PRO 522 HD3 PRO 522 28.299 17.799 -10.982 59 H LEU 523 H LEU 523 23.509 16.904 -13.622 60 HA LEU 523 HA LEU 523 24.205 16.877 -16.442 61 HB2 LEU 523 HB2 LEU 523 22.078 16.046 -16.841 62 HB3 LEU 523 HB3 LEU 523 22.567 15.323 -15.346 63 HG LEU 523 HG LEU 523 20.989 17.802 -14.893 64 HD11 LEU 523 1HD1 LEU 523 19.966 17.118 -17.039 65 HD12 LEU 523 2HD1 LEU 523 19.656 15.501 -16.375 66 HD13 LEU 523 3HD1 LEU 523 18.852 16.929 -15.680 67 HD21 LEU 523 3HD2 LEU 523 19.677 16.334 -13.450 68 HD22 LEU 523 1HD2 LEU 523 20.504 14.904 -14.102 69 HD23 LEU 523 2HD2 LEU 523 21.406 16.101 -13.144 70 HA PRO 524 HA PRO 524 23.221 21.064 -17.543 71 HB2 PRO 524 HB2 PRO 524 22.158 20.826 -20.093 72 HB3 PRO 524 HB3 PRO 524 23.891 20.642 -19.685 73 HG2 PRO 524 HG2 PRO 524 21.812 18.466 -20.009 74 HG3 PRO 524 HG3 PRO 524 23.456 18.537 -20.717 75 HD2 PRO 524 HD2 PRO 524 22.928 17.122 -18.476 76 HD3 PRO 524 HD3 PRO 524 24.454 18.033 -18.630 77 HA PRO 525 HA PRO 525 19.198 21.982 -16.258 78 HB2 PRO 525 HB2 PRO 525 18.687 24.501 -17.214 79 HB3 PRO 525 HB3 PRO 525 19.955 24.139 -16.006 80 HG2 PRO 525 HG2 PRO 525 20.290 24.451 -19.008 81 HG3 PRO 525 HG3 PRO 525 21.247 25.218 -17.702 82 HD2 PRO 525 HD2 PRO 525 22.097 22.967 -18.959 83 HD3 PRO 525 HD3 PRO 525 22.360 23.197 -17.205 84 H GLY 526 H GLY 526 17.451 20.832 -16.895 85 HA2 GLY 526 HA2 GLY 526 15.503 20.299 -17.992 86 HA3 GLY 526 HA3 GLY 526 15.624 21.835 -18.852 87 H TRP 527 H TRP 527 18.127 19.388 -19.118 88 HA TRP 527 HA TRP 527 17.313 18.663 -21.918 89 HB2 TRP 527 HB2 TRP 527 19.962 19.459 -20.709 90 HB3 TRP 527 HB3 TRP 527 19.935 18.350 -22.062 91 HD1 TRP 527 HD1 TRP 527 19.560 21.992 -21.226 92 HE1 TRP 527 HE1 TRP 527 19.505 23.383 -23.375 93 HE3 TRP 527 HE3 TRP 527 19.227 18.192 -24.628 94 HZ2 TRP 527 HZ2 TRP 527 19.356 22.909 -26.224 95 HZ3 TRP 527 HZ3 TRP 527 19.127 18.688 -27.065 96 HH2 TRP 527 HH2 TRP 527 19.200 21.036 -27.871 97 H GLU 528 H GLU 528 18.079 16.618 -22.656 98 HA GLU 528 HA GLU 528 18.929 14.608 -20.629 99 HB2 GLU 528 HB2 GLU 528 16.561 14.298 -20.925 100 HB3 GLU 528 HB3 GLU 528 16.686 14.401 -22.669 101 HG2 GLU 528 HG2 GLU 528 16.306 12.127 -22.083 102 HG3 GLU 528 HG3 GLU 528 17.949 12.234 -22.686 103 H ILE 529 H ILE 529 20.177 12.881 -21.517 104 HA ILE 529 HA ILE 529 21.553 13.448 -24.094 105 HB ILE 529 HB ILE 529 23.198 13.046 -21.573 106 HG12 ILE 529 HG12 ILE 529 23.715 15.623 -21.898 107 HG13 ILE 529 HG13 ILE 529 22.089 15.684 -22.549 108 HG21 ILE 529 HG21 ILE 529 24.228 12.603 -23.768 109 HG22 ILE 529 HG22 ILE 529 23.799 14.239 -24.313 110 HG23 ILE 529 HG23 ILE 529 24.962 14.008 -22.991 111 HD11 ILE 529 3HD1 ILE 529 21.831 16.174 -20.250 112 HD12 ILE 529 1HD1 ILE 529 21.427 14.461 -20.272 113 HD13 ILE 529 2HD1 ILE 529 23.038 14.966 -19.754 114 H ARG 530 H ARG 530 21.970 11.606 -25.136 115 HA ARG 530 HA ARG 530 21.949 8.998 -23.645 116 HB2 ARG 530 HB2 ARG 530 20.334 9.673 -26.139 117 HB3 ARG 530 HB3 ARG 530 20.476 8.073 -25.434 118 HG2 ARG 530 HG2 ARG 530 19.545 9.945 -23.378 119 HG3 ARG 530 HG3 ARG 530 18.579 10.118 -24.832 120 HD2 ARG 530 HD2 ARG 530 17.513 8.515 -23.426 121 HD3 ARG 530 HD3 ARG 530 18.179 7.646 -24.819 122 HE ARG 530 HE ARG 530 20.001 7.703 -22.540 123 HH11 ARG 530 HH11 ARG 530 17.168 5.989 -23.687 124 HH12 ARG 530 HH12 ARG 530 17.534 4.571 -22.745 125 HH21 ARG 530 HH21 ARG 530 20.424 5.840 -21.389 126 HH22 ARG 530 HH22 ARG 530 19.325 4.498 -21.485 127 H TYR 531 H TYR 531 22.715 7.201 -24.862 128 HA TYR 531 HA TYR 531 24.938 7.864 -26.745 129 HB2 TYR 531 HB2 TYR 531 25.113 6.141 -24.245 130 HB3 TYR 531 HB3 TYR 531 26.397 6.423 -25.408 131 HD1 TYR 531 HD2 TYR 531 24.363 7.940 -22.695 132 HD2 TYR 531 HD1 TYR 531 27.716 8.471 -25.359 133 HE1 TYR 531 HE2 TYR 531 25.091 9.915 -21.374 134 HE2 TYR 531 HE1 TYR 531 28.473 10.421 -24.001 135 HH TYR 531 HH TYR 531 26.664 11.559 -21.123 136 H THR 532 H THR 532 24.205 6.843 -28.576 137 HA THR 532 HA THR 532 22.554 4.434 -28.454 138 HB THR 532 HB THR 532 22.687 4.508 -30.924 139 HG1 THR 532 HG1 THR 532 24.792 5.483 -31.032 140 HG21 THR 532 HG23 THR 532 21.490 6.631 -31.248 141 HG22 THR 532 HG21 THR 532 20.935 5.808 -29.778 142 HG23 THR 532 HG22 THR 532 22.034 7.200 -29.659 143 H ALA 533 H ALA 533 23.030 2.393 -29.442 144 HA ALA 533 HA ALA 533 25.450 1.232 -28.650 145 HB1 ALA 533 HB3 ALA 533 24.627 -0.753 -29.840 146 HB2 ALA 533 HB1 ALA 533 23.317 0.039 -28.948 147 HB3 ALA 533 HB2 ALA 533 23.439 0.237 -30.713 148 H ALA 534 H ALA 534 24.881 2.926 -31.656 149 HA ALA 534 HA ALA 534 27.085 1.921 -33.188 150 HB1 ALA 534 HB3 ALA 534 26.781 4.023 -34.461 151 HB2 ALA 534 HB1 ALA 534 25.234 3.227 -34.148 152 HB3 ALA 534 HB2 ALA 534 25.714 4.650 -33.190 153 H GLY 535 H GLY 535 27.171 3.755 -30.263 154 HA2 GLY 535 HA2 GLY 535 29.095 4.353 -29.078 155 HA3 GLY 535 HA3 GLY 535 30.082 4.225 -30.536 156 H GLU 536 H GLU 536 27.083 6.136 -30.013 157 HA GLU 536 HA GLU 536 28.585 8.681 -30.487 158 HB2 GLU 536 HB2 GLU 536 26.092 7.694 -31.926 159 HB3 GLU 536 HB3 GLU 536 26.702 9.337 -32.029 160 HG2 GLU 536 HG2 GLU 536 28.155 6.825 -32.968 161 HG3 GLU 536 HG3 GLU 536 27.281 7.957 -33.983 162 H ARG 537 H ARG 537 27.932 10.381 -29.346 163 HA ARG 537 HA ARG 537 25.674 10.134 -27.438 164 HB2 ARG 537 HB2 ARG 537 27.682 10.933 -26.460 165 HB3 ARG 537 HB3 ARG 537 27.961 12.106 -27.750 166 HG2 ARG 537 HG2 ARG 537 26.282 13.569 -26.987 167 HG3 ARG 537 HG3 ARG 537 25.479 12.322 -26.029 168 HD2 ARG 537 HD2 ARG 537 26.674 14.076 -24.706 169 HD3 ARG 537 HD3 ARG 537 27.034 12.399 -24.315 170 HE ARG 537 HE ARG 537 28.960 13.499 -26.188 171 HH11 ARG 537 HH11 ARG 537 28.213 13.299 -22.765 172 HH12 ARG 537 HH12 ARG 537 29.818 13.778 -22.292 173 HH21 ARG 537 HH21 ARG 537 31.045 13.916 -25.501 174 HH22 ARG 537 HH22 ARG 537 31.389 14.049 -23.802 175 H PHE 538 H PHE 538 23.895 11.320 -27.460 176 HA PHE 538 HA PHE 538 23.472 13.489 -29.461 177 HB2 PHE 538 HB2 PHE 538 21.569 11.176 -28.892 178 HB3 PHE 538 HB3 PHE 538 21.171 12.612 -29.823 179 HD1 PHE 538 HD2 PHE 538 22.098 12.996 -32.055 180 HD2 PHE 538 HD1 PHE 538 23.003 9.408 -29.855 181 HE1 PHE 538 HE2 PHE 538 22.904 11.907 -34.156 182 HE2 PHE 538 HE1 PHE 538 23.809 8.337 -31.943 183 HZ PHE 538 HZ PHE 538 23.772 9.583 -34.081 184 H PHE 539 H PHE 539 21.794 14.952 -28.872 185 HA PHE 539 HA PHE 539 21.158 15.028 -25.942 186 HB2 PHE 539 HB2 PHE 539 21.851 17.280 -27.847 187 HB3 PHE 539 HB3 PHE 539 21.253 17.501 -26.214 188 HD1 PHE 539 HD1 PHE 539 24.142 16.242 -28.211 189 HD2 PHE 539 HD2 PHE 539 22.689 17.359 -24.308 190 HE1 PHE 539 HE1 PHE 539 26.466 16.205 -27.335 191 HE2 PHE 539 HE2 PHE 539 25.015 17.333 -23.437 192 HZ PHE 539 HZ PHE 539 26.906 16.755 -24.947 193 H VAL 540 H VAL 540 19.213 15.790 -25.331 194 HA VAL 540 HA VAL 540 16.987 15.820 -27.330 195 HB VAL 540 HB VAL 540 17.297 14.206 -24.767 196 HG11 VAL 540 HG11 VAL 540 14.943 14.956 -25.061 197 HG12 VAL 540 HG12 VAL 540 14.932 14.227 -26.685 198 HG13 VAL 540 HG13 VAL 540 15.139 13.222 -25.225 199 HG21 VAL 540 HG23 VAL 540 17.076 12.211 -26.196 200 HG22 VAL 540 HG21 VAL 540 17.112 13.243 -27.642 201 HG23 VAL 540 HG22 VAL 540 18.527 13.137 -26.571 202 H ASP 541 H ASP 541 15.585 17.414 -27.019 203 HA ASP 541 HA ASP 541 15.508 18.862 -24.399 204 HB2 ASP 541 HB2 ASP 541 16.347 20.236 -26.214 205 HB3 ASP 541 HB3 ASP 541 14.967 19.816 -27.234 206 H HIS 542 H HIS 542 13.806 18.252 -23.225 207 HA HIS 542 HA HIS 542 11.390 17.091 -24.371 208 HB2 HIS 542 HB2 HIS 542 11.947 18.073 -21.546 209 HB3 HIS 542 HB3 HIS 542 10.625 17.021 -22.043 210 HD2 HIS 542 HD2 HIS 542 12.489 15.003 -23.890 211 HE1 HIS 542 HE1 HIS 542 14.290 14.073 -20.139 212 H ASN 543 H ASN 543 12.348 20.352 -23.907 213 HA ASN 543 HA ASN 543 9.791 21.465 -23.141 214 HB2 ASN 543 HB2 ASN 543 12.226 22.896 -24.286 215 HB3 ASN 543 HB3 ASN 543 10.917 23.600 -23.352 216 HD21 ASN 543 2HD2 ASN 543 14.008 22.063 -23.178 217 HD22 ASN 543 1HD2 ASN 543 14.026 21.814 -21.438 218 H THR 544 H THR 544 11.461 21.101 -26.279 219 HA THR 544 HA THR 544 8.864 21.704 -27.669 220 HB THR 544 HB THR 544 10.074 22.714 -29.496 221 HG1 THR 544 HG1 THR 544 12.331 23.134 -29.202 222 HG21 THR 544 HG23 THR 544 10.847 24.763 -28.499 223 HG22 THR 544 HG21 THR 544 9.454 24.185 -27.570 224 HG23 THR 544 HG22 THR 544 11.099 23.979 -26.925 225 H ARG 545 H ARG 545 10.670 19.187 -26.920 226 HA ARG 545 HA ARG 545 10.940 17.077 -27.620 227 HB2 ARG 545 HB2 ARG 545 8.476 17.608 -28.480 228 HB3 ARG 545 HB3 ARG 545 9.216 17.395 -30.069 229 HG2 ARG 545 HG2 ARG 545 9.993 15.098 -29.325 230 HG3 ARG 545 HG3 ARG 545 9.239 15.409 -27.759 231 HD2 ARG 545 HD2 ARG 545 7.689 14.086 -28.923 232 HD3 ARG 545 HD3 ARG 545 7.033 15.718 -28.970 233 HE ARG 545 HE ARG 545 8.550 14.451 -31.264 234 HH11 ARG 545 HH11 ARG 545 5.762 16.400 -30.340 235 HH12 ARG 545 HH12 ARG 545 5.131 16.340 -31.962 236 HH21 ARG 545 HH21 ARG 545 7.740 14.409 -33.149 237 HH22 ARG 545 HH22 ARG 545 6.259 15.271 -33.572 238 H ARG 546 H ARG 546 12.417 19.473 -29.062 239 HA ARG 546 HA ARG 546 13.503 18.255 -31.478 240 HB2 ARG 546 HB2 ARG 546 14.282 20.676 -29.797 241 HB3 ARG 546 HB3 ARG 546 15.266 20.120 -31.147 242 HG2 ARG 546 HG2 ARG 546 13.114 20.228 -32.589 243 HG3 ARG 546 HG3 ARG 546 12.402 21.128 -31.247 244 HD2 ARG 546 HD2 ARG 546 13.246 22.706 -32.856 245 HD3 ARG 546 HD3 ARG 546 14.301 22.780 -31.431 246 HE ARG 546 HE ARG 546 15.372 20.891 -33.298 247 HH11 ARG 546 HH11 ARG 546 14.985 24.364 -33.120 248 HH12 ARG 546 HH12 ARG 546 16.382 24.659 -34.120 249 HH21 ARG 546 HH21 ARG 546 17.155 21.329 -34.526 250 HH22 ARG 546 HH22 ARG 546 17.573 22.975 -34.897 251 H THR 547 H THR 547 15.729 17.849 -31.856 252 HA THR 547 HA THR 547 17.390 16.828 -29.631 253 HB THR 547 HB THR 547 17.833 14.735 -30.896 254 HG1 THR 547 HG1 THR 547 16.181 14.196 -32.479 255 HG21 THR 547 HG23 THR 547 15.876 13.518 -30.255 256 HG22 THR 547 HG21 THR 547 16.057 14.820 -29.078 257 HG23 THR 547 HG22 THR 547 14.842 14.956 -30.364 258 H THR 548 H THR 548 19.641 16.416 -30.321 259 HA THR 548 HA THR 548 20.545 17.496 -32.891 260 HB THR 548 HB THR 548 20.091 19.580 -31.784 261 HG1 THR 548 HG1 THR 548 22.066 20.487 -32.013 262 HG21 THR 548 HG23 THR 548 21.266 20.303 -29.751 263 HG22 THR 548 HG21 THR 548 20.202 18.934 -29.414 264 HG23 THR 548 HG22 THR 548 21.951 18.676 -29.569 265 H PHE 549 H PHE 549 22.877 17.569 -33.095 266 HA PHE 549 HA PHE 549 24.071 15.069 -32.073 267 HB2 PHE 549 HB2 PHE 549 25.212 16.986 -34.119 268 HB3 PHE 549 HB3 PHE 549 25.558 15.275 -33.935 269 HD1 PHE 549 HD2 PHE 549 22.673 14.225 -33.818 270 HD2 PHE 549 HD1 PHE 549 24.584 17.102 -36.390 271 HE1 PHE 549 HE2 PHE 549 21.025 13.715 -35.601 272 HE2 PHE 549 HE1 PHE 549 22.935 16.596 -38.174 273 HZ PHE 549 HZ PHE 549 21.152 14.904 -37.785 274 H GLU 550 H GLU 550 24.192 18.316 -31.159 275 HA GLU 550 HA GLU 550 26.828 18.088 -29.810 276 HB2 GLU 550 HB2 GLU 550 27.625 20.165 -30.731 277 HB3 GLU 550 HB3 GLU 550 27.249 19.056 -32.039 278 HG2 GLU 550 HG2 GLU 550 25.063 20.260 -32.390 279 HG3 GLU 550 HG3 GLU 550 25.537 21.413 -31.142 280 H ASP 551 H ASP 551 27.013 20.692 -28.837 281 HA ASP 551 HA ASP 551 24.615 20.895 -27.051 282 HB2 ASP 551 HB2 ASP 551 26.540 19.922 -25.941 283 HB3 ASP 551 HB3 ASP 551 27.540 21.300 -26.399 284 HA PRO 552 HA PRO 552 25.023 25.026 -29.191 285 HB2 PRO 552 HB2 PRO 552 22.527 25.263 -30.211 286 HB3 PRO 552 HB3 PRO 552 23.733 24.181 -30.966 287 HG2 PRO 552 HG2 PRO 552 21.553 23.427 -28.984 288 HG3 PRO 552 HG3 PRO 552 21.902 22.682 -30.579 289 HD2 PRO 552 HD2 PRO 552 22.887 21.674 -28.226 290 HD3 PRO 552 HD3 PRO 552 23.794 21.590 -29.763 291 H ARG 553 H ARG 553 23.301 26.956 -28.885 292 HA ARG 553 HA ARG 553 22.936 27.530 -26.119 293 HB2 ARG 553 HB2 ARG 553 21.805 28.718 -28.682 294 HB3 ARG 553 HB3 ARG 553 21.188 29.238 -27.114 295 HG2 ARG 553 HG2 ARG 553 23.549 29.728 -26.386 296 HG3 ARG 553 HG3 ARG 553 24.077 29.442 -28.053 297 HD2 ARG 553 HD2 ARG 553 22.749 31.280 -28.875 298 HD3 ARG 553 HD3 ARG 553 21.877 31.442 -27.354 299 HE ARG 553 HE ARG 553 24.515 32.513 -27.999 300 HH11 ARG 553 HH11 ARG 553 22.437 31.670 -25.295 301 HH12 ARG 553 HH12 ARG 553 23.314 32.693 -24.192 302 HH21 ARG 553 HH21 ARG 553 25.565 33.811 -26.531 303 HH22 ARG 553 HH22 ARG 553 25.023 33.874 -24.879 304 HA PRO 554 HA PRO 554 19.292 25.329 -24.992 305 HB2 PRO 554 HB2 PRO 554 18.314 26.807 -22.901 306 HB3 PRO 554 HB3 PRO 554 19.851 25.894 -22.820 307 HG2 PRO 554 HG2 PRO 554 19.476 28.841 -23.442 308 HG3 PRO 554 HG3 PRO 554 20.597 28.093 -22.254 309 HD2 PRO 554 HD2 PRO 554 21.423 28.812 -24.735 310 HD3 PRO 554 HD3 PRO 554 22.032 27.322 -23.955 311 H GLY 555 H GLY 555 18.947 28.647 -26.050 312 HA2 GLY 555 HA2 GLY 555 17.299 28.793 -27.934 313 HA3 GLY 555 HA3 GLY 555 16.078 28.199 -26.808 314 H ALA 556 H ALA 556 16.699 29.653 -24.528 315 HA ALA 556 HA ALA 556 16.896 32.496 -25.057 316 HB1 ALA 556 HB3 ALA 556 14.623 33.079 -24.236 317 HB2 ALA 556 HB1 ALA 556 14.587 32.197 -25.768 318 HB3 ALA 556 HB2 ALA 556 14.178 31.360 -24.260 319 HA PRO 557 HA PRO 557 16.339 32.041 -20.342 320 HB2 PRO 557 HB2 PRO 557 16.301 29.614 -19.066 321 HB3 PRO 557 HB3 PRO 557 14.846 30.434 -19.709 322 HG2 PRO 557 HG2 PRO 557 16.487 28.251 -21.023 323 HG3 PRO 557 HG3 PRO 557 14.706 28.353 -20.854 324 HD2 PRO 557 HD2 PRO 557 15.967 29.083 -23.122 325 HD3 PRO 557 HD3 PRO 557 14.543 29.989 -22.532 326 H ASN2319 H ASN2319 30.597 4.011 -42.611 327 HA ASN2319 HA ASN2319 27.849 4.778 -41.858 328 HB2 ASN2319 HB2 ASN2319 30.219 4.121 -40.047 329 HB3 ASN2319 HB3 ASN2319 28.748 4.933 -39.521 330 HD21 ASN2319 2HD2 ASN2319 27.882 3.301 -38.131 331 HD22 ASN2319 1HD2 ASN2319 27.442 1.720 -38.749 332 H THR2320 H THR2320 27.842 6.692 -43.035 333 HA THR2320 HA THR2320 29.411 8.941 -41.926 334 HB THR2320 HB THR2320 29.785 9.799 -44.283 335 HG1 THR2320 HG1 THR2320 29.854 8.254 -45.918 336 HG21 THR2320 HG23 THR2320 31.864 8.645 -44.653 337 HG22 THR2320 HG21 THR2320 31.639 8.842 -42.909 338 HG23 THR2320 HG22 THR2320 31.346 7.262 -43.669 339 H GLY2321 H GLY2321 28.477 11.028 -42.482 340 HA2 GLY2321 HA2 GLY2321 26.685 12.480 -42.662 341 HA3 GLY2321 HA3 GLY2321 25.920 11.337 -43.766 342 H ALA2322 H ALA2322 23.989 10.667 -43.059 343 HA ALA2322 HA ALA2322 22.876 11.020 -40.490 344 HB1 ALA2322 HB3 ALA2322 21.081 9.552 -41.350 345 HB2 ALA2322 HB1 ALA2322 21.576 10.746 -42.561 346 HB3 ALA2322 HB2 ALA2322 22.122 9.059 -42.701 347 H LYS2323 H LYS2323 22.163 9.483 -38.947 348 HA LYS2323 HA LYS2323 23.725 6.991 -38.540 349 HB2 LYS2323 HB2 LYS2323 24.625 9.421 -37.478 350 HB3 LYS2323 HB3 LYS2323 23.634 8.814 -36.179 351 HG2 LYS2323 HG2 LYS2323 25.555 7.724 -35.568 352 HG3 LYS2323 HG3 LYS2323 25.040 6.528 -36.751 353 HD2 LYS2323 HD2 LYS2323 27.311 6.980 -37.302 354 HD3 LYS2323 HD3 LYS2323 26.373 7.893 -38.496 355 HE2 LYS2323 HE2 LYS2323 26.566 9.866 -36.741 356 HE3 LYS2323 HE3 LYS2323 27.851 8.891 -36.025 357 HZ1 LYS2323 HZ3 LYS2323 28.751 10.462 -37.616 358 HZ2 LYS2323 HZ1 LYS2323 28.982 8.960 -38.210 359 HZ3 LYS2323 HZ2 LYS2323 27.790 9.916 -38.815 360 H GLN2324 H GLN2324 22.970 6.428 -35.923 361 HA GLN2324 HA GLN2324 20.227 5.649 -36.024 362 HB2 GLN2324 HB2 GLN2324 22.067 6.073 -33.635 363 HB3 GLN2324 HB3 GLN2324 20.415 5.450 -33.543 364 HG2 GLN2324 HG2 GLN2324 21.169 3.638 -35.237 365 HG3 GLN2324 HG3 GLN2324 22.816 4.166 -34.889 366 HE21 GLN2324 HE22 GLN2324 23.324 2.035 -33.978 367 HE22 GLN2324 HE21 GLN2324 22.617 1.540 -32.449 368 HA PRO2325 HA PRO2325 18.662 9.817 -35.424 369 HB2 PRO2325 HB2 PRO2325 15.964 9.366 -35.528 370 HB3 PRO2325 HB3 PRO2325 17.039 9.328 -36.956 371 HG2 PRO2325 HG2 PRO2325 16.026 6.983 -35.328 372 HG3 PRO2325 HG3 PRO2325 16.084 7.160 -37.110 373 HD2 PRO2325 HD2 PRO2325 18.000 5.811 -35.687 374 HD3 PRO2325 HD3 PRO2325 18.387 6.729 -37.174 375 HA PRO2326 HA PRO2326 17.847 9.510 -30.922 376 HB2 PRO2326 HB2 PRO2326 17.985 12.162 -30.282 377 HB3 PRO2326 HB3 PRO2326 19.421 11.147 -30.606 378 HG2 PRO2326 HG2 PRO2326 17.999 13.005 -32.535 379 HG3 PRO2326 HG3 PRO2326 19.749 12.903 -32.203 380 HD2 PRO2326 HD2 PRO2326 18.555 11.664 -34.322 381 HD3 PRO2326 HD3 PRO2326 19.939 10.916 -33.466 382 H SER2327 H SER2327 15.837 9.099 -30.294 383 HA SER2327 HA SER2327 13.578 10.962 -30.781 384 HB2 SER2327 HB2 SER2327 13.521 8.055 -31.701 385 HB3 SER2327 HB3 SER2327 12.186 9.215 -31.770 386 HG SER2327 HG SER2327 13.650 10.505 -33.147 387 H TYR2328 H TYR2328 13.849 11.193 -28.452 388 HA TYR2328 HA TYR2328 13.186 8.900 -26.726 389 HB2 TYR2328 HB2 TYR2328 14.864 10.636 -26.139 390 HB3 TYR2328 HB3 TYR2328 13.588 11.835 -26.072 391 HD1 TYR2328 HD1 TYR2328 14.772 8.610 -24.577 392 HD2 TYR2328 HD2 TYR2328 12.376 12.155 -24.019 393 HE1 TYR2328 HE1 TYR2328 14.437 8.017 -22.175 394 HE2 TYR2328 HE2 TYR2328 12.021 11.547 -21.637 395 HH TYR2328 HH TYR2328 12.469 10.046 -19.968 396 H GLU2329 H GLU2329 11.660 12.042 -26.158 397 HA GLU2329 HA GLU2329 9.014 11.032 -25.781 398 HB2 GLU2329 HB2 GLU2329 10.206 13.767 -26.281 399 HB3 GLU2329 HB3 GLU2329 8.460 13.572 -26.215 400 HG2 GLU2329 HG2 GLU2329 10.131 12.486 -23.943 401 HG3 GLU2329 HG3 GLU2329 9.832 14.216 -24.068 402 H ASP2330 H ASP2330 10.677 12.002 -28.718 403 HA ASP2330 HA ASP2330 8.396 12.240 -30.441 404 HB2 ASP2330 HB2 ASP2330 10.791 13.050 -30.802 405 HB3 ASP2330 HB3 ASP2330 11.217 11.384 -31.183 406 H CYS2331 H CYS2331 9.891 9.419 -29.058 407 HA CYS2331 HA CYS2331 8.537 7.597 -31.017 408 HB2 CYS2331 HB2 CYS2331 11.002 7.377 -30.717 409 HB3 CYS2331 HB3 CYS2331 10.743 7.023 -28.999 410 HG CYS2331 HG CYS2331 11.284 4.798 -30.272 411 H ILE2332 H ILE2332 8.958 8.177 -27.474 412 HA ILE2332 HA ILE2332 7.056 6.070 -26.835 413 HB ILE2332 HB ILE2332 7.474 6.534 -24.536 414 HG12 ILE2332 HG12 ILE2332 9.504 8.689 -25.082 415 HG13 ILE2332 HG13 ILE2332 7.806 9.156 -24.987 416 HG21 ILE2332 HG21 ILE2332 9.056 5.137 -25.797 417 HG22 ILE2332 HG22 ILE2332 10.079 6.556 -26.111 418 HG23 ILE2332 HG23 ILE2332 9.843 5.976 -24.454 419 HD11 ILE2332 3HD1 ILE2332 8.951 9.361 -22.808 420 HD12 ILE2332 1HD1 ILE2332 7.620 8.190 -22.744 421 HD13 ILE2332 2HD1 ILE2332 9.305 7.622 -22.819 422 H LYS2333 H LYS2333 6.049 8.520 -28.293 423 HA LYS2333 HA LYS2333 4.270 10.147 -26.918 424 HB2 LYS2333 HB2 LYS2333 3.969 8.772 -29.619 425 HB3 LYS2333 HB3 LYS2333 2.864 10.004 -29.050 426 HG2 LYS2333 HG2 LYS2333 5.849 10.392 -29.537 427 HG3 LYS2333 HG3 LYS2333 4.562 10.879 -30.626 428 HD2 LYS2333 HD2 LYS2333 5.003 12.009 -27.828 429 HD3 LYS2333 HD3 LYS2333 5.459 12.784 -29.345 430 HE2 LYS2333 HE2 LYS2333 3.133 12.949 -30.054 431 HE3 LYS2333 HE3 LYS2333 2.590 12.015 -28.655 432 HZ1 LYS2333 HZ3 LYS2333 2.290 14.395 -28.307 433 HZ2 LYS2333 HZ1 LYS2333 3.342 13.803 -27.212 434 HZ3 LYS2333 HZ2 LYS2333 3.886 14.680 -28.481 Start of MODEL 16 1 H VAL 515 H VAL 515 29.737 6.623 -19.006 2 HA VAL 515 HA VAL 515 28.978 8.898 -18.670 3 HB VAL 515 HB VAL 515 26.697 7.573 -17.172 4 HG11 VAL 515 HG11 VAL 515 27.421 9.513 -15.832 5 HG12 VAL 515 HG12 VAL 515 27.442 10.535 -17.289 6 HG13 VAL 515 HG13 VAL 515 25.917 9.877 -16.671 7 HG21 VAL 515 HG23 VAL 515 25.320 8.931 -18.741 8 HG22 VAL 515 HG21 VAL 515 26.794 9.506 -19.542 9 HG23 VAL 515 HG22 VAL 515 26.330 7.789 -19.619 10 H SER 516 H SER 516 28.767 6.435 -16.012 11 HA SER 516 HA SER 516 29.188 7.936 -13.928 12 HB2 SER 516 HB2 SER 516 30.513 5.220 -14.139 13 HB3 SER 516 HB3 SER 516 29.808 5.990 -12.704 14 HG SER 516 HG SER 516 28.318 4.532 -13.546 15 H LEU 517 H LEU 517 32.036 7.053 -15.865 16 HA LEU 517 HA LEU 517 33.627 8.932 -14.184 17 HB2 LEU 517 HB2 LEU 517 35.536 7.549 -14.162 18 HB3 LEU 517 HB3 LEU 517 34.200 6.621 -13.526 19 HG LEU 517 HG LEU 517 34.491 6.194 -16.434 20 HD11 LEU 517 1HD1 LEU 517 36.864 6.673 -15.998 21 HD12 LEU 517 2HD1 LEU 517 36.877 5.458 -14.698 22 HD13 LEU 517 3HD1 LEU 517 36.604 4.966 -16.387 23 HD21 LEU 517 3HD2 LEU 517 34.504 3.844 -15.791 24 HD22 LEU 517 1HD2 LEU 517 34.756 4.279 -14.085 25 HD23 LEU 517 2HD2 LEU 517 33.233 4.702 -14.902 26 H ILE 518 H ILE 518 32.223 9.065 -16.849 27 HA ILE 518 HA ILE 518 34.502 10.000 -18.559 28 HB ILE 518 HB ILE 518 31.968 8.653 -19.568 29 HG12 ILE 518 HG12 ILE 518 33.988 6.922 -20.290 30 HG13 ILE 518 HG13 ILE 518 34.594 7.453 -18.736 31 HG21 ILE 518 HG21 ILE 518 32.961 10.155 -21.237 32 HG22 ILE 518 HG22 ILE 518 34.555 9.405 -20.993 33 HG23 ILE 518 HG23 ILE 518 33.213 8.485 -21.707 34 HD11 ILE 518 3HD1 ILE 518 33.265 5.417 -18.500 35 HD12 ILE 518 1HD1 ILE 518 32.364 6.734 -17.729 36 HD13 ILE 518 2HD1 ILE 518 31.897 6.161 -19.345 37 H ASN 519 H ASN 519 31.413 10.742 -17.153 38 HA ASN 519 HA ASN 519 31.462 13.474 -18.346 39 HB2 ASN 519 HB2 ASN 519 29.300 11.412 -18.540 40 HB3 ASN 519 HB3 ASN 519 28.776 13.023 -18.074 41 HD21 ASN 519 2HD2 ASN 519 31.084 11.681 -20.524 42 HD22 ASN 519 1HD2 ASN 519 30.346 12.591 -21.830 43 H GLU 520 H GLU 520 32.685 13.738 -16.340 44 HA GLU 520 HA GLU 520 31.465 13.556 -13.736 45 HB2 GLU 520 HB2 GLU 520 33.752 15.314 -14.719 46 HB3 GLU 520 HB3 GLU 520 33.335 14.997 -13.031 47 HG2 GLU 520 HG2 GLU 520 33.742 12.548 -13.431 48 HG3 GLU 520 HG3 GLU 520 34.311 12.936 -15.055 49 H GLY 521 H GLY 521 30.808 15.280 -12.332 50 HA2 GLY 521 HA2 GLY 521 30.010 17.407 -11.763 51 HA3 GLY 521 HA3 GLY 521 30.083 17.918 -13.443 52 HA PRO 522 HA PRO 522 25.619 16.981 -12.182 53 HB2 PRO 522 HB2 PRO 522 24.564 19.499 -12.247 54 HB3 PRO 522 HB3 PRO 522 25.427 18.848 -10.821 55 HG2 PRO 522 HG2 PRO 522 26.540 20.625 -13.014 56 HG3 PRO 522 HG3 PRO 522 26.684 20.837 -11.240 57 HD2 PRO 522 HD2 PRO 522 28.651 19.672 -12.736 58 HD3 PRO 522 HD3 PRO 522 28.290 19.121 -11.072 59 H LEU 523 H LEU 523 23.745 17.052 -13.568 60 HA LEU 523 HA LEU 523 24.408 17.025 -16.375 61 HB2 LEU 523 HB2 LEU 523 22.411 15.947 -16.708 62 HB3 LEU 523 HB3 LEU 523 22.862 15.447 -15.116 63 HG LEU 523 HG LEU 523 21.150 17.794 -14.848 64 HD11 LEU 523 1HD1 LEU 523 20.379 17.185 -17.146 65 HD12 LEU 523 2HD1 LEU 523 19.972 15.563 -16.558 66 HD13 LEU 523 3HD1 LEU 523 19.118 16.988 -15.922 67 HD21 LEU 523 3HD2 LEU 523 19.696 16.253 -13.639 68 HD22 LEU 523 1HD2 LEU 523 20.608 14.860 -14.264 69 HD23 LEU 523 2HD2 LEU 523 21.384 16.019 -13.159 70 HA PRO 524 HA PRO 524 23.298 21.097 -17.615 71 HB2 PRO 524 HB2 PRO 524 22.231 20.779 -20.155 72 HB3 PRO 524 HB3 PRO 524 23.965 20.624 -19.742 73 HG2 PRO 524 HG2 PRO 524 21.908 18.422 -20.007 74 HG3 PRO 524 HG3 PRO 524 23.555 18.483 -20.708 75 HD2 PRO 524 HD2 PRO 524 23.011 17.130 -18.427 76 HD3 PRO 524 HD3 PRO 524 24.542 18.033 -18.604 77 HA PRO 525 HA PRO 525 19.339 22.037 -16.256 78 HB2 PRO 525 HB2 PRO 525 18.781 24.531 -17.255 79 HB3 PRO 525 HB3 PRO 525 20.088 24.199 -16.081 80 HG2 PRO 525 HG2 PRO 525 20.326 24.439 -19.099 81 HG3 PRO 525 HG3 PRO 525 21.322 25.241 -17.843 82 HD2 PRO 525 HD2 PRO 525 22.146 22.966 -19.068 83 HD3 PRO 525 HD3 PRO 525 22.449 23.231 -17.324 84 H GLY 526 H GLY 526 17.633 20.795 -16.818 85 HA2 GLY 526 HA2 GLY 526 15.659 20.176 -17.823 86 HA3 GLY 526 HA3 GLY 526 15.673 21.711 -18.694 87 H TRP 527 H TRP 527 18.296 19.416 -19.074 88 HA TRP 527 HA TRP 527 17.414 18.688 -21.854 89 HB2 TRP 527 HB2 TRP 527 20.071 19.454 -20.650 90 HB3 TRP 527 HB3 TRP 527 20.038 18.355 -22.012 91 HD1 TRP 527 HD1 TRP 527 19.627 21.993 -21.138 92 HE1 TRP 527 HE1 TRP 527 19.568 23.404 -23.279 93 HE3 TRP 527 HE3 TRP 527 19.350 18.219 -24.577 94 HZ2 TRP 527 HZ2 TRP 527 19.431 22.951 -26.126 95 HZ3 TRP 527 HZ3 TRP 527 19.256 18.737 -27.011 96 HH2 TRP 527 HH2 TRP 527 19.308 21.093 -27.794 97 H GLU 528 H GLU 528 18.169 16.652 -22.639 98 HA GLU 528 HA GLU 528 19.046 14.616 -20.651 99 HB2 GLU 528 HB2 GLU 528 16.693 14.267 -20.882 100 HB3 GLU 528 HB3 GLU 528 16.744 14.442 -22.620 101 HG2 GLU 528 HG2 GLU 528 16.408 12.148 -22.143 102 HG3 GLU 528 HG3 GLU 528 18.039 12.286 -22.765 103 H ILE 529 H ILE 529 20.291 12.920 -21.560 104 HA ILE 529 HA ILE 529 21.621 13.500 -24.158 105 HB ILE 529 HB ILE 529 23.302 13.063 -21.667 106 HG12 ILE 529 HG12 ILE 529 23.831 15.642 -22.003 107 HG13 ILE 529 HG13 ILE 529 22.191 15.707 -22.620 108 HG21 ILE 529 HG21 ILE 529 24.302 12.616 -23.869 109 HG22 ILE 529 HG22 ILE 529 23.866 14.249 -24.416 110 HG23 ILE 529 HG23 ILE 529 25.052 14.024 -23.112 111 HD11 ILE 529 3HD1 ILE 529 21.955 16.178 -20.319 112 HD12 ILE 529 1HD1 ILE 529 21.598 14.453 -20.329 113 HD13 ILE 529 2HD1 ILE 529 23.203 15.006 -19.846 114 H ARG 530 H ARG 530 21.979 11.660 -25.229 115 HA ARG 530 HA ARG 530 21.959 9.040 -23.760 116 HB2 ARG 530 HB2 ARG 530 20.300 9.755 -26.212 117 HB3 ARG 530 HB3 ARG 530 20.429 8.150 -25.514 118 HG2 ARG 530 HG2 ARG 530 19.565 10.066 -23.452 119 HG3 ARG 530 HG3 ARG 530 18.563 10.198 -24.885 120 HD2 ARG 530 HD2 ARG 530 17.528 8.633 -23.426 121 HD3 ARG 530 HD3 ARG 530 18.178 7.723 -24.800 122 HE ARG 530 HE ARG 530 19.983 7.882 -22.489 123 HH11 ARG 530 HH11 ARG 530 17.296 6.025 -23.760 124 HH12 ARG 530 HH12 ARG 530 17.690 4.628 -22.797 125 HH21 ARG 530 HH21 ARG 530 20.439 6.048 -21.305 126 HH22 ARG 530 HH22 ARG 530 19.417 4.649 -21.450 127 H TYR 531 H TYR 531 22.692 7.248 -24.991 128 HA TYR 531 HA TYR 531 24.892 7.905 -26.909 129 HB2 TYR 531 HB2 TYR 531 25.082 6.217 -24.385 130 HB3 TYR 531 HB3 TYR 531 26.351 6.442 -25.576 131 HD1 TYR 531 HD1 TYR 531 24.380 8.094 -22.888 132 HD2 TYR 531 HD2 TYR 531 27.738 8.432 -25.580 133 HE1 TYR 531 HE1 TYR 531 25.183 10.081 -21.630 134 HE2 TYR 531 HE2 TYR 531 28.571 10.390 -24.277 135 HH TYR 531 HH TYR 531 26.805 11.685 -21.443 136 H THR 532 H THR 532 23.963 6.947 -28.684 137 HA THR 532 HA THR 532 22.418 4.486 -28.538 138 HB THR 532 HB THR 532 22.385 4.520 -30.964 139 HG1 THR 532 HG1 THR 532 24.470 6.321 -30.605 140 HG21 THR 532 HG23 THR 532 21.331 6.721 -31.334 141 HG22 THR 532 HG21 THR 532 20.784 5.958 -29.833 142 HG23 THR 532 HG22 THR 532 21.956 7.291 -29.775 143 H ALA 533 H ALA 533 22.886 2.438 -29.471 144 HA ALA 533 HA ALA 533 25.331 1.314 -28.707 145 HB1 ALA 533 HB3 ALA 533 24.472 -0.715 -29.792 146 HB2 ALA 533 HB1 ALA 533 23.187 0.112 -28.896 147 HB3 ALA 533 HB2 ALA 533 23.263 0.244 -30.671 148 H ALA 534 H ALA 534 24.729 2.988 -31.687 149 HA ALA 534 HA ALA 534 26.837 1.847 -33.291 150 HB1 ALA 534 HB3 ALA 534 26.518 3.894 -34.624 151 HB2 ALA 534 HB1 ALA 534 24.961 3.149 -34.221 152 HB3 ALA 534 HB2 ALA 534 25.512 4.596 -33.338 153 H GLY 535 H GLY 535 27.010 3.801 -30.448 154 HA2 GLY 535 HA2 GLY 535 28.984 4.405 -29.331 155 HA3 GLY 535 HA3 GLY 535 29.922 4.243 -30.817 156 H GLU 536 H GLU 536 26.933 6.147 -30.278 157 HA GLU 536 HA GLU 536 28.407 8.698 -30.814 158 HB2 GLU 536 HB2 GLU 536 25.828 7.762 -32.129 159 HB3 GLU 536 HB3 GLU 536 26.536 9.354 -32.329 160 HG2 GLU 536 HG2 GLU 536 27.851 6.746 -33.218 161 HG3 GLU 536 HG3 GLU 536 26.852 7.771 -34.229 162 H ARG 537 H ARG 537 27.790 10.393 -29.643 163 HA ARG 537 HA ARG 537 25.593 10.146 -27.666 164 HB2 ARG 537 HB2 ARG 537 27.614 10.934 -26.722 165 HB3 ARG 537 HB3 ARG 537 27.896 12.090 -28.027 166 HG2 ARG 537 HG2 ARG 537 26.261 13.595 -27.253 167 HG3 ARG 537 HG3 ARG 537 25.444 12.371 -26.274 168 HD2 ARG 537 HD2 ARG 537 26.637 14.101 -24.976 169 HD3 ARG 537 HD3 ARG 537 27.027 12.431 -24.578 170 HE ARG 537 HE ARG 537 28.993 13.276 -26.411 171 HH11 ARG 537 HH11 ARG 537 27.994 14.090 -23.157 172 HH12 ARG 537 HH12 ARG 537 29.539 14.742 -22.721 173 HH21 ARG 537 HH21 ARG 537 31.034 13.929 -25.727 174 HH22 ARG 537 HH22 ARG 537 31.241 14.584 -24.131 175 H PHE 538 H PHE 538 23.843 11.376 -27.588 176 HA PHE 538 HA PHE 538 23.338 13.542 -29.572 177 HB2 PHE 538 HB2 PHE 538 21.459 11.241 -28.880 178 HB3 PHE 538 HB3 PHE 538 21.008 12.670 -29.797 179 HD1 PHE 538 HD1 PHE 538 21.821 13.048 -32.073 180 HD2 PHE 538 HD2 PHE 538 22.829 9.465 -29.911 181 HE1 PHE 538 HE1 PHE 538 22.435 11.924 -34.215 182 HE2 PHE 538 HE2 PHE 538 23.456 8.354 -32.043 183 HZ PHE 538 HZ PHE 538 23.239 9.584 -34.192 184 H PHE 539 H PHE 539 21.699 15.015 -28.905 185 HA PHE 539 HA PHE 539 21.139 15.087 -25.961 186 HB2 PHE 539 HB2 PHE 539 21.719 17.376 -27.866 187 HB3 PHE 539 HB3 PHE 539 21.269 17.535 -26.179 188 HD1 PHE 539 HD1 PHE 539 23.981 16.430 -28.476 189 HD2 PHE 539 HD2 PHE 539 22.859 17.285 -24.402 190 HE1 PHE 539 HE1 PHE 539 26.372 16.355 -27.802 191 HE2 PHE 539 HE2 PHE 539 25.251 17.234 -23.734 192 HZ PHE 539 HZ PHE 539 27.011 16.769 -25.431 193 H VAL 540 H VAL 540 19.178 15.860 -25.323 194 HA VAL 540 HA VAL 540 16.930 15.911 -27.304 195 HB VAL 540 HB VAL 540 17.213 14.335 -24.719 196 HG11 VAL 540 HG11 VAL 540 14.872 15.097 -25.062 197 HG12 VAL 540 HG12 VAL 540 14.880 14.348 -26.676 198 HG13 VAL 540 HG13 VAL 540 15.046 13.358 -25.202 199 HG21 VAL 540 HG23 VAL 540 17.027 12.305 -26.054 200 HG22 VAL 540 HG21 VAL 540 17.005 13.256 -27.549 201 HG23 VAL 540 HG22 VAL 540 18.454 13.226 -26.520 202 H ASP 541 H ASP 541 15.463 17.450 -26.942 203 HA ASP 541 HA ASP 541 15.579 19.044 -24.414 204 HB2 ASP 541 HB2 ASP 541 16.612 20.154 -26.337 205 HB3 ASP 541 HB3 ASP 541 15.121 19.982 -27.262 206 H HIS 542 H HIS 542 13.937 17.929 -23.407 207 HA HIS 542 HA HIS 542 11.416 17.201 -24.399 208 HB2 HIS 542 HB2 HIS 542 12.070 18.119 -21.575 209 HB3 HIS 542 HB3 HIS 542 10.732 17.082 -22.056 210 HD2 HIS 542 HD2 HIS 542 12.482 15.034 -23.933 211 HE1 HIS 542 HE1 HIS 542 14.433 14.116 -20.254 212 H ASN 543 H ASN 543 12.455 20.433 -23.593 213 HA ASN 543 HA ASN 543 9.922 21.605 -22.960 214 HB2 ASN 543 HB2 ASN 543 12.409 22.895 -24.168 215 HB3 ASN 543 HB3 ASN 543 11.086 23.737 -23.373 216 HD21 ASN 543 2HD2 ASN 543 14.029 21.978 -22.892 217 HD22 ASN 543 1HD2 ASN 543 14.005 22.017 -21.128 218 H THR 544 H THR 544 11.281 20.701 -26.054 219 HA THR 544 HA THR 544 8.776 21.502 -27.404 220 HB THR 544 HB THR 544 10.215 23.491 -27.504 221 HG1 THR 544 HG1 THR 544 8.802 23.218 -29.165 222 HG21 THR 544 HG23 THR 544 12.193 23.487 -29.044 223 HG22 THR 544 HG21 THR 544 12.438 22.645 -27.510 224 HG23 THR 544 HG22 THR 544 12.162 21.714 -28.989 225 H ARG 545 H ARG 545 10.409 19.024 -26.716 226 HA ARG 545 HA ARG 545 10.877 16.969 -27.493 227 HB2 ARG 545 HB2 ARG 545 8.394 17.507 -28.305 228 HB3 ARG 545 HB3 ARG 545 9.109 17.344 -29.909 229 HG2 ARG 545 HG2 ARG 545 9.937 15.032 -29.202 230 HG3 ARG 545 HG3 ARG 545 9.140 15.305 -27.650 231 HD2 ARG 545 HD2 ARG 545 7.662 13.968 -28.903 232 HD3 ARG 545 HD3 ARG 545 6.958 15.582 -28.893 233 HE ARG 545 HE ARG 545 8.512 14.391 -31.205 234 HH11 ARG 545 HH11 ARG 545 5.798 16.440 -30.259 235 HH12 ARG 545 HH12 ARG 545 5.259 16.553 -31.910 236 HH21 ARG 545 HH21 ARG 545 7.794 14.538 -33.122 237 HH22 ARG 545 HH22 ARG 545 6.402 15.536 -33.546 238 H ARG 546 H ARG 546 12.499 19.262 -28.707 239 HA ARG 546 HA ARG 546 13.408 18.167 -31.301 240 HB2 ARG 546 HB2 ARG 546 14.170 20.613 -29.657 241 HB3 ARG 546 HB3 ARG 546 15.136 20.089 -31.027 242 HG2 ARG 546 HG2 ARG 546 13.008 20.123 -32.454 243 HG3 ARG 546 HG3 ARG 546 12.214 20.929 -31.101 244 HD2 ARG 546 HD2 ARG 546 12.966 22.650 -32.581 245 HD3 ARG 546 HD3 ARG 546 14.059 22.675 -31.184 246 HE ARG 546 HE ARG 546 15.062 20.966 -33.304 247 HH11 ARG 546 HH11 ARG 546 14.836 24.372 -32.469 248 HH12 ARG 546 HH12 ARG 546 16.251 24.762 -33.425 249 HH21 ARG 546 HH21 ARG 546 16.851 21.549 -34.468 250 HH22 ARG 546 HH22 ARG 546 17.341 23.213 -34.540 251 H THR 547 H THR 547 15.713 17.986 -31.740 252 HA THR 547 HA THR 547 17.415 16.891 -29.596 253 HB THR 547 HB THR 547 17.973 14.904 -31.006 254 HG1 THR 547 HG1 THR 547 15.563 15.485 -32.379 255 HG21 THR 547 HG23 THR 547 16.086 13.532 -30.417 256 HG22 THR 547 HG21 THR 547 16.344 14.712 -29.124 257 HG23 THR 547 HG22 THR 547 15.014 14.937 -30.276 258 H THR 548 H THR 548 19.661 16.551 -30.317 259 HA THR 548 HA THR 548 20.537 17.586 -32.893 260 HB THR 548 HB THR 548 20.146 19.720 -31.881 261 HG1 THR 548 HG1 THR 548 22.125 20.575 -32.144 262 HG21 THR 548 HG23 THR 548 21.386 20.483 -29.864 263 HG22 THR 548 HG21 THR 548 20.179 19.243 -29.503 264 HG23 THR 548 HG22 THR 548 21.896 18.804 -29.584 265 H PHE 549 H PHE 549 22.907 17.613 -33.088 266 HA PHE 549 HA PHE 549 24.014 15.101 -32.006 267 HB2 PHE 549 HB2 PHE 549 25.262 16.985 -34.024 268 HB3 PHE 549 HB3 PHE 549 25.573 15.269 -33.816 269 HD1 PHE 549 HD1 PHE 549 22.710 14.231 -33.779 270 HD2 PHE 549 HD2 PHE 549 24.656 17.128 -36.300 271 HE1 PHE 549 HE1 PHE 549 21.079 13.745 -35.587 272 HE2 PHE 549 HE2 PHE 549 23.031 16.638 -38.111 273 HZ PHE 549 HZ PHE 549 21.238 14.949 -37.758 274 H GLU 550 H GLU 550 24.256 18.406 -31.208 275 HA GLU 550 HA GLU 550 26.703 18.083 -29.593 276 HB2 GLU 550 HB2 GLU 550 27.877 19.913 -30.640 277 HB3 GLU 550 HB3 GLU 550 27.533 18.675 -31.833 278 HG2 GLU 550 HG2 GLU 550 25.570 20.050 -32.638 279 HG3 GLU 550 HG3 GLU 550 26.055 21.319 -31.512 280 H ASP 551 H ASP 551 27.074 20.846 -29.010 281 HA ASP 551 HA ASP 551 24.482 21.594 -27.705 282 HB2 ASP 551 HB2 ASP 551 26.082 20.647 -26.114 283 HB3 ASP 551 HB3 ASP 551 27.269 21.870 -26.561 284 HA PRO 552 HA PRO 552 25.858 25.071 -30.473 285 HB2 PRO 552 HB2 PRO 552 23.541 25.523 -31.817 286 HB3 PRO 552 HB3 PRO 552 24.623 24.157 -32.225 287 HG2 PRO 552 HG2 PRO 552 22.140 24.102 -30.476 288 HG3 PRO 552 HG3 PRO 552 22.559 23.012 -31.838 289 HD2 PRO 552 HD2 PRO 552 23.057 22.371 -29.220 290 HD3 PRO 552 HD3 PRO 552 24.129 21.852 -30.549 291 H ARG 553 H ARG 553 25.055 27.332 -30.585 292 HA ARG 553 HA ARG 553 24.258 28.395 -28.040 293 HB2 ARG 553 HB2 ARG 553 24.639 29.562 -30.821 294 HB3 ARG 553 HB3 ARG 553 23.865 30.521 -29.565 295 HG2 ARG 553 HG2 ARG 553 25.848 30.065 -28.056 296 HG3 ARG 553 HG3 ARG 553 26.651 29.297 -29.427 297 HD2 ARG 553 HD2 ARG 553 27.395 31.637 -29.147 298 HD3 ARG 553 HD3 ARG 553 26.593 31.389 -30.693 299 HE ARG 553 HE ARG 553 24.973 32.904 -30.103 300 HH11 ARG 553 HH11 ARG 553 26.541 32.031 -27.087 301 HH12 ARG 553 HH12 ARG 553 25.560 33.137 -26.164 302 HH21 ARG 553 HH21 ARG 553 23.767 34.275 -28.865 303 HH22 ARG 553 HH22 ARG 553 24.047 34.382 -27.152 304 HA PRO 554 HA PRO 554 19.804 28.500 -28.305 305 HB2 PRO 554 HB2 PRO 554 19.177 30.614 -26.701 306 HB3 PRO 554 HB3 PRO 554 19.885 29.100 -26.062 307 HG2 PRO 554 HG2 PRO 554 21.336 31.671 -26.774 308 HG3 PRO 554 HG3 PRO 554 21.451 30.723 -25.255 309 HD2 PRO 554 HD2 PRO 554 23.255 30.444 -27.276 310 HD3 PRO 554 HD3 PRO 554 22.738 29.043 -26.292 311 H GLY 555 H GLY 555 18.005 29.857 -29.004 312 HA2 GLY 555 HA2 GLY 555 17.338 32.095 -29.933 313 HA3 GLY 555 HA3 GLY 555 18.732 31.972 -31.012 314 H ALA 556 H ALA 556 18.243 29.025 -31.345 315 HA ALA 556 HA ALA 556 16.459 28.949 -33.591 316 HB1 ALA 556 HB3 ALA 556 16.983 26.543 -33.498 317 HB2 ALA 556 HB1 ALA 556 18.448 27.480 -33.211 318 HB3 ALA 556 HB2 ALA 556 17.603 26.715 -31.844 319 HA PRO 557 HA PRO 557 12.486 28.257 -31.689 320 HB2 PRO 557 HB2 PRO 557 11.310 26.300 -33.246 321 HB3 PRO 557 HB3 PRO 557 11.510 28.009 -33.737 322 HG2 PRO 557 HG2 PRO 557 13.290 25.651 -34.413 323 HG3 PRO 557 HG3 PRO 557 12.654 26.913 -35.517 324 HD2 PRO 557 HD2 PRO 557 15.155 27.070 -34.528 325 HD3 PRO 557 HD3 PRO 557 14.154 28.540 -34.664 326 H ASN2319 H ASN2319 34.204 18.045 -33.274 327 HA ASN2319 HA ASN2319 33.839 15.940 -32.221 328 HB2 ASN2319 HB2 ASN2319 32.285 17.550 -30.136 329 HB3 ASN2319 HB3 ASN2319 32.259 15.797 -30.295 330 HD21 ASN2319 2HD2 ASN2319 33.202 15.372 -28.209 331 HD22 ASN2319 1HD2 ASN2319 34.874 15.791 -27.884 332 H THR2320 H THR2320 32.710 15.171 -33.927 333 HA THR2320 HA THR2320 29.813 15.733 -34.105 334 HB THR2320 HB THR2320 30.007 15.833 -36.637 335 HG1 THR2320 HG1 THR2320 32.640 16.705 -36.046 336 HG21 THR2320 HG23 THR2320 30.338 18.224 -36.764 337 HG22 THR2320 HG21 THR2320 29.404 17.822 -35.314 338 HG23 THR2320 HG22 THR2320 31.123 18.252 -35.171 339 H GLY2321 H GLY2321 28.614 14.090 -34.972 340 HA2 GLY2321 HA2 GLY2321 29.242 12.031 -36.646 341 HA3 GLY2321 HA3 GLY2321 29.765 11.406 -35.081 342 H ALA2322 H ALA2322 27.582 10.541 -36.878 343 HA ALA2322 HA ALA2322 25.547 10.023 -34.888 344 HB1 ALA2322 HB3 ALA2322 23.669 11.012 -36.244 345 HB2 ALA2322 HB1 ALA2322 24.761 12.252 -35.607 346 HB3 ALA2322 HB2 ALA2322 24.865 11.768 -37.313 347 H LYS2323 H LYS2323 24.422 8.148 -35.411 348 HA LYS2323 HA LYS2323 24.395 7.144 -38.208 349 HB2 LYS2323 HB2 LYS2323 26.402 6.279 -36.589 350 HB3 LYS2323 HB3 LYS2323 25.137 5.179 -36.062 351 HG2 LYS2323 HG2 LYS2323 26.319 4.039 -37.757 352 HG3 LYS2323 HG3 LYS2323 24.825 4.556 -38.540 353 HD2 LYS2323 HD2 LYS2323 26.133 6.593 -39.412 354 HD3 LYS2323 HD3 LYS2323 27.593 5.821 -38.802 355 HE2 LYS2323 HE2 LYS2323 25.659 4.670 -40.871 356 HE3 LYS2323 HE3 LYS2323 27.195 5.457 -41.234 357 HZ1 LYS2323 HZ3 LYS2323 27.459 3.065 -41.232 358 HZ2 LYS2323 HZ1 LYS2323 28.324 3.675 -39.994 359 HZ3 LYS2323 HZ2 LYS2323 26.898 2.924 -39.709 360 H GLN2324 H GLN2324 22.559 7.744 -35.552 361 HA GLN2324 HA GLN2324 20.357 6.030 -36.513 362 HB2 GLN2324 HB2 GLN2324 21.246 6.202 -33.597 363 HB3 GLN2324 HB3 GLN2324 19.713 5.523 -34.151 364 HG2 GLN2324 HG2 GLN2324 20.990 3.792 -35.450 365 HG3 GLN2324 HG3 GLN2324 22.491 4.441 -34.775 366 HE21 GLN2324 HE22 GLN2324 22.769 2.162 -33.965 367 HE22 GLN2324 HE21 GLN2324 21.948 1.732 -32.475 368 HA PRO2325 HA PRO2325 18.377 9.997 -35.746 369 HB2 PRO2325 HB2 PRO2325 15.724 9.347 -35.821 370 HB3 PRO2325 HB3 PRO2325 16.777 9.393 -37.266 371 HG2 PRO2325 HG2 PRO2325 15.952 6.974 -35.641 372 HG3 PRO2325 HG3 PRO2325 15.981 7.162 -37.420 373 HD2 PRO2325 HD2 PRO2325 18.003 5.946 -36.009 374 HD3 PRO2325 HD3 PRO2325 18.304 6.872 -37.510 375 HA PRO2326 HA PRO2326 17.776 9.439 -31.235 376 HB2 PRO2326 HB2 PRO2326 17.953 12.036 -30.435 377 HB3 PRO2326 HB3 PRO2326 19.373 11.074 -30.938 378 HG2 PRO2326 HG2 PRO2326 17.766 13.011 -32.633 379 HG3 PRO2326 HG3 PRO2326 19.536 12.959 -32.424 380 HD2 PRO2326 HD2 PRO2326 18.267 11.799 -34.538 381 HD3 PRO2326 HD3 PRO2326 19.712 11.044 -33.799 382 H SER2327 H SER2327 15.815 9.034 -30.449 383 HA SER2327 HA SER2327 13.542 10.931 -30.738 384 HB2 SER2327 HB2 SER2327 13.456 8.031 -31.671 385 HB3 SER2327 HB3 SER2327 12.052 9.099 -31.483 386 HG SER2327 HG SER2327 12.747 9.077 -33.635 387 H TYR2328 H TYR2328 13.587 11.283 -28.515 388 HA TYR2328 HA TYR2328 13.232 8.985 -26.666 389 HB2 TYR2328 HB2 TYR2328 14.822 10.814 -26.160 390 HB3 TYR2328 HB3 TYR2328 13.496 11.959 -26.120 391 HD1 TYR2328 HD1 TYR2328 14.887 8.884 -24.507 392 HD2 TYR2328 HD2 TYR2328 12.218 12.249 -24.081 393 HE1 TYR2328 HE1 TYR2328 14.583 8.351 -22.088 394 HE2 TYR2328 HE2 TYR2328 11.897 11.698 -21.684 395 HH TYR2328 HH TYR2328 12.449 10.294 -19.961 396 H GLU2329 H GLU2329 11.544 12.047 -26.151 397 HA GLU2329 HA GLU2329 8.957 10.922 -25.718 398 HB2 GLU2329 HB2 GLU2329 10.047 13.673 -26.260 399 HB3 GLU2329 HB3 GLU2329 8.306 13.436 -26.298 400 HG2 GLU2329 HG2 GLU2329 9.892 12.459 -23.909 401 HG3 GLU2329 HG3 GLU2329 9.509 14.165 -24.094 402 H ASP2330 H ASP2330 10.517 12.011 -28.695 403 HA ASP2330 HA ASP2330 8.240 11.998 -30.409 404 HB2 ASP2330 HB2 ASP2330 10.616 12.926 -30.769 405 HB3 ASP2330 HB3 ASP2330 11.086 11.286 -31.202 406 H CYS2331 H CYS2331 10.013 9.307 -29.031 407 HA CYS2331 HA CYS2331 8.809 7.350 -30.944 408 HB2 CYS2331 HB2 CYS2331 11.265 7.291 -30.461 409 HB3 CYS2331 HB3 CYS2331 10.900 6.943 -28.764 410 HG CYS2331 HG CYS2331 9.461 4.756 -29.285 411 H ILE2332 H ILE2332 8.862 8.194 -27.443 412 HA ILE2332 HA ILE2332 7.126 5.929 -26.806 413 HB ILE2332 HB ILE2332 7.352 6.538 -24.506 414 HG12 ILE2332 HG12 ILE2332 9.219 8.819 -25.155 415 HG13 ILE2332 HG13 ILE2332 7.488 9.123 -25.011 416 HG21 ILE2332 HG21 ILE2332 9.096 5.190 -25.618 417 HG22 ILE2332 HG22 ILE2332 10.042 6.661 -25.930 418 HG23 ILE2332 HG23 ILE2332 9.743 6.127 -24.268 419 HD11 ILE2332 3HD1 ILE2332 8.641 9.562 -22.896 420 HD12 ILE2332 1HD1 ILE2332 7.494 8.220 -22.718 421 HD13 ILE2332 2HD1 ILE2332 9.241 7.894 -22.840 422 H LYS2333 H LYS2333 5.981 8.117 -28.504 423 HA LYS2333 HA LYS2333 3.481 8.578 -26.946 424 HB2 LYS2333 HB2 LYS2333 3.196 10.744 -27.808 425 HB3 LYS2333 HB3 LYS2333 4.824 10.673 -27.126 426 HG2 LYS2333 HG2 LYS2333 5.700 10.311 -29.484 427 HG3 LYS2333 HG3 LYS2333 4.068 10.579 -30.085 428 HD2 LYS2333 HD2 LYS2333 5.709 12.624 -28.525 429 HD3 LYS2333 HD3 LYS2333 5.528 12.553 -30.272 430 HE2 LYS2333 HE2 LYS2333 3.926 14.101 -29.870 431 HE3 LYS2333 HE3 LYS2333 2.933 12.650 -29.735 432 HZ1 LYS2333 HZ3 LYS2333 2.548 14.174 -27.880 433 HZ2 LYS2333 HZ1 LYS2333 3.212 12.811 -27.294 434 HZ3 LYS2333 HZ2 LYS2333 4.120 14.159 -27.458 Start of MODEL 17 1 H VAL 515 H VAL 515 28.255 3.048 -14.757 2 HA VAL 515 HA VAL 515 29.597 4.308 -13.219 3 HB VAL 515 HB VAL 515 31.304 2.584 -12.925 4 HG11 VAL 515 HG11 VAL 515 31.858 2.040 -15.310 5 HG12 VAL 515 HG12 VAL 515 32.684 3.616 -15.435 6 HG13 VAL 515 HG13 VAL 515 33.258 2.393 -14.299 7 HG21 VAL 515 HG23 VAL 515 33.183 4.100 -12.553 8 HG22 VAL 515 HG21 VAL 515 32.417 5.342 -13.561 9 HG23 VAL 515 HG22 VAL 515 31.656 4.816 -12.036 10 H SER 516 H SER 516 30.624 3.769 -16.639 11 HA SER 516 HA SER 516 31.920 6.011 -17.089 12 HB2 SER 516 HB2 SER 516 30.186 4.702 -19.198 13 HB3 SER 516 HB3 SER 516 31.760 5.495 -19.415 14 HG SER 516 HG SER 516 31.960 3.207 -19.330 15 H LEU 517 H LEU 517 28.414 6.106 -17.111 16 HA LEU 517 HA LEU 517 28.563 9.026 -17.693 17 HB2 LEU 517 HB2 LEU 517 26.618 8.989 -19.063 18 HB3 LEU 517 HB3 LEU 517 27.804 7.912 -19.752 19 HG LEU 517 HG LEU 517 25.924 6.520 -17.917 20 HD11 LEU 517 1HD1 LEU 517 24.358 8.208 -18.775 21 HD12 LEU 517 2HD1 LEU 517 24.785 7.755 -20.440 22 HD13 LEU 517 3HD1 LEU 517 23.979 6.585 -19.374 23 HD21 LEU 517 3HD2 LEU 517 25.761 4.942 -19.771 24 HD22 LEU 517 1HD2 LEU 517 26.598 6.080 -20.850 25 HD23 LEU 517 2HD2 LEU 517 27.461 5.351 -19.477 26 H ILE 518 H ILE 518 28.238 7.233 -15.233 27 HA ILE 518 HA ILE 518 25.747 8.463 -14.094 28 HB ILE 518 HB ILE 518 26.848 5.697 -13.468 29 HG12 ILE 518 HG12 ILE 518 24.335 5.265 -14.551 30 HG13 ILE 518 HG13 ILE 518 24.878 6.602 -15.542 31 HG21 ILE 518 HG21 ILE 518 25.629 6.642 -11.569 32 HG22 ILE 518 HG22 ILE 518 24.262 7.071 -12.625 33 HG23 ILE 518 HG23 ILE 518 24.675 5.371 -12.313 34 HD11 ILE 518 3HD1 ILE 518 25.442 4.470 -16.589 35 HD12 ILE 518 1HD1 ILE 518 26.960 5.235 -16.081 36 HD13 ILE 518 2HD1 ILE 518 26.259 3.913 -15.121 37 H ASN 519 H ASN 519 29.157 7.721 -13.615 38 HA ASN 519 HA ASN 519 29.110 8.876 -10.876 39 HB2 ASN 519 HB2 ASN 519 30.149 6.596 -11.598 40 HB3 ASN 519 HB3 ASN 519 31.456 7.563 -12.285 41 HD21 ASN 519 2HD2 ASN 519 29.620 6.932 -9.260 42 HD22 ASN 519 1HD2 ASN 519 30.983 7.258 -8.200 43 H GLU 520 H GLU 520 29.165 10.238 -13.751 44 HA GLU 520 HA GLU 520 31.550 11.945 -13.672 45 HB2 GLU 520 HB2 GLU 520 29.106 12.013 -15.487 46 HB3 GLU 520 HB3 GLU 520 30.638 12.837 -15.766 47 HG2 GLU 520 HG2 GLU 520 30.177 9.827 -15.777 48 HG3 GLU 520 HG3 GLU 520 30.464 10.862 -17.165 49 H GLY 521 H GLY 521 30.808 14.386 -14.453 50 HA2 GLY 521 HA2 GLY 521 29.928 15.779 -12.107 51 HA3 GLY 521 HA3 GLY 521 30.215 16.466 -13.700 52 HA PRO 522 HA PRO 522 25.655 16.518 -12.416 53 HB2 PRO 522 HB2 PRO 522 25.213 19.228 -12.390 54 HB3 PRO 522 HB3 PRO 522 25.904 18.324 -11.008 55 HG2 PRO 522 HG2 PRO 522 27.396 19.871 -13.149 56 HG3 PRO 522 HG3 PRO 522 27.605 19.963 -11.371 57 HD2 PRO 522 HD2 PRO 522 29.227 18.433 -12.925 58 HD3 PRO 522 HD3 PRO 522 28.714 17.874 -11.304 59 H LEU 523 H LEU 523 23.810 16.888 -13.706 60 HA LEU 523 HA LEU 523 24.364 16.891 -16.541 61 HB2 LEU 523 HB2 LEU 523 22.244 16.051 -16.844 62 HB3 LEU 523 HB3 LEU 523 22.741 15.384 -15.328 63 HG LEU 523 HG LEU 523 21.214 17.887 -14.910 64 HD11 LEU 523 1HD1 LEU 523 20.184 17.225 -17.068 65 HD12 LEU 523 2HD1 LEU 523 19.814 15.626 -16.392 66 HD13 LEU 523 3HD1 LEU 523 19.056 17.086 -15.713 67 HD21 LEU 523 3HD2 LEU 523 19.850 16.455 -13.479 68 HD22 LEU 523 1HD2 LEU 523 20.643 15.004 -14.126 69 HD23 LEU 523 2HD2 LEU 523 21.571 16.177 -13.163 70 HA PRO 524 HA PRO 524 23.435 21.094 -17.616 71 HB2 PRO 524 HB2 PRO 524 22.274 20.874 -20.123 72 HB3 PRO 524 HB3 PRO 524 24.015 20.643 -19.780 73 HG2 PRO 524 HG2 PRO 524 21.864 18.526 -20.012 74 HG3 PRO 524 HG3 PRO 524 23.479 18.547 -20.786 75 HD2 PRO 524 HD2 PRO 524 22.998 17.157 -18.518 76 HD3 PRO 524 HD3 PRO 524 24.544 18.020 -18.737 77 HA PRO 525 HA PRO 525 19.472 22.117 -16.206 78 HB2 PRO 525 HB2 PRO 525 18.974 24.628 -17.191 79 HB3 PRO 525 HB3 PRO 525 20.267 24.265 -16.011 80 HG2 PRO 525 HG2 PRO 525 20.526 24.524 -19.026 81 HG3 PRO 525 HG3 PRO 525 21.532 25.293 -17.758 82 HD2 PRO 525 HD2 PRO 525 22.308 23.010 -19.004 83 HD3 PRO 525 HD3 PRO 525 22.624 23.259 -17.261 84 H GLY 526 H GLY 526 17.673 21.017 -16.756 85 HA2 GLY 526 HA2 GLY 526 15.708 20.456 -17.804 86 HA3 GLY 526 HA3 GLY 526 15.797 22.003 -18.651 87 H TRP 527 H TRP 527 18.229 19.464 -19.005 88 HA TRP 527 HA TRP 527 17.337 18.854 -21.809 89 HB2 TRP 527 HB2 TRP 527 20.021 19.576 -20.644 90 HB3 TRP 527 HB3 TRP 527 19.962 18.456 -21.988 91 HD1 TRP 527 HD1 TRP 527 19.782 22.102 -21.196 92 HE1 TRP 527 HE1 TRP 527 19.700 23.472 -23.361 93 HE3 TRP 527 HE3 TRP 527 19.009 18.295 -24.523 94 HZ2 TRP 527 HZ2 TRP 527 19.391 22.975 -26.188 95 HZ3 TRP 527 HZ3 TRP 527 18.840 18.773 -26.961 96 HH2 TRP 527 HH2 TRP 527 19.043 21.099 -27.801 97 H GLU 528 H GLU 528 17.932 16.790 -22.610 98 HA GLU 528 HA GLU 528 18.779 14.715 -20.636 99 HB2 GLU 528 HB2 GLU 528 16.401 14.436 -20.949 100 HB3 GLU 528 HB3 GLU 528 16.535 14.636 -22.677 101 HG2 GLU 528 HG2 GLU 528 16.113 12.339 -22.206 102 HG3 GLU 528 HG3 GLU 528 17.726 12.480 -22.880 103 H ILE 529 H ILE 529 20.125 13.091 -21.483 104 HA ILE 529 HA ILE 529 21.354 13.580 -24.143 105 HB ILE 529 HB ILE 529 23.137 13.177 -21.727 106 HG12 ILE 529 HG12 ILE 529 23.610 15.765 -22.017 107 HG13 ILE 529 HG13 ILE 529 21.947 15.828 -22.573 108 HG21 ILE 529 HG21 ILE 529 24.015 12.816 -24.016 109 HG22 ILE 529 HG22 ILE 529 23.568 14.482 -24.447 110 HG23 ILE 529 HG23 ILE 529 24.805 14.173 -23.211 111 HD11 ILE 529 3HD1 ILE 529 21.803 16.244 -20.249 112 HD12 ILE 529 1HD1 ILE 529 21.437 14.523 -20.295 113 HD13 ILE 529 2HD1 ILE 529 23.064 15.052 -19.857 114 H ARG 530 H ARG 530 21.850 11.728 -25.162 115 HA ARG 530 HA ARG 530 21.802 9.130 -23.655 116 HB2 ARG 530 HB2 ARG 530 20.190 9.833 -26.144 117 HB3 ARG 530 HB3 ARG 530 20.353 8.212 -25.496 118 HG2 ARG 530 HG2 ARG 530 19.404 10.021 -23.387 119 HG3 ARG 530 HG3 ARG 530 18.418 10.184 -24.829 120 HD2 ARG 530 HD2 ARG 530 17.422 8.527 -23.423 121 HD3 ARG 530 HD3 ARG 530 18.077 7.716 -24.854 122 HE ARG 530 HE ARG 530 19.806 7.817 -22.445 123 HH11 ARG 530 HH11 ARG 530 17.471 5.843 -24.159 124 HH12 ARG 530 HH12 ARG 530 17.983 4.383 -23.359 125 HH21 ARG 530 HH21 ARG 530 20.432 5.903 -21.490 126 HH22 ARG 530 HH22 ARG 530 19.611 4.426 -21.892 127 H TYR 531 H TYR 531 22.550 7.320 -24.876 128 HA TYR 531 HA TYR 531 24.750 7.931 -26.812 129 HB2 TYR 531 HB2 TYR 531 24.886 6.172 -24.329 130 HB3 TYR 531 HB3 TYR 531 26.140 6.331 -25.543 131 HD1 TYR 531 HD1 TYR 531 24.281 8.168 -22.870 132 HD2 TYR 531 HD2 TYR 531 27.761 8.084 -25.421 133 HE1 TYR 531 HE1 TYR 531 25.302 9.997 -21.530 134 HE2 TYR 531 HE2 TYR 531 28.804 9.879 -24.041 135 HH TYR 531 HH TYR 531 27.144 11.310 -21.208 136 H THR 532 H THR 532 24.115 6.916 -28.624 137 HA THR 532 HA THR 532 22.328 4.596 -28.594 138 HB THR 532 HB THR 532 22.540 4.635 -31.032 139 HG1 THR 532 HG1 THR 532 24.317 6.797 -30.610 140 HG21 THR 532 HG23 THR 532 21.586 6.867 -31.454 141 HG22 THR 532 HG21 THR 532 20.881 6.106 -30.020 142 HG23 THR 532 HG22 THR 532 22.084 7.395 -29.834 143 H ALA 533 H ALA 533 22.745 2.554 -29.651 144 HA ALA 533 HA ALA 533 25.102 1.234 -28.815 145 HB1 ALA 533 HB3 ALA 533 24.199 -0.659 -30.093 146 HB2 ALA 533 HB1 ALA 533 22.915 0.152 -29.181 147 HB3 ALA 533 HB2 ALA 533 23.068 0.419 -30.935 148 H ALA 534 H ALA 534 24.676 3.175 -31.665 149 HA ALA 534 HA ALA 534 26.830 2.068 -33.258 150 HB1 ALA 534 HB3 ALA 534 26.580 4.182 -34.503 151 HB2 ALA 534 HB1 ALA 534 25.004 3.427 -34.212 152 HB3 ALA 534 HB2 ALA 534 25.517 4.826 -33.234 153 H GLY 535 H GLY 535 26.904 3.790 -30.288 154 HA2 GLY 535 HA2 GLY 535 28.758 4.526 -29.083 155 HA3 GLY 535 HA3 GLY 535 29.788 4.392 -30.513 156 H GLU 536 H GLU 536 26.710 6.127 -30.608 157 HA GLU 536 HA GLU 536 28.158 8.737 -30.898 158 HB2 GLU 536 HB2 GLU 536 25.690 7.707 -32.336 159 HB3 GLU 536 HB3 GLU 536 26.309 9.344 -32.479 160 HG2 GLU 536 HG2 GLU 536 27.953 6.892 -33.250 161 HG3 GLU 536 HG3 GLU 536 26.817 7.672 -34.335 162 H ARG 537 H ARG 537 27.575 10.329 -29.644 163 HA ARG 537 HA ARG 537 25.346 10.045 -27.713 164 HB2 ARG 537 HB2 ARG 537 27.444 10.581 -26.744 165 HB3 ARG 537 HB3 ARG 537 27.779 11.847 -27.926 166 HG2 ARG 537 HG2 ARG 537 26.196 13.345 -26.957 167 HG3 ARG 537 HG3 ARG 537 25.496 12.080 -25.922 168 HD2 ARG 537 HD2 ARG 537 27.330 12.013 -24.504 169 HD3 ARG 537 HD3 ARG 537 28.442 12.703 -25.693 170 HE ARG 537 HE ARG 537 26.728 14.780 -25.245 171 HH11 ARG 537 HH11 ARG 537 28.432 12.783 -22.906 172 HH12 ARG 537 HH12 ARG 537 28.905 14.157 -21.950 173 HH21 ARG 537 HH21 ARG 537 27.280 16.469 -23.876 174 HH22 ARG 537 HH22 ARG 537 28.232 16.159 -22.457 175 H PHE 538 H PHE 538 23.709 11.459 -27.486 176 HA PHE 538 HA PHE 538 23.274 13.646 -29.472 177 HB2 PHE 538 HB2 PHE 538 21.336 11.379 -28.832 178 HB3 PHE 538 HB3 PHE 538 20.946 12.806 -29.775 179 HD1 PHE 538 HD1 PHE 538 22.847 9.622 -29.768 180 HD2 PHE 538 HD2 PHE 538 21.642 13.050 -32.076 181 HE1 PHE 538 HE1 PHE 538 23.510 8.453 -31.858 182 HE2 PHE 538 HE2 PHE 538 22.263 11.845 -34.173 183 HZ PHE 538 HZ PHE 538 23.205 9.562 -34.054 184 H PHE 539 H PHE 539 21.646 15.140 -28.849 185 HA PHE 539 HA PHE 539 20.983 15.199 -25.928 186 HB2 PHE 539 HB2 PHE 539 21.467 17.506 -27.833 187 HB3 PHE 539 HB3 PHE 539 21.012 17.637 -26.148 188 HD1 PHE 539 HD2 PHE 539 23.773 16.623 -28.440 189 HD2 PHE 539 HD1 PHE 539 22.633 17.585 -24.395 190 HE1 PHE 539 HE2 PHE 539 26.164 16.839 -27.819 191 HE2 PHE 539 HE1 PHE 539 25.022 17.848 -23.785 192 HZ PHE 539 HZ PHE 539 26.795 17.525 -25.520 193 H VAL 540 H VAL 540 18.993 15.866 -25.343 194 HA VAL 540 HA VAL 540 16.775 15.888 -27.361 195 HB VAL 540 HB VAL 540 17.114 14.330 -24.774 196 HG11 VAL 540 HG11 VAL 540 14.794 15.167 -24.861 197 HG12 VAL 540 HG12 VAL 540 14.619 14.528 -26.515 198 HG13 VAL 540 HG13 VAL 540 14.864 13.434 -25.129 199 HG21 VAL 540 HG23 VAL 540 16.825 12.337 -26.071 200 HG22 VAL 540 HG21 VAL 540 16.514 13.261 -27.549 201 HG23 VAL 540 HG22 VAL 540 18.127 13.274 -26.804 202 H ASP 541 H ASP 541 15.677 17.720 -27.207 203 HA ASP 541 HA ASP 541 15.732 19.340 -24.721 204 HB2 ASP 541 HB2 ASP 541 16.301 20.484 -26.808 205 HB3 ASP 541 HB3 ASP 541 14.763 19.996 -27.521 206 H HIS 542 H HIS 542 14.374 17.976 -23.469 207 HA HIS 542 HA HIS 542 11.765 17.121 -24.129 208 HB2 HIS 542 HB2 HIS 542 13.471 17.168 -21.818 209 HB3 HIS 542 HB3 HIS 542 11.937 17.847 -21.321 210 HD2 HIS 542 HD2 HIS 542 12.685 14.812 -23.703 211 HE1 HIS 542 HE1 HIS 542 10.248 13.397 -20.501 212 H ASN 543 H ASN 543 12.755 20.365 -23.585 213 HA ASN 543 HA ASN 543 10.251 21.475 -22.682 214 HB2 ASN 543 HB2 ASN 543 12.544 22.880 -24.112 215 HB3 ASN 543 HB3 ASN 543 11.334 23.611 -23.067 216 HD21 ASN 543 2HD2 ASN 543 14.426 22.154 -23.192 217 HD22 ASN 543 1HD2 ASN 543 14.640 21.855 -21.470 218 H THR 544 H THR 544 11.537 20.807 -25.927 219 HA THR 544 HA THR 544 8.930 21.704 -27.119 220 HB THR 544 HB THR 544 10.034 22.635 -29.027 221 HG1 THR 544 HG1 THR 544 12.514 22.143 -27.740 222 HG21 THR 544 HG23 THR 544 11.125 24.593 -28.143 223 HG22 THR 544 HG21 THR 544 9.744 24.175 -27.113 224 HG23 THR 544 HG22 THR 544 11.398 23.806 -26.575 225 H ARG 545 H ARG 545 10.963 19.134 -26.711 226 HA ARG 545 HA ARG 545 11.097 17.052 -27.488 227 HB2 ARG 545 HB2 ARG 545 8.519 17.559 -28.030 228 HB3 ARG 545 HB3 ARG 545 9.087 17.365 -29.694 229 HG2 ARG 545 HG2 ARG 545 9.975 15.096 -29.074 230 HG3 ARG 545 HG3 ARG 545 9.460 15.388 -27.409 231 HD2 ARG 545 HD2 ARG 545 7.807 13.999 -28.393 232 HD3 ARG 545 HD3 ARG 545 7.078 15.591 -28.230 233 HE ARG 545 HE ARG 545 7.980 14.242 -30.755 234 HH11 ARG 545 HH11 ARG 545 6.352 17.099 -29.489 235 HH12 ARG 545 HH12 ARG 545 5.789 17.528 -31.080 236 HH21 ARG 545 HH21 ARG 545 7.287 14.786 -32.578 237 HH22 ARG 545 HH22 ARG 545 6.312 16.234 -32.848 238 H ARG 546 H ARG 546 12.293 19.569 -28.957 239 HA ARG 546 HA ARG 546 13.329 18.528 -31.467 240 HB2 ARG 546 HB2 ARG 546 14.080 20.800 -29.593 241 HB3 ARG 546 HB3 ARG 546 15.199 20.293 -30.844 242 HG2 ARG 546 HG2 ARG 546 13.388 20.619 -32.566 243 HG3 ARG 546 HG3 ARG 546 12.351 21.272 -31.293 244 HD2 ARG 546 HD2 ARG 546 13.418 23.063 -32.589 245 HD3 ARG 546 HD3 ARG 546 13.950 23.107 -30.902 246 HE ARG 546 HE ARG 546 15.930 21.642 -31.950 247 HH11 ARG 546 HH11 ARG 546 14.631 24.609 -33.415 248 HH12 ARG 546 HH12 ARG 546 16.180 24.953 -34.125 249 HH21 ARG 546 HH21 ARG 546 17.798 22.196 -32.924 250 HH22 ARG 546 HH22 ARG 546 17.906 23.668 -33.838 251 H THR 547 H THR 547 15.575 18.099 -31.881 252 HA THR 547 HA THR 547 17.219 16.934 -29.711 253 HB THR 547 HB THR 547 17.807 15.010 -31.249 254 HG1 THR 547 HG1 THR 547 15.313 15.593 -32.453 255 HG21 THR 547 HG23 THR 547 15.888 13.606 -30.659 256 HG22 THR 547 HG21 THR 547 16.405 14.624 -29.305 257 HG23 THR 547 HG22 THR 547 14.941 15.041 -30.219 258 H THR 548 H THR 548 19.472 16.633 -30.354 259 HA THR 548 HA THR 548 20.407 17.627 -32.919 260 HB THR 548 HB THR 548 20.053 19.790 -31.927 261 HG1 THR 548 HG1 THR 548 21.812 20.147 -32.944 262 HG21 THR 548 HG23 THR 548 21.288 20.536 -29.911 263 HG22 THR 548 HG21 THR 548 20.042 19.332 -29.549 264 HG23 THR 548 HG22 THR 548 21.748 18.849 -29.602 265 H PHE 549 H PHE 549 22.705 17.441 -33.187 266 HA PHE 549 HA PHE 549 23.782 15.016 -31.961 267 HB2 PHE 549 HB2 PHE 549 25.170 16.908 -33.882 268 HB3 PHE 549 HB3 PHE 549 25.444 15.185 -33.672 269 HD1 PHE 549 HD2 PHE 549 22.736 14.041 -33.849 270 HD2 PHE 549 HD1 PHE 549 24.489 17.249 -36.109 271 HE1 PHE 549 HE2 PHE 549 21.154 13.579 -35.713 272 HE2 PHE 549 HE1 PHE 549 22.928 16.782 -37.983 273 HZ PHE 549 HZ PHE 549 21.255 14.951 -37.787 274 H GLU 550 H GLU 550 24.133 18.425 -31.434 275 HA GLU 550 HA GLU 550 26.558 18.124 -29.726 276 HB2 GLU 550 HB2 GLU 550 27.666 19.914 -30.915 277 HB3 GLU 550 HB3 GLU 550 27.266 18.599 -32.007 278 HG2 GLU 550 HG2 GLU 550 25.202 19.968 -32.718 279 HG3 GLU 550 HG3 GLU 550 25.917 21.313 -31.822 280 H ASP 551 H ASP 551 26.981 20.828 -29.162 281 HA ASP 551 HA ASP 551 24.445 21.618 -27.770 282 HB2 ASP 551 HB2 ASP 551 26.039 20.610 -26.244 283 HB3 ASP 551 HB3 ASP 551 27.278 21.769 -26.729 284 HA PRO 552 HA PRO 552 25.781 25.116 -30.529 285 HB2 PRO 552 HB2 PRO 552 23.439 25.576 -31.834 286 HB3 PRO 552 HB3 PRO 552 24.513 24.212 -32.262 287 HG2 PRO 552 HG2 PRO 552 22.067 24.151 -30.462 288 HG3 PRO 552 HG3 PRO 552 22.447 23.076 -31.847 289 HD2 PRO 552 HD2 PRO 552 23.011 22.388 -29.264 290 HD3 PRO 552 HD3 PRO 552 24.063 21.911 -30.628 291 H ARG 553 H ARG 553 24.688 27.344 -30.773 292 HA ARG 553 HA ARG 553 24.287 28.610 -28.274 293 HB2 ARG 553 HB2 ARG 553 23.767 29.402 -31.157 294 HB3 ARG 553 HB3 ARG 553 23.255 30.468 -29.848 295 HG2 ARG 553 HG2 ARG 553 25.502 30.612 -28.950 296 HG3 ARG 553 HG3 ARG 553 26.121 29.461 -30.141 297 HD2 ARG 553 HD2 ARG 553 24.784 32.091 -30.899 298 HD3 ARG 553 HD3 ARG 553 26.523 31.950 -30.597 299 HE ARG 553 HE ARG 553 26.134 29.974 -32.432 300 HH11 ARG 553 HH11 ARG 553 25.295 33.375 -32.539 301 HH12 ARG 553 HH12 ARG 553 25.500 33.461 -34.268 302 HH21 ARG 553 HH21 ARG 553 26.389 30.157 -34.625 303 HH22 ARG 553 HH22 ARG 553 26.110 31.684 -35.410 304 HA PRO 554 HA PRO 554 20.117 27.821 -27.183 305 HB2 PRO 554 HB2 PRO 554 19.467 29.963 -25.603 306 HB3 PRO 554 HB3 PRO 554 20.673 28.728 -25.131 307 HG2 PRO 554 HG2 PRO 554 21.188 31.431 -26.413 308 HG3 PRO 554 HG3 PRO 554 21.973 30.729 -24.960 309 HD2 PRO 554 HD2 PRO 554 23.123 30.579 -27.418 310 HD3 PRO 554 HD3 PRO 554 23.238 29.219 -26.261 311 H GLY 555 H GLY 555 17.923 28.441 -27.428 312 HA2 GLY 555 HA2 GLY 555 16.501 30.495 -28.143 313 HA3 GLY 555 HA3 GLY 555 17.334 30.302 -29.690 314 H ALA 556 H ALA 556 17.393 27.422 -29.626 315 HA ALA 556 HA ALA 556 16.233 25.808 -30.754 316 HB1 ALA 556 HB3 ALA 556 14.812 24.587 -29.184 317 HB2 ALA 556 HB1 ALA 556 16.252 25.234 -28.381 318 HB3 ALA 556 HB2 ALA 556 14.678 26.031 -28.157 319 HA PRO 557 HA PRO 557 12.653 28.434 -32.359 320 HB2 PRO 557 HB2 PRO 557 13.456 28.650 -34.981 321 HB3 PRO 557 HB3 PRO 557 13.954 29.775 -33.682 322 HG2 PRO 557 HG2 PRO 557 15.474 27.384 -34.760 323 HG3 PRO 557 HG3 PRO 557 16.082 29.047 -34.474 324 HD2 PRO 557 HD2 PRO 557 16.483 27.071 -32.661 325 HD3 PRO 557 HD3 PRO 557 16.108 28.738 -32.138 326 H ASN2319 H ASN2319 29.914 18.075 -38.442 327 HA ASN2319 HA ASN2319 28.687 19.013 -35.934 328 HB2 ASN2319 HB2 ASN2319 27.820 16.667 -37.694 329 HB3 ASN2319 HB3 ASN2319 27.089 17.154 -36.166 330 HD21 ASN2319 2HD2 ASN2319 26.339 19.626 -36.148 331 HD22 ASN2319 1HD2 ASN2319 25.479 20.089 -37.618 332 H THR2320 H THR2320 28.623 17.300 -34.238 333 HA THR2320 HA THR2320 31.161 16.106 -33.657 334 HB THR2320 HB THR2320 29.700 14.856 -31.917 335 HG1 THR2320 HG1 THR2320 27.604 15.728 -31.739 336 HG21 THR2320 HG23 THR2320 29.301 16.902 -30.583 337 HG22 THR2320 HG21 THR2320 30.904 16.919 -31.337 338 HG23 THR2320 HG22 THR2320 29.597 17.906 -32.022 339 H GLY2321 H GLY2321 28.102 14.651 -34.786 340 HA2 GLY2321 HA2 GLY2321 28.709 12.967 -36.732 341 HA3 GLY2321 HA3 GLY2321 29.416 12.049 -35.402 342 H ALA2322 H ALA2322 27.318 11.114 -37.054 343 HA ALA2322 HA ALA2322 25.434 10.266 -35.013 344 HB1 ALA2322 HB3 ALA2322 23.402 10.976 -36.285 345 HB2 ALA2322 HB1 ALA2322 24.346 12.370 -35.731 346 HB3 ALA2322 HB2 ALA2322 24.434 11.858 -37.429 347 H LYS2323 H LYS2323 24.470 8.314 -35.522 348 HA LYS2323 HA LYS2323 24.516 7.285 -38.307 349 HB2 LYS2323 HB2 LYS2323 26.556 6.529 -36.709 350 HB3 LYS2323 HB3 LYS2323 25.344 5.407 -36.105 351 HG2 LYS2323 HG2 LYS2323 26.500 4.223 -37.785 352 HG3 LYS2323 HG3 LYS2323 24.993 4.698 -38.569 353 HD2 LYS2323 HD2 LYS2323 26.336 6.768 -39.442 354 HD3 LYS2323 HD3 LYS2323 27.773 5.887 -38.932 355 HE2 LYS2323 HE2 LYS2323 25.661 4.954 -40.935 356 HE3 LYS2323 HE3 LYS2323 27.256 5.592 -41.336 357 HZ1 LYS2323 HZ3 LYS2323 27.268 3.184 -41.400 358 HZ2 LYS2323 HZ1 LYS2323 28.237 3.670 -40.182 359 HZ3 LYS2323 HZ2 LYS2323 26.751 3.063 -39.860 360 H GLN2324 H GLN2324 22.650 7.853 -35.670 361 HA GLN2324 HA GLN2324 20.497 6.091 -36.639 362 HB2 GLN2324 HB2 GLN2324 21.334 6.301 -33.708 363 HB3 GLN2324 HB3 GLN2324 19.823 5.592 -34.285 364 HG2 GLN2324 HG2 GLN2324 21.146 3.869 -35.543 365 HG3 GLN2324 HG3 GLN2324 22.626 4.548 -34.857 366 HE21 GLN2324 HE22 GLN2324 22.920 2.278 -34.020 367 HE22 GLN2324 HE21 GLN2324 22.073 1.847 -32.541 368 HA PRO2325 HA PRO2325 18.433 10.022 -35.925 369 HB2 PRO2325 HB2 PRO2325 15.792 9.316 -35.964 370 HB3 PRO2325 HB3 PRO2325 16.830 9.352 -37.420 371 HG2 PRO2325 HG2 PRO2325 16.071 6.952 -35.734 372 HG3 PRO2325 HG3 PRO2325 16.078 7.103 -37.517 373 HD2 PRO2325 HD2 PRO2325 18.137 5.959 -36.101 374 HD3 PRO2325 HD3 PRO2325 18.406 6.858 -37.624 375 HA PRO2326 HA PRO2326 17.826 9.575 -31.396 376 HB2 PRO2326 HB2 PRO2326 17.847 12.201 -30.684 377 HB3 PRO2326 HB3 PRO2326 19.328 11.308 -31.131 378 HG2 PRO2326 HG2 PRO2326 17.644 13.101 -32.909 379 HG3 PRO2326 HG3 PRO2326 19.415 13.144 -32.681 380 HD2 PRO2326 HD2 PRO2326 18.225 11.851 -34.770 381 HD3 PRO2326 HD3 PRO2326 19.707 11.204 -34.001 382 H SER2327 H SER2327 15.884 9.204 -30.512 383 HA SER2327 HA SER2327 13.580 11.007 -30.782 384 HB2 SER2327 HB2 SER2327 13.549 8.222 -32.017 385 HB3 SER2327 HB3 SER2327 12.087 9.134 -31.596 386 HG SER2327 HG SER2327 13.982 10.492 -33.107 387 H TYR2328 H TYR2328 13.747 11.180 -28.553 388 HA TYR2328 HA TYR2328 13.448 8.742 -26.881 389 HB2 TYR2328 HB2 TYR2328 15.151 10.452 -26.359 390 HB3 TYR2328 HB3 TYR2328 13.895 11.652 -26.149 391 HD1 TYR2328 HD1 TYR2328 14.759 8.179 -24.933 392 HD2 TYR2328 HD2 TYR2328 13.340 12.122 -23.902 393 HE1 TYR2328 HE1 TYR2328 14.713 7.536 -22.529 394 HE2 TYR2328 HE2 TYR2328 13.303 11.473 -21.494 395 HH TYR2328 HH TYR2328 14.280 8.214 -20.383 396 H GLU2329 H GLU2329 11.905 11.853 -26.099 397 HA GLU2329 HA GLU2329 9.365 10.709 -25.512 398 HB2 GLU2329 HB2 GLU2329 10.600 13.252 -25.309 399 HB3 GLU2329 HB3 GLU2329 9.165 13.509 -26.281 400 HG2 GLU2329 HG2 GLU2329 9.186 12.087 -23.589 401 HG3 GLU2329 HG3 GLU2329 8.894 13.810 -23.794 402 H ASP2330 H ASP2330 10.655 11.949 -28.562 403 HA ASP2330 HA ASP2330 8.172 11.985 -30.005 404 HB2 ASP2330 HB2 ASP2330 10.374 13.161 -30.567 405 HB3 ASP2330 HB3 ASP2330 10.949 11.608 -31.177 406 H CYS2331 H CYS2331 10.025 9.299 -28.924 407 HA CYS2331 HA CYS2331 8.808 7.449 -30.940 408 HB2 CYS2331 HB2 CYS2331 11.261 7.329 -30.554 409 HB3 CYS2331 HB3 CYS2331 10.969 6.964 -28.847 410 HG CYS2331 HG CYS2331 9.978 5.288 -31.551 411 H ILE2332 H ILE2332 8.980 8.085 -27.403 412 HA ILE2332 HA ILE2332 7.138 5.882 -26.839 413 HB ILE2332 HB ILE2332 7.450 6.386 -24.512 414 HG12 ILE2332 HG12 ILE2332 9.479 8.535 -25.117 415 HG13 ILE2332 HG13 ILE2332 7.782 8.981 -24.956 416 HG21 ILE2332 HG21 ILE2332 9.066 4.962 -25.728 417 HG22 ILE2332 HG22 ILE2332 10.106 6.374 -26.007 418 HG23 ILE2332 HG23 ILE2332 9.811 5.796 -24.358 419 HD11 ILE2332 3HD1 ILE2332 8.972 9.257 -22.834 420 HD12 ILE2332 1HD1 ILE2332 7.719 8.008 -22.691 421 HD13 ILE2332 2HD1 ILE2332 9.431 7.543 -22.833 422 H LYS2333 H LYS2333 5.986 7.979 -28.465 423 HA LYS2333 HA LYS2333 3.630 8.711 -26.790 424 HB2 LYS2333 HB2 LYS2333 3.437 10.857 -27.799 425 HB3 LYS2333 HB3 LYS2333 5.042 10.714 -27.087 426 HG2 LYS2333 HG2 LYS2333 5.998 10.260 -29.347 427 HG3 LYS2333 HG3 LYS2333 4.400 10.430 -30.067 428 HD2 LYS2333 HD2 LYS2333 5.818 12.612 -28.486 429 HD3 LYS2333 HD3 LYS2333 5.880 12.475 -30.241 430 HE2 LYS2333 HE2 LYS2333 3.302 12.834 -28.648 431 HE3 LYS2333 HE3 LYS2333 4.233 14.163 -29.335 432 HZ1 LYS2333 HZ3 LYS2333 2.452 13.501 -30.828 433 HZ2 LYS2333 HZ1 LYS2333 3.884 13.202 -31.546 434 HZ3 LYS2333 HZ2 LYS2333 3.005 11.972 -30.923 Start of MODEL 18 1 H VAL 515 H VAL 515 27.114 4.386 -16.746 2 HA VAL 515 HA VAL 515 26.568 6.748 -16.704 3 HB VAL 515 HB VAL 515 24.353 5.885 -14.814 4 HG11 VAL 515 HG11 VAL 515 25.380 7.965 -13.926 5 HG12 VAL 515 HG12 VAL 515 25.280 8.704 -15.541 6 HG13 VAL 515 HG13 VAL 515 23.810 8.296 -14.646 7 HG21 VAL 515 HG23 VAL 515 22.935 7.102 -16.473 8 HG22 VAL 515 HG21 VAL 515 24.363 7.382 -17.490 9 HG23 VAL 515 HG22 VAL 515 23.749 5.729 -17.222 10 H SER 516 H SER 516 26.368 4.795 -13.663 11 HA SER 516 HA SER 516 27.159 6.654 -11.921 12 HB2 SER 516 HB2 SER 516 27.940 3.723 -11.753 13 HB3 SER 516 HB3 SER 516 27.566 4.790 -10.391 14 HG SER 516 HG SER 516 25.872 3.402 -10.835 15 H LEU 517 H LEU 517 29.662 4.962 -13.830 16 HA LEU 517 HA LEU 517 31.683 6.797 -12.601 17 HB2 LEU 517 HB2 LEU 517 33.343 5.129 -12.523 18 HB3 LEU 517 HB3 LEU 517 31.953 4.537 -11.647 19 HG LEU 517 HG LEU 517 31.968 3.704 -14.512 20 HD11 LEU 517 1HD1 LEU 517 34.386 3.695 -14.127 21 HD12 LEU 517 2HD1 LEU 517 34.164 2.709 -12.658 22 HD13 LEU 517 3HD1 LEU 517 33.754 2.041 -14.261 23 HD21 LEU 517 3HD2 LEU 517 31.462 1.513 -13.561 24 HD22 LEU 517 1HD2 LEU 517 31.839 2.100 -11.925 25 HD23 LEU 517 2HD2 LEU 517 30.432 2.742 -12.803 26 H ILE 518 H ILE 518 30.052 6.763 -15.155 27 HA ILE 518 HA ILE 518 32.263 7.105 -17.141 28 HB ILE 518 HB ILE 518 29.476 6.065 -17.699 29 HG12 ILE 518 HG12 ILE 518 31.169 4.013 -18.410 30 HG13 ILE 518 HG13 ILE 518 31.995 4.622 -17.019 31 HG21 ILE 518 HG21 ILE 518 30.386 7.227 -19.641 32 HG22 ILE 518 HG22 ILE 518 31.909 6.315 -19.492 33 HG23 ILE 518 HG23 ILE 518 30.396 5.491 -19.932 34 HD11 ILE 518 3HD1 ILE 518 29.116 3.649 -17.186 35 HD12 ILE 518 1HD1 ILE 518 30.477 2.819 -16.385 36 HD13 ILE 518 2HD1 ILE 518 29.834 4.337 -15.705 37 H ASN 519 H ASN 519 29.506 8.546 -15.603 38 HA ASN 519 HA ASN 519 29.585 10.861 -17.483 39 HB2 ASN 519 HB2 ASN 519 27.586 9.027 -17.362 40 HB3 ASN 519 HB3 ASN 519 27.015 10.130 -16.123 41 HD21 ASN 519 2HD2 ASN 519 26.950 9.466 -19.389 42 HD22 ASN 519 1HD2 ASN 519 26.667 11.070 -20.023 43 H GLU 520 H GLU 520 31.297 11.075 -15.541 44 HA GLU 520 HA GLU 520 30.517 11.957 -12.979 45 HB2 GLU 520 HB2 GLU 520 32.953 12.781 -14.621 46 HB3 GLU 520 HB3 GLU 520 32.760 12.982 -12.871 47 HG2 GLU 520 HG2 GLU 520 32.539 10.489 -12.639 48 HG3 GLU 520 HG3 GLU 520 32.871 10.327 -14.367 49 H GLY 521 H GLY 521 30.187 13.932 -12.005 50 HA2 GLY 521 HA2 GLY 521 29.975 16.263 -11.811 51 HA3 GLY 521 HA3 GLY 521 30.085 16.452 -13.556 52 HA PRO 522 HA PRO 522 25.562 16.763 -12.179 53 HB2 PRO 522 HB2 PRO 522 25.118 19.430 -12.519 54 HB3 PRO 522 HB3 PRO 522 25.859 18.764 -11.034 55 HG2 PRO 522 HG2 PRO 522 27.272 19.972 -13.434 56 HG3 PRO 522 HG3 PRO 522 27.517 20.355 -11.700 57 HD2 PRO 522 HD2 PRO 522 29.117 18.596 -13.053 58 HD3 PRO 522 HD3 PRO 522 28.703 18.356 -11.330 59 H LEU 523 H LEU 523 23.709 17.321 -13.577 60 HA LEU 523 HA LEU 523 24.387 17.007 -16.436 61 HB2 LEU 523 HB2 LEU 523 22.346 16.006 -16.748 62 HB3 LEU 523 HB3 LEU 523 22.858 15.425 -15.200 63 HG LEU 523 HG LEU 523 21.183 17.815 -14.828 64 HD11 LEU 523 1HD1 LEU 523 20.259 17.163 -17.043 65 HD12 LEU 523 2HD1 LEU 523 19.922 15.539 -16.411 66 HD13 LEU 523 3HD1 LEU 523 19.088 16.957 -15.732 67 HD21 LEU 523 3HD2 LEU 523 19.828 16.298 -13.480 68 HD22 LEU 523 1HD2 LEU 523 20.703 14.894 -14.133 69 HD23 LEU 523 2HD2 LEU 523 21.548 16.081 -13.112 70 HA PRO 524 HA PRO 524 23.286 21.117 -17.595 71 HB2 PRO 524 HB2 PRO 524 22.182 20.827 -20.121 72 HB3 PRO 524 HB3 PRO 524 23.922 20.662 -19.739 73 HG2 PRO 524 HG2 PRO 524 21.855 18.465 -19.992 74 HG3 PRO 524 HG3 PRO 524 23.489 18.536 -20.724 75 HD2 PRO 524 HD2 PRO 524 22.993 17.158 -18.448 76 HD3 PRO 524 HD3 PRO 524 24.518 18.066 -18.645 77 HA PRO 525 HA PRO 525 19.283 22.018 -16.241 78 HB2 PRO 525 HB2 PRO 525 18.736 24.524 -17.214 79 HB3 PRO 525 HB3 PRO 525 20.023 24.184 -16.020 80 HG2 PRO 525 HG2 PRO 525 20.313 24.470 -19.030 81 HG3 PRO 525 HG3 PRO 525 21.284 25.255 -17.745 82 HD2 PRO 525 HD2 PRO 525 22.132 22.999 -18.995 83 HD3 PRO 525 HD3 PRO 525 22.418 23.245 -17.247 84 H GLY 526 H GLY 526 17.521 20.874 -16.824 85 HA2 GLY 526 HA2 GLY 526 15.572 20.291 -17.892 86 HA3 GLY 526 HA3 GLY 526 15.662 21.821 -18.772 87 H TRP 527 H TRP 527 18.204 19.423 -19.063 88 HA TRP 527 HA TRP 527 17.346 18.669 -21.849 89 HB2 TRP 527 HB2 TRP 527 20.014 19.462 -20.654 90 HB3 TRP 527 HB3 TRP 527 19.968 18.360 -22.021 91 HD1 TRP 527 HD1 TRP 527 19.723 21.989 -21.156 92 HE1 TRP 527 HE1 TRP 527 19.677 23.399 -23.296 93 HE3 TRP 527 HE3 TRP 527 19.095 18.241 -24.564 94 HZ2 TRP 527 HZ2 TRP 527 19.381 22.955 -26.143 95 HZ3 TRP 527 HZ3 TRP 527 18.949 18.749 -26.997 96 HH2 TRP 527 HH2 TRP 527 19.094 21.099 -27.792 97 H GLU 528 H GLU 528 18.088 16.621 -22.579 98 HA GLU 528 HA GLU 528 19.019 14.640 -20.562 99 HB2 GLU 528 HB2 GLU 528 16.678 14.243 -20.768 100 HB3 GLU 528 HB3 GLU 528 16.708 14.403 -22.505 101 HG2 GLU 528 HG2 GLU 528 16.402 12.112 -22.012 102 HG3 GLU 528 HG3 GLU 528 18.027 12.264 -22.647 103 H ILE 529 H ILE 529 20.273 12.927 -21.460 104 HA ILE 529 HA ILE 529 21.567 13.488 -24.076 105 HB ILE 529 HB ILE 529 23.269 13.047 -21.615 106 HG12 ILE 529 HG12 ILE 529 23.808 15.625 -21.976 107 HG13 ILE 529 HG13 ILE 529 22.165 15.687 -22.564 108 HG21 ILE 529 HG21 ILE 529 24.225 12.603 -23.865 109 HG22 ILE 529 HG22 ILE 529 23.845 14.281 -24.339 110 HG23 ILE 529 HG23 ILE 529 25.026 13.948 -23.039 111 HD11 ILE 529 3HD1 ILE 529 21.963 16.188 -20.272 112 HD12 ILE 529 1HD1 ILE 529 21.593 14.463 -20.258 113 HD13 ILE 529 2HD1 ILE 529 23.215 15.009 -19.804 114 H ARG 530 H ARG 530 21.965 11.667 -25.159 115 HA ARG 530 HA ARG 530 21.875 9.021 -23.733 116 HB2 ARG 530 HB2 ARG 530 20.273 9.847 -26.192 117 HB3 ARG 530 HB3 ARG 530 20.364 8.206 -25.569 118 HG2 ARG 530 HG2 ARG 530 19.463 10.152 -23.499 119 HG3 ARG 530 HG3 ARG 530 18.456 10.143 -24.934 120 HD2 ARG 530 HD2 ARG 530 17.519 8.615 -23.372 121 HD3 ARG 530 HD3 ARG 530 18.179 7.681 -24.724 122 HE ARG 530 HE ARG 530 20.074 7.948 -22.527 123 HH11 ARG 530 HH11 ARG 530 17.218 6.119 -23.411 124 HH12 ARG 530 HH12 ARG 530 17.642 4.781 -22.378 125 HH21 ARG 530 HH21 ARG 530 20.578 6.170 -21.260 126 HH22 ARG 530 HH22 ARG 530 19.488 4.818 -21.204 127 H TYR 531 H TYR 531 22.616 7.247 -24.997 128 HA TYR 531 HA TYR 531 24.902 7.939 -26.806 129 HB2 TYR 531 HB2 TYR 531 24.920 6.179 -24.316 130 HB3 TYR 531 HB3 TYR 531 26.247 6.348 -25.459 131 HD1 TYR 531 HD2 TYR 531 24.187 8.200 -22.937 132 HD2 TYR 531 HD1 TYR 531 27.818 8.141 -25.271 133 HE1 TYR 531 HE2 TYR 531 25.022 10.180 -21.686 134 HE2 TYR 531 HE1 TYR 531 28.692 10.058 -23.950 135 HH TYR 531 HH TYR 531 28.268 11.576 -22.272 136 H THR 532 H THR 532 24.158 7.071 -28.659 137 HA THR 532 HA THR 532 22.477 4.719 -28.796 138 HB THR 532 HB THR 532 22.748 4.883 -31.222 139 HG1 THR 532 HG1 THR 532 24.498 7.038 -30.677 140 HG21 THR 532 HG23 THR 532 21.817 7.150 -31.560 141 HG22 THR 532 HG21 THR 532 21.058 6.303 -30.195 142 HG23 THR 532 HG22 THR 532 22.259 7.580 -29.890 143 H ALA 533 H ALA 533 22.908 2.684 -29.793 144 HA ALA 533 HA ALA 533 25.303 1.431 -28.943 145 HB1 ALA 533 HB3 ALA 533 24.411 -0.540 -30.100 146 HB2 ALA 533 HB1 ALA 533 23.128 0.298 -29.195 147 HB3 ALA 533 HB2 ALA 533 23.232 0.476 -30.975 148 H ALA 534 H ALA 534 24.803 3.257 -31.841 149 HA ALA 534 HA ALA 534 26.945 2.176 -33.450 150 HB1 ALA 534 HB3 ALA 534 26.696 4.318 -34.651 151 HB2 ALA 534 HB1 ALA 534 25.123 3.576 -34.350 152 HB3 ALA 534 HB2 ALA 534 25.666 4.940 -33.359 153 H GLY 535 H GLY 535 27.029 3.872 -30.462 154 HA2 GLY 535 HA2 GLY 535 28.933 4.422 -29.219 155 HA3 GLY 535 HA3 GLY 535 29.940 4.390 -30.668 156 H GLU 536 H GLU 536 26.876 6.182 -30.505 157 HA GLU 536 HA GLU 536 28.396 8.759 -30.726 158 HB2 GLU 536 HB2 GLU 536 26.046 7.842 -32.420 159 HB3 GLU 536 HB3 GLU 536 26.839 9.425 -32.490 160 HG2 GLU 536 HG2 GLU 536 28.986 8.307 -33.097 161 HG3 GLU 536 HG3 GLU 536 28.161 6.744 -33.120 162 H ARG 537 H ARG 537 27.799 10.302 -29.486 163 HA ARG 537 HA ARG 537 25.540 10.091 -27.626 164 HB2 ARG 537 HB2 ARG 537 27.723 10.691 -26.806 165 HB3 ARG 537 HB3 ARG 537 27.886 11.984 -27.992 166 HG2 ARG 537 HG2 ARG 537 26.165 13.314 -26.875 167 HG3 ARG 537 HG3 ARG 537 25.856 11.993 -25.715 168 HD2 ARG 537 HD2 ARG 537 28.125 12.148 -24.855 169 HD3 ARG 537 HD3 ARG 537 28.594 13.295 -26.132 170 HE ARG 537 HE ARG 537 26.494 14.560 -24.807 171 HH11 ARG 537 HH11 ARG 537 29.678 13.413 -23.865 172 HH12 ARG 537 HH12 ARG 537 29.824 14.586 -22.589 173 HH21 ARG 537 HH21 ARG 537 26.764 16.053 -23.156 174 HH22 ARG 537 HH22 ARG 537 28.233 16.059 -22.232 175 H PHE 538 H PHE 538 23.817 11.421 -27.491 176 HA PHE 538 HA PHE 538 23.498 13.747 -29.322 177 HB2 PHE 538 HB2 PHE 538 21.487 11.476 -29.022 178 HB3 PHE 538 HB3 PHE 538 21.164 13.005 -29.818 179 HD1 PHE 538 HD2 PHE 538 22.914 9.772 -30.103 180 HD2 PHE 538 HD1 PHE 538 22.061 13.530 -32.034 181 HE1 PHE 538 HE2 PHE 538 23.610 8.808 -32.287 182 HE2 PHE 538 HE1 PHE 538 22.747 12.561 -34.219 183 HZ PHE 538 HZ PHE 538 23.495 10.191 -34.340 184 H PHE 539 H PHE 539 21.712 15.112 -28.700 185 HA PHE 539 HA PHE 539 21.038 15.040 -25.784 186 HB2 PHE 539 HB2 PHE 539 21.521 17.451 -27.560 187 HB3 PHE 539 HB3 PHE 539 21.095 17.481 -25.864 188 HD1 PHE 539 HD1 PHE 539 23.817 16.542 -28.256 189 HD2 PHE 539 HD2 PHE 539 22.756 17.444 -24.173 190 HE1 PHE 539 HE1 PHE 539 26.219 16.691 -27.666 191 HE2 PHE 539 HE2 PHE 539 25.157 17.649 -23.596 192 HZ PHE 539 HZ PHE 539 26.904 17.267 -25.347 193 H VAL 540 H VAL 540 19.050 15.849 -25.202 194 HA VAL 540 HA VAL 540 16.858 15.891 -27.235 195 HB VAL 540 HB VAL 540 17.065 14.329 -24.645 196 HG11 VAL 540 HG11 VAL 540 14.734 15.102 -25.065 197 HG12 VAL 540 HG12 VAL 540 14.790 14.314 -26.664 198 HG13 VAL 540 HG13 VAL 540 14.915 13.357 -25.159 199 HG21 VAL 540 HG23 VAL 540 16.901 12.289 -25.989 200 HG22 VAL 540 HG21 VAL 540 16.965 13.260 -27.484 201 HG23 VAL 540 HG22 VAL 540 18.362 13.202 -26.379 202 H ASP 541 H ASP 541 15.475 17.535 -26.969 203 HA ASP 541 HA ASP 541 15.544 19.109 -24.425 204 HB2 ASP 541 HB2 ASP 541 16.317 20.341 -26.366 205 HB3 ASP 541 HB3 ASP 541 14.851 19.929 -27.266 206 H HIS 542 H HIS 542 14.008 18.004 -23.223 207 HA HIS 542 HA HIS 542 11.430 17.178 -24.081 208 HB2 HIS 542 HB2 HIS 542 12.280 18.154 -21.323 209 HB3 HIS 542 HB3 HIS 542 10.860 17.167 -21.692 210 HD2 HIS 542 HD2 HIS 542 12.482 15.068 -23.693 211 HE1 HIS 542 HE1 HIS 542 14.457 14.006 -20.063 212 H ASN 543 H ASN 543 12.522 20.434 -23.517 213 HA ASN 543 HA ASN 543 9.973 21.615 -22.865 214 HB2 ASN 543 HB2 ASN 543 12.437 22.919 -24.101 215 HB3 ASN 543 HB3 ASN 543 11.119 23.735 -23.267 216 HD21 ASN 543 2HD2 ASN 543 14.130 22.102 -22.887 217 HD22 ASN 543 1HD2 ASN 543 14.138 22.061 -21.126 218 H THR 544 H THR 544 11.437 20.743 -25.953 219 HA THR 544 HA THR 544 9.002 21.747 -27.394 220 HB THR 544 HB THR 544 10.366 22.549 -29.220 221 HG1 THR 544 HG1 THR 544 12.653 22.047 -27.607 222 HG21 THR 544 HG23 THR 544 11.354 24.515 -28.276 223 HG22 THR 544 HG21 THR 544 9.886 24.144 -27.363 224 HG23 THR 544 HG22 THR 544 11.482 23.771 -26.670 225 H ARG 545 H ARG 545 10.894 19.088 -26.776 226 HA ARG 545 HA ARG 545 11.012 16.994 -27.520 227 HB2 ARG 545 HB2 ARG 545 8.488 17.585 -28.216 228 HB3 ARG 545 HB3 ARG 545 9.140 17.346 -29.843 229 HG2 ARG 545 HG2 ARG 545 9.909 15.051 -29.136 230 HG3 ARG 545 HG3 ARG 545 9.284 15.386 -27.514 231 HD2 ARG 545 HD2 ARG 545 7.667 14.035 -28.633 232 HD3 ARG 545 HD3 ARG 545 6.987 15.644 -28.472 233 HE ARG 545 HE ARG 545 8.032 14.359 -30.982 234 HH11 ARG 545 HH11 ARG 545 6.195 17.075 -29.691 235 HH12 ARG 545 HH12 ARG 545 5.656 17.522 -31.289 236 HH21 ARG 545 HH21 ARG 545 7.359 14.921 -32.812 237 HH22 ARG 545 HH22 ARG 545 6.301 16.313 -33.077 238 H ARG 546 H ARG 546 12.376 19.459 -28.993 239 HA ARG 546 HA ARG 546 13.430 18.291 -31.450 240 HB2 ARG 546 HB2 ARG 546 14.393 20.584 -29.686 241 HB3 ARG 546 HB3 ARG 546 15.182 20.099 -31.183 242 HG2 ARG 546 HG2 ARG 546 12.986 20.490 -32.396 243 HG3 ARG 546 HG3 ARG 546 12.372 21.219 -30.912 244 HD2 ARG 546 HD2 ARG 546 14.920 22.419 -31.312 245 HD3 ARG 546 HD3 ARG 546 14.263 22.258 -32.930 246 HE ARG 546 HE ARG 546 12.517 23.767 -32.408 247 HH11 ARG 546 HH11 ARG 546 14.348 23.227 -29.485 248 HH12 ARG 546 HH12 ARG 546 14.004 24.801 -28.847 249 HH21 ARG 546 HH21 ARG 546 12.006 25.727 -31.484 250 HH22 ARG 546 HH22 ARG 546 12.676 26.164 -29.942 251 H THR 547 H THR 547 15.690 17.868 -31.814 252 HA THR 547 HA THR 547 17.320 16.806 -29.586 253 HB THR 547 HB THR 547 17.822 14.753 -30.932 254 HG1 THR 547 HG1 THR 547 16.134 14.215 -32.481 255 HG21 THR 547 HG23 THR 547 15.890 13.475 -30.281 256 HG22 THR 547 HG21 THR 547 16.171 14.704 -29.044 257 HG23 THR 547 HG22 THR 547 14.859 14.929 -30.231 258 H THR 548 H THR 548 19.572 16.426 -30.213 259 HA THR 548 HA THR 548 20.569 17.463 -32.768 260 HB THR 548 HB THR 548 20.225 19.580 -31.801 261 HG1 THR 548 HG1 THR 548 22.852 19.357 -31.001 262 HG21 THR 548 HG23 THR 548 21.047 20.348 -29.657 263 HG22 THR 548 HG21 THR 548 19.946 18.994 -29.404 264 HG23 THR 548 HG22 THR 548 21.704 18.737 -29.289 265 H PHE 549 H PHE 549 22.760 17.035 -33.140 266 HA PHE 549 HA PHE 549 23.972 14.863 -31.538 267 HB2 PHE 549 HB2 PHE 549 24.053 14.702 -33.957 268 HB3 PHE 549 HB3 PHE 549 24.757 16.310 -34.099 269 HD1 PHE 549 HD2 PHE 549 25.446 12.954 -32.523 270 HD2 PHE 549 HD1 PHE 549 27.106 16.542 -34.260 271 HE1 PHE 549 HE2 PHE 549 27.726 12.004 -32.313 272 HE2 PHE 549 HE1 PHE 549 29.387 15.575 -34.063 273 HZ PHE 549 HZ PHE 549 29.704 13.307 -33.086 274 H GLU 550 H GLU 550 24.754 18.246 -32.411 275 HA GLU 550 HA GLU 550 27.026 18.338 -30.515 276 HB2 GLU 550 HB2 GLU 550 27.493 20.497 -31.440 277 HB3 GLU 550 HB3 GLU 550 27.236 19.350 -32.751 278 HG2 GLU 550 HG2 GLU 550 24.884 20.236 -33.009 279 HG3 GLU 550 HG3 GLU 550 25.248 21.449 -31.773 280 H ASP 551 H ASP 551 27.021 20.667 -29.332 281 HA ASP 551 HA ASP 551 24.555 20.777 -27.648 282 HB2 ASP 551 HB2 ASP 551 26.467 19.831 -26.506 283 HB3 ASP 551 HB3 ASP 551 27.460 21.233 -26.925 284 HA PRO 552 HA PRO 552 24.898 24.942 -29.712 285 HB2 PRO 552 HB2 PRO 552 22.343 25.217 -30.585 286 HB3 PRO 552 HB3 PRO 552 23.486 24.102 -31.384 287 HG2 PRO 552 HG2 PRO 552 21.427 23.416 -29.250 288 HG3 PRO 552 HG3 PRO 552 21.644 22.651 -30.862 289 HD2 PRO 552 HD2 PRO 552 22.783 21.619 -28.607 290 HD3 PRO 552 HD3 PRO 552 23.603 21.570 -30.197 291 H ARG 553 H ARG 553 23.109 26.846 -29.403 292 HA ARG 553 HA ARG 553 23.118 27.801 -26.795 293 HB2 ARG 553 HB2 ARG 553 21.397 29.398 -27.521 294 HB3 ARG 553 HB3 ARG 553 22.704 29.242 -28.672 295 HG2 ARG 553 HG2 ARG 553 20.429 27.430 -29.287 296 HG3 ARG 553 HG3 ARG 553 19.939 29.112 -29.192 297 HD2 ARG 553 HD2 ARG 553 22.209 28.063 -30.928 298 HD3 ARG 553 HD3 ARG 553 20.555 28.368 -31.484 299 HE ARG 553 HE ARG 553 21.323 30.772 -30.339 300 HH11 ARG 553 HH11 ARG 553 22.584 28.863 -32.997 301 HH12 ARG 553 HH12 ARG 553 23.275 30.256 -33.783 302 HH21 ARG 553 HH21 ARG 553 22.223 32.499 -31.397 303 HH22 ARG 553 HH22 ARG 553 23.062 32.259 -32.903 304 HA PRO 554 HA PRO 554 20.129 25.539 -24.506 305 HB2 PRO 554 HB2 PRO 554 19.433 27.272 -22.495 306 HB3 PRO 554 HB3 PRO 554 21.053 26.525 -22.635 307 HG2 PRO 554 HG2 PRO 554 20.184 29.272 -23.592 308 HG3 PRO 554 HG3 PRO 554 21.616 28.849 -22.597 309 HD2 PRO 554 HD2 PRO 554 21.802 29.185 -25.282 310 HD3 PRO 554 HD3 PRO 554 22.739 27.911 -24.452 311 H GLY 555 H GLY 555 17.897 25.459 -23.741 312 HA2 GLY 555 HA2 GLY 555 15.957 26.819 -25.542 313 HA3 GLY 555 HA3 GLY 555 15.692 25.368 -24.591 314 H ALA 556 H ALA 556 13.674 26.607 -24.149 315 HA ALA 556 HA ALA 556 13.555 28.901 -22.494 316 HB1 ALA 556 HB3 ALA 556 11.225 28.124 -22.083 317 HB2 ALA 556 HB1 ALA 556 11.665 28.015 -23.797 318 HB3 ALA 556 HB2 ALA 556 11.630 26.549 -22.784 319 HA PRO 557 HA PRO 557 14.649 27.417 -18.422 320 HB2 PRO 557 HB2 PRO 557 13.141 29.001 -16.766 321 HB3 PRO 557 HB3 PRO 557 14.553 29.591 -17.692 322 HG2 PRO 557 HG2 PRO 557 11.618 29.783 -18.435 323 HG3 PRO 557 HG3 PRO 557 12.855 31.081 -18.472 324 HD2 PRO 557 HD2 PRO 557 12.158 29.702 -20.703 325 HD3 PRO 557 HD3 PRO 557 13.852 30.191 -20.424 326 H ASN2319 H ASN2319 25.111 17.853 -38.574 327 HA ASN2319 HA ASN2319 24.673 15.526 -39.008 328 HB2 ASN2319 HB2 ASN2319 24.345 16.481 -41.882 329 HB3 ASN2319 HB3 ASN2319 24.614 14.790 -41.439 330 HD21 ASN2319 2HD2 ASN2319 22.114 16.907 -42.211 331 HD22 ASN2319 1HD2 ASN2319 20.855 16.110 -41.289 332 H THR2320 H THR2320 26.679 15.174 -38.169 333 HA THR2320 HA THR2320 28.937 15.034 -40.072 334 HB THR2320 HB THR2320 28.957 17.319 -39.085 335 HG1 THR2320 HG1 THR2320 31.119 15.621 -38.441 336 HG21 THR2320 HG23 THR2320 29.713 17.699 -36.809 337 HG22 THR2320 HG21 THR2320 28.164 16.834 -36.794 338 HG23 THR2320 HG22 THR2320 29.676 15.953 -36.458 339 H GLY2321 H GLY2321 27.178 13.248 -38.125 340 HA2 GLY2321 HA2 GLY2321 28.935 11.143 -37.605 341 HA3 GLY2321 HA3 GLY2321 29.031 12.182 -36.179 342 H ALA2322 H ALA2322 26.443 10.826 -38.326 343 HA ALA2322 HA ALA2322 24.920 9.992 -35.920 344 HB1 ALA2322 HB3 ALA2322 22.908 11.181 -36.715 345 HB2 ALA2322 HB1 ALA2322 24.236 12.302 -36.361 346 HB3 ALA2322 HB2 ALA2322 23.846 11.890 -38.046 347 H LYS2323 H LYS2323 25.277 7.868 -36.441 348 HA LYS2323 HA LYS2323 24.212 6.662 -38.905 349 HB2 LYS2323 HB2 LYS2323 26.245 5.915 -37.412 350 HB3 LYS2323 HB3 LYS2323 25.019 5.241 -36.344 351 HG2 LYS2323 HG2 LYS2323 25.689 3.424 -37.687 352 HG3 LYS2323 HG3 LYS2323 24.156 3.918 -38.388 353 HD2 LYS2323 HD2 LYS2323 25.559 3.539 -40.240 354 HD3 LYS2323 HD3 LYS2323 25.557 5.304 -40.089 355 HE2 LYS2323 HE2 LYS2323 27.722 5.150 -38.803 356 HE3 LYS2323 HE3 LYS2323 27.691 3.394 -39.010 357 HZ1 LYS2323 HZ3 LYS2323 29.082 4.416 -40.693 358 HZ2 LYS2323 HZ1 LYS2323 27.781 3.762 -41.432 359 HZ3 LYS2323 HZ2 LYS2323 27.870 5.382 -41.214 360 H GLN2324 H GLN2324 22.928 7.376 -35.736 361 HA GLN2324 HA GLN2324 20.403 5.907 -36.380 362 HB2 GLN2324 HB2 GLN2324 21.808 6.116 -33.697 363 HB3 GLN2324 HB3 GLN2324 20.158 5.554 -33.918 364 HG2 GLN2324 HG2 GLN2324 21.021 3.714 -35.399 365 HG3 GLN2324 HG3 GLN2324 22.665 4.250 -35.044 366 HE21 GLN2324 HE22 GLN2324 23.058 2.052 -34.156 367 HE22 GLN2324 HE21 GLN2324 22.413 1.658 -32.577 368 HA PRO2325 HA PRO2325 18.730 9.993 -35.548 369 HB2 PRO2325 HB2 PRO2325 16.054 9.497 -35.697 370 HB3 PRO2325 HB3 PRO2325 17.135 9.493 -37.125 371 HG2 PRO2325 HG2 PRO2325 16.134 7.110 -35.538 372 HG3 PRO2325 HG3 PRO2325 16.202 7.318 -37.316 373 HD2 PRO2325 HD2 PRO2325 18.131 5.977 -35.874 374 HD3 PRO2325 HD3 PRO2325 18.496 6.874 -37.381 375 HA PRO2326 HA PRO2326 17.850 9.437 -31.064 376 HB2 PRO2326 HB2 PRO2326 17.956 12.053 -30.291 377 HB3 PRO2326 HB3 PRO2326 19.417 11.082 -30.644 378 HG2 PRO2326 HG2 PRO2326 17.973 12.993 -32.508 379 HG3 PRO2326 HG3 PRO2326 19.717 12.936 -32.141 380 HD2 PRO2326 HD2 PRO2326 18.634 11.756 -34.343 381 HD3 PRO2326 HD3 PRO2326 19.999 10.994 -33.470 382 H SER2327 H SER2327 15.832 9.131 -30.330 383 HA SER2327 HA SER2327 13.628 11.055 -30.745 384 HB2 SER2327 HB2 SER2327 13.577 8.240 -31.906 385 HB3 SER2327 HB3 SER2327 12.121 9.209 -31.602 386 HG SER2327 HG SER2327 14.214 10.395 -33.062 387 H TYR2328 H TYR2328 13.656 11.286 -28.506 388 HA TYR2328 HA TYR2328 13.176 8.917 -26.780 389 HB2 TYR2328 HB2 TYR2328 14.839 10.655 -26.194 390 HB3 TYR2328 HB3 TYR2328 13.558 11.859 -26.122 391 HD1 TYR2328 HD1 TYR2328 14.714 8.613 -24.625 392 HD2 TYR2328 HD2 TYR2328 12.411 12.217 -24.057 393 HE1 TYR2328 HE1 TYR2328 14.391 8.036 -22.217 394 HE2 TYR2328 HE2 TYR2328 12.062 11.623 -21.667 395 HH TYR2328 HH TYR2328 12.496 10.119 -19.997 396 H GLU2329 H GLU2329 11.585 12.063 -26.226 397 HA GLU2329 HA GLU2329 8.983 10.898 -25.828 398 HB2 GLU2329 HB2 GLU2329 9.995 13.717 -26.146 399 HB3 GLU2329 HB3 GLU2329 8.259 13.376 -26.138 400 HG2 GLU2329 HG2 GLU2329 8.544 12.162 -23.957 401 HG3 GLU2329 HG3 GLU2329 10.222 12.716 -23.912 402 H ASP2330 H ASP2330 10.554 12.051 -28.771 403 HA ASP2330 HA ASP2330 8.155 12.107 -30.368 404 HB2 ASP2330 HB2 ASP2330 10.443 13.216 -30.803 405 HB3 ASP2330 HB3 ASP2330 10.955 11.653 -31.404 406 H CYS2331 H CYS2331 9.705 9.460 -28.959 407 HA CYS2331 HA CYS2331 8.578 7.540 -30.972 408 HB2 CYS2331 HB2 CYS2331 11.044 7.471 -30.640 409 HB3 CYS2331 HB3 CYS2331 10.789 7.118 -28.921 410 HG CYS2331 HG CYS2331 11.482 4.929 -30.191 411 H ILE2332 H ILE2332 8.850 8.207 -27.426 412 HA ILE2332 HA ILE2332 7.015 6.029 -26.813 413 HB ILE2332 HB ILE2332 7.205 6.654 -24.508 414 HG12 ILE2332 HG12 ILE2332 9.126 8.881 -25.165 415 HG13 ILE2332 HG13 ILE2332 7.403 9.221 -25.006 416 HG21 ILE2332 HG21 ILE2332 8.934 5.253 -25.600 417 HG22 ILE2332 HG22 ILE2332 9.929 6.701 -25.874 418 HG23 ILE2332 HG23 ILE2332 9.571 6.161 -24.223 419 HD11 ILE2332 3HD1 ILE2332 8.569 9.657 -22.906 420 HD12 ILE2332 1HD1 ILE2332 7.425 8.315 -22.705 421 HD13 ILE2332 2HD1 ILE2332 9.174 7.991 -22.849 422 H LYS2333 H LYS2333 6.178 8.808 -28.230 423 HA LYS2333 HA LYS2333 3.503 9.006 -26.886 424 HB2 LYS2333 HB2 LYS2333 5.032 11.000 -28.596 425 HB3 LYS2333 HB3 LYS2333 3.330 11.173 -28.163 426 HG2 LYS2333 HG2 LYS2333 3.882 11.226 -25.776 427 HG3 LYS2333 HG3 LYS2333 5.603 10.997 -26.135 428 HD2 LYS2333 HD2 LYS2333 5.617 13.102 -27.444 429 HD3 LYS2333 HD3 LYS2333 3.914 13.372 -27.068 430 HE2 LYS2333 HE2 LYS2333 6.131 13.122 -24.983 431 HE3 LYS2333 HE3 LYS2333 5.589 14.658 -25.658 432 HZ1 LYS2333 HZ3 LYS2333 4.493 14.201 -23.566 433 HZ2 LYS2333 HZ1 LYS2333 3.375 14.220 -24.755 434 HZ3 LYS2333 HZ2 LYS2333 3.868 12.796 -24.115 Start of MODEL 19 1 H VAL 515 H VAL 515 31.370 3.874 -14.498 2 HA VAL 515 HA VAL 515 31.952 5.544 -12.874 3 HB VAL 515 HB VAL 515 34.050 4.506 -12.188 4 HG11 VAL 515 HG11 VAL 515 35.144 4.089 -14.403 5 HG12 VAL 515 HG12 VAL 515 35.420 5.845 -14.554 6 HG13 VAL 515 HG13 VAL 515 36.163 4.933 -13.239 7 HG21 VAL 515 HG23 VAL 515 35.243 6.567 -11.669 8 HG22 VAL 515 HG21 VAL 515 34.318 7.450 -12.899 9 HG23 VAL 515 HG22 VAL 515 33.500 6.766 -11.470 10 H SER 516 H SER 516 33.651 5.303 -16.050 11 HA SER 516 HA SER 516 34.211 7.844 -16.450 12 HB2 SER 516 HB2 SER 516 33.372 5.985 -18.699 13 HB3 SER 516 HB3 SER 516 34.625 7.247 -18.732 14 HG SER 516 HG SER 516 35.418 5.047 -18.425 15 H LEU 517 H LEU 517 30.929 6.739 -17.056 16 HA LEU 517 HA LEU 517 30.198 9.537 -17.751 17 HB2 LEU 517 HB2 LEU 517 28.652 8.909 -19.411 18 HB3 LEU 517 HB3 LEU 517 30.216 8.275 -19.860 19 HG LEU 517 HG LEU 517 28.304 6.430 -18.402 20 HD11 LEU 517 1HD1 LEU 517 26.870 7.491 -20.072 21 HD12 LEU 517 2HD1 LEU 517 28.058 7.142 -21.348 22 HD13 LEU 517 3HD1 LEU 517 27.213 5.814 -20.516 23 HD21 LEU 517 3HD2 LEU 517 29.292 4.741 -19.882 24 HD22 LEU 517 1HD2 LEU 517 30.209 5.995 -20.742 25 HD23 LEU 517 2HD2 LEU 517 30.577 5.621 -19.046 26 H ILE 518 H ILE 518 30.081 7.778 -15.286 27 HA ILE 518 HA ILE 518 27.187 8.152 -14.603 28 HB ILE 518 HB ILE 518 28.940 5.850 -13.662 29 HG12 ILE 518 HG12 ILE 518 26.961 4.633 -15.129 30 HG13 ILE 518 HG13 ILE 518 27.153 6.092 -16.074 31 HG21 ILE 518 HG21 ILE 518 27.160 6.350 -12.063 32 HG22 ILE 518 HG22 ILE 518 25.951 6.374 -13.371 33 HG23 ILE 518 HG23 ILE 518 26.776 4.867 -12.913 34 HD11 ILE 518 3HD1 ILE 518 28.557 4.299 -16.951 35 HD12 ILE 518 1HD1 ILE 518 29.636 5.524 -16.260 36 HD13 ILE 518 2HD1 ILE 518 29.289 4.031 -15.361 37 H ASN 519 H ASN 519 30.473 8.791 -13.734 38 HA ASN 519 HA ASN 519 29.623 9.909 -11.096 39 HB2 ASN 519 HB2 ASN 519 31.207 7.815 -11.338 40 HB3 ASN 519 HB3 ASN 519 32.431 9.008 -11.774 41 HD21 ASN 519 2HD2 ASN 519 30.030 8.143 -9.243 42 HD22 ASN 519 1HD2 ASN 519 30.979 8.797 -7.920 43 H GLU 520 H GLU 520 29.863 11.145 -13.926 44 HA GLU 520 HA GLU 520 31.885 13.237 -13.744 45 HB2 GLU 520 HB2 GLU 520 29.441 12.962 -15.542 46 HB3 GLU 520 HB3 GLU 520 30.756 14.124 -15.745 47 HG2 GLU 520 HG2 GLU 520 32.358 12.166 -15.930 48 HG3 GLU 520 HG3 GLU 520 30.945 11.107 -16.021 49 H GLY 521 H GLY 521 30.930 15.574 -14.291 50 HA2 GLY 521 HA2 GLY 521 29.775 16.693 -11.923 51 HA3 GLY 521 HA3 GLY 521 30.080 17.516 -13.447 52 HA PRO 522 HA PRO 522 25.494 17.076 -12.401 53 HB2 PRO 522 HB2 PRO 522 24.784 19.731 -12.364 54 HB3 PRO 522 HB3 PRO 522 25.503 18.874 -10.967 55 HG2 PRO 522 HG2 PRO 522 26.922 20.597 -13.022 56 HG3 PRO 522 HG3 PRO 522 27.053 20.673 -11.235 57 HD2 PRO 522 HD2 PRO 522 28.874 19.339 -12.744 58 HD3 PRO 522 HD3 PRO 522 28.353 18.697 -11.157 59 H LEU 523 H LEU 523 23.660 17.285 -13.730 60 HA LEU 523 HA LEU 523 24.259 17.261 -16.533 61 HB2 LEU 523 HB2 LEU 523 22.151 16.367 -16.848 62 HB3 LEU 523 HB3 LEU 523 22.646 15.763 -15.306 63 HG LEU 523 HG LEU 523 21.078 18.234 -14.946 64 HD11 LEU 523 1HD1 LEU 523 20.100 17.564 -17.132 65 HD12 LEU 523 2HD1 LEU 523 19.714 15.969 -16.458 66 HD13 LEU 523 3HD1 LEU 523 18.942 17.433 -15.803 67 HD21 LEU 523 3HD2 LEU 523 19.686 16.792 -13.551 68 HD22 LEU 523 1HD2 LEU 523 20.504 15.347 -14.181 69 HD23 LEU 523 2HD2 LEU 523 21.400 16.526 -13.194 70 HA PRO 524 HA PRO 524 23.308 21.384 -17.800 71 HB2 PRO 524 HB2 PRO 524 22.202 21.060 -20.325 72 HB3 PRO 524 HB3 PRO 524 23.937 20.878 -19.931 73 HG2 PRO 524 HG2 PRO 524 21.839 18.714 -20.161 74 HG3 PRO 524 HG3 PRO 524 23.486 18.735 -20.864 75 HD2 PRO 524 HD2 PRO 524 22.926 17.417 -18.565 76 HD3 PRO 524 HD3 PRO 524 24.472 18.287 -18.762 77 HA PRO 525 HA PRO 525 19.356 22.424 -16.443 78 HB2 PRO 525 HB2 PRO 525 18.869 24.926 -17.462 79 HB3 PRO 525 HB3 PRO 525 20.158 24.570 -16.275 80 HG2 PRO 525 HG2 PRO 525 20.425 24.789 -19.292 81 HG3 PRO 525 HG3 PRO 525 21.431 25.571 -18.032 82 HD2 PRO 525 HD2 PRO 525 22.205 23.269 -19.242 83 HD3 PRO 525 HD3 PRO 525 22.507 23.538 -17.499 84 H GLY 526 H GLY 526 17.551 21.326 -16.971 85 HA2 GLY 526 HA2 GLY 526 15.565 20.788 -17.995 86 HA3 GLY 526 HA3 GLY 526 15.691 22.293 -18.908 87 H TRP 527 H TRP 527 18.078 19.707 -19.126 88 HA TRP 527 HA TRP 527 17.220 18.992 -21.916 89 HB2 TRP 527 HB2 TRP 527 19.902 19.672 -20.711 90 HB3 TRP 527 HB3 TRP 527 19.832 18.529 -22.034 91 HD1 TRP 527 HD1 TRP 527 19.704 22.200 -21.320 92 HE1 TRP 527 HE1 TRP 527 19.681 23.523 -23.516 93 HE3 TRP 527 HE3 TRP 527 18.965 18.328 -24.579 94 HZ2 TRP 527 HZ2 TRP 527 19.408 22.968 -26.337 95 HZ3 TRP 527 HZ3 TRP 527 18.839 18.755 -27.029 96 HH2 TRP 527 HH2 TRP 527 19.068 21.062 -27.914 97 H GLU 528 H GLU 528 17.883 16.900 -22.645 98 HA GLU 528 HA GLU 528 18.708 14.898 -20.606 99 HB2 GLU 528 HB2 GLU 528 16.313 14.624 -20.895 100 HB3 GLU 528 HB3 GLU 528 16.458 14.662 -22.639 101 HG2 GLU 528 HG2 GLU 528 16.063 12.410 -21.948 102 HG3 GLU 528 HG3 GLU 528 17.695 12.494 -22.582 103 H ILE 529 H ILE 529 19.960 13.162 -21.497 104 HA ILE 529 HA ILE 529 21.271 13.669 -24.117 105 HB ILE 529 HB ILE 529 23.044 13.392 -21.675 106 HG12 ILE 529 HG12 ILE 529 23.438 15.971 -21.948 107 HG13 ILE 529 HG13 ILE 529 21.790 16.006 -22.543 108 HG21 ILE 529 HG21 ILE 529 23.942 13.032 -23.944 109 HG22 ILE 529 HG22 ILE 529 23.417 14.660 -24.418 110 HG23 ILE 529 HG23 ILE 529 24.671 14.449 -23.179 111 HD11 ILE 529 3HD1 ILE 529 21.648 16.438 -20.200 112 HD12 ILE 529 1HD1 ILE 529 21.207 14.737 -20.287 113 HD13 ILE 529 2HD1 ILE 529 22.845 15.185 -19.806 114 H ARG 530 H ARG 530 21.791 11.764 -25.075 115 HA ARG 530 HA ARG 530 22.038 9.290 -23.416 116 HB2 ARG 530 HB2 ARG 530 20.025 9.625 -25.692 117 HB3 ARG 530 HB3 ARG 530 20.437 8.104 -24.895 118 HG2 ARG 530 HG2 ARG 530 19.809 9.362 -22.680 119 HG3 ARG 530 HG3 ARG 530 18.968 10.489 -23.739 120 HD2 ARG 530 HD2 ARG 530 17.227 9.090 -23.959 121 HD3 ARG 530 HD3 ARG 530 18.244 7.745 -24.456 122 HE ARG 530 HE ARG 530 17.161 8.269 -21.797 123 HH11 ARG 530 HH11 ARG 530 19.679 6.468 -23.446 124 HH12 ARG 530 HH12 ARG 530 20.068 5.539 -22.027 125 HH21 ARG 530 HH21 ARG 530 17.702 7.027 -20.034 126 HH22 ARG 530 HH22 ARG 530 18.958 5.831 -20.164 127 H TYR 531 H TYR 531 22.595 7.393 -24.633 128 HA TYR 531 HA TYR 531 24.676 7.929 -26.706 129 HB2 TYR 531 HB2 TYR 531 24.867 6.075 -24.299 130 HB3 TYR 531 HB3 TYR 531 26.100 6.341 -25.514 131 HD1 TYR 531 HD1 TYR 531 24.224 7.957 -22.704 132 HD2 TYR 531 HD2 TYR 531 27.715 8.082 -25.239 133 HE1 TYR 531 HE1 TYR 531 25.209 9.712 -21.250 134 HE2 TYR 531 HE2 TYR 531 28.732 9.790 -23.732 135 HH TYR 531 HH TYR 531 27.016 11.072 -20.862 136 H THR 532 H THR 532 24.144 6.763 -28.537 137 HA THR 532 HA THR 532 22.195 4.548 -28.327 138 HB THR 532 HB THR 532 22.082 4.536 -30.692 139 HG1 THR 532 HG1 THR 532 23.452 6.167 -31.807 140 HG21 THR 532 HG23 THR 532 21.405 6.812 -31.236 141 HG22 THR 532 HG21 THR 532 20.857 6.372 -29.610 142 HG23 THR 532 HG22 THR 532 22.261 7.436 -29.810 143 H ALA 533 H ALA 533 22.527 2.490 -29.468 144 HA ALA 533 HA ALA 533 24.832 1.088 -28.647 145 HB1 ALA 533 HB3 ALA 533 23.869 -0.756 -29.958 146 HB2 ALA 533 HB1 ALA 533 22.612 0.090 -29.040 147 HB3 ALA 533 HB2 ALA 533 22.782 0.377 -30.789 148 H ALA 534 H ALA 534 24.620 3.174 -31.370 149 HA ALA 534 HA ALA 534 26.706 1.909 -32.988 150 HB1 ALA 534 HB3 ALA 534 26.566 4.010 -34.276 151 HB2 ALA 534 HB1 ALA 534 24.963 3.311 -34.013 152 HB3 ALA 534 HB2 ALA 534 25.499 4.712 -33.045 153 H GLY 535 H GLY 535 26.774 3.620 -30.023 154 HA2 GLY 535 HA2 GLY 535 28.642 4.172 -28.748 155 HA3 GLY 535 HA3 GLY 535 29.700 3.978 -30.150 156 H GLU 536 H GLU 536 26.775 6.028 -29.925 157 HA GLU 536 HA GLU 536 28.429 8.503 -30.259 158 HB2 GLU 536 HB2 GLU 536 26.047 7.535 -31.887 159 HB3 GLU 536 HB3 GLU 536 26.623 9.195 -31.938 160 HG2 GLU 536 HG2 GLU 536 28.354 6.790 -32.671 161 HG3 GLU 536 HG3 GLU 536 27.354 7.676 -33.804 162 H ARG 537 H ARG 537 27.637 10.352 -29.398 163 HA ARG 537 HA ARG 537 25.358 10.095 -27.495 164 HB2 ARG 537 HB2 ARG 537 27.393 10.574 -26.384 165 HB3 ARG 537 HB3 ARG 537 27.829 11.851 -27.526 166 HG2 ARG 537 HG2 ARG 537 26.218 13.361 -26.656 167 HG3 ARG 537 HG3 ARG 537 25.340 12.085 -25.804 168 HD2 ARG 537 HD2 ARG 537 26.679 13.606 -24.320 169 HD3 ARG 537 HD3 ARG 537 26.951 11.891 -24.124 170 HE ARG 537 HE ARG 537 29.129 12.077 -24.898 171 HH11 ARG 537 HH11 ARG 537 27.605 15.189 -25.352 172 HH12 ARG 537 HH12 ARG 537 29.135 16.004 -25.565 173 HH21 ARG 537 HH21 ARG 537 31.030 13.164 -25.182 174 HH22 ARG 537 HH22 ARG 537 31.019 14.876 -25.477 175 H PHE 538 H PHE 538 23.728 11.473 -27.404 176 HA PHE 538 HA PHE 538 23.424 13.688 -29.381 177 HB2 PHE 538 HB2 PHE 538 21.427 11.439 -28.877 178 HB3 PHE 538 HB3 PHE 538 21.150 12.850 -29.882 179 HD1 PHE 538 HD2 PHE 538 23.021 9.649 -29.617 180 HD2 PHE 538 HD1 PHE 538 22.005 12.989 -32.133 181 HE1 PHE 538 HE2 PHE 538 23.857 8.409 -31.595 182 HE2 PHE 538 HE1 PHE 538 22.823 11.732 -34.129 183 HZ PHE 538 HZ PHE 538 23.740 9.442 -33.856 184 H PHE 539 H PHE 539 21.708 15.157 -28.834 185 HA PHE 539 HA PHE 539 20.999 15.217 -25.920 186 HB2 PHE 539 HB2 PHE 539 21.533 17.499 -27.843 187 HB3 PHE 539 HB3 PHE 539 21.000 17.665 -26.183 188 HD1 PHE 539 HD2 PHE 539 23.870 16.579 -28.312 189 HD2 PHE 539 HD1 PHE 539 22.524 17.648 -24.357 190 HE1 PHE 539 HE2 PHE 539 26.228 16.723 -27.549 191 HE2 PHE 539 HE1 PHE 539 24.883 17.819 -23.602 192 HZ PHE 539 HZ PHE 539 26.736 17.387 -25.198 193 H VAL 540 H VAL 540 18.999 15.900 -25.345 194 HA VAL 540 HA VAL 540 16.798 15.850 -27.373 195 HB VAL 540 HB VAL 540 17.033 14.365 -24.729 196 HG11 VAL 540 HG11 VAL 540 14.702 15.110 -25.101 197 HG12 VAL 540 HG12 VAL 540 14.731 14.395 -26.729 198 HG13 VAL 540 HG13 VAL 540 14.853 13.367 -25.281 199 HG21 VAL 540 HG23 VAL 540 16.897 12.307 -26.004 200 HG22 VAL 540 HG21 VAL 540 16.826 13.206 -27.529 201 HG23 VAL 540 HG22 VAL 540 18.296 13.238 -26.532 202 H ASP 541 H ASP 541 15.623 17.611 -27.252 203 HA ASP 541 HA ASP 541 15.765 19.368 -24.878 204 HB2 ASP 541 HB2 ASP 541 16.359 20.181 -27.176 205 HB3 ASP 541 HB3 ASP 541 14.681 19.959 -27.648 206 H HIS 542 H HIS 542 14.383 18.179 -23.531 207 HA HIS 542 HA HIS 542 11.792 17.248 -24.069 208 HB2 HIS 542 HB2 HIS 542 13.482 17.682 -21.730 209 HB3 HIS 542 HB3 HIS 542 11.828 18.122 -21.358 210 HD2 HIS 542 HD2 HIS 542 13.851 15.079 -22.693 211 HE1 HIS 542 HE1 HIS 542 10.219 13.576 -21.030 212 H ASN 543 H ASN 543 12.677 20.577 -23.814 213 HA ASN 543 HA ASN 543 10.122 21.638 -22.968 214 HB2 ASN 543 HB2 ASN 543 12.347 22.989 -24.557 215 HB3 ASN 543 HB3 ASN 543 11.066 23.785 -23.654 216 HD21 ASN 543 2HD2 ASN 543 14.175 22.280 -23.463 217 HD22 ASN 543 1HD2 ASN 543 14.379 22.395 -21.714 218 H THR 544 H THR 544 11.377 20.622 -26.112 219 HA THR 544 HA THR 544 8.792 21.360 -27.440 220 HB THR 544 HB THR 544 10.057 22.206 -29.389 221 HG1 THR 544 HG1 THR 544 12.292 22.681 -29.000 222 HG21 THR 544 HG23 THR 544 10.717 24.345 -28.544 223 HG22 THR 544 HG21 THR 544 9.301 23.812 -27.624 224 HG23 THR 544 HG22 THR 544 10.922 23.715 -26.896 225 H ARG 545 H ARG 545 10.780 18.850 -26.780 226 HA ARG 545 HA ARG 545 11.046 16.745 -27.516 227 HB2 ARG 545 HB2 ARG 545 8.494 17.439 -28.590 228 HB3 ARG 545 HB3 ARG 545 9.340 16.585 -29.875 229 HG2 ARG 545 HG2 ARG 545 9.853 14.748 -28.262 230 HG3 ARG 545 HG3 ARG 545 8.946 15.618 -27.015 231 HD2 ARG 545 HD2 ARG 545 7.915 14.298 -29.541 232 HD3 ARG 545 HD3 ARG 545 7.496 13.903 -27.877 233 HE ARG 545 HE ARG 545 6.263 15.862 -29.591 234 HH11 ARG 545 HH11 ARG 545 6.790 15.301 -26.130 235 HH12 ARG 545 HH12 ARG 545 5.762 16.648 -25.713 236 HH21 ARG 545 HH21 ARG 545 4.878 17.430 -28.938 237 HH22 ARG 545 HH22 ARG 545 4.636 17.746 -27.248 238 H ARG 546 H ARG 546 12.226 19.245 -29.060 239 HA ARG 546 HA ARG 546 13.322 18.137 -31.513 240 HB2 ARG 546 HB2 ARG 546 13.889 20.543 -29.746 241 HB3 ARG 546 HB3 ARG 546 15.007 20.152 -31.027 242 HG2 ARG 546 HG2 ARG 546 12.024 20.599 -31.478 243 HG3 ARG 546 HG3 ARG 546 13.248 21.857 -31.613 244 HD2 ARG 546 HD2 ARG 546 13.062 19.341 -33.327 245 HD3 ARG 546 HD3 ARG 546 12.657 20.970 -33.833 246 HE ARG 546 HE ARG 546 15.300 19.774 -33.706 247 HH11 ARG 546 HH11 ARG 546 13.712 22.897 -33.682 248 HH12 ARG 546 HH12 ARG 546 15.182 23.740 -34.088 249 HH21 ARG 546 HH21 ARG 546 17.135 20.909 -34.152 250 HH22 ARG 546 HH22 ARG 546 17.062 22.634 -34.365 251 H THR 547 H THR 547 15.619 17.937 -31.914 252 HA THR 547 HA THR 547 17.321 16.903 -29.724 253 HB THR 547 HB THR 547 17.917 14.930 -31.217 254 HG1 THR 547 HG1 THR 547 16.916 15.628 -33.134 255 HG21 THR 547 HG23 THR 547 16.100 13.521 -30.483 256 HG22 THR 547 HG21 THR 547 16.496 14.675 -29.209 257 HG23 THR 547 HG22 THR 547 15.046 14.917 -30.207 258 H THR 548 H THR 548 19.572 16.618 -30.373 259 HA THR 548 HA THR 548 20.489 17.606 -32.957 260 HB THR 548 HB THR 548 20.063 19.760 -31.988 261 HG1 THR 548 HG1 THR 548 21.840 20.158 -32.969 262 HG21 THR 548 HG23 THR 548 21.254 20.536 -29.937 263 HG22 THR 548 HG21 THR 548 19.995 19.334 -29.617 264 HG23 THR 548 HG22 THR 548 21.700 18.849 -29.612 265 H PHE 549 H PHE 549 22.817 17.557 -33.179 266 HA PHE 549 HA PHE 549 23.969 15.150 -31.971 267 HB2 PHE 549 HB2 PHE 549 25.251 17.074 -33.932 268 HB3 PHE 549 HB3 PHE 549 25.634 15.377 -33.687 269 HD1 PHE 549 HD1 PHE 549 22.887 14.141 -33.813 270 HD2 PHE 549 HD2 PHE 549 24.709 17.211 -36.220 271 HE1 PHE 549 HE1 PHE 549 21.382 13.549 -35.697 272 HE2 PHE 549 HE2 PHE 549 23.213 16.613 -38.108 273 HZ PHE 549 HZ PHE 549 21.544 14.786 -37.850 274 H GLU 550 H GLU 550 24.095 18.490 -31.197 275 HA GLU 550 HA GLU 550 26.474 18.212 -29.465 276 HB2 GLU 550 HB2 GLU 550 27.674 20.031 -30.486 277 HB3 GLU 550 HB3 GLU 550 27.373 18.784 -31.681 278 HG2 GLU 550 HG2 GLU 550 25.421 20.161 -32.543 279 HG3 GLU 550 HG3 GLU 550 25.913 21.444 -31.436 280 H ASP 551 H ASP 551 26.810 20.982 -28.922 281 HA ASP 551 HA ASP 551 24.186 21.751 -27.699 282 HB2 ASP 551 HB2 ASP 551 25.672 20.824 -26.026 283 HB3 ASP 551 HB3 ASP 551 26.947 21.950 -26.483 284 HA PRO 552 HA PRO 552 25.657 25.203 -30.454 285 HB2 PRO 552 HB2 PRO 552 23.433 25.556 -31.966 286 HB3 PRO 552 HB3 PRO 552 24.539 24.179 -32.233 287 HG2 PRO 552 HG2 PRO 552 21.959 24.200 -30.628 288 HG3 PRO 552 HG3 PRO 552 22.445 23.059 -31.925 289 HD2 PRO 552 HD2 PRO 552 22.811 22.521 -29.262 290 HD3 PRO 552 HD3 PRO 552 23.937 21.946 -30.521 291 H ARG 553 H ARG 553 24.336 27.376 -30.931 292 HA ARG 553 HA ARG 553 23.765 28.762 -28.528 293 HB2 ARG 553 HB2 ARG 553 23.066 29.301 -31.444 294 HB3 ARG 553 HB3 ARG 553 22.547 30.385 -30.159 295 HG2 ARG 553 HG2 ARG 553 24.940 30.646 -29.427 296 HG3 ARG 553 HG3 ARG 553 25.432 29.647 -30.800 297 HD2 ARG 553 HD2 ARG 553 25.725 31.975 -31.370 298 HD3 ARG 553 HD3 ARG 553 24.416 31.303 -32.357 299 HE ARG 553 HE ARG 553 23.252 32.455 -30.033 300 HH11 ARG 553 HH11 ARG 553 24.964 33.642 -32.847 301 HH12 ARG 553 HH12 ARG 553 24.137 35.177 -32.813 302 HH21 ARG 553 HH21 ARG 553 22.210 34.413 -30.067 303 HH22 ARG 553 HH22 ARG 553 22.620 35.593 -31.276 304 HA PRO 554 HA PRO 554 19.668 27.608 -27.399 305 HB2 PRO 554 HB2 PRO 554 18.748 29.817 -26.056 306 HB3 PRO 554 HB3 PRO 554 20.053 28.762 -25.439 307 HG2 PRO 554 HG2 PRO 554 20.339 31.367 -26.970 308 HG3 PRO 554 HG3 PRO 554 21.138 30.893 -25.435 309 HD2 PRO 554 HD2 PRO 554 22.390 30.626 -27.826 310 HD3 PRO 554 HD3 PRO 554 22.586 29.392 -26.547 311 H GLY 555 H GLY 555 17.372 28.164 -27.573 312 HA2 GLY 555 HA2 GLY 555 16.600 29.908 -29.879 313 HA3 GLY 555 HA3 GLY 555 16.148 28.200 -29.838 314 H ALA 556 H ALA 556 16.229 30.347 -27.023 315 HA ALA 556 HA ALA 556 13.285 30.597 -26.899 316 HB1 ALA 556 HB3 ALA 556 13.309 29.689 -24.562 317 HB2 ALA 556 HB1 ALA 556 13.792 28.473 -25.757 318 HB3 ALA 556 HB2 ALA 556 15.022 29.278 -24.755 319 HA PRO 557 HA PRO 557 14.349 34.604 -25.307 320 HB2 PRO 557 HB2 PRO 557 12.182 35.273 -23.760 321 HB3 PRO 557 HB3 PRO 557 12.141 35.176 -25.546 322 HG2 PRO 557 HG2 PRO 557 11.285 33.064 -23.546 323 HG3 PRO 557 HG3 PRO 557 10.395 33.652 -24.986 324 HD2 PRO 557 HD2 PRO 557 11.869 31.373 -25.051 325 HD3 PRO 557 HD3 PRO 557 11.812 32.472 -26.459 326 H ASN2319 H ASN2319 31.113 12.358 -41.225 327 HA ASN2319 HA ASN2319 31.424 14.920 -42.654 328 HB2 ASN2319 HB2 ASN2319 32.908 12.288 -43.102 329 HB3 ASN2319 HB3 ASN2319 32.905 13.651 -44.216 330 HD21 ASN2319 2HD2 ASN2319 34.994 14.535 -44.071 331 HD22 ASN2319 1HD2 ASN2319 35.743 14.951 -42.543 332 H THR2320 H THR2320 29.386 15.150 -43.430 333 HA THR2320 HA THR2320 27.384 14.678 -44.448 334 HB THR2320 HB THR2320 27.689 14.378 -46.881 335 HG1 THR2320 HG1 THR2320 29.449 12.974 -46.887 336 HG21 THR2320 HG23 THR2320 28.970 16.390 -47.255 337 HG22 THR2320 HG21 THR2320 27.974 16.593 -45.805 338 HG23 THR2320 HG22 THR2320 29.719 16.280 -45.649 339 H GLY2321 H GLY2321 27.571 12.562 -42.817 340 HA2 GLY2321 HA2 GLY2321 26.392 10.315 -44.410 341 HA3 GLY2321 HA3 GLY2321 27.652 10.013 -43.216 342 H ALA2322 H ALA2322 24.483 9.728 -43.635 343 HA ALA2322 HA ALA2322 23.281 10.811 -41.278 344 HB1 ALA2322 HB3 ALA2322 21.459 9.230 -41.813 345 HB2 ALA2322 HB1 ALA2322 22.016 10.084 -43.263 346 HB3 ALA2322 HB2 ALA2322 22.510 8.397 -42.980 347 H LYS2323 H LYS2323 22.566 9.729 -39.408 348 HA LYS2323 HA LYS2323 24.036 7.318 -38.480 349 HB2 LYS2323 HB2 LYS2323 25.067 9.747 -37.935 350 HB3 LYS2323 HB3 LYS2323 23.865 9.737 -36.661 351 HG2 LYS2323 HG2 LYS2323 25.170 8.387 -35.383 352 HG3 LYS2323 HG3 LYS2323 25.285 7.183 -36.660 353 HD2 LYS2323 HD2 LYS2323 27.507 7.885 -36.091 354 HD3 LYS2323 HD3 LYS2323 27.142 8.473 -37.713 355 HE2 LYS2323 HE2 LYS2323 26.706 10.733 -36.850 356 HE3 LYS2323 HE3 LYS2323 26.880 10.167 -35.184 357 HZ1 LYS2323 HZ3 LYS2323 28.916 11.233 -36.014 358 HZ2 LYS2323 HZ1 LYS2323 29.191 9.674 -35.608 359 HZ3 LYS2323 HZ2 LYS2323 29.071 10.106 -37.191 360 H GLN2324 H GLN2324 23.083 6.644 -36.226 361 HA GLN2324 HA GLN2324 20.367 6.053 -36.624 362 HB2 GLN2324 HB2 GLN2324 21.927 6.038 -34.014 363 HB3 GLN2324 HB3 GLN2324 20.301 5.379 -34.236 364 HG2 GLN2324 HG2 GLN2324 21.341 3.979 -36.178 365 HG3 GLN2324 HG3 GLN2324 22.897 4.380 -35.441 366 HE21 GLN2324 HE22 GLN2324 22.901 3.923 -32.893 367 HE22 GLN2324 HE21 GLN2324 22.120 2.401 -32.454 368 HA PRO2325 HA PRO2325 18.735 10.071 -35.703 369 HB2 PRO2325 HB2 PRO2325 16.027 9.611 -35.884 370 HB3 PRO2325 HB3 PRO2325 17.134 9.726 -37.284 371 HG2 PRO2325 HG2 PRO2325 16.130 7.223 -35.904 372 HG3 PRO2325 HG3 PRO2325 16.218 7.566 -37.661 373 HD2 PRO2325 HD2 PRO2325 18.127 6.111 -36.371 374 HD3 PRO2325 HD3 PRO2325 18.549 7.227 -37.705 375 HA PRO2326 HA PRO2326 17.980 9.454 -31.256 376 HB2 PRO2326 HB2 PRO2326 18.032 12.055 -30.421 377 HB3 PRO2326 HB3 PRO2326 19.497 11.133 -30.870 378 HG2 PRO2326 HG2 PRO2326 17.916 13.049 -32.612 379 HG3 PRO2326 HG3 PRO2326 19.682 13.021 -32.339 380 HD2 PRO2326 HD2 PRO2326 18.510 11.866 -34.508 381 HD3 PRO2326 HD3 PRO2326 19.933 11.115 -33.721 382 H SER2327 H SER2327 16.022 8.871 -30.654 383 HA SER2327 HA SER2327 13.678 10.694 -30.816 384 HB2 SER2327 HB2 SER2327 13.706 7.871 -31.965 385 HB3 SER2327 HB3 SER2327 12.265 8.876 -31.714 386 HG SER2327 HG SER2327 13.001 9.015 -33.860 387 H TYR2328 H TYR2328 14.130 10.815 -28.524 388 HA TYR2328 HA TYR2328 13.666 8.378 -26.907 389 HB2 TYR2328 HB2 TYR2328 15.431 9.998 -26.318 390 HB3 TYR2328 HB3 TYR2328 14.234 11.256 -26.108 391 HD1 TYR2328 HD1 TYR2328 14.755 7.687 -24.962 392 HD2 TYR2328 HD2 TYR2328 13.790 11.744 -23.841 393 HE1 TYR2328 HE1 TYR2328 14.633 7.003 -22.572 394 HE2 TYR2328 HE2 TYR2328 13.695 11.053 -21.448 395 HH TYR2328 HH TYR2328 13.926 9.339 -19.952 396 H GLU2329 H GLU2329 12.286 11.539 -26.119 397 HA GLU2329 HA GLU2329 9.705 10.717 -25.385 398 HB2 GLU2329 HB2 GLU2329 11.170 13.179 -25.818 399 HB3 GLU2329 HB3 GLU2329 9.593 13.336 -26.544 400 HG2 GLU2329 HG2 GLU2329 9.927 12.361 -23.696 401 HG3 GLU2329 HG3 GLU2329 9.911 14.074 -24.114 402 H ASP2330 H ASP2330 10.819 11.835 -28.599 403 HA ASP2330 HA ASP2330 8.285 11.805 -29.879 404 HB2 ASP2330 HB2 ASP2330 10.373 13.009 -30.592 405 HB3 ASP2330 HB3 ASP2330 11.036 11.465 -31.131 406 H CYS2331 H CYS2331 10.254 9.085 -29.024 407 HA CYS2331 HA CYS2331 8.880 7.275 -30.964 408 HB2 CYS2331 HB2 CYS2331 11.332 7.077 -30.635 409 HB3 CYS2331 HB3 CYS2331 11.067 6.713 -28.919 410 HG CYS2331 HG CYS2331 11.666 4.516 -30.245 411 H ILE2332 H ILE2332 9.220 7.838 -27.409 412 HA ILE2332 HA ILE2332 7.467 5.611 -26.806 413 HB ILE2332 HB ILE2332 7.709 6.194 -24.487 414 HG12 ILE2332 HG12 ILE2332 9.464 8.547 -25.231 415 HG13 ILE2332 HG13 ILE2332 7.750 8.754 -24.881 416 HG21 ILE2332 HG21 ILE2332 9.450 4.882 -25.686 417 HG22 ILE2332 HG22 ILE2332 10.388 6.369 -25.931 418 HG23 ILE2332 HG23 ILE2332 10.092 5.757 -24.295 419 HD11 ILE2332 3HD1 ILE2332 9.068 9.222 -22.895 420 HD12 ILE2332 1HD1 ILE2332 8.076 7.774 -22.631 421 HD13 ILE2332 2HD1 ILE2332 9.819 7.618 -22.955 422 H LYS2333 H LYS2333 6.604 8.759 -27.749 423 HA LYS2333 HA LYS2333 3.843 8.320 -26.704 424 HB2 LYS2333 HB2 LYS2333 3.563 10.509 -26.011 425 HB3 LYS2333 HB3 LYS2333 5.101 10.017 -25.333 426 HG2 LYS2333 HG2 LYS2333 6.143 11.768 -26.289 427 HG3 LYS2333 HG3 LYS2333 5.646 11.261 -27.894 428 HD2 LYS2333 HD2 LYS2333 4.831 13.481 -27.589 429 HD3 LYS2333 HD3 LYS2333 3.429 12.406 -27.513 430 HE2 LYS2333 HE2 LYS2333 3.686 12.455 -24.959 431 HE3 LYS2333 HE3 LYS2333 4.914 13.704 -25.179 432 HZ1 LYS2333 HZ3 LYS2333 2.738 14.689 -24.769 433 HZ2 LYS2333 HZ1 LYS2333 3.183 15.060 -26.297 434 HZ3 LYS2333 HZ2 LYS2333 2.067 13.900 -26.026 Start of MODEL 20 1 H VAL 515 H VAL 515 27.815 2.781 -10.441 2 HA VAL 515 HA VAL 515 29.012 4.576 -9.355 3 HB VAL 515 HB VAL 515 31.459 2.825 -9.749 4 HG11 VAL 515 HG11 VAL 515 32.031 5.207 -10.166 5 HG12 VAL 515 HG12 VAL 515 31.240 5.661 -8.636 6 HG13 VAL 515 HG13 VAL 515 32.696 4.651 -8.633 7 HG21 VAL 515 HG23 VAL 515 31.646 3.042 -7.269 8 HG22 VAL 515 HG21 VAL 515 30.085 3.886 -7.230 9 HG23 VAL 515 HG22 VAL 515 30.184 2.177 -7.733 10 H SER 516 H SER 516 30.602 2.806 -12.095 11 HA SER 516 HA SER 516 31.861 4.789 -13.238 12 HB2 SER 516 HB2 SER 516 30.480 2.665 -14.866 13 HB3 SER 516 HB3 SER 516 32.011 3.456 -15.222 14 HG SER 516 HG SER 516 32.266 1.371 -14.237 15 H LEU 517 H LEU 517 28.385 4.482 -13.899 16 HA LEU 517 HA LEU 517 28.537 7.118 -15.274 17 HB2 LEU 517 HB2 LEU 517 26.991 6.544 -16.940 18 HB3 LEU 517 HB3 LEU 517 28.297 5.392 -17.017 19 HG LEU 517 HG LEU 517 25.895 4.563 -15.393 20 HD11 LEU 517 1HD1 LEU 517 24.819 5.652 -17.302 21 HD12 LEU 517 2HD1 LEU 517 25.822 4.711 -18.431 22 HD13 LEU 517 3HD1 LEU 517 24.631 3.894 -17.389 23 HD21 LEU 517 3HD2 LEU 517 26.313 2.400 -16.447 24 HD22 LEU 517 1HD2 LEU 517 27.536 3.119 -17.515 25 HD23 LEU 517 2HD2 LEU 517 27.822 3.025 -15.764 26 H ILE 518 H ILE 518 27.776 6.141 -12.506 27 HA ILE 518 HA ILE 518 25.148 7.528 -12.272 28 HB ILE 518 HB ILE 518 25.755 5.138 -10.534 29 HG12 ILE 518 HG12 ILE 518 23.981 3.976 -12.164 30 HG13 ILE 518 HG13 ILE 518 24.678 5.031 -13.356 31 HG21 ILE 518 HG21 ILE 518 23.876 6.647 -9.877 32 HG22 ILE 518 HG22 ILE 518 23.148 6.411 -11.480 33 HG23 ILE 518 HG23 ILE 518 23.295 5.058 -10.335 34 HD11 ILE 518 3HD1 ILE 518 26.064 2.892 -11.680 35 HD12 ILE 518 1HD1 ILE 518 25.736 2.836 -13.423 36 HD13 ILE 518 2HD1 ILE 518 26.948 3.967 -12.788 37 H ASN 519 H ASN 519 28.303 7.794 -11.568 38 HA ASN 519 HA ASN 519 27.799 9.430 -9.129 39 HB2 ASN 519 HB2 ASN 519 28.857 6.992 -8.873 40 HB3 ASN 519 HB3 ASN 519 30.330 7.793 -9.420 41 HD21 ASN 519 2HD2 ASN 519 27.725 7.878 -6.963 42 HD22 ASN 519 1HD2 ASN 519 28.728 8.594 -5.705 43 H GLU 520 H GLU 520 28.306 9.926 -12.132 44 HA GLU 520 HA GLU 520 30.824 11.436 -12.251 45 HB2 GLU 520 HB2 GLU 520 28.536 11.205 -14.250 46 HB3 GLU 520 HB3 GLU 520 30.128 11.914 -14.549 47 HG2 GLU 520 HG2 GLU 520 31.152 9.664 -13.969 48 HG3 GLU 520 HG3 GLU 520 29.519 8.991 -13.991 49 H GLY 521 H GLY 521 30.356 13.688 -13.593 50 HA2 GLY 521 HA2 GLY 521 29.519 15.611 -11.672 51 HA3 GLY 521 HA3 GLY 521 29.875 15.919 -13.367 52 HA PRO 522 HA PRO 522 25.289 16.462 -12.217 53 HB2 PRO 522 HB2 PRO 522 25.028 19.183 -12.405 54 HB3 PRO 522 HB3 PRO 522 25.633 18.354 -10.939 55 HG2 PRO 522 HG2 PRO 522 27.265 19.624 -13.162 56 HG3 PRO 522 HG3 PRO 522 27.438 19.857 -11.393 57 HD2 PRO 522 HD2 PRO 522 28.993 18.098 -12.768 58 HD3 PRO 522 HD3 PRO 522 28.417 17.725 -11.116 59 H LEU 523 H LEU 523 23.500 17.007 -13.581 60 HA LEU 523 HA LEU 523 24.178 16.830 -16.430 61 HB2 LEU 523 HB2 LEU 523 22.115 15.887 -16.770 62 HB3 LEU 523 HB3 LEU 523 22.587 15.277 -15.223 63 HG LEU 523 HG LEU 523 20.965 17.714 -14.871 64 HD11 LEU 523 1HD1 LEU 523 20.054 17.055 -17.089 65 HD12 LEU 523 2HD1 LEU 523 19.677 15.446 -16.443 66 HD13 LEU 523 3HD1 LEU 523 18.866 16.889 -15.789 67 HD21 LEU 523 3HD2 LEU 523 19.568 16.233 -13.526 68 HD22 LEU 523 1HD2 LEU 523 20.423 14.808 -14.156 69 HD23 LEU 523 2HD2 LEU 523 21.280 15.988 -13.135 70 HA PRO 524 HA PRO 524 23.146 20.988 -17.546 71 HB2 PRO 524 HB2 PRO 524 22.081 20.731 -20.091 72 HB3 PRO 524 HB3 PRO 524 23.814 20.540 -19.685 73 HG2 PRO 524 HG2 PRO 524 21.720 18.374 -19.983 74 HG3 PRO 524 HG3 PRO 524 23.361 18.429 -20.700 75 HD2 PRO 524 HD2 PRO 524 22.822 17.039 -18.441 76 HD3 PRO 524 HD3 PRO 524 24.362 17.925 -18.616 77 HA PRO 525 HA PRO 525 19.120 21.921 -16.272 78 HB2 PRO 525 HB2 PRO 525 18.596 24.418 -17.279 79 HB3 PRO 525 HB3 PRO 525 19.864 24.086 -16.064 80 HG2 PRO 525 HG2 PRO 525 20.200 24.338 -19.072 81 HG3 PRO 525 HG3 PRO 525 21.152 25.137 -17.781 82 HD2 PRO 525 HD2 PRO 525 22.017 22.867 -18.990 83 HD3 PRO 525 HD3 PRO 525 22.273 23.131 -17.240 84 H GLY 526 H GLY 526 17.384 20.742 -16.885 85 HA2 GLY 526 HA2 GLY 526 15.453 20.146 -17.979 86 HA3 GLY 526 HA3 GLY 526 15.533 21.684 -18.843 87 H TRP 527 H TRP 527 18.075 19.271 -19.103 88 HA TRP 527 HA TRP 527 17.277 18.539 -21.906 89 HB2 TRP 527 HB2 TRP 527 19.907 19.390 -20.692 90 HB3 TRP 527 HB3 TRP 527 19.906 18.277 -22.045 91 HD1 TRP 527 HD1 TRP 527 19.550 21.912 -21.220 92 HE1 TRP 527 HE1 TRP 527 19.453 23.302 -23.369 93 HE3 TRP 527 HE3 TRP 527 19.099 18.114 -24.603 94 HZ2 TRP 527 HZ2 TRP 527 19.223 22.824 -26.210 95 HZ3 TRP 527 HZ3 TRP 527 18.943 18.606 -27.041 96 HH2 TRP 527 HH2 TRP 527 19.013 20.950 -27.851 97 H GLU 528 H GLU 528 17.965 16.496 -22.627 98 HA GLU 528 HA GLU 528 18.936 14.503 -20.629 99 HB2 GLU 528 HB2 GLU 528 16.648 13.972 -20.840 100 HB3 GLU 528 HB3 GLU 528 16.615 14.335 -22.546 101 HG2 GLU 528 HG2 GLU 528 16.347 12.018 -22.344 102 HG3 GLU 528 HG3 GLU 528 17.956 12.273 -23.016 103 H ILE 529 H ILE 529 20.233 12.838 -21.540 104 HA ILE 529 HA ILE 529 21.553 13.462 -24.139 105 HB ILE 529 HB ILE 529 23.249 13.054 -21.649 106 HG12 ILE 529 HG12 ILE 529 23.714 15.642 -21.958 107 HG13 ILE 529 HG13 ILE 529 22.078 15.678 -22.574 108 HG21 ILE 529 HG21 ILE 529 24.243 12.645 -23.865 109 HG22 ILE 529 HG22 ILE 529 23.777 14.281 -24.391 110 HG23 ILE 529 HG23 ILE 529 24.970 14.057 -23.088 111 HD11 ILE 529 3HD1 ILE 529 21.796 16.105 -20.280 112 HD12 ILE 529 1HD1 ILE 529 21.524 14.365 -20.298 113 HD13 ILE 529 2HD1 ILE 529 23.102 14.988 -19.810 114 H ARG 530 H ARG 530 21.972 11.624 -25.210 115 HA ARG 530 HA ARG 530 22.125 9.038 -23.709 116 HB2 ARG 530 HB2 ARG 530 20.298 9.517 -26.109 117 HB3 ARG 530 HB3 ARG 530 20.568 7.988 -25.264 118 HG2 ARG 530 HG2 ARG 530 19.863 9.460 -23.135 119 HG3 ARG 530 HG3 ARG 530 19.054 10.436 -24.348 120 HD2 ARG 530 HD2 ARG 530 17.360 8.951 -24.515 121 HD3 ARG 530 HD3 ARG 530 18.442 7.576 -24.711 122 HE ARG 530 HE ARG 530 17.330 8.650 -22.174 123 HH11 ARG 530 HH11 ARG 530 19.710 6.423 -23.496 124 HH12 ARG 530 HH12 ARG 530 20.008 5.701 -21.940 125 HH21 ARG 530 HH21 ARG 530 17.714 7.652 -20.281 126 HH22 ARG 530 HH22 ARG 530 18.857 6.336 -20.173 127 H TYR 531 H TYR 531 22.890 7.260 -24.908 128 HA TYR 531 HA TYR 531 25.068 7.987 -26.832 129 HB2 TYR 531 HB2 TYR 531 25.242 6.219 -24.356 130 HB3 TYR 531 HB3 TYR 531 26.534 6.536 -25.498 131 HD1 TYR 531 HD1 TYR 531 24.402 8.036 -22.827 132 HD2 TYR 531 HD2 TYR 531 27.912 8.502 -25.297 133 HE1 TYR 531 HE1 TYR 531 25.162 9.924 -21.392 134 HE2 TYR 531 HE2 TYR 531 28.698 10.347 -23.824 135 HH TYR 531 HH TYR 531 28.297 11.569 -21.925 136 H THR 532 H THR 532 24.422 6.954 -28.678 137 HA THR 532 HA THR 532 22.707 4.613 -28.584 138 HB THR 532 HB THR 532 22.705 4.719 -30.986 139 HG1 THR 532 HG1 THR 532 24.057 6.414 -31.943 140 HG21 THR 532 HG23 THR 532 21.959 7.041 -31.363 141 HG22 THR 532 HG21 THR 532 21.334 6.409 -29.834 142 HG23 THR 532 HG22 THR 532 22.696 7.545 -29.840 143 H ALA 533 H ALA 533 23.112 2.579 -29.723 144 HA ALA 533 HA ALA 533 25.514 1.280 -28.948 145 HB1 ALA 533 HB3 ALA 533 24.601 -0.612 -30.224 146 HB2 ALA 533 HB1 ALA 533 23.337 0.167 -29.259 147 HB3 ALA 533 HB2 ALA 533 23.424 0.459 -31.014 148 H ALA 534 H ALA 534 25.020 3.302 -31.710 149 HA ALA 534 HA ALA 534 27.172 2.190 -33.357 150 HB1 ALA 534 HB3 ALA 534 26.771 4.202 -34.719 151 HB2 ALA 534 HB1 ALA 534 25.247 3.378 -34.352 152 HB3 ALA 534 HB2 ALA 534 25.700 4.861 -33.467 153 H GLY 535 H GLY 535 27.161 3.979 -30.450 154 HA2 GLY 535 HA2 GLY 535 28.999 4.778 -29.269 155 HA3 GLY 535 HA3 GLY 535 30.008 4.712 -30.716 156 H GLU 536 H GLU 536 26.842 6.346 -30.661 157 HA GLU 536 HA GLU 536 28.226 8.988 -30.986 158 HB2 GLU 536 HB2 GLU 536 25.708 7.961 -32.342 159 HB3 GLU 536 HB3 GLU 536 26.349 9.606 -32.451 160 HG2 GLU 536 HG2 GLU 536 28.511 8.578 -33.348 161 HG3 GLU 536 HG3 GLU 536 27.641 7.048 -33.476 162 H ARG 537 H ARG 537 27.867 10.373 -29.419 163 HA ARG 537 HA ARG 537 25.561 10.196 -27.606 164 HB2 ARG 537 HB2 ARG 537 27.560 10.888 -26.576 165 HB3 ARG 537 HB3 ARG 537 27.928 12.073 -27.835 166 HG2 ARG 537 HG2 ARG 537 26.340 13.617 -27.059 167 HG3 ARG 537 HG3 ARG 537 25.419 12.398 -26.174 168 HD2 ARG 537 HD2 ARG 537 26.673 14.025 -24.758 169 HD3 ARG 537 HD3 ARG 537 26.914 12.314 -24.399 170 HE ARG 537 HE ARG 537 28.997 13.151 -26.152 171 HH11 ARG 537 HH11 ARG 537 27.997 13.783 -22.855 172 HH12 ARG 537 HH12 ARG 537 29.633 14.005 -22.299 173 HH21 ARG 537 HH21 ARG 537 31.077 13.407 -25.360 174 HH22 ARG 537 HH22 ARG 537 31.320 13.784 -23.680 175 H PHE 538 H PHE 538 23.780 11.372 -27.628 176 HA PHE 538 HA PHE 538 23.464 13.706 -29.449 177 HB2 PHE 538 HB2 PHE 538 21.500 11.394 -29.172 178 HB3 PHE 538 HB3 PHE 538 21.118 12.938 -29.914 179 HD1 PHE 538 HD1 PHE 538 22.003 13.579 -32.113 180 HD2 PHE 538 HD2 PHE 538 22.914 9.758 -30.345 181 HE1 PHE 538 HE1 PHE 538 22.702 12.716 -34.338 182 HE2 PHE 538 HE2 PHE 538 23.601 8.895 -32.570 183 HZ PHE 538 HZ PHE 538 23.502 10.370 -34.561 184 H PHE 539 H PHE 539 21.711 15.078 -28.821 185 HA PHE 539 HA PHE 539 21.079 15.036 -25.896 186 HB2 PHE 539 HB2 PHE 539 21.641 17.387 -27.733 187 HB3 PHE 539 HB3 PHE 539 21.136 17.501 -26.059 188 HD1 PHE 539 HD1 PHE 539 23.942 16.451 -28.284 189 HD2 PHE 539 HD2 PHE 539 22.688 17.324 -24.253 190 HE1 PHE 539 HE1 PHE 539 26.311 16.421 -27.541 191 HE2 PHE 539 HE2 PHE 539 25.059 17.312 -23.514 192 HZ PHE 539 HZ PHE 539 26.874 16.855 -25.155 193 H VAL 540 H VAL 540 19.101 15.730 -25.278 194 HA VAL 540 HA VAL 540 16.886 15.801 -27.292 195 HB VAL 540 HB VAL 540 17.105 14.224 -24.701 196 HG11 VAL 540 HG11 VAL 540 14.769 15.035 -25.181 197 HG12 VAL 540 HG12 VAL 540 14.839 14.170 -26.732 198 HG13 VAL 540 HG13 VAL 540 14.957 13.297 -25.179 199 HG21 VAL 540 HG23 VAL 540 16.945 12.195 -26.064 200 HG22 VAL 540 HG21 VAL 540 17.003 13.166 -27.549 201 HG23 VAL 540 HG22 VAL 540 18.401 13.110 -26.453 202 H ASP 541 H ASP 541 15.598 17.479 -27.022 203 HA ASP 541 HA ASP 541 15.523 18.963 -24.430 204 HB2 ASP 541 HB2 ASP 541 16.181 20.328 -26.301 205 HB3 ASP 541 HB3 ASP 541 14.844 19.731 -27.289 206 H HIS 542 H HIS 542 13.857 18.453 -23.143 207 HA HIS 542 HA HIS 542 11.419 17.162 -24.144 208 HB2 HIS 542 HB2 HIS 542 12.127 18.219 -21.381 209 HB3 HIS 542 HB3 HIS 542 10.757 17.184 -21.775 210 HD2 HIS 542 HD2 HIS 542 12.521 15.119 -23.699 211 HE1 HIS 542 HE1 HIS 542 14.391 14.153 -19.989 212 H ASN 543 H ASN 543 12.358 20.455 -23.798 213 HA ASN 543 HA ASN 543 9.820 21.552 -22.970 214 HB2 ASN 543 HB2 ASN 543 12.192 22.912 -24.323 215 HB3 ASN 543 HB3 ASN 543 10.883 23.709 -23.461 216 HD21 ASN 543 2HD2 ASN 543 13.951 22.162 -23.137 217 HD22 ASN 543 1HD2 ASN 543 13.995 22.151 -21.373 218 H THR 544 H THR 544 11.267 20.998 -26.173 219 HA THR 544 HA THR 544 8.576 21.315 -27.405 220 HB THR 544 HB THR 544 9.721 23.478 -27.533 221 HG1 THR 544 HG1 THR 544 8.291 23.039 -29.128 222 HG21 THR 544 HG23 THR 544 11.581 23.717 -29.267 223 HG22 THR 544 HG21 THR 544 12.017 23.109 -27.668 224 HG23 THR 544 HG22 THR 544 11.876 21.981 -29.022 225 H ARG 545 H ARG 545 10.386 19.031 -26.754 226 HA ARG 545 HA ARG 545 10.913 16.988 -27.516 227 HB2 ARG 545 HB2 ARG 545 8.458 17.661 -28.708 228 HB3 ARG 545 HB3 ARG 545 9.381 16.963 -30.029 229 HG2 ARG 545 HG2 ARG 545 9.873 14.978 -28.484 230 HG3 ARG 545 HG3 ARG 545 8.739 15.696 -27.333 231 HD2 ARG 545 HD2 ARG 545 8.149 14.623 -30.117 232 HD3 ARG 545 HD3 ARG 545 7.590 13.968 -28.574 233 HE ARG 545 HE ARG 545 6.701 16.689 -28.922 234 HH11 ARG 545 HH11 ARG 545 5.641 13.390 -29.765 235 HH12 ARG 545 HH12 ARG 545 4.260 14.018 -30.581 236 HH21 ARG 545 HH21 ARG 545 4.797 17.305 -29.842 237 HH22 ARG 545 HH22 ARG 545 3.730 16.111 -30.515 238 H ARG 546 H ARG 546 12.395 19.401 -28.847 239 HA ARG 546 HA ARG 546 13.447 18.366 -31.359 240 HB2 ARG 546 HB2 ARG 546 14.216 20.668 -29.522 241 HB3 ARG 546 HB3 ARG 546 15.187 20.251 -30.934 242 HG2 ARG 546 HG2 ARG 546 13.218 20.538 -32.418 243 HG3 ARG 546 HG3 ARG 546 12.225 20.952 -31.023 244 HD2 ARG 546 HD2 ARG 546 12.829 23.008 -32.035 245 HD3 ARG 546 HD3 ARG 546 13.808 22.885 -30.564 246 HE ARG 546 HE ARG 546 15.297 21.798 -32.744 247 HH11 ARG 546 HH11 ARG 546 14.174 24.955 -31.723 248 HH12 ARG 546 HH12 ARG 546 15.438 25.784 -32.590 249 HH21 ARG 546 HH21 ARG 546 16.886 22.918 -33.821 250 HH22 ARG 546 HH22 ARG 546 16.929 24.654 -33.742 251 H THR 547 H THR 547 15.724 18.037 -31.793 252 HA THR 547 HA THR 547 17.385 16.880 -29.636 253 HB THR 547 HB THR 547 17.886 14.880 -31.064 254 HG1 THR 547 HG1 THR 547 15.448 15.506 -32.361 255 HG21 THR 547 HG23 THR 547 15.967 13.550 -30.435 256 HG22 THR 547 HG21 THR 547 16.370 14.673 -29.134 257 HG23 THR 547 HG22 THR 547 14.974 14.998 -30.181 258 H THR 548 H THR 548 19.610 16.470 -30.309 259 HA THR 548 HA THR 548 20.569 17.413 -32.893 260 HB THR 548 HB THR 548 20.259 19.582 -31.944 261 HG1 THR 548 HG1 THR 548 22.286 20.330 -32.148 262 HG21 THR 548 HG23 THR 548 21.409 20.339 -29.891 263 HG22 THR 548 HG21 THR 548 20.182 19.118 -29.544 264 HG23 THR 548 HG22 THR 548 21.897 18.665 -29.562 265 H PHE 549 H PHE 549 22.868 17.192 -33.152 266 HA PHE 549 HA PHE 549 24.030 14.908 -31.653 267 HB2 PHE 549 HB2 PHE 549 23.922 14.867 -34.110 268 HB3 PHE 549 HB3 PHE 549 24.808 16.380 -34.198 269 HD1 PHE 549 HD2 PHE 549 25.239 12.966 -32.606 270 HD2 PHE 549 HD1 PHE 549 27.059 16.212 -34.790 271 HE1 PHE 549 HE2 PHE 549 27.366 11.699 -32.724 272 HE2 PHE 549 HE1 PHE 549 29.183 14.933 -34.911 273 HZ PHE 549 HZ PHE 549 29.340 12.675 -33.881 274 H GLU 550 H GLU 550 24.192 18.324 -31.517 275 HA GLU 550 HA GLU 550 26.824 18.266 -30.099 276 HB2 GLU 550 HB2 GLU 550 27.551 20.247 -31.206 277 HB3 GLU 550 HB3 GLU 550 27.142 19.037 -32.412 278 HG2 GLU 550 HG2 GLU 550 24.927 20.196 -32.764 279 HG3 GLU 550 HG3 GLU 550 25.453 21.453 -31.642 280 H ASP 551 H ASP 551 26.970 20.918 -29.332 281 HA ASP 551 HA ASP 551 24.623 21.199 -27.489 282 HB2 ASP 551 HB2 ASP 551 26.559 20.229 -26.379 283 HB3 ASP 551 HB3 ASP 551 27.563 21.592 -26.886 284 HA PRO 552 HA PRO 552 25.125 25.160 -29.900 285 HB2 PRO 552 HB2 PRO 552 22.613 25.417 -30.891 286 HB3 PRO 552 HB3 PRO 552 23.779 24.254 -31.587 287 HG2 PRO 552 HG2 PRO 552 21.601 23.696 -29.541 288 HG3 PRO 552 HG3 PRO 552 21.920 22.828 -31.080 289 HD2 PRO 552 HD2 PRO 552 22.893 21.964 -28.669 290 HD3 PRO 552 HD3 PRO 552 23.792 21.751 -30.197 291 H ARG 553 H ARG 553 23.649 27.209 -29.727 292 HA ARG 553 HA ARG 553 23.317 28.050 -27.026 293 HB2 ARG 553 HB2 ARG 553 22.250 29.125 -29.673 294 HB3 ARG 553 HB3 ARG 553 21.876 29.892 -28.135 295 HG2 ARG 553 HG2 ARG 553 24.387 30.059 -27.689 296 HG3 ARG 553 HG3 ARG 553 24.640 29.517 -29.355 297 HD2 ARG 553 HD2 ARG 553 24.753 31.933 -29.301 298 HD3 ARG 553 HD3 ARG 553 23.284 31.449 -30.161 299 HE ARG 553 HE ARG 553 23.077 32.058 -27.252 300 HH11 ARG 553 HH11 ARG 553 22.509 33.318 -30.469 301 HH12 ARG 553 HH12 ARG 553 21.342 34.483 -29.904 302 HH21 ARG 553 HH21 ARG 553 21.582 33.558 -26.600 303 HH22 ARG 553 HH22 ARG 553 20.861 34.626 -27.768 304 HA PRO 554 HA PRO 554 19.407 26.439 -25.802 305 HB2 PRO 554 HB2 PRO 554 18.509 28.281 -23.974 306 HB3 PRO 554 HB3 PRO 554 19.899 27.191 -23.688 307 HG2 PRO 554 HG2 PRO 554 19.962 30.072 -24.639 308 HG3 PRO 554 HG3 PRO 554 20.921 29.317 -23.323 309 HD2 PRO 554 HD2 PRO 554 21.943 29.644 -25.815 310 HD3 PRO 554 HD3 PRO 554 22.305 28.178 -24.859 311 H GLY 555 H GLY 555 19.401 29.746 -27.078 312 HA2 GLY 555 HA2 GLY 555 17.914 29.611 -29.185 313 HA3 GLY 555 HA3 GLY 555 16.582 29.466 -28.037 314 H ALA 556 H ALA 556 17.167 31.298 -26.101 315 HA ALA 556 HA ALA 556 17.671 33.945 -27.264 316 HB1 ALA 556 HB3 ALA 556 15.349 34.735 -26.723 317 HB2 ALA 556 HB1 ALA 556 15.348 33.485 -27.978 318 HB3 ALA 556 HB2 ALA 556 14.899 33.071 -26.307 319 HA PRO 557 HA PRO 557 18.623 34.820 -22.950 320 HB2 PRO 557 HB2 PRO 557 18.232 37.528 -22.775 321 HB3 PRO 557 HB3 PRO 557 19.603 36.777 -23.651 322 HG2 PRO 557 HG2 PRO 557 16.983 37.784 -24.800 323 HG3 PRO 557 HG3 PRO 557 18.648 38.094 -25.393 324 HD2 PRO 557 HD2 PRO 557 17.064 36.167 -26.480 325 HD3 PRO 557 HD3 PRO 557 18.824 35.928 -26.301 326 H ASN2319 H ASN2319 32.703 14.391 -34.746 327 HA ASN2319 HA ASN2319 34.002 13.857 -37.336 328 HB2 ASN2319 HB2 ASN2319 33.362 11.891 -35.078 329 HB3 ASN2319 HB3 ASN2319 33.814 11.433 -36.717 330 HD21 ASN2319 2HD2 ASN2319 35.966 10.726 -36.720 331 HD22 ASN2319 1HD2 ASN2319 37.243 11.543 -35.838 332 H THR2320 H THR2320 32.673 13.043 -38.947 333 HA THR2320 HA THR2320 29.782 13.460 -38.665 334 HB THR2320 HB THR2320 29.731 12.750 -41.053 335 HG1 THR2320 HG1 THR2320 32.421 12.970 -41.410 336 HG21 THR2320 HG23 THR2320 30.890 14.689 -41.977 337 HG22 THR2320 HG21 THR2320 30.062 15.132 -40.477 338 HG23 THR2320 HG22 THR2320 31.822 14.898 -40.475 339 H GLY2321 H GLY2321 28.191 11.850 -39.296 340 HA2 GLY2321 HA2 GLY2321 28.546 9.188 -39.901 341 HA3 GLY2321 HA3 GLY2321 28.566 9.201 -38.134 342 H ALA2322 H ALA2322 26.718 10.290 -37.055 343 HA ALA2322 HA ALA2322 24.563 10.324 -36.516 344 HB1 ALA2322 HB3 ALA2322 23.106 11.745 -37.864 345 HB2 ALA2322 HB1 ALA2322 24.737 12.428 -37.770 346 HB3 ALA2322 HB2 ALA2322 24.206 11.597 -39.252 347 H LYS2323 H LYS2323 25.198 7.820 -37.127 348 HA LYS2323 HA LYS2323 23.572 6.571 -39.198 349 HB2 LYS2323 HB2 LYS2323 25.854 5.820 -38.216 350 HB3 LYS2323 HB3 LYS2323 24.948 5.232 -36.829 351 HG2 LYS2323 HG2 LYS2323 25.398 3.389 -38.285 352 HG3 LYS2323 HG3 LYS2323 23.670 3.699 -38.380 353 HD2 LYS2323 HD2 LYS2323 24.017 4.893 -40.560 354 HD3 LYS2323 HD3 LYS2323 25.759 4.668 -40.386 355 HE2 LYS2323 HE2 LYS2323 25.064 3.001 -41.900 356 HE3 LYS2323 HE3 LYS2323 25.373 2.170 -40.378 357 HZ1 LYS2323 HZ3 LYS2323 23.288 1.442 -41.393 358 HZ2 LYS2323 HZ1 LYS2323 22.952 2.182 -39.977 359 HZ3 LYS2323 HZ2 LYS2323 22.689 2.958 -41.394 360 H GLN2324 H GLN2324 22.923 7.488 -35.971 361 HA GLN2324 HA GLN2324 20.518 5.713 -35.729 362 HB2 GLN2324 HB2 GLN2324 22.565 6.675 -33.712 363 HB3 GLN2324 HB3 GLN2324 21.024 5.971 -33.235 364 HG2 GLN2324 HG2 GLN2324 22.908 4.438 -35.074 365 HG3 GLN2324 HG3 GLN2324 23.163 4.494 -33.340 366 HE21 GLN2324 HE22 GLN2324 22.835 2.155 -33.270 367 HE22 GLN2324 HE21 GLN2324 21.187 1.547 -33.282 368 HA PRO2325 HA PRO2325 18.754 9.927 -35.522 369 HB2 PRO2325 HB2 PRO2325 16.103 9.298 -35.789 370 HB3 PRO2325 HB3 PRO2325 17.257 9.357 -37.153 371 HG2 PRO2325 HG2 PRO2325 16.308 6.924 -35.620 372 HG3 PRO2325 HG3 PRO2325 16.465 7.132 -37.391 373 HD2 PRO2325 HD2 PRO2325 18.365 5.887 -35.858 374 HD3 PRO2325 HD3 PRO2325 18.795 6.838 -37.312 375 HA PRO2326 HA PRO2326 17.837 9.398 -31.071 376 HB2 PRO2326 HB2 PRO2326 17.923 12.005 -30.277 377 HB3 PRO2326 HB3 PRO2326 19.388 11.059 -30.675 378 HG2 PRO2326 HG2 PRO2326 17.873 12.970 -32.485 379 HG3 PRO2326 HG3 PRO2326 19.627 12.932 -32.158 380 HD2 PRO2326 HD2 PRO2326 18.516 11.748 -34.347 381 HD3 PRO2326 HD3 PRO2326 19.912 11.009 -33.504 382 H SER2327 H SER2327 15.852 8.990 -30.366 383 HA SER2327 HA SER2327 13.625 10.931 -30.628 384 HB2 SER2327 HB2 SER2327 13.432 8.057 -31.629 385 HB3 SER2327 HB3 SER2327 12.065 9.159 -31.383 386 HG SER2327 HG SER2327 12.718 9.160 -33.553 387 H TYR2328 H TYR2328 13.653 11.221 -28.401 388 HA TYR2328 HA TYR2328 13.280 8.866 -26.616 389 HB2 TYR2328 HB2 TYR2328 14.905 10.624 -26.030 390 HB3 TYR2328 HB3 TYR2328 13.612 11.814 -26.022 391 HD1 TYR2328 HD1 TYR2328 14.725 8.609 -24.403 392 HD2 TYR2328 HD2 TYR2328 12.428 12.239 -23.993 393 HE1 TYR2328 HE1 TYR2328 14.349 8.103 -21.995 394 HE2 TYR2328 HE2 TYR2328 12.038 11.718 -21.589 395 HH TYR2328 HH TYR2328 13.382 8.787 -20.029 396 H GLU2329 H GLU2329 11.644 12.032 -26.221 397 HA GLU2329 HA GLU2329 9.069 10.861 -25.738 398 HB2 GLU2329 HB2 GLU2329 9.983 13.669 -26.338 399 HB3 GLU2329 HB3 GLU2329 8.263 13.251 -26.306 400 HG2 GLU2329 HG2 GLU2329 8.560 12.276 -24.018 401 HG3 GLU2329 HG3 GLU2329 10.217 12.882 -24.012 402 H ASP2330 H ASP2330 10.503 12.178 -28.753 403 HA ASP2330 HA ASP2330 8.168 11.926 -30.341 404 HB2 ASP2330 HB2 ASP2330 10.303 13.180 -30.858 405 HB3 ASP2330 HB3 ASP2330 11.041 11.635 -31.280 406 H CYS2331 H CYS2331 10.050 9.361 -29.032 407 HA CYS2331 HA CYS2331 8.968 7.360 -30.965 408 HB2 CYS2331 HB2 CYS2331 11.350 7.194 -30.296 409 HB3 CYS2331 HB3 CYS2331 10.863 7.022 -28.601 410 HG CYS2331 HG CYS2331 10.068 5.115 -31.215 411 H ILE2332 H ILE2332 8.911 8.083 -27.392 412 HA ILE2332 HA ILE2332 6.931 6.010 -26.959 413 HB ILE2332 HB ILE2332 6.843 6.721 -24.659 414 HG12 ILE2332 HG12 ILE2332 8.918 8.838 -25.190 415 HG13 ILE2332 HG13 ILE2332 7.211 9.243 -25.170 416 HG21 ILE2332 HG21 ILE2332 8.628 5.200 -25.493 417 HG22 ILE2332 HG22 ILE2332 9.713 6.596 -25.684 418 HG23 ILE2332 HG23 ILE2332 9.136 6.124 -24.073 419 HD11 ILE2332 3HD1 ILE2332 8.191 9.720 -23.006 420 HD12 ILE2332 1HD1 ILE2332 7.026 8.383 -22.854 421 HD13 ILE2332 2HD1 ILE2332 8.779 8.050 -22.854 422 H LYS2333 H LYS2333 6.553 9.368 -27.789 423 HA LYS2333 HA LYS2333 3.652 8.984 -27.997 424 HB2 LYS2333 HB2 LYS2333 3.100 11.105 -26.882 425 HB3 LYS2333 HB3 LYS2333 3.682 9.853 -25.809 426 HG2 LYS2333 HG2 LYS2333 5.129 11.275 -24.905 427 HG3 LYS2333 HG3 LYS2333 6.011 11.338 -26.413 428 HD2 LYS2333 HD2 LYS2333 5.561 13.576 -25.786 429 HD3 LYS2333 HD3 LYS2333 4.502 13.229 -27.159 430 HE2 LYS2333 HE2 LYS2333 2.608 12.822 -25.599 431 HE3 LYS2333 HE3 LYS2333 3.680 13.109 -24.221 432 HZ1 LYS2333 HZ3 LYS2333 2.407 15.096 -24.771 433 HZ2 LYS2333 HZ1 LYS2333 3.993 15.388 -25.015 434 HZ3 LYS2333 HZ2 LYS2333 2.998 15.129 -26.289
Contact the webmaster for help, if required. Sunday, May 19, 2024 4:45:11 AM GMT (wattos1)