NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
565208 | 2ltb | 18466 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 ALA 500 H1 ALA 500 13.742 -12.013 11.052 2 H2 ALA 500 H2 ALA 500 14.732 -11.559 9.754 3 H3 ALA 500 H3 ALA 500 15.403 -12.344 11.101 4 HA ALA 500 HA ALA 500 15.189 -13.854 9.241 5 HB1 ALA 500 HB1 ALA 500 15.007 -14.705 11.535 6 HB2 ALA 500 HB2 ALA 500 13.260 -14.476 11.471 7 HB3 ALA 500 HB3 ALA 500 14.034 -15.642 10.401 8 H GLY 501 HN GLY 501 12.085 -12.495 10.304 9 HA2 GLY 501 HA2 GLY 501 10.362 -11.856 8.806 10 HA3 GLY 501 HA3 GLY 501 11.033 -12.954 7.606 11 H MET 502 HN MET 502 8.329 -12.929 8.174 12 HA MET 502 HA MET 502 7.960 -15.406 9.714 13 HB2 MET 502 HB2 MET 502 5.981 -13.244 8.978 14 HB3 MET 502 HB3 MET 502 5.527 -14.767 9.723 15 HG2 MET 502 HG2 MET 502 5.610 -13.225 11.474 16 HG3 MET 502 HG3 MET 502 7.094 -14.163 11.610 17 HE1 MET 502 HE1 MET 502 6.169 -11.189 9.148 18 HE2 MET 502 HE2 MET 502 5.458 -10.762 10.704 19 HE3 MET 502 HE3 MET 502 6.809 -9.826 10.063 20 H GLY 503 HN GLY 503 6.351 -13.816 6.959 21 HA2 GLY 503 HA2 GLY 503 6.917 -16.083 5.258 22 HA3 GLY 503 HA3 GLY 503 5.224 -15.909 5.697 23 H THR 504 HN THR 504 4.165 -15.098 4.025 24 HA THR 504 HA THR 504 5.414 -13.340 2.121 25 HB THR 504 HB THR 504 3.107 -13.265 1.115 26 HG1 THR 504 HG1 THR 504 1.800 -15.132 2.134 27 HG21 THR 504 HG21 THR 504 4.274 -16.000 1.653 28 HG22 THR 504 HG22 THR 504 4.724 -14.910 0.341 29 HG23 THR 504 HG23 THR 504 3.111 -15.621 0.382 30 H VAL 505 HN VAL 505 4.160 -11.296 1.466 31 HA VAL 505 HA VAL 505 4.095 -9.460 3.554 32 HB VAL 505 HB VAL 505 2.784 -7.986 1.969 33 HG11 VAL 505 HG11 VAL 505 5.299 -9.292 0.926 34 HG12 VAL 505 HG12 VAL 505 4.652 -7.744 0.383 35 HG13 VAL 505 HG13 VAL 505 5.216 -7.931 2.044 36 HG21 VAL 505 HG21 VAL 505 3.099 -10.365 0.141 37 HG22 VAL 505 HG22 VAL 505 1.578 -9.725 0.760 38 HG23 VAL 505 HG23 VAL 505 2.556 -8.762 -0.349 39 H MET 506 HN MET 506 1.527 -11.472 2.230 40 HA MET 506 HA MET 506 -0.668 -10.264 3.490 41 HB2 MET 506 HB2 MET 506 -0.227 -13.137 2.668 42 HB3 MET 506 HB3 MET 506 -1.758 -12.522 3.274 43 HG2 MET 506 HG2 MET 506 -0.335 -11.636 0.777 44 HG3 MET 506 HG3 MET 506 -1.777 -12.641 0.861 45 HE1 MET 506 HE1 MET 506 -4.152 -11.732 1.744 46 HE2 MET 506 HE2 MET 506 -3.366 -11.209 3.235 47 HE3 MET 506 HE3 MET 506 -4.392 -10.089 2.339 48 H ASP 507 HN ASP 507 1.681 -12.609 4.623 49 HA ASP 507 HA ASP 507 0.289 -13.365 6.973 50 HB2 ASP 507 HB2 ASP 507 2.132 -14.704 5.983 51 HB3 ASP 507 HB3 ASP 507 3.270 -13.440 6.444 52 H VAL 508 HN VAL 508 2.570 -10.834 6.195 53 HA VAL 508 HA VAL 508 2.978 -9.932 8.867 54 HB VAL 508 HB VAL 508 3.336 -8.393 6.289 55 HG11 VAL 508 HG11 VAL 508 4.958 -7.068 7.575 56 HG12 VAL 508 HG12 VAL 508 3.327 -6.945 8.236 57 HG13 VAL 508 HG13 VAL 508 4.526 -7.971 9.028 58 HG21 VAL 508 HG21 VAL 508 5.694 -9.087 6.422 59 HG22 VAL 508 HG22 VAL 508 5.297 -10.121 7.795 60 HG23 VAL 508 HG23 VAL 508 4.605 -10.459 6.209 61 H LEU 509 HN LEU 509 0.812 -9.020 6.230 62 HA LEU 509 HA LEU 509 -0.221 -6.661 7.357 63 HB2 LEU 509 HB2 LEU 509 -1.603 -8.561 5.468 64 HB3 LEU 509 HB3 LEU 509 -2.039 -6.887 5.753 65 HG LEU 509 HG LEU 509 0.541 -7.833 4.518 66 HD11 LEU 509 HD11 LEU 509 -1.361 -8.207 3.052 67 HD12 LEU 509 HD12 LEU 509 -1.881 -6.537 3.275 68 HD13 LEU 509 HD13 LEU 509 -0.363 -6.886 2.448 69 HD21 LEU 509 HD21 LEU 509 0.852 -5.762 5.731 70 HD22 LEU 509 HD22 LEU 509 0.878 -5.446 3.995 71 HD23 LEU 509 HD23 LEU 509 -0.560 -5.057 4.944 72 H LYS 510 HN LYS 510 -1.064 -10.003 7.854 73 HA LYS 510 HA LYS 510 -3.528 -9.307 9.235 74 HB2 LYS 510 HB2 LYS 510 -3.876 -11.720 9.464 75 HB3 LYS 510 HB3 LYS 510 -3.552 -11.278 7.795 76 HG2 LYS 510 HG2 LYS 510 -1.293 -12.088 7.970 77 HG3 LYS 510 HG3 LYS 510 -1.509 -12.411 9.691 78 HD2 LYS 510 HD2 LYS 510 -3.162 -14.104 9.206 79 HD3 LYS 510 HD3 LYS 510 -3.090 -13.725 7.483 80 HE2 LYS 510 HE2 LYS 510 -1.799 -15.730 8.007 81 HE3 LYS 510 HE3 LYS 510 -0.762 -14.434 7.412 82 HZ1 LYS 510 HZ1 LYS 510 -0.310 -13.923 9.817 83 HZ2 LYS 510 HZ2 LYS 510 0.340 -15.372 9.239 84 HZ3 LYS 510 HZ3 LYS 510 -1.060 -15.395 10.199 85 H GLY 511 HN GLY 511 -0.263 -9.767 9.947 86 HA2 GLY 511 HA2 GLY 511 -0.700 -10.482 12.723 87 HA3 GLY 511 HA3 GLY 511 0.848 -10.109 11.970 88 H ASP 512 HN ASP 512 -0.835 -7.701 10.840 89 HA ASP 512 HA ASP 512 -0.274 -5.984 13.180 90 HB2 ASP 512 HB2 ASP 512 1.026 -5.593 11.031 91 HB3 ASP 512 HB3 ASP 512 -0.492 -5.076 10.306 92 H ASN 513 HN ASN 513 -1.850 -4.721 14.004 93 HA ASN 513 HA ASN 513 -4.551 -5.400 13.380 94 HB2 ASN 513 HB2 ASN 513 -3.454 -3.277 15.235 95 HB3 ASN 513 HB3 ASN 513 -5.132 -3.808 15.176 96 HD21 ASN 513 HD21 ASN 513 -5.694 -5.792 16.037 97 HD22 ASN 513 HD22 ASN 513 -4.616 -6.695 17.054 98 H ARG 514 HN ARG 514 -2.416 -2.927 12.341 99 HA ARG 514 HA ARG 514 -4.515 -1.046 11.666 100 HB2 ARG 514 HB2 ARG 514 -1.552 -1.014 11.056 101 HB3 ARG 514 HB3 ARG 514 -2.663 0.327 10.801 102 HG2 ARG 514 HG2 ARG 514 -2.943 0.682 13.092 103 HG3 ARG 514 HG3 ARG 514 -2.288 -0.903 13.507 104 HD2 ARG 514 HD2 ARG 514 -0.700 1.328 12.247 105 HD3 ARG 514 HD3 ARG 514 -0.742 0.989 13.977 106 HE ARG 514 HE ARG 514 -0.007 -1.306 12.407 107 HH11 ARG 514 HH12 ARG 514 1.206 1.633 13.898 108 HH12 ARG 514 HH11 ARG 514 2.832 1.040 14.037 109 HH21 ARG 514 HH22 ARG 514 2.121 -2.086 12.595 110 HH22 ARG 514 HH21 ARG 514 3.354 -1.058 13.288 111 H PHE 515 HN PHE 515 -2.485 -3.424 10.087 112 HA PHE 515 HA PHE 515 -3.267 -2.678 7.419 113 HB2 PHE 515 HB2 PHE 515 -1.896 -5.182 8.416 114 HB3 PHE 515 HB3 PHE 515 -1.988 -4.631 6.756 115 HD1 PHE 515 HD1 PHE 515 -1.557 -1.629 7.995 116 HD2 PHE 515 HD2 PHE 515 0.559 -5.318 7.964 117 HE1 PHE 515 HE1 PHE 515 0.563 -0.417 8.287 118 HE2 PHE 515 HE2 PHE 515 2.676 -4.116 8.250 119 HZ PHE 515 HZ PHE 515 2.679 -1.661 8.410 120 H SER 516 HN SER 516 -4.780 -4.252 9.913 121 HA SER 516 HA SER 516 -5.795 -6.593 8.804 122 HB2 SER 516 HB2 SER 516 -5.853 -6.030 11.220 123 HB3 SER 516 HB3 SER 516 -7.117 -4.846 10.886 124 HG SER 516 HG SER 516 -7.580 -7.397 9.914 125 H MET 517 HN MET 517 -7.190 -3.305 8.792 126 HA MET 517 HA MET 517 -9.593 -4.071 7.492 127 HB2 MET 517 HB2 MET 517 -8.218 -1.387 7.636 128 HB3 MET 517 HB3 MET 517 -9.801 -1.637 6.914 129 HG2 MET 517 HG2 MET 517 -10.244 -0.857 9.063 130 HG3 MET 517 HG3 MET 517 -10.492 -2.599 9.163 131 HE1 MET 517 HE1 MET 517 -7.073 -0.630 9.037 132 HE2 MET 517 HE2 MET 517 -8.175 0.400 9.952 133 HE3 MET 517 HE3 MET 517 -6.802 -0.360 10.759 134 H LEU 518 HN LEU 518 -6.397 -3.243 6.350 135 HA LEU 518 HA LEU 518 -7.138 -2.945 3.625 136 HB2 LEU 518 HB2 LEU 518 -5.021 -2.066 4.390 137 HB3 LEU 518 HB3 LEU 518 -4.495 -3.663 4.887 138 HG LEU 518 HG LEU 518 -4.548 -4.374 2.503 139 HD11 LEU 518 HD11 LEU 518 -6.164 -2.801 1.645 140 HD12 LEU 518 HD12 LEU 518 -5.084 -1.453 2.008 141 HD13 LEU 518 HD13 LEU 518 -4.640 -2.630 0.772 142 HD21 LEU 518 HD21 LEU 518 -2.519 -3.184 1.843 143 HD22 LEU 518 HD22 LEU 518 -2.806 -1.996 3.114 144 HD23 LEU 518 HD23 LEU 518 -2.464 -3.674 3.537 145 H VAL 519 HN VAL 519 -6.003 -5.669 5.570 146 HA VAL 519 HA VAL 519 -5.950 -7.624 3.579 147 HB VAL 519 HB VAL 519 -6.855 -7.998 6.446 148 HG11 VAL 519 HG11 VAL 519 -5.740 -9.994 4.474 149 HG12 VAL 519 HG12 VAL 519 -6.138 -10.317 6.160 150 HG13 VAL 519 HG13 VAL 519 -7.414 -9.901 5.018 151 HG21 VAL 519 HG21 VAL 519 -4.663 -6.933 6.329 152 HG22 VAL 519 HG22 VAL 519 -4.535 -8.587 6.924 153 HG23 VAL 519 HG23 VAL 519 -4.090 -8.212 5.260 154 H ALA 520 HN ALA 520 -8.629 -6.226 5.365 155 HA ALA 520 HA ALA 520 -10.592 -8.103 4.499 156 HB1 ALA 520 HB1 ALA 520 -10.971 -5.283 5.511 157 HB2 ALA 520 HB2 ALA 520 -12.224 -6.519 5.375 158 HB3 ALA 520 HB3 ALA 520 -10.889 -6.733 6.511 159 H ALA 521 HN ALA 521 -9.514 -4.937 3.342 160 HA ALA 521 HA ALA 521 -11.369 -4.730 1.215 161 HB1 ALA 521 HB1 ALA 521 -9.896 -3.007 0.337 162 HB2 ALA 521 HB2 ALA 521 -10.103 -2.810 2.077 163 HB3 ALA 521 HB3 ALA 521 -8.619 -3.518 1.437 164 H ILE 522 HN ILE 522 -8.018 -5.883 1.383 165 HA ILE 522 HA ILE 522 -7.645 -6.628 -1.263 166 HB ILE 522 HB ILE 522 -6.557 -7.893 1.256 167 HG12 ILE 522 HG12 ILE 522 -5.332 -5.971 -0.735 168 HG13 ILE 522 HG13 ILE 522 -5.932 -5.535 0.863 169 HG21 ILE 522 HG21 ILE 522 -6.424 -9.537 -0.499 170 HG22 ILE 522 HG22 ILE 522 -5.737 -8.347 -1.606 171 HG23 ILE 522 HG23 ILE 522 -4.814 -8.876 -0.199 172 HD11 ILE 522 HD11 ILE 522 -3.634 -7.393 0.282 173 HD12 ILE 522 HD12 ILE 522 -3.515 -5.728 0.847 174 HD13 ILE 522 HD13 ILE 522 -4.232 -6.959 1.884 175 H GLN 523 HN GLN 523 -9.054 -8.523 1.397 176 HA GLN 523 HA GLN 523 -9.470 -10.874 -0.081 177 HB2 GLN 523 HB2 GLN 523 -10.708 -9.753 2.425 178 HB3 GLN 523 HB3 GLN 523 -11.157 -11.317 1.777 179 HG2 GLN 523 HG2 GLN 523 -8.818 -12.046 1.964 180 HG3 GLN 523 HG3 GLN 523 -8.419 -10.483 2.675 181 HE21 GLN 523 HE21 GLN 523 -11.011 -10.396 4.114 182 HE22 GLN 523 HE22 GLN 523 -10.814 -11.471 5.460 183 H SER 524 HN SER 524 -11.565 -8.093 0.598 184 HA SER 524 HA SER 524 -13.869 -9.228 -0.607 185 HB2 SER 524 HB2 SER 524 -13.950 -7.426 1.101 186 HB3 SER 524 HB3 SER 524 -13.270 -6.307 -0.081 187 HG SER 524 HG SER 524 -15.204 -7.121 -1.397 188 H ALA 525 HN ALA 525 -11.229 -7.263 -1.840 189 HA ALA 525 HA ALA 525 -12.585 -6.802 -4.360 190 HB1 ALA 525 HB1 ALA 525 -11.084 -5.111 -3.299 191 HB2 ALA 525 HB2 ALA 525 -9.724 -6.164 -3.678 192 HB3 ALA 525 HB3 ALA 525 -10.700 -5.477 -4.982 193 H GLY 526 HN GLY 526 -10.289 -9.038 -3.023 194 HA2 GLY 526 HA2 GLY 526 -9.872 -11.168 -3.924 195 HA3 GLY 526 HA3 GLY 526 -10.454 -10.603 -5.481 196 H LEU 527 HN LEU 527 -8.069 -8.894 -3.569 197 HA LEU 527 HA LEU 527 -6.190 -9.161 -5.787 198 HB2 LEU 527 HB2 LEU 527 -6.622 -7.235 -3.602 199 HB3 LEU 527 HB3 LEU 527 -4.938 -7.564 -3.959 200 HG LEU 527 HG LEU 527 -5.790 -5.588 -5.152 201 HD11 LEU 527 HD11 LEU 527 -5.024 -6.244 -7.409 202 HD12 LEU 527 HD12 LEU 527 -3.946 -6.789 -6.124 203 HD13 LEU 527 HD13 LEU 527 -5.047 -7.931 -6.892 204 HD21 LEU 527 HD21 LEU 527 -8.092 -6.235 -5.450 205 HD22 LEU 527 HD22 LEU 527 -7.359 -5.903 -7.017 206 HD23 LEU 527 HD23 LEU 527 -7.612 -7.567 -6.497 207 H THR 528 HN THR 528 -6.840 -10.825 -3.031 208 HA THR 528 HA THR 528 -4.458 -11.135 -1.672 209 HB THR 528 HB THR 528 -6.416 -13.384 -2.150 210 HG1 THR 528 HG1 THR 528 -6.851 -11.860 0.074 211 HG21 THR 528 HG21 THR 528 -4.737 -12.639 0.253 212 HG22 THR 528 HG22 THR 528 -4.362 -13.929 -0.891 213 HG23 THR 528 HG23 THR 528 -5.805 -14.037 0.118 214 H GLU 529 HN GLU 529 -5.535 -12.717 -4.635 215 HA GLU 529 HA GLU 529 -3.624 -14.770 -4.710 216 HB2 GLU 529 HB2 GLU 529 -5.184 -13.405 -6.894 217 HB3 GLU 529 HB3 GLU 529 -4.164 -14.810 -7.174 218 HG2 GLU 529 HG2 GLU 529 -6.421 -14.775 -5.195 219 HG3 GLU 529 HG3 GLU 529 -6.606 -15.271 -6.875 220 H THR 530 HN THR 530 -3.293 -11.402 -5.362 221 HA THR 530 HA THR 530 -0.981 -11.639 -7.042 222 HB THR 530 HB THR 530 -1.955 -9.266 -5.428 223 HG1 THR 530 HG1 THR 530 -3.092 -10.418 -7.453 224 HG21 THR 530 HG21 THR 530 -0.603 -7.928 -6.957 225 HG22 THR 530 HG22 THR 530 -0.035 -9.395 -7.754 226 HG23 THR 530 HG23 THR 530 0.408 -9.075 -6.076 227 H LEU 531 HN LEU 531 -1.446 -10.641 -3.637 228 HA LEU 531 HA LEU 531 1.324 -10.756 -3.029 229 HB2 LEU 531 HB2 LEU 531 -1.052 -10.724 -1.174 230 HB3 LEU 531 HB3 LEU 531 0.593 -10.311 -0.764 231 HG LEU 531 HG LEU 531 -0.443 -8.272 -0.953 232 HD11 LEU 531 HD11 LEU 531 0.785 -8.786 -3.633 233 HD12 LEU 531 HD12 LEU 531 0.431 -7.188 -2.972 234 HD13 LEU 531 HD13 LEU 531 1.611 -8.229 -2.176 235 HD21 LEU 531 HD21 LEU 531 -1.713 -8.860 -3.575 236 HD22 LEU 531 HD22 LEU 531 -2.499 -9.274 -2.048 237 HD23 LEU 531 HD23 LEU 531 -2.093 -7.598 -2.408 238 H ASN 532 HN ASN 532 -0.924 -13.125 -3.515 239 HA ASN 532 HA ASN 532 -0.063 -15.001 -1.505 240 HB2 ASN 532 HB2 ASN 532 -2.375 -14.967 -2.459 241 HB3 ASN 532 HB3 ASN 532 -1.709 -15.475 -4.003 242 HD21 ASN 532 HD21 ASN 532 -3.050 -17.304 -3.950 243 HD22 ASN 532 HD22 ASN 532 -2.655 -18.666 -2.955 244 H ARG 533 HN ARG 533 1.269 -13.841 -4.295 245 HA ARG 533 HA ARG 533 2.741 -16.332 -4.840 246 HB2 ARG 533 HB2 ARG 533 2.322 -13.885 -6.564 247 HB3 ARG 533 HB3 ARG 533 3.346 -15.244 -7.002 248 HG2 ARG 533 HG2 ARG 533 0.383 -15.391 -6.498 249 HG3 ARG 533 HG3 ARG 533 1.150 -15.335 -8.088 250 HD2 ARG 533 HD2 ARG 533 1.464 -17.485 -5.995 251 HD3 ARG 533 HD3 ARG 533 0.591 -17.623 -7.521 252 HE ARG 533 HE ARG 533 3.178 -16.915 -8.194 253 HH11 ARG 533 HH12 ARG 533 1.624 -19.579 -6.527 254 HH12 ARG 533 HH11 ARG 533 2.833 -20.744 -6.983 255 HH21 ARG 533 HH22 ARG 533 4.782 -18.426 -8.777 256 HH22 ARG 533 HH21 ARG 533 4.620 -20.083 -8.269 257 H GLU 534 HN GLU 534 5.007 -16.281 -4.890 258 HA GLU 534 HA GLU 534 6.178 -14.045 -3.454 259 HB2 GLU 534 HB2 GLU 534 7.471 -16.645 -4.296 260 HB3 GLU 534 HB3 GLU 534 8.177 -15.430 -3.236 261 HG2 GLU 534 HG2 GLU 534 6.324 -15.823 -1.636 262 HG3 GLU 534 HG3 GLU 534 5.773 -17.144 -2.668 263 H GLY 535 HN GLY 535 8.171 -13.057 -4.190 264 HA2 GLY 535 HA2 GLY 535 9.459 -13.009 -6.521 265 HA3 GLY 535 HA3 GLY 535 7.884 -12.383 -7.001 266 H VAL 536 HN VAL 536 8.202 -10.250 -7.317 267 HA VAL 536 HA VAL 536 9.365 -8.774 -5.056 268 HB VAL 536 HB VAL 536 10.213 -7.086 -6.626 269 HG11 VAL 536 HG11 VAL 536 11.092 -9.924 -7.151 270 HG12 VAL 536 HG12 VAL 536 11.993 -8.494 -7.673 271 HG13 VAL 536 HG13 VAL 536 11.742 -8.801 -5.953 272 HG21 VAL 536 HG21 VAL 536 9.318 -8.980 -8.803 273 HG22 VAL 536 HG22 VAL 536 8.602 -7.407 -8.451 274 HG23 VAL 536 HG23 VAL 536 10.265 -7.510 -9.034 275 H TYR 537 HN TYR 537 8.112 -7.311 -4.164 276 HA TYR 537 HA TYR 537 6.098 -5.845 -5.634 277 HB2 TYR 537 HB2 TYR 537 5.348 -7.736 -3.384 278 HB3 TYR 537 HB3 TYR 537 4.304 -6.436 -3.946 279 HD1 TYR 537 HD2 TYR 537 3.542 -6.498 -6.385 280 HD2 TYR 537 HD1 TYR 537 5.317 -9.833 -4.423 281 HE1 TYR 537 HE2 TYR 537 2.613 -7.996 -8.099 282 HE2 TYR 537 HE1 TYR 537 4.395 -11.338 -6.135 283 HH TYR 537 HH TYR 537 3.038 -10.184 -9.045 284 H THR 538 HN THR 538 5.373 -4.007 -4.513 285 HA THR 538 HA THR 538 6.609 -3.523 -1.887 286 HB THR 538 HB THR 538 6.408 -1.531 -4.159 287 HG1 THR 538 HG1 THR 538 8.312 -2.354 -4.611 288 HG21 THR 538 HG21 THR 538 7.485 -1.190 -1.356 289 HG22 THR 538 HG22 THR 538 6.026 -0.439 -2.005 290 HG23 THR 538 HG23 THR 538 7.607 -0.001 -2.652 291 H VAL 539 HN VAL 539 4.898 -3.598 -0.550 292 HA VAL 539 HA VAL 539 2.317 -2.583 -1.520 293 HB VAL 539 HB VAL 539 2.843 -4.317 0.899 294 HG11 VAL 539 HG11 VAL 539 0.441 -4.808 0.752 295 HG12 VAL 539 HG12 VAL 539 0.751 -3.091 1.020 296 HG13 VAL 539 HG13 VAL 539 0.300 -3.666 -0.586 297 HG21 VAL 539 HG21 VAL 539 3.540 -5.496 -1.101 298 HG22 VAL 539 HG22 VAL 539 2.038 -6.186 -0.484 299 HG23 VAL 539 HG23 VAL 539 2.006 -5.118 -1.888 300 H PHE 540 HN PHE 540 1.568 -0.711 -0.798 301 HA PHE 540 HA PHE 540 2.609 0.386 1.706 302 HB2 PHE 540 HB2 PHE 540 0.938 1.616 -0.500 303 HB3 PHE 540 HB3 PHE 540 1.389 2.455 0.977 304 HD1 PHE 540 HD1 PHE 540 3.719 3.092 1.384 305 HD2 PHE 540 HD2 PHE 540 2.510 1.282 -2.280 306 HE1 PHE 540 HE1 PHE 540 5.813 3.832 0.328 307 HE2 PHE 540 HE2 PHE 540 4.613 2.021 -3.336 308 HZ PHE 540 HZ PHE 540 6.263 3.293 -2.032 309 H ALA 541 HN ALA 541 1.500 -0.163 3.478 310 HA ALA 541 HA ALA 541 -1.347 -0.837 3.197 311 HB1 ALA 541 HB1 ALA 541 0.022 -2.610 4.128 312 HB2 ALA 541 HB2 ALA 541 0.595 -1.527 5.397 313 HB3 ALA 541 HB3 ALA 541 -1.105 -2.007 5.351 314 HA PRO 542 HA PRO 542 -2.144 3.051 5.303 315 HB2 PRO 542 HB2 PRO 542 -4.944 2.273 4.934 316 HB3 PRO 542 HB3 PRO 542 -4.081 3.672 4.296 317 HG2 PRO 542 HG2 PRO 542 -4.883 1.642 2.716 318 HG3 PRO 542 HG3 PRO 542 -3.389 2.549 2.404 319 HD2 PRO 542 HD2 PRO 542 -3.746 -0.131 3.701 320 HD3 PRO 542 HD3 PRO 542 -2.538 0.390 2.503 321 H THR 543 HN THR 543 -2.572 3.501 7.384 322 HA THR 543 HA THR 543 -3.236 1.311 9.154 323 HB THR 543 HB THR 543 -2.822 3.000 10.951 324 HG1 THR 543 HG1 THR 543 -2.408 5.053 10.458 325 HG21 THR 543 HG21 THR 543 -0.667 2.709 8.853 326 HG22 THR 543 HG22 THR 543 -1.013 1.576 10.159 327 HG23 THR 543 HG23 THR 543 -0.399 3.189 10.528 328 H ASN 544 HN ASN 544 -4.636 2.260 11.179 329 HA ASN 544 HA ASN 544 -7.302 2.250 10.307 330 HB2 ASN 544 HB2 ASN 544 -6.669 3.535 12.930 331 HB3 ASN 544 HB3 ASN 544 -7.912 2.356 12.531 332 HD21 ASN 544 HD21 ASN 544 -4.610 2.851 13.463 333 HD22 ASN 544 HD22 ASN 544 -4.275 1.196 13.869 334 H GLU 545 HN GLU 545 -5.139 4.830 11.242 335 HA GLU 545 HA GLU 545 -6.913 6.970 11.351 336 HB2 GLU 545 HB2 GLU 545 -4.046 7.099 10.404 337 HB3 GLU 545 HB3 GLU 545 -4.980 8.399 11.127 338 HG2 GLU 545 HG2 GLU 545 -3.574 7.688 12.834 339 HG3 GLU 545 HG3 GLU 545 -5.111 6.911 13.204 340 H ALA 546 HN ALA 546 -5.221 5.543 8.609 341 HA ALA 546 HA ALA 546 -5.800 7.547 6.723 342 HB1 ALA 546 HB1 ALA 546 -4.068 5.853 6.377 343 HB2 ALA 546 HB2 ALA 546 -5.318 4.616 6.236 344 HB3 ALA 546 HB3 ALA 546 -5.213 5.905 5.033 345 H PHE 547 HN PHE 547 -7.482 4.588 7.592 346 HA PHE 547 HA PHE 547 -9.505 4.860 5.617 347 HB2 PHE 547 HB2 PHE 547 -9.279 3.163 8.099 348 HB3 PHE 547 HB3 PHE 547 -10.626 3.073 6.988 349 HD1 PHE 547 HD2 PHE 547 -10.091 2.560 4.513 350 HD2 PHE 547 HD1 PHE 547 -7.385 1.877 7.729 351 HE1 PHE 547 HE2 PHE 547 -8.838 0.964 3.118 352 HE2 PHE 547 HE1 PHE 547 -6.128 0.285 6.336 353 HZ PHE 547 HZ PHE 547 -6.857 -0.176 4.030 354 H ARG 548 HN ARG 548 -9.083 5.994 8.866 355 HA ARG 548 HA ARG 548 -11.853 6.704 9.240 356 HB2 ARG 548 HB2 ARG 548 -10.169 6.103 11.074 357 HB3 ARG 548 HB3 ARG 548 -9.491 7.704 10.836 358 HG2 ARG 548 HG2 ARG 548 -12.410 7.420 11.403 359 HG3 ARG 548 HG3 ARG 548 -11.248 7.279 12.720 360 HD2 ARG 548 HD2 ARG 548 -11.367 9.619 10.826 361 HD3 ARG 548 HD3 ARG 548 -12.182 9.574 12.390 362 HE ARG 548 HE ARG 548 -9.787 9.126 13.259 363 HH11 ARG 548 HH12 ARG 548 -10.603 11.201 10.564 364 HH12 ARG 548 HH11 ARG 548 -9.248 12.263 10.811 365 HH21 ARG 548 HH22 ARG 548 -8.026 10.511 13.587 366 HH22 ARG 548 HH21 ARG 548 -7.782 11.867 12.523 367 H ALA 549 HN ALA 549 -8.949 8.182 8.057 368 HA ALA 549 HA ALA 549 -9.908 10.880 8.117 369 HB1 ALA 549 HB1 ALA 549 -7.633 9.708 6.524 370 HB2 ALA 549 HB2 ALA 549 -7.908 11.417 6.859 371 HB3 ALA 549 HB3 ALA 549 -7.512 10.312 8.176 372 H LEU 550 HN LEU 550 -10.371 8.211 6.030 373 HA LEU 550 HA LEU 550 -10.777 9.443 3.561 374 HB2 LEU 550 HB2 LEU 550 -11.849 6.971 4.851 375 HB3 LEU 550 HB3 LEU 550 -12.521 7.499 3.321 376 HG LEU 550 HG LEU 550 -9.597 6.914 3.785 377 HD11 LEU 550 HD11 LEU 550 -10.911 4.876 3.988 378 HD12 LEU 550 HD12 LEU 550 -11.734 5.235 2.473 379 HD13 LEU 550 HD13 LEU 550 -10.008 4.878 2.475 380 HD21 LEU 550 HD21 LEU 550 -9.484 6.973 1.329 381 HD22 LEU 550 HD22 LEU 550 -11.180 7.456 1.272 382 HD23 LEU 550 HD23 LEU 550 -9.982 8.524 2.008 383 HA PRO 551 HA PRO 551 -14.307 12.016 4.271 384 HB2 PRO 551 HB2 PRO 551 -14.799 11.673 1.373 385 HB3 PRO 551 HB3 PRO 551 -14.503 13.149 2.295 386 HG2 PRO 551 HG2 PRO 551 -12.644 12.165 0.670 387 HG3 PRO 551 HG3 PRO 551 -12.205 12.898 2.225 388 HD2 PRO 551 HD2 PRO 551 -12.423 9.998 1.497 389 HD3 PRO 551 HD3 PRO 551 -11.177 10.825 2.460 390 HA PRO 552 HA PRO 552 -17.665 9.232 4.868 391 HB2 PRO 552 HB2 PRO 552 -19.730 11.067 4.466 392 HB3 PRO 552 HB3 PRO 552 -18.904 10.765 5.997 393 HG2 PRO 552 HG2 PRO 552 -18.452 12.926 3.989 394 HG3 PRO 552 HG3 PRO 552 -18.385 13.003 5.760 395 HD2 PRO 552 HD2 PRO 552 -16.147 12.948 4.299 396 HD3 PRO 552 HD3 PRO 552 -16.253 12.073 5.842 397 H ARG 553 HN ARG 553 -17.821 11.443 2.114 398 HA ARG 553 HA ARG 553 -19.823 10.009 0.700 399 HB2 ARG 553 HB2 ARG 553 -17.737 11.867 -0.450 400 HB3 ARG 553 HB3 ARG 553 -19.277 11.437 -1.176 401 HG2 ARG 553 HG2 ARG 553 -18.861 13.069 1.319 402 HG3 ARG 553 HG3 ARG 553 -19.385 13.659 -0.259 403 HD2 ARG 553 HD2 ARG 553 -20.889 11.739 1.518 404 HD3 ARG 553 HD3 ARG 553 -21.268 13.441 1.269 405 HE ARG 553 HE ARG 553 -21.220 12.093 -1.214 406 HH11 ARG 553 HH12 ARG 553 -23.131 12.405 1.699 407 HH12 ARG 553 HH11 ARG 553 -24.639 12.051 0.901 408 HH21 ARG 553 HH22 ARG 553 -23.172 11.636 -2.274 409 HH22 ARG 553 HH21 ARG 553 -24.670 11.643 -1.381 410 H GLU 554 HN GLU 554 -16.305 10.214 0.297 411 HA GLU 554 HA GLU 554 -16.168 8.423 -1.872 412 HB2 GLU 554 HB2 GLU 554 -14.138 9.550 0.024 413 HB3 GLU 554 HB3 GLU 554 -13.683 8.362 -1.191 414 HG2 GLU 554 HG2 GLU 554 -14.136 9.787 -2.950 415 HG3 GLU 554 HG3 GLU 554 -15.198 10.809 -1.985 416 H ARG 555 HN ARG 555 -15.411 7.928 1.599 417 HA ARG 555 HA ARG 555 -14.582 5.256 1.155 418 HB2 ARG 555 HB2 ARG 555 -14.380 5.016 3.500 419 HB3 ARG 555 HB3 ARG 555 -13.894 6.656 3.109 420 HG2 ARG 555 HG2 ARG 555 -16.164 7.412 3.822 421 HG3 ARG 555 HG3 ARG 555 -16.467 5.761 4.380 422 HD2 ARG 555 HD2 ARG 555 -14.279 6.016 5.695 423 HD3 ARG 555 HD3 ARG 555 -14.443 7.741 5.384 424 HE ARG 555 HE ARG 555 -16.678 6.329 6.644 425 HH11 ARG 555 HH12 ARG 555 -14.046 8.651 6.894 426 HH12 ARG 555 HH11 ARG 555 -14.501 9.174 8.483 427 HH21 ARG 555 HH22 ARG 555 -17.259 7.030 8.738 428 HH22 ARG 555 HH21 ARG 555 -16.323 8.263 9.533 429 H SER 556 HN SER 556 -17.717 6.668 1.750 430 HA SER 556 HA SER 556 -19.031 4.244 2.464 431 HB2 SER 556 HB2 SER 556 -20.019 6.416 3.005 432 HB3 SER 556 HB3 SER 556 -20.154 6.797 1.287 433 HG SER 556 HG SER 556 -21.339 4.480 1.614 434 H ARG 557 HN ARG 557 -18.211 5.795 -0.551 435 HA ARG 557 HA ARG 557 -19.889 4.056 -2.140 436 HB2 ARG 557 HB2 ARG 557 -19.540 6.323 -2.913 437 HB3 ARG 557 HB3 ARG 557 -17.797 6.114 -2.878 438 HG2 ARG 557 HG2 ARG 557 -18.550 6.014 -5.145 439 HG3 ARG 557 HG3 ARG 557 -18.013 4.405 -4.656 440 HD2 ARG 557 HD2 ARG 557 -20.405 3.856 -4.170 441 HD3 ARG 557 HD3 ARG 557 -20.842 5.401 -4.902 442 HE ARG 557 HE ARG 557 -19.368 3.315 -6.388 443 HH11 ARG 557 HH12 ARG 557 -21.967 5.641 -6.138 444 HH12 ARG 557 HH11 ARG 557 -22.556 5.371 -7.751 445 HH21 ARG 557 HH22 ARG 557 -20.128 2.943 -8.510 446 HH22 ARG 557 HH21 ARG 557 -21.523 3.801 -9.090 447 H LEU 558 HN LEU 558 -16.423 4.588 -1.695 448 HA LEU 558 HA LEU 558 -15.482 2.687 -3.488 449 HB2 LEU 558 HB2 LEU 558 -14.340 4.588 -2.010 450 HB3 LEU 558 HB3 LEU 558 -13.950 3.217 -0.993 451 HG LEU 558 HG LEU 558 -12.132 3.842 -2.557 452 HD11 LEU 558 HD11 LEU 558 -13.330 1.126 -3.063 453 HD12 LEU 558 HD12 LEU 558 -11.655 1.593 -3.364 454 HD13 LEU 558 HD13 LEU 558 -12.279 1.561 -1.713 455 HD21 LEU 558 HD21 LEU 558 -14.086 2.969 -4.672 456 HD22 LEU 558 HD22 LEU 558 -13.499 4.611 -4.410 457 HD23 LEU 558 HD23 LEU 558 -12.385 3.350 -4.941 458 H LEU 559 HN LEU 559 -16.129 2.359 -0.009 459 HA LEU 559 HA LEU 559 -15.151 -0.344 0.089 460 HB2 LEU 559 HB2 LEU 559 -16.670 1.289 2.124 461 HB3 LEU 559 HB3 LEU 559 -15.974 -0.291 2.430 462 HG LEU 559 HG LEU 559 -14.371 2.149 1.656 463 HD11 LEU 559 HD11 LEU 559 -14.778 0.875 4.355 464 HD12 LEU 559 HD12 LEU 559 -13.693 2.215 3.993 465 HD13 LEU 559 HD13 LEU 559 -15.435 2.428 3.841 466 HD21 LEU 559 HD21 LEU 559 -12.460 0.808 2.360 467 HD22 LEU 559 HD22 LEU 559 -13.532 -0.548 2.709 468 HD23 LEU 559 HD23 LEU 559 -13.334 0.013 1.050 469 H GLY 560 HN GLY 560 -17.869 0.845 -1.233 470 HA2 GLY 560 HA2 GLY 560 -19.651 -1.228 -0.180 471 HA3 GLY 560 HA3 GLY 560 -20.135 0.139 -1.175 472 H ASP 561 HN ASP 561 -17.528 -0.788 -2.777 473 HA ASP 561 HA ASP 561 -18.917 -2.910 -4.266 474 HB2 ASP 561 HB2 ASP 561 -19.340 -0.747 -5.375 475 HB3 ASP 561 HB3 ASP 561 -17.604 -0.489 -5.517 476 H ALA 562 HN ALA 562 -17.677 -4.578 -4.777 477 HA ALA 562 HA ALA 562 -15.057 -4.809 -3.783 478 HB1 ALA 562 HB1 ALA 562 -15.063 -7.010 -4.810 479 HB2 ALA 562 HB2 ALA 562 -16.604 -6.690 -4.011 480 HB3 ALA 562 HB3 ALA 562 -16.479 -6.574 -5.767 481 H LYS 563 HN LYS 563 -16.250 -3.850 -6.920 482 HA LYS 563 HA LYS 563 -13.750 -4.371 -8.255 483 HB2 LYS 563 HB2 LYS 563 -16.103 -2.741 -9.235 484 HB3 LYS 563 HB3 LYS 563 -14.782 -3.368 -10.214 485 HG2 LYS 563 HG2 LYS 563 -16.906 -4.961 -8.793 486 HG3 LYS 563 HG3 LYS 563 -16.724 -4.737 -10.534 487 HD2 LYS 563 HD2 LYS 563 -14.586 -5.920 -10.461 488 HD3 LYS 563 HD3 LYS 563 -14.760 -6.136 -8.718 489 HE2 LYS 563 HE2 LYS 563 -16.869 -7.378 -9.152 490 HE3 LYS 563 HE3 LYS 563 -16.532 -7.261 -10.877 491 HZ1 LYS 563 HZ1 LYS 563 -15.806 -9.373 -10.034 492 HZ2 LYS 563 HZ2 LYS 563 -14.857 -8.629 -8.849 493 HZ3 LYS 563 HZ3 LYS 563 -14.448 -8.460 -10.485 494 H GLU 564 HN GLU 564 -15.481 -1.560 -6.986 495 HA GLU 564 HA GLU 564 -13.573 0.378 -7.760 496 HB2 GLU 564 HB2 GLU 564 -15.535 0.364 -5.454 497 HB3 GLU 564 HB3 GLU 564 -14.586 1.764 -5.931 498 HG2 GLU 564 HG2 GLU 564 -15.644 1.693 -8.158 499 HG3 GLU 564 HG3 GLU 564 -16.644 0.349 -7.614 500 H LEU 565 HN LEU 565 -13.829 -1.761 -4.980 501 HA LEU 565 HA LEU 565 -11.678 -0.754 -3.484 502 HB2 LEU 565 HB2 LEU 565 -12.970 -3.457 -3.690 503 HB3 LEU 565 HB3 LEU 565 -11.613 -3.175 -2.629 504 HG LEU 565 HG LEU 565 -14.225 -1.674 -2.460 505 HD11 LEU 565 HD11 LEU 565 -13.210 -4.002 -0.829 506 HD12 LEU 565 HD12 LEU 565 -14.664 -3.061 -0.488 507 HD13 LEU 565 HD13 LEU 565 -14.567 -4.031 -1.957 508 HD21 LEU 565 HD21 LEU 565 -11.863 -1.851 -0.592 509 HD22 LEU 565 HD22 LEU 565 -12.318 -0.452 -1.566 510 HD23 LEU 565 HD23 LEU 565 -13.374 -1.000 -0.265 511 H ALA 566 HN ALA 566 -11.832 -3.420 -5.837 512 HA ALA 566 HA ALA 566 -9.187 -4.261 -5.683 513 HB1 ALA 566 HB1 ALA 566 -9.552 -5.349 -7.809 514 HB2 ALA 566 HB2 ALA 566 -10.995 -5.497 -6.807 515 HB3 ALA 566 HB3 ALA 566 -10.955 -4.325 -8.125 516 H ASN 567 HN ASN 567 -10.633 -1.773 -7.666 517 HA ASN 567 HA ASN 567 -8.459 -1.281 -9.375 518 HB2 ASN 567 HB2 ASN 567 -10.732 -0.439 -9.812 519 HB3 ASN 567 HB3 ASN 567 -10.593 0.645 -8.436 520 HD21 ASN 567 HD21 ASN 567 -8.069 -0.051 -10.824 521 HD22 ASN 567 HD22 ASN 567 -7.981 1.563 -11.434 522 H ILE 568 HN ILE 568 -9.379 0.252 -6.307 523 HA ILE 568 HA ILE 568 -7.234 2.120 -6.306 524 HB ILE 568 HB ILE 568 -8.947 1.149 -4.012 525 HG12 ILE 568 HG12 ILE 568 -10.278 2.153 -5.791 526 HG13 ILE 568 HG13 ILE 568 -10.223 3.228 -4.399 527 HG21 ILE 568 HG21 ILE 568 -8.293 3.235 -2.893 528 HG22 ILE 568 HG22 ILE 568 -6.913 2.174 -3.187 529 HG23 ILE 568 HG23 ILE 568 -7.179 3.582 -4.215 530 HD11 ILE 568 HD11 ILE 568 -8.505 4.571 -5.525 531 HD12 ILE 568 HD12 ILE 568 -8.617 3.509 -6.928 532 HD13 ILE 568 HD13 ILE 568 -10.004 4.485 -6.447 533 H LEU 569 HN LEU 569 -7.628 -1.132 -5.043 534 HA LEU 569 HA LEU 569 -5.386 -1.122 -3.322 535 HB2 LEU 569 HB2 LEU 569 -6.784 -3.397 -4.716 536 HB3 LEU 569 HB3 LEU 569 -5.535 -3.609 -3.505 537 HG LEU 569 HG LEU 569 -8.226 -2.316 -3.074 538 HD11 LEU 569 HD11 LEU 569 -7.074 -4.930 -2.119 539 HD12 LEU 569 HD12 LEU 569 -8.621 -4.250 -1.619 540 HD13 LEU 569 HD13 LEU 569 -8.366 -4.721 -3.298 541 HD21 LEU 569 HD21 LEU 569 -7.588 -2.194 -0.725 542 HD22 LEU 569 HD22 LEU 569 -5.990 -2.832 -1.114 543 HD23 LEU 569 HD23 LEU 569 -6.481 -1.253 -1.727 544 H LYS 570 HN LYS 570 -5.743 -1.760 -6.746 545 HA LYS 570 HA LYS 570 -3.192 -2.923 -7.161 546 HB2 LYS 570 HB2 LYS 570 -5.080 -1.493 -9.037 547 HB3 LYS 570 HB3 LYS 570 -3.602 -2.283 -9.568 548 HG2 LYS 570 HG2 LYS 570 -4.406 -4.417 -8.948 549 HG3 LYS 570 HG3 LYS 570 -5.763 -3.727 -8.059 550 HD2 LYS 570 HD2 LYS 570 -6.557 -4.618 -10.155 551 HD3 LYS 570 HD3 LYS 570 -6.673 -2.861 -10.189 552 HE2 LYS 570 HE2 LYS 570 -5.842 -3.678 -12.308 553 HE3 LYS 570 HE3 LYS 570 -4.585 -2.765 -11.478 554 HZ1 LYS 570 HZ1 LYS 570 -3.874 -4.905 -12.543 555 HZ2 LYS 570 HZ2 LYS 570 -4.759 -5.723 -11.346 556 HZ3 LYS 570 HZ3 LYS 570 -3.459 -4.730 -10.914 557 H TYR 571 HN TYR 571 -4.182 0.308 -6.600 558 HA TYR 571 HA TYR 571 -1.805 1.491 -7.755 559 HB2 TYR 571 HB2 TYR 571 -4.048 2.612 -7.762 560 HB3 TYR 571 HB3 TYR 571 -3.910 2.790 -6.018 561 HD1 TYR 571 HD1 TYR 571 -1.548 3.357 -8.863 562 HD2 TYR 571 HD2 TYR 571 -3.518 4.980 -5.459 563 HE1 TYR 571 HE1 TYR 571 -0.374 5.484 -9.210 564 HE2 TYR 571 HE2 TYR 571 -2.344 7.111 -5.783 565 HH TYR 571 HH TYR 571 -0.520 7.771 -8.662 566 H HIS 572 HN HIS 572 -2.716 0.107 -4.756 567 HA HIS 572 HA HIS 572 -0.787 1.646 -3.212 568 HB2 HIS 572 HB2 HIS 572 -2.804 -0.473 -2.501 569 HB3 HIS 572 HB3 HIS 572 -1.561 0.023 -1.356 570 HD1 HIS 572 HD1 HIS 572 -4.589 1.407 -3.180 571 HD2 HIS 572 HD2 HIS 572 -2.005 2.373 -0.068 572 HE1 HIS 572 HE1 HIS 572 -5.593 3.416 -2.018 573 H ILE 573 HN ILE 573 -0.794 -1.139 -5.102 574 HA ILE 573 HA ILE 573 1.556 -2.215 -3.703 575 HB ILE 573 HB ILE 573 -0.098 -3.594 -5.825 576 HG12 ILE 573 HG12 ILE 573 -0.196 -4.062 -2.840 577 HG13 ILE 573 HG13 ILE 573 -1.352 -3.040 -3.690 578 HG21 ILE 573 HG21 ILE 573 2.176 -4.441 -5.607 579 HG22 ILE 573 HG22 ILE 573 1.951 -4.632 -3.869 580 HG23 ILE 573 HG23 ILE 573 1.017 -5.620 -4.992 581 HD11 ILE 573 HD11 ILE 573 -2.248 -5.261 -3.306 582 HD12 ILE 573 HD12 ILE 573 -2.057 -4.942 -5.030 583 HD13 ILE 573 HD13 ILE 573 -0.895 -5.971 -4.190 584 H GLY 574 HN GLY 574 3.443 -1.689 -4.549 585 HA2 GLY 574 HA2 GLY 574 3.614 -0.820 -7.332 586 HA3 GLY 574 HA3 GLY 574 4.881 -0.682 -6.122 587 H ASP 575 HN ASP 575 5.122 -1.672 -8.805 588 HA ASP 575 HA ASP 575 5.290 -4.586 -8.569 589 HB2 ASP 575 HB2 ASP 575 4.256 -3.261 -10.544 590 HB3 ASP 575 HB3 ASP 575 5.920 -2.960 -11.027 591 H GLU 576 HN GLU 576 7.216 -2.327 -7.525 592 HA GLU 576 HA GLU 576 9.691 -3.663 -8.257 593 HB2 GLU 576 HB2 GLU 576 9.297 -0.673 -8.463 594 HB3 GLU 576 HB3 GLU 576 10.826 -1.512 -8.651 595 HG2 GLU 576 HG2 GLU 576 10.076 -2.562 -10.661 596 HG3 GLU 576 HG3 GLU 576 8.444 -1.935 -10.430 597 H ILE 577 HN ILE 577 10.885 -4.015 -6.523 598 HA ILE 577 HA ILE 577 9.968 -3.038 -3.985 599 HB ILE 577 HB ILE 577 12.401 -4.705 -4.645 600 HG12 ILE 577 HG12 ILE 577 9.660 -5.451 -3.602 601 HG13 ILE 577 HG13 ILE 577 10.288 -5.803 -5.210 602 HG21 ILE 577 HG21 ILE 577 12.693 -3.537 -2.532 603 HG22 ILE 577 HG22 ILE 577 11.114 -4.098 -1.980 604 HG23 ILE 577 HG23 ILE 577 12.418 -5.255 -2.245 605 HD11 ILE 577 HD11 ILE 577 11.334 -6.899 -2.608 606 HD12 ILE 577 HD12 ILE 577 10.372 -7.767 -3.805 607 HD13 ILE 577 HD13 ILE 577 12.005 -7.235 -4.205 608 H LEU 578 HN LEU 578 10.331 -0.980 -3.538 609 HA LEU 578 HA LEU 578 13.111 -0.027 -3.709 610 HB2 LEU 578 HB2 LEU 578 10.545 1.395 -4.265 611 HB3 LEU 578 HB3 LEU 578 11.876 2.307 -3.586 612 HG LEU 578 HG LEU 578 11.901 2.601 -5.964 613 HD11 LEU 578 HD11 LEU 578 14.122 1.677 -6.539 614 HD12 LEU 578 HD12 LEU 578 14.077 2.471 -4.964 615 HD13 LEU 578 HD13 LEU 578 14.064 0.711 -5.065 616 HD21 LEU 578 HD21 LEU 578 12.133 0.723 -7.525 617 HD22 LEU 578 HD22 LEU 578 11.962 -0.408 -6.182 618 HD23 LEU 578 HD23 LEU 578 10.617 0.642 -6.626 619 H VAL 579 HN VAL 579 13.817 -0.481 -1.698 620 HA VAL 579 HA VAL 579 12.248 0.307 0.623 621 HB VAL 579 HB VAL 579 14.115 -0.554 1.955 622 HG11 VAL 579 HG11 VAL 579 12.412 -2.114 1.214 623 HG12 VAL 579 HG12 VAL 579 13.305 -2.410 -0.277 624 HG13 VAL 579 HG13 VAL 579 13.988 -2.904 1.271 625 HG21 VAL 579 HG21 VAL 579 15.973 0.102 0.529 626 HG22 VAL 579 HG22 VAL 579 16.044 -1.625 0.876 627 HG23 VAL 579 HG23 VAL 579 15.468 -1.064 -0.695 628 H SER 580 HN SER 580 13.451 1.623 2.350 629 HA SER 580 HA SER 580 13.791 4.210 1.350 630 HB2 SER 580 HB2 SER 580 14.795 3.121 3.990 631 HB3 SER 580 HB3 SER 580 14.477 4.814 3.612 632 HG SER 580 HG SER 580 12.632 2.673 3.858 633 H GLY 581 HN GLY 581 16.201 1.768 2.213 634 HA2 GLY 581 HA2 GLY 581 18.430 3.530 1.796 635 HA3 GLY 581 HA3 GLY 581 18.507 1.790 2.026 636 H GLY 582 HN GLY 582 16.367 2.010 -0.347 637 HA2 GLY 582 HA2 GLY 582 18.466 1.650 -2.374 638 HA3 GLY 582 HA3 GLY 582 16.856 0.949 -2.432 639 H ILE 583 HN ILE 583 15.656 3.568 -1.619 640 HA ILE 583 HA ILE 583 15.002 4.494 -4.177 641 HB ILE 583 HB ILE 583 14.735 5.969 -1.549 642 HG12 ILE 583 HG12 ILE 583 12.721 4.267 -3.032 643 HG13 ILE 583 HG13 ILE 583 13.638 3.728 -1.630 644 HG21 ILE 583 HG21 ILE 583 12.959 7.234 -2.675 645 HG22 ILE 583 HG22 ILE 583 14.523 7.476 -3.454 646 HG23 ILE 583 HG23 ILE 583 13.327 6.403 -4.186 647 HD11 ILE 583 HD11 ILE 583 11.658 5.992 -1.695 648 HD12 ILE 583 HD12 ILE 583 11.406 4.394 -0.993 649 HD13 ILE 583 HD13 ILE 583 12.596 5.489 -0.286 650 H GLY 584 HN GLY 584 16.945 6.173 -1.698 651 HA2 GLY 584 HA2 GLY 584 18.954 7.343 -2.106 652 HA3 GLY 584 HA3 GLY 584 18.590 7.323 -3.827 653 H ALA 585 HN ALA 585 16.913 8.776 -4.607 654 HA ALA 585 HA ALA 585 16.462 11.070 -2.818 655 HB1 ALA 585 HB1 ALA 585 17.193 11.238 -5.738 656 HB2 ALA 585 HB2 ALA 585 16.820 12.601 -4.681 657 HB3 ALA 585 HB3 ALA 585 18.257 11.622 -4.385 658 H LEU 586 HN LEU 586 15.490 9.958 -6.077 659 HA LEU 586 HA LEU 586 12.732 9.773 -5.211 660 HB2 LEU 586 HB2 LEU 586 13.337 12.220 -5.920 661 HB3 LEU 586 HB3 LEU 586 13.272 11.574 -7.546 662 HG LEU 586 HG LEU 586 10.958 11.255 -5.658 663 HD11 LEU 586 HD11 LEU 586 9.981 13.280 -6.594 664 HD12 LEU 586 HD12 LEU 586 11.494 13.644 -5.763 665 HD13 LEU 586 HD13 LEU 586 11.450 13.571 -7.525 666 HD21 LEU 586 HD21 LEU 586 9.663 11.096 -7.698 667 HD22 LEU 586 HD22 LEU 586 11.113 11.380 -8.666 668 HD23 LEU 586 HD23 LEU 586 10.966 9.905 -7.706 669 H VAL 587 HN VAL 587 11.562 8.375 -6.494 670 HA VAL 587 HA VAL 587 12.781 7.458 -8.982 671 HB VAL 587 HB VAL 587 13.700 5.969 -7.275 672 HG11 VAL 587 HG11 VAL 587 12.223 4.459 -6.018 673 HG12 VAL 587 HG12 VAL 587 11.983 6.155 -5.590 674 HG13 VAL 587 HG13 VAL 587 10.826 5.339 -6.641 675 HG21 VAL 587 HG21 VAL 587 12.982 3.824 -8.237 676 HG22 VAL 587 HG22 VAL 587 11.625 4.638 -9.015 677 HG23 VAL 587 HG23 VAL 587 13.279 5.041 -9.478 678 H ARG 588 HN ARG 588 11.340 6.963 -10.518 679 HA ARG 588 HA ARG 588 8.517 7.134 -9.904 680 HB2 ARG 588 HB2 ARG 588 9.170 8.217 -11.917 681 HB3 ARG 588 HB3 ARG 588 10.079 6.818 -12.467 682 HG2 ARG 588 HG2 ARG 588 7.993 5.580 -12.744 683 HG3 ARG 588 HG3 ARG 588 7.084 6.998 -12.216 684 HD2 ARG 588 HD2 ARG 588 7.352 8.062 -14.183 685 HD3 ARG 588 HD3 ARG 588 9.000 7.472 -14.394 686 HE ARG 588 HE ARG 588 7.679 5.249 -14.884 687 HH11 ARG 588 HH12 ARG 588 6.893 8.507 -15.933 688 HH12 ARG 588 HH11 ARG 588 6.191 7.979 -17.436 689 HH21 ARG 588 HH22 ARG 588 6.746 4.565 -16.859 690 HH22 ARG 588 HH21 ARG 588 6.104 5.758 -17.959 691 H LEU 589 HN LEU 589 7.744 5.411 -8.901 692 HA LEU 589 HA LEU 589 8.647 2.725 -9.645 693 HB2 LEU 589 HB2 LEU 589 8.438 3.815 -7.232 694 HB3 LEU 589 HB3 LEU 589 6.770 3.320 -7.396 695 HG LEU 589 HG LEU 589 9.109 1.420 -7.584 696 HD11 LEU 589 HD11 LEU 589 9.014 2.382 -5.364 697 HD12 LEU 589 HD12 LEU 589 7.282 2.061 -5.270 698 HD13 LEU 589 HD13 LEU 589 8.429 0.720 -5.321 699 HD21 LEU 589 HD21 LEU 589 7.449 -0.305 -7.330 700 HD22 LEU 589 HD22 LEU 589 6.167 0.901 -7.184 701 HD23 LEU 589 HD23 LEU 589 7.027 0.706 -8.711 702 H LYS 590 HN LYS 590 7.339 1.392 -10.824 703 HA LYS 590 HA LYS 590 4.722 2.376 -11.607 704 HB2 LYS 590 HB2 LYS 590 4.630 0.315 -12.998 705 HB3 LYS 590 HB3 LYS 590 6.076 1.274 -13.293 706 HG2 LYS 590 HG2 LYS 590 7.435 -0.216 -12.058 707 HG3 LYS 590 HG3 LYS 590 6.023 -1.054 -11.412 708 HD2 LYS 590 HD2 LYS 590 5.544 -2.053 -13.504 709 HD3 LYS 590 HD3 LYS 590 6.677 -0.989 -14.349 710 HE2 LYS 590 HE2 LYS 590 8.526 -2.130 -13.595 711 HE3 LYS 590 HE3 LYS 590 7.699 -2.737 -12.162 712 HZ1 LYS 590 HZ1 LYS 590 8.225 -4.376 -14.000 713 HZ2 LYS 590 HZ2 LYS 590 6.957 -3.657 -14.871 714 HZ3 LYS 590 HZ3 LYS 590 6.651 -4.396 -13.375 715 H SER 591 HN SER 591 2.743 1.459 -11.114 716 HA SER 591 HA SER 591 2.743 -0.330 -8.786 717 HB2 SER 591 HB2 SER 591 0.461 0.534 -8.377 718 HB3 SER 591 HB3 SER 591 1.645 1.834 -8.447 719 HG SER 591 HG SER 591 0.963 2.331 -10.515 720 H LEU 592 HN LEU 592 0.901 -1.888 -8.668 721 HA LEU 592 HA LEU 592 0.777 -3.529 -10.946 722 HB2 LEU 592 HB2 LEU 592 -0.586 -3.456 -8.291 723 HB3 LEU 592 HB3 LEU 592 -1.151 -4.574 -9.515 724 HG LEU 592 HG LEU 592 0.452 -5.506 -7.829 725 HD11 LEU 592 HD11 LEU 592 0.024 -6.607 -9.962 726 HD12 LEU 592 HD12 LEU 592 1.273 -5.621 -10.722 727 HD13 LEU 592 HD13 LEU 592 1.711 -6.800 -9.484 728 HD21 LEU 592 HD21 LEU 592 2.825 -5.103 -8.129 729 HD22 LEU 592 HD22 LEU 592 2.468 -3.882 -9.350 730 HD23 LEU 592 HD23 LEU 592 1.985 -3.620 -7.675 731 H GLN 593 HN GLN 593 -0.973 -0.717 -10.249 732 HA GLN 593 HA GLN 593 -3.331 -1.489 -11.751 733 HB2 GLN 593 HB2 GLN 593 -3.624 0.084 -9.919 734 HB3 GLN 593 HB3 GLN 593 -2.458 1.186 -10.639 735 HG2 GLN 593 HG2 GLN 593 -3.964 1.457 -12.576 736 HG3 GLN 593 HG3 GLN 593 -5.145 0.435 -11.759 737 HE21 GLN 593 HE21 GLN 593 -3.161 2.623 -9.957 738 HE22 GLN 593 HE22 GLN 593 -4.392 3.774 -9.603 739 H GLY 594 HN GLY 594 -0.281 0.080 -12.294 740 HA2 GLY 594 HA2 GLY 594 0.496 0.090 -14.634 741 HA3 GLY 594 HA3 GLY 594 -1.115 0.649 -15.071 742 H ASP 595 HN ASP 595 -1.069 2.361 -12.559 743 HA ASP 595 HA ASP 595 0.095 4.683 -13.799 744 HB2 ASP 595 HB2 ASP 595 -2.037 4.618 -12.339 745 HB3 ASP 595 HB3 ASP 595 -0.941 4.559 -10.967 746 H LYS 596 HN LYS 596 1.298 6.133 -11.975 747 HA LYS 596 HA LYS 596 3.586 4.461 -11.180 748 HB2 LYS 596 HB2 LYS 596 5.096 6.224 -11.768 749 HB3 LYS 596 HB3 LYS 596 4.036 5.958 -13.142 750 HG2 LYS 596 HG2 LYS 596 3.634 8.149 -11.125 751 HG3 LYS 596 HG3 LYS 596 4.539 8.345 -12.624 752 HD2 LYS 596 HD2 LYS 596 2.662 8.244 -13.934 753 HD3 LYS 596 HD3 LYS 596 1.777 7.241 -12.779 754 HE2 LYS 596 HE2 LYS 596 2.420 10.174 -12.437 755 HE3 LYS 596 HE3 LYS 596 0.856 9.513 -12.917 756 HZ1 LYS 596 HZ1 LYS 596 0.724 8.351 -10.803 757 HZ2 LYS 596 HZ2 LYS 596 0.923 10.020 -10.549 758 HZ3 LYS 596 HZ3 LYS 596 2.240 8.972 -10.336 759 H LEU 597 HN LEU 597 4.406 4.719 -9.184 760 HA LEU 597 HA LEU 597 3.097 6.670 -7.424 761 HB2 LEU 597 HB2 LEU 597 4.830 4.272 -6.810 762 HB3 LEU 597 HB3 LEU 597 4.156 5.349 -5.601 763 HG LEU 597 HG LEU 597 2.449 3.773 -7.524 764 HD11 LEU 597 HD11 LEU 597 3.308 3.068 -4.721 765 HD12 LEU 597 HD12 LEU 597 2.071 2.225 -5.657 766 HD13 LEU 597 HD13 LEU 597 3.750 2.217 -6.202 767 HD21 LEU 597 HD21 LEU 597 0.675 4.292 -5.965 768 HD22 LEU 597 HD22 LEU 597 1.817 5.104 -4.891 769 HD23 LEU 597 HD23 LEU 597 1.464 5.787 -6.477 770 H GLU 598 HN GLU 598 4.126 8.541 -7.153 771 HA GLU 598 HA GLU 598 6.943 8.753 -7.765 772 HB2 GLU 598 HB2 GLU 598 4.958 10.805 -6.773 773 HB3 GLU 598 HB3 GLU 598 6.653 11.158 -7.077 774 HG2 GLU 598 HG2 GLU 598 5.760 11.831 -9.051 775 HG3 GLU 598 HG3 GLU 598 6.096 10.146 -9.436 776 H VAL 599 HN VAL 599 7.841 7.381 -6.242 777 HA VAL 599 HA VAL 599 7.557 8.086 -3.421 778 HB VAL 599 HB VAL 599 9.197 5.849 -4.633 779 HG11 VAL 599 HG11 VAL 599 9.860 6.460 -2.373 780 HG12 VAL 599 HG12 VAL 599 8.194 6.289 -1.821 781 HG13 VAL 599 HG13 VAL 599 9.085 4.877 -2.389 782 HG21 VAL 599 HG21 VAL 599 6.854 5.567 -5.242 783 HG22 VAL 599 HG22 VAL 599 7.341 4.358 -4.055 784 HG23 VAL 599 HG23 VAL 599 6.379 5.750 -3.555 785 H SER 600 HN SER 600 9.018 9.289 -2.381 786 HA SER 600 HA SER 600 11.683 9.570 -3.562 787 HB2 SER 600 HB2 SER 600 11.571 12.039 -3.041 788 HB3 SER 600 HB3 SER 600 10.562 11.500 -4.381 789 HG SER 600 HG SER 600 8.766 11.648 -3.081 790 H LEU 601 HN LEU 601 13.260 10.464 -2.143 791 HA LEU 601 HA LEU 601 12.682 10.126 0.720 792 HB2 LEU 601 HB2 LEU 601 13.830 8.112 -0.161 793 HB3 LEU 601 HB3 LEU 601 15.125 9.127 -0.763 794 HG LEU 601 HG LEU 601 15.504 9.833 1.656 795 HD11 LEU 601 HD11 LEU 601 14.742 8.282 3.371 796 HD12 LEU 601 HD12 LEU 601 13.378 9.058 2.567 797 HD13 LEU 601 HD13 LEU 601 13.809 7.395 2.167 798 HD21 LEU 601 HD21 LEU 601 16.831 7.840 2.140 799 HD22 LEU 601 HD22 LEU 601 15.976 6.962 0.875 800 HD23 LEU 601 HD23 LEU 601 16.999 8.336 0.457 801 H LYS 602 HN LYS 602 12.925 12.143 1.507 802 HA LYS 602 HA LYS 602 15.382 13.572 0.807 803 HB2 LYS 602 HB2 LYS 602 14.192 15.687 0.550 804 HB3 LYS 602 HB3 LYS 602 13.642 14.512 -0.631 805 HG2 LYS 602 HG2 LYS 602 11.683 14.066 0.877 806 HG3 LYS 602 HG3 LYS 602 12.204 15.448 1.842 807 HD2 LYS 602 HD2 LYS 602 10.592 16.310 0.354 808 HD3 LYS 602 HD3 LYS 602 12.150 16.781 -0.330 809 HE2 LYS 602 HE2 LYS 602 11.052 15.981 -2.193 810 HE3 LYS 602 HE3 LYS 602 11.922 14.546 -1.655 811 HZ1 LYS 602 HZ1 LYS 602 9.055 15.156 -1.457 812 HZ2 LYS 602 HZ2 LYS 602 9.751 14.093 -0.344 813 HZ3 LYS 602 HZ3 LYS 602 9.808 13.738 -2.002 814 H ASN 603 HN ASN 603 16.382 14.460 2.488 815 HA ASN 603 HA ASN 603 16.917 14.974 4.633 816 HB2 ASN 603 HB2 ASN 603 13.930 15.370 4.979 817 HB3 ASN 603 HB3 ASN 603 15.150 15.822 6.164 818 HD21 ASN 603 HD21 ASN 603 17.048 16.710 4.116 819 HD22 ASN 603 HD22 ASN 603 16.442 18.223 3.532 820 H ASN 604 HN ASN 604 16.257 12.303 3.706 821 HA ASN 604 HA ASN 604 16.244 10.173 4.469 822 HB2 ASN 604 HB2 ASN 604 17.589 11.272 6.403 823 HB3 ASN 604 HB3 ASN 604 16.099 11.118 7.323 824 HD21 ASN 604 HD21 ASN 604 18.693 9.413 5.753 825 HD22 ASN 604 HD22 ASN 604 18.399 7.878 6.497 826 H VAL 605 HN VAL 605 13.833 12.182 4.452 827 HA VAL 605 HA VAL 605 11.879 10.442 5.778 828 HB VAL 605 HB VAL 605 11.470 13.166 4.520 829 HG11 VAL 605 HG11 VAL 605 9.311 13.134 5.697 830 HG12 VAL 605 HG12 VAL 605 9.441 11.842 4.505 831 HG13 VAL 605 HG13 VAL 605 9.636 11.482 6.219 832 HG21 VAL 605 HG21 VAL 605 11.289 13.987 6.830 833 HG22 VAL 605 HG22 VAL 605 11.748 12.390 7.421 834 HG23 VAL 605 HG23 VAL 605 12.891 13.343 6.474 835 H VAL 606 HN VAL 606 10.925 8.946 4.569 836 HA VAL 606 HA VAL 606 10.963 9.172 1.669 837 HB VAL 606 HB VAL 606 11.662 7.041 2.554 838 HG11 VAL 606 HG11 VAL 606 10.495 7.120 4.696 839 HG12 VAL 606 HG12 VAL 606 8.957 6.860 3.874 840 HG13 VAL 606 HG13 VAL 606 10.190 5.599 3.860 841 HG21 VAL 606 HG21 VAL 606 8.923 6.801 1.317 842 HG22 VAL 606 HG22 VAL 606 10.441 7.006 0.444 843 HG23 VAL 606 HG23 VAL 606 10.149 5.534 1.371 844 H SER 607 HN SER 607 9.205 9.433 0.408 845 HA SER 607 HA SER 607 6.546 9.401 1.626 846 HB2 SER 607 HB2 SER 607 7.580 11.777 0.057 847 HB3 SER 607 HB3 SER 607 5.982 11.612 0.782 848 HG SER 607 HG SER 607 7.647 11.180 2.731 849 H VAL 608 HN VAL 608 4.945 8.799 0.267 850 HA VAL 608 HA VAL 608 5.682 8.341 -2.548 851 HB VAL 608 HB VAL 608 5.292 6.215 -1.490 852 HG11 VAL 608 HG11 VAL 608 4.043 6.898 0.455 853 HG12 VAL 608 HG12 VAL 608 2.658 7.346 -0.545 854 HG13 VAL 608 HG13 VAL 608 3.143 5.652 -0.410 855 HG21 VAL 608 HG21 VAL 608 4.440 6.430 -3.756 856 HG22 VAL 608 HG22 VAL 608 3.416 5.348 -2.811 857 HG23 VAL 608 HG23 VAL 608 2.889 6.998 -3.138 858 H ASN 609 HN ASN 609 4.765 9.737 -3.866 859 HA ASN 609 HA ASN 609 3.390 11.338 -4.716 860 HB2 ASN 609 HB2 ASN 609 1.258 9.691 -3.338 861 HB3 ASN 609 HB3 ASN 609 0.943 10.972 -4.501 862 HD21 ASN 609 HD21 ASN 609 0.187 8.212 -4.670 863 HD22 ASN 609 HD22 ASN 609 0.919 7.586 -6.105 864 H LYS 610 HN LYS 610 4.699 12.063 -2.489 865 HA LYS 610 HA LYS 610 4.860 13.797 -1.071 866 HB2 LYS 610 HB2 LYS 610 3.619 15.557 -1.594 867 HB3 LYS 610 HB3 LYS 610 2.624 14.514 -2.591 868 HG2 LYS 610 HG2 LYS 610 1.107 14.143 -0.726 869 HG3 LYS 610 HG3 LYS 610 2.127 15.138 0.315 870 HD2 LYS 610 HD2 LYS 610 1.725 17.063 -1.152 871 HD3 LYS 610 HD3 LYS 610 0.694 16.066 -2.177 872 HE2 LYS 610 HE2 LYS 610 0.191 16.600 0.746 873 HE3 LYS 610 HE3 LYS 610 -0.547 17.506 -0.573 874 HZ1 LYS 610 HZ1 LYS 610 -2.038 15.805 0.189 875 HZ2 LYS 610 HZ2 LYS 610 -0.867 14.598 -0.031 876 HZ3 LYS 610 HZ3 LYS 610 -1.516 15.412 -1.374 877 H GLU 611 HN GLU 611 2.524 11.322 -0.599 878 HA GLU 611 HA GLU 611 1.988 11.982 2.154 879 HB2 GLU 611 HB2 GLU 611 1.515 9.370 0.715 880 HB3 GLU 611 HB3 GLU 611 0.829 9.845 2.260 881 HG2 GLU 611 HG2 GLU 611 0.219 10.953 -0.459 882 HG3 GLU 611 HG3 GLU 611 -0.859 10.089 0.633 883 HA PRO 612 HA PRO 612 5.867 10.281 3.537 884 HB2 PRO 612 HB2 PRO 612 4.824 10.707 6.238 885 HB3 PRO 612 HB3 PRO 612 6.181 11.490 5.426 886 HG2 PRO 612 HG2 PRO 612 3.876 12.793 5.976 887 HG3 PRO 612 HG3 PRO 612 4.871 13.163 4.556 888 HD2 PRO 612 HD2 PRO 612 2.363 11.533 4.739 889 HD3 PRO 612 HD3 PRO 612 2.850 12.718 3.507 890 H VAL 613 HN VAL 613 6.607 8.378 4.335 891 HA VAL 613 HA VAL 613 4.644 6.306 4.882 892 HB VAL 613 HB VAL 613 7.654 6.141 4.583 893 HG11 VAL 613 HG11 VAL 613 6.773 4.350 6.008 894 HG12 VAL 613 HG12 VAL 613 5.635 3.913 4.734 895 HG13 VAL 613 HG13 VAL 613 7.369 3.736 4.465 896 HG21 VAL 613 HG21 VAL 613 7.141 5.096 2.423 897 HG22 VAL 613 HG22 VAL 613 5.426 5.389 2.703 898 HG23 VAL 613 HG23 VAL 613 6.531 6.749 2.515 899 H ALA 614 HN ALA 614 4.364 5.310 6.807 900 HA ALA 614 HA ALA 614 5.285 6.778 9.127 901 HB1 ALA 614 HB1 ALA 614 3.653 5.411 10.350 902 HB2 ALA 614 HB2 ALA 614 2.937 6.196 8.943 903 HB3 ALA 614 HB3 ALA 614 3.343 4.482 8.882 904 H GLU 615 HN GLU 615 5.832 3.664 7.622 905 HA GLU 615 HA GLU 615 8.094 3.156 9.308 906 HB2 GLU 615 HB2 GLU 615 6.184 2.422 10.758 907 HB3 GLU 615 HB3 GLU 615 5.759 1.244 9.525 908 HG2 GLU 615 HG2 GLU 615 6.965 0.081 11.178 909 HG3 GLU 615 HG3 GLU 615 8.059 0.274 9.810 910 HA PRO 616 HA PRO 616 8.348 1.262 5.194 911 HB2 PRO 616 HB2 PRO 616 10.663 2.324 4.453 912 HB3 PRO 616 HB3 PRO 616 9.204 3.320 4.552 913 HG2 PRO 616 HG2 PRO 616 11.502 3.131 6.452 914 HG3 PRO 616 HG3 PRO 616 10.566 4.553 5.957 915 HD2 PRO 616 HD2 PRO 616 10.184 3.056 8.300 916 HD3 PRO 616 HD3 PRO 616 9.043 4.232 7.618 917 H ASP 617 HN ASP 617 9.666 -0.349 4.251 918 HA ASP 617 HA ASP 617 11.489 -1.679 3.882 919 HB2 ASP 617 HB2 ASP 617 12.592 -0.165 6.240 920 HB3 ASP 617 HB3 ASP 617 13.441 -1.555 5.572 921 H ILE 618 HN ILE 618 9.155 -2.283 5.317 922 HA ILE 618 HA ILE 618 9.801 -4.288 7.253 923 HB ILE 618 HB ILE 618 7.353 -3.358 5.799 924 HG12 ILE 618 HG12 ILE 618 8.064 -3.692 8.727 925 HG13 ILE 618 HG13 ILE 618 8.039 -2.185 7.817 926 HG21 ILE 618 HG21 ILE 618 7.471 -5.880 7.492 927 HG22 ILE 618 HG22 ILE 618 6.005 -5.141 6.854 928 HG23 ILE 618 HG23 ILE 618 7.201 -5.828 5.751 929 HD11 ILE 618 HD11 ILE 618 5.665 -3.915 8.469 930 HD12 ILE 618 HD12 ILE 618 6.078 -2.367 9.207 931 HD13 ILE 618 HD13 ILE 618 5.620 -2.438 7.506 932 H MET 619 HN MET 619 10.850 -6.061 6.650 933 HA MET 619 HA MET 619 10.963 -6.866 3.899 934 HB2 MET 619 HB2 MET 619 12.217 -8.115 6.344 935 HB3 MET 619 HB3 MET 619 12.566 -8.562 4.683 936 HG2 MET 619 HG2 MET 619 13.001 -5.770 5.675 937 HG3 MET 619 HG3 MET 619 14.203 -7.031 5.918 938 HE1 MET 619 HE1 MET 619 11.960 -6.070 2.530 939 HE2 MET 619 HE2 MET 619 12.323 -4.737 3.630 940 HE3 MET 619 HE3 MET 619 13.132 -4.841 2.067 941 H ALA 620 HN ALA 620 9.881 -8.398 2.921 942 HA ALA 620 HA ALA 620 8.717 -10.572 4.520 943 HB1 ALA 620 HB1 ALA 620 6.755 -10.586 3.082 944 HB2 ALA 620 HB2 ALA 620 6.939 -9.007 3.849 945 HB3 ALA 620 HB3 ALA 620 7.396 -9.228 2.157 946 H THR 621 HN THR 621 8.112 -12.467 2.871 947 HA THR 621 HA THR 621 10.609 -13.176 1.686 948 HB THR 621 HB THR 621 8.985 -14.799 2.764 949 HG1 THR 621 HG1 THR 621 9.353 -16.102 0.447 950 HG21 THR 621 HG21 THR 621 7.628 -14.688 0.066 951 HG22 THR 621 HG22 THR 621 6.960 -14.013 1.556 952 HG23 THR 621 HG23 THR 621 7.224 -15.750 1.417 953 H ASN 622 HN ASN 622 7.668 -11.790 0.454 954 HA ASN 622 HA ASN 622 8.645 -12.211 -2.285 955 HB2 ASN 622 HB2 ASN 622 6.330 -12.218 -3.050 956 HB3 ASN 622 HB3 ASN 622 6.604 -13.479 -1.858 957 HD21 ASN 622 HD21 ASN 622 4.143 -12.257 -2.721 958 HD22 ASN 622 HD22 ASN 622 3.411 -11.569 -1.312 959 H GLY 623 HN GLY 623 9.046 -9.901 -0.335 960 HA2 GLY 623 HA2 GLY 623 9.452 -7.884 -2.004 961 HA3 GLY 623 HA3 GLY 623 7.712 -7.770 -1.801 962 H VAL 624 HN VAL 624 7.963 -5.708 -0.926 963 HA VAL 624 HA VAL 624 8.845 -5.730 1.881 964 HB VAL 624 HB VAL 624 10.466 -4.521 0.342 965 HG11 VAL 624 HG11 VAL 624 9.830 -2.269 -0.388 966 HG12 VAL 624 HG12 VAL 624 8.852 -3.516 -1.161 967 HG13 VAL 624 HG13 VAL 624 8.183 -2.570 0.168 968 HG21 VAL 624 HG21 VAL 624 10.445 -4.090 2.727 969 HG22 VAL 624 HG22 VAL 624 10.736 -2.593 1.841 970 HG23 VAL 624 HG23 VAL 624 9.143 -2.918 2.525 971 H VAL 625 HN VAL 625 7.787 -4.099 3.188 972 HA VAL 625 HA VAL 625 5.218 -3.167 2.112 973 HB VAL 625 HB VAL 625 5.651 -4.334 4.875 974 HG11 VAL 625 HG11 VAL 625 3.230 -4.040 5.157 975 HG12 VAL 625 HG12 VAL 625 4.051 -2.497 4.910 976 HG13 VAL 625 HG13 VAL 625 3.151 -3.239 3.586 977 HG21 VAL 625 HG21 VAL 625 4.097 -6.092 4.143 978 HG22 VAL 625 HG22 VAL 625 4.073 -5.385 2.528 979 HG23 VAL 625 HG23 VAL 625 5.567 -6.066 3.169 980 H HIS 626 HN HIS 626 4.802 -1.072 2.491 981 HA HIS 626 HA HIS 626 6.470 0.314 4.475 982 HB2 HIS 626 HB2 HIS 626 5.373 1.337 1.845 983 HB3 HIS 626 HB3 HIS 626 6.155 2.344 3.048 984 HD2 HIS 626 HD2 HIS 626 7.126 1.047 -0.143 985 HE1 HIS 626 HE1 HIS 626 10.569 0.402 2.226 986 HE2 HIS 626 HE2 HIS 626 9.710 0.775 -0.129 987 H VAL 627 HN VAL 627 5.269 0.738 6.200 988 HA VAL 627 HA VAL 627 2.444 0.832 6.260 989 HB VAL 627 HB VAL 627 4.336 2.114 8.243 990 HG11 VAL 627 HG11 VAL 627 2.534 1.692 9.852 991 HG12 VAL 627 HG12 VAL 627 2.037 2.783 8.559 992 HG13 VAL 627 HG13 VAL 627 1.516 1.098 8.538 993 HG21 VAL 627 HG21 VAL 627 4.235 -0.001 9.471 994 HG22 VAL 627 HG22 VAL 627 3.318 -0.719 8.146 995 HG23 VAL 627 HG23 VAL 627 4.980 -0.193 7.885 996 H ILE 628 HN ILE 628 1.056 2.428 5.673 997 HA ILE 628 HA ILE 628 2.090 5.188 5.676 998 HB ILE 628 HB ILE 628 0.242 5.634 3.936 999 HG12 ILE 628 HG12 ILE 628 0.645 2.667 3.495 1000 HG13 ILE 628 HG13 ILE 628 -0.833 3.429 4.077 1001 HG21 ILE 628 HG21 ILE 628 2.736 4.127 3.178 1002 HG22 ILE 628 HG22 ILE 628 1.784 5.148 2.098 1003 HG23 ILE 628 HG23 ILE 628 2.606 5.858 3.490 1004 HD11 ILE 628 HD11 ILE 628 -0.945 2.829 1.703 1005 HD12 ILE 628 HD12 ILE 628 -1.114 4.565 1.957 1006 HD13 ILE 628 HD13 ILE 628 0.417 3.902 1.380 1007 H THR 629 HN THR 629 0.821 6.766 6.507 1008 HA THR 629 HA THR 629 -1.420 5.825 8.143 1009 HB THR 629 HB THR 629 0.333 7.012 9.342 1010 HG1 THR 629 HG1 THR 629 -1.844 7.347 10.030 1011 HG21 THR 629 HG21 THR 629 1.202 8.371 7.517 1012 HG22 THR 629 HG22 THR 629 0.815 9.371 8.920 1013 HG23 THR 629 HG23 THR 629 -0.270 9.347 7.529 1014 H ASN 630 HN ASN 630 -1.022 6.913 5.175 1015 HA ASN 630 HA ASN 630 -3.657 8.204 5.094 1016 HB2 ASN 630 HB2 ASN 630 -1.262 9.050 3.446 1017 HB3 ASN 630 HB3 ASN 630 -2.882 9.707 3.300 1018 HD21 ASN 630 HD21 ASN 630 -3.654 11.116 4.888 1019 HD22 ASN 630 HD22 ASN 630 -2.594 11.890 6.011 1020 H VAL 631 HN VAL 631 -4.742 7.878 3.028 1021 HA VAL 631 HA VAL 631 -3.956 5.412 1.752 1022 HB VAL 631 HB VAL 631 -6.143 5.598 0.634 1023 HG11 VAL 631 HG11 VAL 631 -7.521 5.109 2.594 1024 HG12 VAL 631 HG12 VAL 631 -5.949 4.320 2.709 1025 HG13 VAL 631 HG13 VAL 631 -6.270 5.788 3.633 1026 HG21 VAL 631 HG21 VAL 631 -7.719 7.282 1.397 1027 HG22 VAL 631 HG22 VAL 631 -6.440 7.988 2.387 1028 HG23 VAL 631 HG23 VAL 631 -6.292 7.988 0.634 1029 H LEU 632 HN LEU 632 -3.917 5.273 -0.587 1030 HA LEU 632 HA LEU 632 -2.907 7.765 -1.750 1031 HB2 LEU 632 HB2 LEU 632 -2.354 4.896 -2.503 1032 HB3 LEU 632 HB3 LEU 632 -1.756 6.292 -3.385 1033 HG LEU 632 HG LEU 632 -1.120 5.734 -0.488 1034 HD11 LEU 632 HD11 LEU 632 -0.179 4.002 -1.944 1035 HD12 LEU 632 HD12 LEU 632 0.592 5.252 -2.921 1036 HD13 LEU 632 HD13 LEU 632 1.069 5.027 -1.237 1037 HD21 LEU 632 HD21 LEU 632 0.577 7.451 -0.787 1038 HD22 LEU 632 HD22 LEU 632 0.067 7.682 -2.462 1039 HD23 LEU 632 HD23 LEU 632 -1.029 8.091 -1.142 1040 H GLN 633 HN GLN 633 -4.294 8.757 -2.944 1041 HA GLN 633 HA GLN 633 -6.211 7.208 -4.560 1042 HB2 GLN 633 HB2 GLN 633 -6.564 9.931 -3.295 1043 HB3 GLN 633 HB3 GLN 633 -7.719 9.174 -4.381 1044 HG2 GLN 633 HG2 GLN 633 -8.078 7.383 -2.779 1045 HG3 GLN 633 HG3 GLN 633 -6.884 8.096 -1.697 1046 HE21 GLN 633 HE21 GLN 633 -10.079 8.379 -3.029 1047 HE22 GLN 633 HE22 GLN 633 -10.667 9.583 -1.930 1048 HA PRO 634 HA PRO 634 -4.175 9.221 -7.981 1049 HB2 PRO 634 HB2 PRO 634 -6.475 8.318 -9.566 1050 HB3 PRO 634 HB3 PRO 634 -4.776 7.855 -9.697 1051 HG2 PRO 634 HG2 PRO 634 -6.661 6.162 -8.778 1052 HG3 PRO 634 HG3 PRO 634 -4.990 6.135 -8.185 1053 HD2 PRO 634 HD2 PRO 634 -7.432 7.324 -6.923 1054 HD3 PRO 634 HD3 PRO 634 -6.109 6.406 -6.173 Start of MODEL 2 1 H1 ALA 500 H1 ALA 500 1.976 -15.273 11.705 2 H2 ALA 500 H2 ALA 500 3.046 -16.588 11.743 3 H3 ALA 500 H3 ALA 500 2.765 -15.764 10.287 4 HA ALA 500 HA ALA 500 3.887 -13.861 10.994 5 HB1 ALA 500 HB1 ALA 500 4.071 -15.146 13.716 6 HB2 ALA 500 HB2 ALA 500 4.721 -13.572 13.255 7 HB3 ALA 500 HB3 ALA 500 2.977 -13.836 13.273 8 H GLY 501 HN GLY 501 6.181 -13.636 10.962 9 HA2 GLY 501 HA2 GLY 501 8.387 -14.529 11.252 10 HA3 GLY 501 HA3 GLY 501 7.705 -16.145 11.126 11 H MET 502 HN MET 502 8.631 -17.033 9.370 12 HA MET 502 HA MET 502 9.253 -15.481 7.041 13 HB2 MET 502 HB2 MET 502 10.602 -17.446 7.740 14 HB3 MET 502 HB3 MET 502 9.232 -18.487 7.376 15 HG2 MET 502 HG2 MET 502 9.336 -17.795 5.030 16 HG3 MET 502 HG3 MET 502 10.722 -16.770 5.401 17 HE1 MET 502 HE1 MET 502 13.092 -17.752 6.247 18 HE2 MET 502 HE2 MET 502 12.235 -18.594 7.540 19 HE3 MET 502 HE3 MET 502 13.372 -19.471 6.516 20 H GLY 503 HN GLY 503 7.409 -14.623 6.193 21 HA2 GLY 503 HA2 GLY 503 5.728 -16.469 4.696 22 HA3 GLY 503 HA3 GLY 503 4.905 -15.486 5.900 23 H THR 504 HN THR 504 3.860 -14.953 3.685 24 HA THR 504 HA THR 504 5.351 -12.968 2.179 25 HB THR 504 HB THR 504 3.253 -12.894 0.780 26 HG1 THR 504 HG1 THR 504 1.675 -14.430 1.196 27 HG21 THR 504 HG21 THR 504 4.508 -15.615 1.149 28 HG22 THR 504 HG22 THR 504 5.168 -14.305 0.169 29 HG23 THR 504 HG23 THR 504 3.637 -15.058 -0.279 30 H VAL 505 HN VAL 505 3.757 -11.057 1.453 31 HA VAL 505 HA VAL 505 3.580 -9.242 3.511 32 HB VAL 505 HB VAL 505 1.709 -9.256 1.136 33 HG11 VAL 505 HG11 VAL 505 1.797 -6.824 1.368 34 HG12 VAL 505 HG12 VAL 505 1.184 -7.592 2.832 35 HG13 VAL 505 HG13 VAL 505 2.843 -6.995 2.778 36 HG21 VAL 505 HG21 VAL 505 3.962 -9.613 0.343 37 HG22 VAL 505 HG22 VAL 505 3.448 -7.970 -0.038 38 HG23 VAL 505 HG23 VAL 505 4.551 -8.261 1.310 39 H MET 506 HN MET 506 1.005 -11.316 2.252 40 HA MET 506 HA MET 506 -1.116 -10.271 3.729 41 HB2 MET 506 HB2 MET 506 -0.702 -13.080 2.703 42 HB3 MET 506 HB3 MET 506 -2.221 -12.481 3.354 43 HG2 MET 506 HG2 MET 506 -0.803 -11.511 0.884 44 HG3 MET 506 HG3 MET 506 -2.302 -12.435 0.960 45 HE1 MET 506 HE1 MET 506 -4.589 -11.436 1.997 46 HE2 MET 506 HE2 MET 506 -3.717 -10.996 3.465 47 HE3 MET 506 HE3 MET 506 -4.712 -9.797 2.642 48 H ASP 507 HN ASP 507 1.298 -12.654 4.661 49 HA ASP 507 HA ASP 507 -0.113 -13.439 7.037 50 HB2 ASP 507 HB2 ASP 507 1.602 -14.873 5.784 51 HB3 ASP 507 HB3 ASP 507 2.835 -13.868 6.541 52 H VAL 508 HN VAL 508 2.419 -11.158 6.211 53 HA VAL 508 HA VAL 508 3.161 -10.448 8.847 54 HB VAL 508 HB VAL 508 3.304 -8.776 6.327 55 HG11 VAL 508 HG11 VAL 508 5.036 -7.511 7.488 56 HG12 VAL 508 HG12 VAL 508 3.504 -7.436 8.358 57 HG13 VAL 508 HG13 VAL 508 4.794 -8.491 8.934 58 HG21 VAL 508 HG21 VAL 508 5.627 -9.545 6.181 59 HG22 VAL 508 HG22 VAL 508 5.373 -10.588 7.580 60 HG23 VAL 508 HG23 VAL 508 4.494 -10.892 6.080 61 H LEU 509 HN LEU 509 0.704 -9.234 6.612 62 HA LEU 509 HA LEU 509 -0.067 -6.980 8.136 63 HB2 LEU 509 HB2 LEU 509 -1.889 -8.542 6.319 64 HB3 LEU 509 HB3 LEU 509 -1.981 -6.841 6.725 65 HG LEU 509 HG LEU 509 0.092 -8.169 4.995 66 HD11 LEU 509 HD11 LEU 509 -0.868 -6.822 3.225 67 HD12 LEU 509 HD12 LEU 509 -2.104 -7.842 3.959 68 HD13 LEU 509 HD13 LEU 509 -2.031 -6.123 4.354 69 HD21 LEU 509 HD21 LEU 509 -0.145 -5.249 5.708 70 HD22 LEU 509 HD22 LEU 509 1.063 -6.354 6.365 71 HD23 LEU 509 HD23 LEU 509 1.048 -5.986 4.640 72 H LYS 510 HN LYS 510 -0.654 -10.316 8.556 73 HA LYS 510 HA LYS 510 -3.078 -10.003 10.097 74 HB2 LYS 510 HB2 LYS 510 -1.291 -12.415 9.735 75 HB3 LYS 510 HB3 LYS 510 -2.820 -12.427 10.594 76 HG2 LYS 510 HG2 LYS 510 -3.804 -11.577 8.359 77 HG3 LYS 510 HG3 LYS 510 -2.300 -12.184 7.667 78 HD2 LYS 510 HD2 LYS 510 -4.269 -13.784 9.300 79 HD3 LYS 510 HD3 LYS 510 -4.060 -13.879 7.552 80 HE2 LYS 510 HE2 LYS 510 -1.791 -14.415 9.456 81 HE3 LYS 510 HE3 LYS 510 -2.938 -15.674 9.001 82 HZ1 LYS 510 HZ1 LYS 510 -1.541 -14.115 6.920 83 HZ2 LYS 510 HZ2 LYS 510 -2.207 -15.670 6.818 84 HZ3 LYS 510 HZ3 LYS 510 -0.760 -15.420 7.673 85 H GLY 511 HN GLY 511 0.304 -10.051 10.603 86 HA2 GLY 511 HA2 GLY 511 0.160 -10.622 13.425 87 HA3 GLY 511 HA3 GLY 511 1.591 -10.136 12.526 88 H ASP 512 HN ASP 512 -0.528 -7.941 11.543 89 HA ASP 512 HA ASP 512 0.092 -6.153 13.818 90 HB2 ASP 512 HB2 ASP 512 1.466 -5.574 11.906 91 HB3 ASP 512 HB3 ASP 512 0.039 -5.459 10.880 92 H ASN 513 HN ASN 513 -1.340 -4.446 14.256 93 HA ASN 513 HA ASN 513 -4.101 -5.208 14.045 94 HB2 ASN 513 HB2 ASN 513 -2.966 -4.163 16.064 95 HB3 ASN 513 HB3 ASN 513 -2.966 -2.645 15.181 96 HD21 ASN 513 HD21 ASN 513 -4.226 -3.364 17.686 97 HD22 ASN 513 HD22 ASN 513 -5.916 -3.039 17.484 98 H ARG 514 HN ARG 514 -2.023 -2.756 12.597 99 HA ARG 514 HA ARG 514 -4.261 -1.190 11.643 100 HB2 ARG 514 HB2 ARG 514 -1.324 -0.850 11.006 101 HB3 ARG 514 HB3 ARG 514 -2.599 0.336 10.767 102 HG2 ARG 514 HG2 ARG 514 -2.020 1.162 12.742 103 HG3 ARG 514 HG3 ARG 514 -2.783 -0.262 13.451 104 HD2 ARG 514 HD2 ARG 514 -0.710 -0.412 14.410 105 HD3 ARG 514 HD3 ARG 514 -0.427 -1.344 12.941 106 HE ARG 514 HE ARG 514 0.182 1.515 12.874 107 HH11 ARG 514 HH12 ARG 514 1.349 -1.808 12.969 108 HH12 ARG 514 HH11 ARG 514 3.000 -1.351 12.669 109 HH21 ARG 514 HH22 ARG 514 2.380 2.079 12.469 110 HH22 ARG 514 HH21 ARG 514 3.594 0.831 12.382 111 H PHE 515 HN PHE 515 -1.922 -3.459 10.353 112 HA PHE 515 HA PHE 515 -2.657 -3.094 7.610 113 HB2 PHE 515 HB2 PHE 515 -1.268 -5.415 8.966 114 HB3 PHE 515 HB3 PHE 515 -1.288 -5.070 7.248 115 HD1 PHE 515 HD1 PHE 515 -0.985 -1.954 7.875 116 HD2 PHE 515 HD2 PHE 515 1.161 -5.483 8.914 117 HE1 PHE 515 HE1 PHE 515 1.069 -0.629 8.116 118 HE2 PHE 515 HE2 PHE 515 3.219 -4.161 9.165 119 HZ PHE 515 HZ PHE 515 3.175 -1.736 8.762 120 H SER 516 HN SER 516 -4.246 -4.485 10.204 121 HA SER 516 HA SER 516 -5.214 -6.912 9.233 122 HB2 SER 516 HB2 SER 516 -5.379 -6.099 11.597 123 HB3 SER 516 HB3 SER 516 -6.680 -5.027 11.085 124 HG SER 516 HG SER 516 -7.468 -6.988 11.947 125 H MET 517 HN MET 517 -6.479 -3.620 8.763 126 HA MET 517 HA MET 517 -8.894 -4.479 7.531 127 HB2 MET 517 HB2 MET 517 -7.462 -1.842 7.567 128 HB3 MET 517 HB3 MET 517 -8.876 -2.088 6.559 129 HG2 MET 517 HG2 MET 517 -9.633 -1.082 8.549 130 HG3 MET 517 HG3 MET 517 -10.108 -2.778 8.632 131 HE1 MET 517 HE1 MET 517 -7.448 -0.145 9.725 132 HE2 MET 517 HE2 MET 517 -6.461 -1.074 10.861 133 HE3 MET 517 HE3 MET 517 -6.454 -1.481 9.146 134 H LEU 518 HN LEU 518 -5.640 -3.990 6.328 135 HA LEU 518 HA LEU 518 -6.331 -4.016 3.578 136 HB2 LEU 518 HB2 LEU 518 -3.889 -4.297 5.140 137 HB3 LEU 518 HB3 LEU 518 -3.887 -5.314 3.710 138 HG LEU 518 HG LEU 518 -3.935 -2.362 3.925 139 HD11 LEU 518 HD11 LEU 518 -2.171 -2.510 2.234 140 HD12 LEU 518 HD12 LEU 518 -1.783 -3.353 3.734 141 HD13 LEU 518 HD13 LEU 518 -2.296 -4.265 2.315 142 HD21 LEU 518 HD21 LEU 518 -5.818 -2.869 2.479 143 HD22 LEU 518 HD22 LEU 518 -4.497 -2.115 1.588 144 HD23 LEU 518 HD23 LEU 518 -4.763 -3.853 1.469 145 H VAL 519 HN VAL 519 -5.572 -6.560 5.905 146 HA VAL 519 HA VAL 519 -5.658 -8.764 4.218 147 HB VAL 519 HB VAL 519 -6.729 -8.698 7.049 148 HG11 VAL 519 HG11 VAL 519 -6.028 -11.040 7.120 149 HG12 VAL 519 HG12 VAL 519 -7.234 -10.758 5.863 150 HG13 VAL 519 HG13 VAL 519 -5.534 -10.938 5.429 151 HG21 VAL 519 HG21 VAL 519 -3.895 -9.088 6.099 152 HG22 VAL 519 HG22 VAL 519 -4.515 -7.688 6.974 153 HG23 VAL 519 HG23 VAL 519 -4.455 -9.264 7.762 154 H ALA 520 HN ALA 520 -8.238 -6.839 5.559 155 HA ALA 520 HA ALA 520 -10.340 -8.623 4.664 156 HB1 ALA 520 HB1 ALA 520 -10.651 -7.378 6.716 157 HB2 ALA 520 HB2 ALA 520 -10.440 -5.850 5.860 158 HB3 ALA 520 HB3 ALA 520 -11.845 -6.865 5.525 159 H ALA 521 HN ALA 521 -9.103 -5.403 3.751 160 HA ALA 521 HA ALA 521 -10.956 -4.962 1.666 161 HB1 ALA 521 HB1 ALA 521 -9.479 -3.171 0.953 162 HB2 ALA 521 HB2 ALA 521 -9.652 -3.164 2.707 163 HB3 ALA 521 HB3 ALA 521 -8.185 -3.808 1.969 164 H ILE 522 HN ILE 522 -7.566 -6.026 1.561 165 HA ILE 522 HA ILE 522 -7.413 -6.557 -1.189 166 HB ILE 522 HB ILE 522 -5.954 -7.950 1.072 167 HG12 ILE 522 HG12 ILE 522 -4.921 -5.639 -0.559 168 HG13 ILE 522 HG13 ILE 522 -5.869 -5.374 0.900 169 HG21 ILE 522 HG21 ILE 522 -5.279 -7.707 -1.860 170 HG22 ILE 522 HG22 ILE 522 -4.189 -8.334 -0.621 171 HG23 ILE 522 HG23 ILE 522 -5.694 -9.181 -0.982 172 HD11 ILE 522 HD11 ILE 522 -3.724 -5.250 1.712 173 HD12 ILE 522 HD12 ILE 522 -4.119 -6.950 1.998 174 HD13 ILE 522 HD13 ILE 522 -3.125 -6.505 0.608 175 H GLN 523 HN GLN 523 -8.827 -8.328 1.433 176 HA GLN 523 HA GLN 523 -8.979 -10.877 0.194 177 HB2 GLN 523 HB2 GLN 523 -9.230 -10.353 2.667 178 HB3 GLN 523 HB3 GLN 523 -10.851 -9.779 2.298 179 HG2 GLN 523 HG2 GLN 523 -11.078 -11.993 3.069 180 HG3 GLN 523 HG3 GLN 523 -11.306 -12.051 1.321 181 HE21 GLN 523 HE21 GLN 523 -8.213 -11.667 2.888 182 HE22 GLN 523 HE22 GLN 523 -7.569 -13.204 2.432 183 H SER 524 HN SER 524 -11.339 -8.237 0.612 184 HA SER 524 HA SER 524 -13.395 -9.587 -0.819 185 HB2 SER 524 HB2 SER 524 -13.905 -7.923 0.911 186 HB3 SER 524 HB3 SER 524 -13.160 -6.659 -0.075 187 HG SER 524 HG SER 524 -14.809 -7.530 -1.721 188 H ALA 525 HN ALA 525 -10.780 -7.528 -1.775 189 HA ALA 525 HA ALA 525 -11.941 -6.889 -4.336 190 HB1 ALA 525 HB1 ALA 525 -9.078 -6.562 -3.450 191 HB2 ALA 525 HB2 ALA 525 -9.859 -5.800 -4.837 192 HB3 ALA 525 HB3 ALA 525 -10.357 -5.373 -3.200 193 H GLY 526 HN GLY 526 -10.223 -9.528 -3.012 194 HA2 GLY 526 HA2 GLY 526 -9.822 -11.579 -4.028 195 HA3 GLY 526 HA3 GLY 526 -10.265 -10.871 -5.573 196 H LEU 527 HN LEU 527 -7.907 -9.266 -3.632 197 HA LEU 527 HA LEU 527 -5.856 -9.931 -5.621 198 HB2 LEU 527 HB2 LEU 527 -6.259 -7.674 -3.704 199 HB3 LEU 527 HB3 LEU 527 -4.634 -8.047 -4.241 200 HG LEU 527 HG LEU 527 -5.518 -6.259 -5.577 201 HD11 LEU 527 HD11 LEU 527 -5.509 -8.810 -7.175 202 HD12 LEU 527 HD12 LEU 527 -5.271 -7.182 -7.808 203 HD13 LEU 527 HD13 LEU 527 -4.086 -7.883 -6.704 204 HD21 LEU 527 HD21 LEU 527 -7.495 -6.464 -6.945 205 HD22 LEU 527 HD22 LEU 527 -7.776 -8.096 -6.341 206 HD23 LEU 527 HD23 LEU 527 -7.902 -6.717 -5.249 207 H THR 528 HN THR 528 -6.850 -11.274 -2.900 208 HA THR 528 HA THR 528 -4.671 -11.327 -1.141 209 HB THR 528 HB THR 528 -6.624 -13.584 -1.585 210 HG1 THR 528 HG1 THR 528 -7.015 -11.012 -0.730 211 HG21 THR 528 HG21 THR 528 -5.052 -12.656 0.821 212 HG22 THR 528 HG22 THR 528 -4.836 -14.163 -0.069 213 HG23 THR 528 HG23 THR 528 -6.308 -13.892 0.863 214 H GLU 529 HN GLU 529 -5.407 -13.257 -3.977 215 HA GLU 529 HA GLU 529 -3.502 -15.295 -3.586 216 HB2 GLU 529 HB2 GLU 529 -3.801 -15.591 -6.109 217 HB3 GLU 529 HB3 GLU 529 -5.232 -15.758 -5.103 218 HG2 GLU 529 HG2 GLU 529 -5.847 -13.430 -5.640 219 HG3 GLU 529 HG3 GLU 529 -4.456 -13.343 -6.719 220 H THR 530 HN THR 530 -3.251 -12.077 -4.893 221 HA THR 530 HA THR 530 -0.871 -12.390 -6.357 222 HB THR 530 HB THR 530 -1.839 -9.883 -4.968 223 HG1 THR 530 HG1 THR 530 -2.376 -10.611 -7.658 224 HG21 THR 530 HG21 THR 530 -0.087 -10.281 -7.398 225 HG22 THR 530 HG22 THR 530 0.445 -9.724 -5.811 226 HG23 THR 530 HG23 THR 530 -0.646 -8.728 -6.774 227 H LEU 531 HN LEU 531 -1.321 -10.926 -3.105 228 HA LEU 531 HA LEU 531 1.466 -10.970 -2.554 229 HB2 LEU 531 HB2 LEU 531 -0.893 -10.532 -0.725 230 HB3 LEU 531 HB3 LEU 531 0.769 -10.139 -0.359 231 HG LEU 531 HG LEU 531 -0.181 -8.121 -0.899 232 HD11 LEU 531 HD11 LEU 531 1.904 -8.407 -2.054 233 HD12 LEU 531 HD12 LEU 531 1.061 -9.125 -3.428 234 HD13 LEU 531 HD13 LEU 531 0.807 -7.426 -3.027 235 HD21 LEU 531 HD21 LEU 531 -2.259 -9.172 -1.846 236 HD22 LEU 531 HD22 LEU 531 -1.747 -7.633 -2.540 237 HD23 LEU 531 HD23 LEU 531 -1.429 -9.135 -3.401 238 H ASN 532 HN ASN 532 -0.530 -13.473 -2.791 239 HA ASN 532 HA ASN 532 0.233 -14.921 -0.391 240 HB2 ASN 532 HB2 ASN 532 -2.013 -15.192 -1.498 241 HB3 ASN 532 HB3 ASN 532 -1.194 -15.947 -2.860 242 HD21 ASN 532 HD21 ASN 532 -2.175 -17.903 -2.651 243 HD22 ASN 532 HD22 ASN 532 -1.887 -18.978 -1.328 244 H ARG 533 HN ARG 533 1.223 -14.537 -3.681 245 HA ARG 533 HA ARG 533 3.035 -16.826 -3.599 246 HB2 ARG 533 HB2 ARG 533 2.218 -14.865 -5.726 247 HB3 ARG 533 HB3 ARG 533 3.609 -15.916 -5.946 248 HG2 ARG 533 HG2 ARG 533 0.887 -16.979 -5.276 249 HG3 ARG 533 HG3 ARG 533 1.413 -16.683 -6.936 250 HD2 ARG 533 HD2 ARG 533 2.737 -18.517 -4.933 251 HD3 ARG 533 HD3 ARG 533 1.777 -19.011 -6.328 252 HE ARG 533 HE ARG 533 4.017 -17.349 -7.026 253 HH11 ARG 533 HH12 ARG 533 2.986 -20.643 -6.416 254 HH12 ARG 533 HH11 ARG 533 4.310 -21.349 -7.292 255 HH21 ARG 533 HH22 ARG 533 5.736 -18.285 -8.200 256 HH22 ARG 533 HH21 ARG 533 5.860 -20.012 -8.303 257 H GLU 534 HN GLU 534 5.330 -16.517 -4.146 258 HA GLU 534 HA GLU 534 6.380 -14.165 -2.814 259 HB2 GLU 534 HB2 GLU 534 7.799 -16.582 -3.934 260 HB3 GLU 534 HB3 GLU 534 8.585 -15.256 -3.088 261 HG2 GLU 534 HG2 GLU 534 7.189 -15.779 -1.102 262 HG3 GLU 534 HG3 GLU 534 6.599 -17.205 -1.956 263 H GLY 535 HN GLY 535 8.614 -13.477 -3.963 264 HA2 GLY 535 HA2 GLY 535 9.338 -13.060 -6.378 265 HA3 GLY 535 HA3 GLY 535 7.700 -12.435 -6.558 266 H VAL 536 HN VAL 536 8.309 -10.319 -6.991 267 HA VAL 536 HA VAL 536 9.422 -8.930 -4.654 268 HB VAL 536 HB VAL 536 10.421 -7.259 -6.157 269 HG11 VAL 536 HG11 VAL 536 11.829 -9.044 -5.401 270 HG12 VAL 536 HG12 VAL 536 11.219 -10.122 -6.660 271 HG13 VAL 536 HG13 VAL 536 12.208 -8.727 -7.094 272 HG21 VAL 536 HG21 VAL 536 9.548 -9.102 -8.381 273 HG22 VAL 536 HG22 VAL 536 8.908 -7.489 -8.061 274 HG23 VAL 536 HG23 VAL 536 10.587 -7.689 -8.563 275 H TYR 537 HN TYR 537 8.214 -7.363 -3.837 276 HA TYR 537 HA TYR 537 6.205 -5.983 -5.408 277 HB2 TYR 537 HB2 TYR 537 5.498 -7.753 -3.057 278 HB3 TYR 537 HB3 TYR 537 4.446 -6.472 -3.637 279 HD1 TYR 537 HD2 TYR 537 3.664 -6.615 -6.092 280 HD2 TYR 537 HD1 TYR 537 5.368 -9.898 -3.981 281 HE1 TYR 537 HE2 TYR 537 2.635 -8.171 -7.693 282 HE2 TYR 537 HE1 TYR 537 4.342 -11.460 -5.577 283 HH TYR 537 HH TYR 537 2.929 -10.447 -8.515 284 H THR 538 HN THR 538 5.453 -4.089 -4.393 285 HA THR 538 HA THR 538 6.683 -3.442 -1.802 286 HB THR 538 HB THR 538 6.462 -1.514 -4.129 287 HG1 THR 538 HG1 THR 538 8.353 -2.290 -4.664 288 HG21 THR 538 HG21 THR 538 6.269 -0.413 -1.952 289 HG22 THR 538 HG22 THR 538 7.814 -0.036 -2.720 290 HG23 THR 538 HG23 THR 538 7.743 -1.218 -1.414 291 H VAL 539 HN VAL 539 4.973 -3.422 -0.477 292 HA VAL 539 HA VAL 539 2.418 -2.409 -1.529 293 HB VAL 539 HB VAL 539 2.892 -4.199 0.860 294 HG11 VAL 539 HG11 VAL 539 0.859 -2.888 1.083 295 HG12 VAL 539 HG12 VAL 539 0.343 -3.375 -0.531 296 HG13 VAL 539 HG13 VAL 539 0.458 -4.575 0.757 297 HG21 VAL 539 HG21 VAL 539 3.465 -5.317 -1.238 298 HG22 VAL 539 HG22 VAL 539 2.006 -6.003 -0.519 299 HG23 VAL 539 HG23 VAL 539 1.880 -4.901 -1.889 300 H PHE 540 HN PHE 540 1.737 -0.506 -0.826 301 HA PHE 540 HA PHE 540 2.771 0.552 1.691 302 HB2 PHE 540 HB2 PHE 540 1.090 1.831 -0.481 303 HB3 PHE 540 HB3 PHE 540 1.634 2.651 0.975 304 HD1 PHE 540 HD2 PHE 540 4.018 3.150 1.300 305 HD2 PHE 540 HD1 PHE 540 2.555 1.471 -2.327 306 HE1 PHE 540 HE2 PHE 540 6.101 3.806 0.161 307 HE2 PHE 540 HE1 PHE 540 4.631 2.128 -3.475 308 HZ PHE 540 HZ PHE 540 6.405 3.292 -2.233 309 H ALA 541 HN ALA 541 1.669 0.012 3.461 310 HA ALA 541 HA ALA 541 -1.164 -0.705 3.197 311 HB1 ALA 541 HB1 ALA 541 0.750 -1.235 5.473 312 HB2 ALA 541 HB2 ALA 541 -0.930 -1.780 5.397 313 HB3 ALA 541 HB3 ALA 541 0.259 -2.393 4.238 314 HA PRO 542 HA PRO 542 -2.038 3.224 5.219 315 HB2 PRO 542 HB2 PRO 542 -4.809 2.548 4.625 316 HB3 PRO 542 HB3 PRO 542 -3.846 3.901 4.028 317 HG2 PRO 542 HG2 PRO 542 -4.632 1.859 2.439 318 HG3 PRO 542 HG3 PRO 542 -3.117 2.746 2.188 319 HD2 PRO 542 HD2 PRO 542 -3.560 0.078 3.486 320 HD3 PRO 542 HD3 PRO 542 -2.288 0.581 2.350 321 H THR 543 HN THR 543 -2.532 3.522 7.318 322 HA THR 543 HA THR 543 -3.122 1.202 8.893 323 HB THR 543 HB THR 543 -2.986 2.809 10.806 324 HG1 THR 543 HG1 THR 543 -2.585 4.935 10.420 325 HG21 THR 543 HG21 THR 543 -0.713 2.913 8.819 326 HG22 THR 543 HG22 THR 543 -1.011 1.618 9.977 327 HG23 THR 543 HG23 THR 543 -0.587 3.231 10.551 328 H ASN 544 HN ASN 544 -4.720 1.715 10.869 329 HA ASN 544 HA ASN 544 -7.337 1.670 9.812 330 HB2 ASN 544 HB2 ASN 544 -6.688 0.607 11.974 331 HB3 ASN 544 HB3 ASN 544 -6.498 2.208 12.678 332 HD21 ASN 544 HD21 ASN 544 -8.738 -0.208 11.603 333 HD22 ASN 544 HD22 ASN 544 -10.160 0.525 12.260 334 H GLU 545 HN GLU 545 -5.331 4.159 11.190 335 HA GLU 545 HA GLU 545 -7.131 6.216 11.584 336 HB2 GLU 545 HB2 GLU 545 -4.328 6.479 10.476 337 HB3 GLU 545 HB3 GLU 545 -5.251 7.750 11.257 338 HG2 GLU 545 HG2 GLU 545 -3.793 7.039 12.912 339 HG3 GLU 545 HG3 GLU 545 -5.292 6.201 13.302 340 H ALA 546 HN ALA 546 -5.468 5.279 8.592 341 HA ALA 546 HA ALA 546 -6.485 7.386 7.008 342 HB1 ALA 546 HB1 ALA 546 -4.513 6.158 6.326 343 HB2 ALA 546 HB2 ALA 546 -5.467 4.683 6.167 344 HB3 ALA 546 HB3 ALA 546 -5.765 6.045 5.084 345 H PHE 547 HN PHE 547 -7.470 4.027 7.390 346 HA PHE 547 HA PHE 547 -9.556 4.099 5.510 347 HB2 PHE 547 HB2 PHE 547 -8.941 2.270 7.831 348 HB3 PHE 547 HB3 PHE 547 -10.326 2.027 6.790 349 HD1 PHE 547 HD2 PHE 547 -9.495 2.420 4.146 350 HD2 PHE 547 HD1 PHE 547 -7.270 0.761 7.376 351 HE1 PHE 547 HE2 PHE 547 -8.112 1.166 2.546 352 HE2 PHE 547 HE1 PHE 547 -5.880 -0.503 5.775 353 HZ PHE 547 HZ PHE 547 -6.306 -0.295 3.358 354 H ARG 548 HN ARG 548 -9.365 5.102 8.816 355 HA ARG 548 HA ARG 548 -12.247 5.292 9.150 356 HB2 ARG 548 HB2 ARG 548 -10.540 4.761 10.993 357 HB3 ARG 548 HB3 ARG 548 -10.129 6.466 10.948 358 HG2 ARG 548 HG2 ARG 548 -12.572 6.943 11.395 359 HG3 ARG 548 HG3 ARG 548 -12.750 5.218 11.726 360 HD2 ARG 548 HD2 ARG 548 -11.031 7.209 13.188 361 HD3 ARG 548 HD3 ARG 548 -12.417 6.314 13.812 362 HE ARG 548 HE ARG 548 -10.658 4.374 13.045 363 HH11 ARG 548 HH12 ARG 548 -10.521 7.108 15.224 364 HH12 ARG 548 HH11 ARG 548 -9.301 6.409 16.233 365 HH21 ARG 548 HH22 ARG 548 -9.069 3.440 14.372 366 HH22 ARG 548 HH21 ARG 548 -8.465 4.313 15.755 367 H ALA 549 HN ALA 549 -9.565 7.244 8.222 368 HA ALA 549 HA ALA 549 -10.833 9.775 8.705 369 HB1 ALA 549 HB1 ALA 549 -8.857 10.757 7.746 370 HB2 ALA 549 HB2 ALA 549 -8.390 9.467 8.856 371 HB3 ALA 549 HB3 ALA 549 -8.345 9.192 7.114 372 H LEU 550 HN LEU 550 -11.025 7.479 6.198 373 HA LEU 550 HA LEU 550 -11.420 9.019 3.924 374 HB2 LEU 550 HB2 LEU 550 -12.665 6.491 4.916 375 HB3 LEU 550 HB3 LEU 550 -13.161 7.209 3.401 376 HG LEU 550 HG LEU 550 -11.009 5.461 3.870 377 HD11 LEU 550 HD11 LEU 550 -10.765 5.741 1.393 378 HD12 LEU 550 HD12 LEU 550 -12.425 5.442 1.919 379 HD13 LEU 550 HD13 LEU 550 -11.918 7.079 1.495 380 HD21 LEU 550 HD21 LEU 550 -9.575 7.320 4.423 381 HD22 LEU 550 HD22 LEU 550 -9.160 6.721 2.818 382 HD23 LEU 550 HD23 LEU 550 -10.115 8.195 2.988 383 HA PRO 551 HA PRO 551 -14.841 11.520 4.951 384 HB2 PRO 551 HB2 PRO 551 -15.450 12.037 2.190 385 HB3 PRO 551 HB3 PRO 551 -14.483 13.023 3.287 386 HG2 PRO 551 HG2 PRO 551 -13.463 11.697 1.096 387 HG3 PRO 551 HG3 PRO 551 -12.509 12.177 2.512 388 HD2 PRO 551 HD2 PRO 551 -13.713 9.509 1.853 389 HD3 PRO 551 HD3 PRO 551 -12.123 9.877 2.529 390 HA PRO 552 HA PRO 552 -18.477 9.053 5.094 391 HB2 PRO 552 HB2 PRO 552 -19.828 11.657 4.475 392 HB3 PRO 552 HB3 PRO 552 -20.226 10.448 5.704 393 HG2 PRO 552 HG2 PRO 552 -18.925 12.668 6.377 394 HG3 PRO 552 HG3 PRO 552 -18.497 11.111 7.106 395 HD2 PRO 552 HD2 PRO 552 -17.045 12.702 5.063 396 HD3 PRO 552 HD3 PRO 552 -16.411 11.593 6.293 397 H ARG 553 HN ARG 553 -18.341 11.453 2.465 398 HA ARG 553 HA ARG 553 -20.155 10.104 0.757 399 HB2 ARG 553 HB2 ARG 553 -17.994 12.126 0.162 400 HB3 ARG 553 HB3 ARG 553 -19.145 11.546 -1.031 401 HG2 ARG 553 HG2 ARG 553 -20.977 12.499 0.178 402 HG3 ARG 553 HG3 ARG 553 -19.919 12.931 1.525 403 HD2 ARG 553 HD2 ARG 553 -20.404 14.868 0.117 404 HD3 ARG 553 HD3 ARG 553 -18.689 14.464 0.081 405 HE ARG 553 HE ARG 553 -20.577 13.736 -2.073 406 HH11 ARG 553 HH12 ARG 553 -17.467 14.899 -0.984 407 HH12 ARG 553 HH11 ARG 553 -16.802 15.038 -2.584 408 HH21 ARG 553 HH22 ARG 553 -19.714 13.886 -4.185 409 HH22 ARG 553 HH21 ARG 553 -18.073 14.439 -4.407 410 H GLU 554 HN GLU 554 -16.597 10.185 0.823 411 HA GLU 554 HA GLU 554 -16.441 8.446 -1.481 412 HB2 GLU 554 HB2 GLU 554 -14.260 9.608 0.255 413 HB3 GLU 554 HB3 GLU 554 -14.011 8.760 -1.265 414 HG2 GLU 554 HG2 GLU 554 -15.602 11.295 -0.971 415 HG3 GLU 554 HG3 GLU 554 -13.907 11.229 -1.445 416 H ARG 555 HN ARG 555 -15.513 8.236 1.958 417 HA ARG 555 HA ARG 555 -14.507 5.735 2.167 418 HB2 ARG 555 HB2 ARG 555 -15.097 7.468 3.977 419 HB3 ARG 555 HB3 ARG 555 -16.673 6.683 4.026 420 HG2 ARG 555 HG2 ARG 555 -15.602 4.564 4.538 421 HG3 ARG 555 HG3 ARG 555 -14.032 5.365 4.498 422 HD2 ARG 555 HD2 ARG 555 -14.794 6.847 6.328 423 HD3 ARG 555 HD3 ARG 555 -16.293 5.918 6.408 424 HE ARG 555 HE ARG 555 -13.647 4.689 6.880 425 HH11 ARG 555 HH12 ARG 555 -16.956 5.281 7.798 426 HH12 ARG 555 HH11 ARG 555 -16.929 4.189 9.143 427 HH21 ARG 555 HH22 ARG 555 -13.583 3.234 8.662 428 HH22 ARG 555 HH21 ARG 555 -15.007 3.024 9.637 429 H SER 556 HN SER 556 -17.998 6.510 2.295 430 HA SER 556 HA SER 556 -18.914 3.862 2.442 431 HB2 SER 556 HB2 SER 556 -20.406 6.232 1.295 432 HB3 SER 556 HB3 SER 556 -21.109 4.769 1.997 433 HG SER 556 HG SER 556 -20.180 7.025 3.227 434 H ARG 557 HN ARG 557 -18.134 5.914 -0.272 435 HA ARG 557 HA ARG 557 -19.212 4.276 -2.322 436 HB2 ARG 557 HB2 ARG 557 -18.815 6.468 -2.976 437 HB3 ARG 557 HB3 ARG 557 -17.265 6.544 -2.154 438 HG2 ARG 557 HG2 ARG 557 -16.384 4.968 -3.902 439 HG3 ARG 557 HG3 ARG 557 -17.899 5.215 -4.772 440 HD2 ARG 557 HD2 ARG 557 -17.447 7.458 -5.173 441 HD3 ARG 557 HD3 ARG 557 -16.262 7.552 -3.871 442 HE ARG 557 HE ARG 557 -15.423 5.732 -5.894 443 HH11 ARG 557 HH12 ARG 557 -15.650 9.138 -5.105 444 HH12 ARG 557 HH11 ARG 557 -14.358 9.593 -6.168 445 HH21 ARG 557 HH22 ARG 557 -13.742 6.308 -7.274 446 HH22 ARG 557 HH21 ARG 557 -13.266 7.980 -7.430 447 H LEU 558 HN LEU 558 -15.855 4.785 -1.235 448 HA LEU 558 HA LEU 558 -14.679 2.870 -2.913 449 HB2 LEU 558 HB2 LEU 558 -13.694 4.810 -1.448 450 HB3 LEU 558 HB3 LEU 558 -13.537 3.565 -0.229 451 HG LEU 558 HG LEU 558 -11.451 3.978 -1.485 452 HD11 LEU 558 HD11 LEU 558 -11.808 1.797 -0.466 453 HD12 LEU 558 HD12 LEU 558 -12.614 1.238 -1.932 454 HD13 LEU 558 HD13 LEU 558 -10.901 1.658 -1.973 455 HD21 LEU 558 HD21 LEU 558 -12.432 4.555 -3.642 456 HD22 LEU 558 HD22 LEU 558 -11.258 3.248 -3.800 457 HD23 LEU 558 HD23 LEU 558 -12.983 2.891 -3.841 458 H LEU 559 HN LEU 559 -15.625 2.652 0.503 459 HA LEU 559 HA LEU 559 -14.958 -0.172 0.565 460 HB2 LEU 559 HB2 LEU 559 -16.130 1.613 2.699 461 HB3 LEU 559 HB3 LEU 559 -15.538 -0.019 2.937 462 HG LEU 559 HG LEU 559 -13.823 2.308 2.072 463 HD11 LEU 559 HD11 LEU 559 -14.621 2.628 4.345 464 HD12 LEU 559 HD12 LEU 559 -14.089 1.005 4.779 465 HD13 LEU 559 HD13 LEU 559 -12.903 2.235 4.337 466 HD21 LEU 559 HD21 LEU 559 -12.973 0.179 1.290 467 HD22 LEU 559 HD22 LEU 559 -11.959 0.808 2.591 468 HD23 LEU 559 HD23 LEU 559 -13.103 -0.494 2.917 469 H GLY 560 HN GLY 560 -17.269 1.076 -0.978 470 HA2 GLY 560 HA2 GLY 560 -19.360 -0.716 0.093 471 HA3 GLY 560 HA3 GLY 560 -19.732 0.863 -0.585 472 H ASP 561 HN ASP 561 -17.205 -0.402 -2.308 473 HA ASP 561 HA ASP 561 -18.894 -1.951 -4.116 474 HB2 ASP 561 HB2 ASP 561 -19.067 0.282 -5.029 475 HB3 ASP 561 HB3 ASP 561 -17.318 0.490 -4.953 476 H ALA 562 HN ALA 562 -17.800 -3.476 -5.315 477 HA ALA 562 HA ALA 562 -15.274 -4.287 -4.216 478 HB1 ALA 562 HB1 ALA 562 -16.915 -5.476 -6.449 479 HB2 ALA 562 HB2 ALA 562 -15.515 -6.232 -5.686 480 HB3 ALA 562 HB3 ALA 562 -16.978 -5.934 -4.747 481 H LYS 563 HN LYS 563 -16.399 -2.767 -7.153 482 HA LYS 563 HA LYS 563 -14.017 -3.143 -8.669 483 HB2 LYS 563 HB2 LYS 563 -16.184 -2.614 -9.717 484 HB3 LYS 563 HB3 LYS 563 -16.169 -1.035 -8.945 485 HG2 LYS 563 HG2 LYS 563 -13.799 -0.969 -10.233 486 HG3 LYS 563 HG3 LYS 563 -14.741 -1.987 -11.323 487 HD2 LYS 563 HD2 LYS 563 -14.937 0.359 -11.949 488 HD3 LYS 563 HD3 LYS 563 -16.495 -0.267 -11.393 489 HE2 LYS 563 HE2 LYS 563 -16.050 0.701 -9.164 490 HE3 LYS 563 HE3 LYS 563 -14.539 1.373 -9.773 491 HZ1 LYS 563 HZ1 LYS 563 -17.271 2.054 -10.719 492 HZ2 LYS 563 HZ2 LYS 563 -15.834 2.678 -11.366 493 HZ3 LYS 563 HZ3 LYS 563 -16.260 3.024 -9.764 494 H GLU 564 HN GLU 564 -15.320 -0.366 -6.845 495 HA GLU 564 HA GLU 564 -13.216 1.407 -7.088 496 HB2 GLU 564 HB2 GLU 564 -14.939 0.885 -4.654 497 HB3 GLU 564 HB3 GLU 564 -13.900 2.286 -4.855 498 HG2 GLU 564 HG2 GLU 564 -16.164 1.596 -6.709 499 HG3 GLU 564 HG3 GLU 564 -16.309 2.687 -5.332 500 H LEU 565 HN LEU 565 -13.618 -1.132 -4.624 501 HA LEU 565 HA LEU 565 -11.267 -0.763 -3.216 502 HB2 LEU 565 HB2 LEU 565 -12.954 -3.172 -3.786 503 HB3 LEU 565 HB3 LEU 565 -11.498 -3.303 -2.831 504 HG LEU 565 HG LEU 565 -13.844 -1.532 -2.147 505 HD11 LEU 565 HD11 LEU 565 -14.463 -3.870 -1.978 506 HD12 LEU 565 HD12 LEU 565 -13.005 -4.214 -1.041 507 HD13 LEU 565 HD13 LEU 565 -14.267 -3.177 -0.369 508 HD21 LEU 565 HD21 LEU 565 -11.745 -0.689 -1.271 509 HD22 LEU 565 HD22 LEU 565 -12.727 -1.353 0.036 510 HD23 LEU 565 HD23 LEU 565 -11.364 -2.276 -0.601 511 H ALA 566 HN ALA 566 -11.859 -2.975 -5.941 512 HA ALA 566 HA ALA 566 -9.319 -4.124 -6.020 513 HB1 ALA 566 HB1 ALA 566 -11.188 -3.715 -8.349 514 HB2 ALA 566 HB2 ALA 566 -9.886 -4.898 -8.239 515 HB3 ALA 566 HB3 ALA 566 -11.292 -5.031 -7.180 516 H ASN 567 HN ASN 567 -10.590 -1.336 -7.820 517 HA ASN 567 HA ASN 567 -8.340 -0.957 -9.459 518 HB2 ASN 567 HB2 ASN 567 -10.493 0.963 -8.567 519 HB3 ASN 567 HB3 ASN 567 -9.235 1.405 -9.714 520 HD21 ASN 567 HD21 ASN 567 -9.197 -1.298 -10.878 521 HD22 ASN 567 HD22 ASN 567 -10.603 -1.392 -11.871 522 H ILE 568 HN ILE 568 -9.188 0.496 -6.334 523 HA ILE 568 HA ILE 568 -6.911 2.218 -6.313 524 HB ILE 568 HB ILE 568 -8.803 1.420 -4.101 525 HG12 ILE 568 HG12 ILE 568 -9.879 2.600 -5.959 526 HG13 ILE 568 HG13 ILE 568 -9.826 3.614 -4.526 527 HG21 ILE 568 HG21 ILE 568 -6.760 3.636 -4.166 528 HG22 ILE 568 HG22 ILE 568 -7.967 3.389 -2.903 529 HG23 ILE 568 HG23 ILE 568 -6.701 2.189 -3.159 530 HD11 ILE 568 HD11 ILE 568 -9.321 4.903 -6.507 531 HD12 ILE 568 HD12 ILE 568 -7.900 4.809 -5.465 532 HD13 ILE 568 HD13 ILE 568 -8.001 3.802 -6.907 533 H LEU 569 HN LEU 569 -7.597 -0.984 -4.972 534 HA LEU 569 HA LEU 569 -5.292 -1.084 -3.316 535 HB2 LEU 569 HB2 LEU 569 -7.006 -3.269 -4.485 536 HB3 LEU 569 HB3 LEU 569 -5.665 -3.582 -3.398 537 HG LEU 569 HG LEU 569 -8.152 -1.995 -2.744 538 HD11 LEU 569 HD11 LEU 569 -8.602 -3.840 -1.194 539 HD12 LEU 569 HD12 LEU 569 -8.569 -4.377 -2.872 540 HD13 LEU 569 HD13 LEU 569 -7.194 -4.698 -1.818 541 HD21 LEU 569 HD21 LEU 569 -7.267 -1.925 -0.469 542 HD22 LEU 569 HD22 LEU 569 -5.784 -2.706 -1.017 543 HD23 LEU 569 HD23 LEU 569 -6.200 -1.093 -1.600 544 H LYS 570 HN LYS 570 -5.872 -1.906 -6.689 545 HA LYS 570 HA LYS 570 -3.414 -3.169 -7.236 546 HB2 LYS 570 HB2 LYS 570 -5.255 -1.533 -8.982 547 HB3 LYS 570 HB3 LYS 570 -3.829 -2.354 -9.602 548 HG2 LYS 570 HG2 LYS 570 -4.740 -4.481 -9.158 549 HG3 LYS 570 HG3 LYS 570 -6.004 -3.807 -8.126 550 HD2 LYS 570 HD2 LYS 570 -6.923 -4.454 -10.285 551 HD3 LYS 570 HD3 LYS 570 -7.006 -2.706 -10.077 552 HE2 LYS 570 HE2 LYS 570 -6.285 -3.074 -12.293 553 HE3 LYS 570 HE3 LYS 570 -4.851 -2.576 -11.390 554 HZ1 LYS 570 HZ1 LYS 570 -5.567 -5.399 -11.972 555 HZ2 LYS 570 HZ2 LYS 570 -4.120 -4.842 -11.283 556 HZ3 LYS 570 HZ3 LYS 570 -4.485 -4.482 -12.898 557 H TYR 571 HN TYR 571 -4.141 0.065 -6.476 558 HA TYR 571 HA TYR 571 -1.817 1.172 -7.834 559 HB2 TYR 571 HB2 TYR 571 -4.061 2.318 -7.782 560 HB3 TYR 571 HB3 TYR 571 -3.827 2.568 -6.059 561 HD1 TYR 571 HD2 TYR 571 -1.750 3.073 -9.143 562 HD2 TYR 571 HD1 TYR 571 -3.272 4.728 -5.526 563 HE1 TYR 571 HE2 TYR 571 -0.606 5.190 -9.640 564 HE2 TYR 571 HE1 TYR 571 -2.133 6.849 -6.001 565 HH TYR 571 HH TYR 571 -0.649 7.484 -9.081 566 H HIS 572 HN HIS 572 -2.670 -0.084 -4.773 567 HA HIS 572 HA HIS 572 -0.619 1.422 -3.354 568 HB2 HIS 572 HB2 HIS 572 -2.716 -0.552 -2.475 569 HB3 HIS 572 HB3 HIS 572 -1.404 -0.073 -1.402 570 HD1 HIS 572 HD1 HIS 572 -4.335 1.452 -3.271 571 HD2 HIS 572 HD2 HIS 572 -1.765 2.296 -0.112 572 HE1 HIS 572 HE1 HIS 572 -5.244 3.522 -2.153 573 H ILE 573 HN ILE 573 -0.912 -1.472 -5.078 574 HA ILE 573 HA ILE 573 1.422 -2.641 -3.736 575 HB ILE 573 HB ILE 573 -0.340 -3.913 -5.835 576 HG12 ILE 573 HG12 ILE 573 -0.427 -4.345 -2.844 577 HG13 ILE 573 HG13 ILE 573 -1.557 -3.315 -3.718 578 HG21 ILE 573 HG21 ILE 573 0.661 -6.004 -5.061 579 HG22 ILE 573 HG22 ILE 573 1.891 -4.891 -5.657 580 HG23 ILE 573 HG23 ILE 573 1.665 -5.111 -3.920 581 HD11 ILE 573 HD11 ILE 573 -2.321 -5.241 -4.997 582 HD12 ILE 573 HD12 ILE 573 -1.190 -6.276 -4.123 583 HD13 ILE 573 HD13 ILE 573 -2.517 -5.492 -3.263 584 H GLY 574 HN GLY 574 3.314 -2.104 -4.600 585 HA2 GLY 574 HA2 GLY 574 3.486 -1.522 -7.472 586 HA3 GLY 574 HA3 GLY 574 4.712 -1.163 -6.266 587 H ASP 575 HN ASP 575 5.119 -2.486 -8.777 588 HA ASP 575 HA ASP 575 5.425 -5.316 -8.143 589 HB2 ASP 575 HB2 ASP 575 4.499 -4.718 -10.325 590 HB3 ASP 575 HB3 ASP 575 5.925 -3.760 -10.697 591 H GLU 576 HN GLU 576 7.235 -2.629 -7.590 592 HA GLU 576 HA GLU 576 9.772 -4.003 -8.052 593 HB2 GLU 576 HB2 GLU 576 9.311 -1.066 -8.569 594 HB3 GLU 576 HB3 GLU 576 10.763 -1.992 -8.926 595 HG2 GLU 576 HG2 GLU 576 9.647 -3.202 -10.658 596 HG3 GLU 576 HG3 GLU 576 8.094 -2.495 -10.215 597 H ILE 577 HN ILE 577 10.941 -4.100 -6.308 598 HA ILE 577 HA ILE 577 9.972 -2.942 -3.890 599 HB ILE 577 HB ILE 577 12.545 -4.459 -4.390 600 HG12 ILE 577 HG12 ILE 577 9.859 -5.393 -3.362 601 HG13 ILE 577 HG13 ILE 577 10.535 -5.755 -4.945 602 HG21 ILE 577 HG21 ILE 577 11.122 -3.791 -1.812 603 HG22 ILE 577 HG22 ILE 577 12.504 -4.876 -1.957 604 HG23 ILE 577 HG23 ILE 577 12.685 -3.165 -2.344 605 HD11 ILE 577 HD11 ILE 577 10.765 -7.635 -3.434 606 HD12 ILE 577 HD12 ILE 577 12.347 -7.000 -3.891 607 HD13 ILE 577 HD13 ILE 577 11.674 -6.631 -2.305 608 H LEU 578 HN LEU 578 10.342 -0.944 -3.260 609 HA LEU 578 HA LEU 578 12.974 0.238 -3.828 610 HB2 LEU 578 HB2 LEU 578 11.120 1.182 -5.242 611 HB3 LEU 578 HB3 LEU 578 10.371 1.756 -3.766 612 HG LEU 578 HG LEU 578 12.266 3.221 -3.323 613 HD11 LEU 578 HD11 LEU 578 14.023 1.822 -4.292 614 HD12 LEU 578 HD12 LEU 578 13.403 2.161 -5.907 615 HD13 LEU 578 HD13 LEU 578 14.076 3.465 -4.930 616 HD21 LEU 578 HD21 LEU 578 10.450 4.086 -4.700 617 HD22 LEU 578 HD22 LEU 578 11.999 4.764 -5.204 618 HD23 LEU 578 HD23 LEU 578 11.248 3.480 -6.152 619 H VAL 579 HN VAL 579 14.008 0.427 -1.990 620 HA VAL 579 HA VAL 579 12.515 1.075 0.457 621 HB VAL 579 HB VAL 579 14.507 0.314 1.696 622 HG11 VAL 579 HG11 VAL 579 14.310 -2.087 1.165 623 HG12 VAL 579 HG12 VAL 579 12.741 -1.285 1.244 624 HG13 VAL 579 HG13 VAL 579 13.458 -1.668 -0.321 625 HG21 VAL 579 HG21 VAL 579 16.216 0.838 0.018 626 HG22 VAL 579 HG22 VAL 579 16.319 -0.846 0.534 627 HG23 VAL 579 HG23 VAL 579 15.590 -0.443 -1.021 628 H SER 580 HN SER 580 13.706 2.528 2.007 629 HA SER 580 HA SER 580 14.029 5.035 0.833 630 HB2 SER 580 HB2 SER 580 13.395 4.681 3.201 631 HB3 SER 580 HB3 SER 580 15.028 4.120 3.545 632 HG SER 580 HG SER 580 15.788 6.134 3.323 633 H GLY 581 HN GLY 581 16.482 2.783 2.057 634 HA2 GLY 581 HA2 GLY 581 18.669 4.485 1.339 635 HA3 GLY 581 HA3 GLY 581 18.778 2.807 1.851 636 H GLY 582 HN GLY 582 16.634 3.085 -0.728 637 HA2 GLY 582 HA2 GLY 582 18.795 2.610 -2.675 638 HA3 GLY 582 HA3 GLY 582 17.419 1.522 -2.573 639 H ILE 583 HN ILE 583 16.471 4.705 -1.976 640 HA ILE 583 HA ILE 583 15.088 4.868 -4.487 641 HB ILE 583 HB ILE 583 15.311 6.988 -2.345 642 HG12 ILE 583 HG12 ILE 583 13.211 4.856 -2.758 643 HG13 ILE 583 HG13 ILE 583 14.372 4.915 -1.440 644 HG21 ILE 583 HG21 ILE 583 14.584 7.890 -4.470 645 HG22 ILE 583 HG22 ILE 583 13.356 6.631 -4.614 646 HG23 ILE 583 HG23 ILE 583 13.226 7.852 -3.345 647 HD11 ILE 583 HD11 ILE 583 13.354 6.963 -0.615 648 HD12 ILE 583 HD12 ILE 583 12.198 6.932 -1.946 649 HD13 ILE 583 HD13 ILE 583 12.170 5.659 -0.726 650 H GLY 584 HN GLY 584 17.025 7.435 -2.951 651 HA2 GLY 584 HA2 GLY 584 18.718 8.739 -3.884 652 HA3 GLY 584 HA3 GLY 584 18.597 7.790 -5.359 653 H ALA 585 HN ALA 585 17.111 10.361 -3.497 654 HA ALA 585 HA ALA 585 16.061 12.270 -4.070 655 HB1 ALA 585 HB1 ALA 585 16.176 13.154 -6.318 656 HB2 ALA 585 HB2 ALA 585 17.741 12.499 -5.840 657 HB3 ALA 585 HB3 ALA 585 16.701 11.588 -6.934 658 H LEU 586 HN LEU 586 15.141 10.235 -6.870 659 HA LEU 586 HA LEU 586 12.499 9.786 -5.874 660 HB2 LEU 586 HB2 LEU 586 12.709 12.289 -6.714 661 HB3 LEU 586 HB3 LEU 586 12.504 11.547 -8.287 662 HG LEU 586 HG LEU 586 10.540 11.058 -6.064 663 HD11 LEU 586 HD11 LEU 586 10.479 13.295 -8.089 664 HD12 LEU 586 HD12 LEU 586 9.182 12.880 -6.969 665 HD13 LEU 586 HD13 LEU 586 10.723 13.477 -6.351 666 HD21 LEU 586 HD21 LEU 586 9.011 10.589 -7.864 667 HD22 LEU 586 HD22 LEU 586 10.238 11.007 -9.062 668 HD23 LEU 586 HD23 LEU 586 10.455 9.591 -8.033 669 H VAL 587 HN VAL 587 11.402 8.269 -7.066 670 HA VAL 587 HA VAL 587 12.565 7.375 -9.612 671 HB VAL 587 HB VAL 587 12.088 5.520 -7.259 672 HG11 VAL 587 HG11 VAL 587 11.443 4.468 -9.360 673 HG12 VAL 587 HG12 VAL 587 13.009 4.883 -10.059 674 HG13 VAL 587 HG13 VAL 587 12.917 3.741 -8.719 675 HG21 VAL 587 HG21 VAL 587 14.177 6.743 -7.034 676 HG22 VAL 587 HG22 VAL 587 14.492 5.049 -7.408 677 HG23 VAL 587 HG23 VAL 587 14.646 6.273 -8.667 678 H ARG 588 HN ARG 588 11.045 6.569 -11.029 679 HA ARG 588 HA ARG 588 8.266 6.793 -10.226 680 HB2 ARG 588 HB2 ARG 588 9.524 6.142 -12.898 681 HB3 ARG 588 HB3 ARG 588 7.791 6.287 -12.623 682 HG2 ARG 588 HG2 ARG 588 9.816 8.477 -12.200 683 HG3 ARG 588 HG3 ARG 588 8.755 8.317 -13.600 684 HD2 ARG 588 HD2 ARG 588 6.813 8.664 -12.275 685 HD3 ARG 588 HD3 ARG 588 7.733 8.520 -10.777 686 HE ARG 588 HE ARG 588 8.716 10.653 -12.378 687 HH11 ARG 588 HH12 ARG 588 6.005 9.792 -10.330 688 HH12 ARG 588 HH11 ARG 588 5.767 11.411 -9.736 689 HH21 ARG 588 HH22 ARG 588 8.393 12.783 -11.608 690 HH22 ARG 588 HH21 ARG 588 7.127 13.108 -10.467 691 H LEU 589 HN LEU 589 7.484 5.152 -9.121 692 HA LEU 589 HA LEU 589 8.348 2.419 -9.744 693 HB2 LEU 589 HB2 LEU 589 8.217 3.656 -7.368 694 HB3 LEU 589 HB3 LEU 589 6.579 3.041 -7.435 695 HG LEU 589 HG LEU 589 8.076 1.557 -6.179 696 HD11 LEU 589 HD11 LEU 589 7.508 -0.533 -7.292 697 HD12 LEU 589 HD12 LEU 589 6.151 0.592 -7.333 698 HD13 LEU 589 HD13 LEU 589 7.135 0.346 -8.776 699 HD21 LEU 589 HD21 LEU 589 9.529 1.287 -8.807 700 HD22 LEU 589 HD22 LEU 589 10.152 2.026 -7.332 701 HD23 LEU 589 HD23 LEU 589 9.818 0.294 -7.377 702 H LYS 590 HN LYS 590 6.990 1.087 -10.851 703 HA LYS 590 HA LYS 590 4.330 2.129 -11.416 704 HB2 LYS 590 HB2 LYS 590 5.851 -0.173 -12.638 705 HB3 LYS 590 HB3 LYS 590 4.218 0.297 -13.107 706 HG2 LYS 590 HG2 LYS 590 5.145 2.581 -13.606 707 HG3 LYS 590 HG3 LYS 590 6.753 1.889 -13.396 708 HD2 LYS 590 HD2 LYS 590 6.161 1.935 -15.749 709 HD3 LYS 590 HD3 LYS 590 6.265 0.267 -15.181 710 HE2 LYS 590 HE2 LYS 590 3.881 0.088 -15.072 711 HE3 LYS 590 HE3 LYS 590 3.684 1.815 -15.375 712 HZ1 LYS 590 HZ1 LYS 590 4.860 -0.117 -17.308 713 HZ2 LYS 590 HZ2 LYS 590 4.531 1.525 -17.590 714 HZ3 LYS 590 HZ3 LYS 590 3.257 0.430 -17.344 715 H SER 591 HN SER 591 2.448 1.156 -10.974 716 HA SER 591 HA SER 591 2.547 -0.874 -8.857 717 HB2 SER 591 HB2 SER 591 0.270 -0.061 -8.311 718 HB3 SER 591 HB3 SER 591 1.464 1.234 -8.271 719 HG SER 591 HG SER 591 0.741 1.941 -10.264 720 H LEU 592 HN LEU 592 0.685 -2.448 -8.841 721 HA LEU 592 HA LEU 592 0.500 -3.818 -11.285 722 HB2 LEU 592 HB2 LEU 592 -0.854 -4.103 -8.633 723 HB3 LEU 592 HB3 LEU 592 -1.336 -5.096 -9.993 724 HG LEU 592 HG LEU 592 1.043 -5.861 -10.167 725 HD11 LEU 592 HD11 LEU 592 1.317 -4.542 -7.486 726 HD12 LEU 592 HD12 LEU 592 2.501 -5.602 -8.251 727 HD13 LEU 592 HD13 LEU 592 2.115 -4.039 -8.975 728 HD21 LEU 592 HD21 LEU 592 0.845 -7.458 -8.359 729 HD22 LEU 592 HD22 LEU 592 -0.355 -6.434 -7.570 730 HD23 LEU 592 HD23 LEU 592 -0.725 -7.193 -9.118 731 H GLN 593 HN GLN 593 -1.236 -1.107 -10.247 732 HA GLN 593 HA GLN 593 -3.613 -1.642 -11.778 733 HB2 GLN 593 HB2 GLN 593 -3.540 0.063 -9.946 734 HB3 GLN 593 HB3 GLN 593 -2.482 1.045 -10.953 735 HG2 GLN 593 HG2 GLN 593 -4.410 0.832 -12.699 736 HG3 GLN 593 HG3 GLN 593 -5.384 0.433 -11.287 737 HE21 GLN 593 HE21 GLN 593 -3.770 2.189 -9.564 738 HE22 GLN 593 HE22 GLN 593 -4.265 3.797 -9.948 739 H GLY 594 HN GLY 594 -0.428 -0.442 -12.354 740 HA2 GLY 594 HA2 GLY 594 0.436 -0.558 -14.622 741 HA3 GLY 594 HA3 GLY 594 -1.122 0.045 -15.181 742 H ASP 595 HN ASP 595 -1.058 1.897 -12.734 743 HA ASP 595 HA ASP 595 0.237 4.065 -14.144 744 HB2 ASP 595 HB2 ASP 595 -2.034 4.164 -12.875 745 HB3 ASP 595 HB3 ASP 595 -1.044 4.327 -11.436 746 H LYS 596 HN LYS 596 1.220 5.702 -12.291 747 HA LYS 596 HA LYS 596 3.490 4.155 -11.238 748 HB2 LYS 596 HB2 LYS 596 4.962 6.030 -11.855 749 HB3 LYS 596 HB3 LYS 596 4.177 5.321 -13.255 750 HG2 LYS 596 HG2 LYS 596 3.177 7.816 -11.906 751 HG3 LYS 596 HG3 LYS 596 4.337 7.825 -13.231 752 HD2 LYS 596 HD2 LYS 596 2.775 6.871 -14.731 753 HD3 LYS 596 HD3 LYS 596 1.658 6.474 -13.425 754 HE2 LYS 596 HE2 LYS 596 1.362 8.906 -13.008 755 HE3 LYS 596 HE3 LYS 596 2.382 9.233 -14.410 756 HZ1 LYS 596 HZ1 LYS 596 -0.177 7.717 -14.469 757 HZ2 LYS 596 HZ2 LYS 596 0.794 8.098 -15.810 758 HZ3 LYS 596 HZ3 LYS 596 0.021 9.336 -14.943 759 H LEU 597 HN LEU 597 4.206 4.617 -9.270 760 HA LEU 597 HA LEU 597 2.605 6.425 -7.651 761 HB2 LEU 597 HB2 LEU 597 4.791 4.492 -6.867 762 HB3 LEU 597 HB3 LEU 597 3.757 5.371 -5.759 763 HG LEU 597 HG LEU 597 2.713 3.384 -7.775 764 HD11 LEU 597 HD11 LEU 597 4.161 2.225 -6.216 765 HD12 LEU 597 HD12 LEU 597 3.326 2.972 -4.855 766 HD13 LEU 597 HD13 LEU 597 2.470 1.837 -5.900 767 HD21 LEU 597 HD21 LEU 597 0.701 3.462 -6.410 768 HD22 LEU 597 HD22 LEU 597 1.457 4.645 -5.341 769 HD23 LEU 597 HD23 LEU 597 1.109 5.066 -7.019 770 H GLU 598 HN GLU 598 3.387 8.170 -6.560 771 HA GLU 598 HA GLU 598 5.838 9.351 -7.578 772 HB2 GLU 598 HB2 GLU 598 3.732 10.670 -7.345 773 HB3 GLU 598 HB3 GLU 598 3.790 10.411 -5.612 774 HG2 GLU 598 HG2 GLU 598 4.570 12.603 -6.031 775 HG3 GLU 598 HG3 GLU 598 5.967 11.631 -5.578 776 H VAL 599 HN VAL 599 7.322 7.863 -6.593 777 HA VAL 599 HA VAL 599 7.425 7.937 -3.655 778 HB VAL 599 HB VAL 599 8.900 6.016 -5.463 779 HG11 VAL 599 HG11 VAL 599 9.924 6.347 -3.270 780 HG12 VAL 599 HG12 VAL 599 8.388 5.972 -2.489 781 HG13 VAL 599 HG13 VAL 599 9.237 4.728 -3.410 782 HG21 VAL 599 HG21 VAL 599 7.232 4.344 -4.824 783 HG22 VAL 599 HG22 VAL 599 6.332 5.574 -3.934 784 HG23 VAL 599 HG23 VAL 599 6.486 5.688 -5.688 785 H SER 600 HN SER 600 8.945 9.066 -2.692 786 HA SER 600 HA SER 600 11.344 9.805 -4.183 787 HB2 SER 600 HB2 SER 600 9.691 11.547 -4.693 788 HB3 SER 600 HB3 SER 600 9.447 11.822 -2.968 789 HG SER 600 HG SER 600 11.905 12.176 -4.352 790 H LEU 601 HN LEU 601 12.801 11.097 -2.812 791 HA LEU 601 HA LEU 601 12.643 10.510 0.048 792 HB2 LEU 601 HB2 LEU 601 13.910 8.661 -1.009 793 HB3 LEU 601 HB3 LEU 601 15.014 9.830 -1.707 794 HG LEU 601 HG LEU 601 15.679 10.500 0.606 795 HD11 LEU 601 HD11 LEU 601 15.122 8.963 2.446 796 HD12 LEU 601 HD12 LEU 601 13.707 9.807 1.815 797 HD13 LEU 601 HD13 LEU 601 13.997 8.121 1.381 798 HD21 LEU 601 HD21 LEU 601 16.056 7.591 -0.098 799 HD22 LEU 601 HD22 LEU 601 17.020 8.940 -0.699 800 HD23 LEU 601 HD23 LEU 601 17.058 8.523 1.015 801 H LYS 602 HN LYS 602 12.729 12.495 0.870 802 HA LYS 602 HA LYS 602 14.670 14.393 -0.276 803 HB2 LYS 602 HB2 LYS 602 11.932 14.970 0.863 804 HB3 LYS 602 HB3 LYS 602 13.101 16.206 0.425 805 HG2 LYS 602 HG2 LYS 602 13.038 15.412 -1.902 806 HG3 LYS 602 HG3 LYS 602 11.810 14.232 -1.444 807 HD2 LYS 602 HD2 LYS 602 10.280 15.983 -0.826 808 HD3 LYS 602 HD3 LYS 602 11.518 17.212 -1.083 809 HE2 LYS 602 HE2 LYS 602 10.043 17.199 -2.974 810 HE3 LYS 602 HE3 LYS 602 11.607 16.558 -3.470 811 HZ1 LYS 602 HZ1 LYS 602 9.864 15.231 -4.388 812 HZ2 LYS 602 HZ2 LYS 602 9.158 14.991 -2.870 813 HZ3 LYS 602 HZ3 LYS 602 10.670 14.307 -3.222 814 H ASN 603 HN ASN 603 16.313 14.414 1.084 815 HA ASN 603 HA ASN 603 17.550 14.834 2.935 816 HB2 ASN 603 HB2 ASN 603 14.971 16.044 3.948 817 HB3 ASN 603 HB3 ASN 603 16.522 16.183 4.768 818 HD21 ASN 603 HD21 ASN 603 14.832 18.282 3.754 819 HD22 ASN 603 HD22 ASN 603 15.773 19.148 2.584 820 H ASN 604 HN ASN 604 16.533 12.311 2.627 821 HA ASN 604 HA ASN 604 16.546 10.331 3.743 822 HB2 ASN 604 HB2 ASN 604 18.155 11.530 5.290 823 HB3 ASN 604 HB3 ASN 604 16.779 11.889 6.326 824 HD21 ASN 604 HD21 ASN 604 17.624 10.736 8.042 825 HD22 ASN 604 HD22 ASN 604 17.685 9.009 8.062 826 H VAL 605 HN VAL 605 14.177 12.343 3.528 827 HA VAL 605 HA VAL 605 12.345 10.797 5.236 828 HB VAL 605 HB VAL 605 11.835 13.462 3.891 829 HG11 VAL 605 HG11 VAL 605 9.806 12.139 4.171 830 HG12 VAL 605 HG12 VAL 605 10.173 11.924 5.884 831 HG13 VAL 605 HG13 VAL 605 9.808 13.531 5.254 832 HG21 VAL 605 HG21 VAL 605 13.477 13.646 5.697 833 HG22 VAL 605 HG22 VAL 605 11.957 14.434 6.117 834 HG23 VAL 605 HG23 VAL 605 12.350 12.854 6.799 835 H VAL 606 HN VAL 606 11.380 9.195 4.191 836 HA VAL 606 HA VAL 606 11.187 9.233 1.303 837 HB VAL 606 HB VAL 606 11.892 7.161 2.324 838 HG11 VAL 606 HG11 VAL 606 9.245 7.164 3.762 839 HG12 VAL 606 HG12 VAL 606 10.415 5.842 3.765 840 HG13 VAL 606 HG13 VAL 606 10.836 7.394 4.489 841 HG21 VAL 606 HG21 VAL 606 10.589 7.002 0.257 842 HG22 VAL 606 HG22 VAL 606 10.319 5.599 1.291 843 HG23 VAL 606 HG23 VAL 606 9.103 6.872 1.197 844 H SER 607 HN SER 607 9.334 9.295 0.100 845 HA SER 607 HA SER 607 6.779 9.591 1.475 846 HB2 SER 607 HB2 SER 607 6.343 11.634 -0.031 847 HB3 SER 607 HB3 SER 607 7.391 11.866 1.370 848 HG SER 607 HG SER 607 9.183 11.539 -0.090 849 H VAL 608 HN VAL 608 4.952 9.331 0.107 850 HA VAL 608 HA VAL 608 5.431 8.443 -2.625 851 HB VAL 608 HB VAL 608 5.504 6.362 -1.386 852 HG11 VAL 608 HG11 VAL 608 3.539 5.586 -0.081 853 HG12 VAL 608 HG12 VAL 608 4.364 6.970 0.637 854 HG13 VAL 608 HG13 VAL 608 2.847 7.204 -0.233 855 HG21 VAL 608 HG21 VAL 608 3.632 5.160 -2.459 856 HG22 VAL 608 HG22 VAL 608 2.882 6.708 -2.848 857 HG23 VAL 608 HG23 VAL 608 4.438 6.275 -3.561 858 H ASN 609 HN ASN 609 4.111 9.586 -3.847 859 HA ASN 609 HA ASN 609 2.241 10.561 -4.703 860 HB2 ASN 609 HB2 ASN 609 0.870 8.725 -2.729 861 HB3 ASN 609 HB3 ASN 609 0.047 9.611 -4.007 862 HD21 ASN 609 HD21 ASN 609 -0.673 7.575 -4.760 863 HD22 ASN 609 HD22 ASN 609 0.367 6.554 -5.688 864 H LYS 610 HN LYS 610 3.502 12.146 -2.954 865 HA LYS 610 HA LYS 610 3.183 14.164 -1.918 866 HB2 LYS 610 HB2 LYS 610 0.240 13.461 -1.858 867 HB3 LYS 610 HB3 LYS 610 0.929 15.023 -1.444 868 HG2 LYS 610 HG2 LYS 610 1.477 15.497 -3.672 869 HG3 LYS 610 HG3 LYS 610 1.302 13.809 -4.163 870 HD2 LYS 610 HD2 LYS 610 -0.942 15.613 -3.242 871 HD3 LYS 610 HD3 LYS 610 -0.598 15.181 -4.918 872 HE2 LYS 610 HE2 LYS 610 -0.997 12.837 -4.416 873 HE3 LYS 610 HE3 LYS 610 -1.284 13.230 -2.720 874 HZ1 LYS 610 HZ1 LYS 610 -3.362 12.951 -3.825 875 HZ2 LYS 610 HZ2 LYS 610 -2.943 14.049 -5.048 876 HZ3 LYS 610 HZ3 LYS 610 -3.187 14.596 -3.461 877 H GLU 611 HN GLU 611 2.027 11.193 -0.645 878 HA GLU 611 HA GLU 611 1.733 12.216 2.064 879 HB2 GLU 611 HB2 GLU 611 1.506 9.369 1.088 880 HB3 GLU 611 HB3 GLU 611 0.951 10.003 2.628 881 HG2 GLU 611 HG2 GLU 611 -0.170 10.564 -0.099 882 HG3 GLU 611 HG3 GLU 611 -0.942 9.702 1.231 883 HA PRO 612 HA PRO 612 5.836 10.779 3.153 884 HB2 PRO 612 HB2 PRO 612 5.722 11.217 5.795 885 HB3 PRO 612 HB3 PRO 612 5.815 12.555 4.641 886 HG2 PRO 612 HG2 PRO 612 3.445 11.486 6.115 887 HG3 PRO 612 HG3 PRO 612 3.880 13.166 5.761 888 HD2 PRO 612 HD2 PRO 612 2.037 11.681 4.329 889 HD3 PRO 612 HD3 PRO 612 2.893 13.104 3.703 890 H VAL 613 HN VAL 613 6.656 8.810 3.747 891 HA VAL 613 HA VAL 613 4.817 6.733 4.483 892 HB VAL 613 HB VAL 613 7.838 6.661 4.280 893 HG11 VAL 613 HG11 VAL 613 6.977 4.933 5.799 894 HG12 VAL 613 HG12 VAL 613 5.883 4.375 4.535 895 HG13 VAL 613 HG13 VAL 613 7.629 4.234 4.317 896 HG21 VAL 613 HG21 VAL 613 7.406 5.460 2.177 897 HG22 VAL 613 HG22 VAL 613 5.675 5.721 2.401 898 HG23 VAL 613 HG23 VAL 613 6.749 7.098 2.152 899 H ALA 614 HN ALA 614 4.213 6.191 6.445 900 HA ALA 614 HA ALA 614 5.136 7.757 8.660 901 HB1 ALA 614 HB1 ALA 614 2.764 7.210 8.344 902 HB2 ALA 614 HB2 ALA 614 3.131 5.506 8.609 903 HB3 ALA 614 HB3 ALA 614 3.365 6.673 9.912 904 H GLU 615 HN GLU 615 5.799 4.578 7.452 905 HA GLU 615 HA GLU 615 7.735 4.069 9.490 906 HB2 GLU 615 HB2 GLU 615 5.399 3.613 10.515 907 HB3 GLU 615 HB3 GLU 615 5.392 2.188 9.494 908 HG2 GLU 615 HG2 GLU 615 7.160 1.204 10.656 909 HG3 GLU 615 HG3 GLU 615 7.619 2.731 11.417 910 HA PRO 616 HA PRO 616 8.383 1.855 5.566 911 HB2 PRO 616 HB2 PRO 616 10.824 2.773 5.034 912 HB3 PRO 616 HB3 PRO 616 9.405 3.812 4.848 913 HG2 PRO 616 HG2 PRO 616 11.436 3.743 7.030 914 HG3 PRO 616 HG3 PRO 616 10.623 5.135 6.295 915 HD2 PRO 616 HD2 PRO 616 9.905 3.898 8.702 916 HD3 PRO 616 HD3 PRO 616 8.891 5.010 7.761 917 H ASP 617 HN ASP 617 9.701 0.129 4.933 918 HA ASP 617 HA ASP 617 11.413 -1.354 4.899 919 HB2 ASP 617 HB2 ASP 617 12.895 0.396 5.878 920 HB3 ASP 617 HB3 ASP 617 12.442 -0.173 7.482 921 H ILE 618 HN ILE 618 9.314 -2.312 5.314 922 HA ILE 618 HA ILE 618 9.456 -4.036 7.678 923 HB ILE 618 HB ILE 618 7.166 -2.890 6.113 924 HG12 ILE 618 HG12 ILE 618 7.711 -3.206 9.073 925 HG13 ILE 618 HG13 ILE 618 7.975 -1.749 8.123 926 HG21 ILE 618 HG21 ILE 618 5.630 -4.483 7.249 927 HG22 ILE 618 HG22 ILE 618 6.732 -5.307 6.144 928 HG23 ILE 618 HG23 ILE 618 7.025 -5.355 7.882 929 HD11 ILE 618 HD11 ILE 618 5.932 -1.582 9.394 930 HD12 ILE 618 HD12 ILE 618 5.573 -1.630 7.666 931 HD13 ILE 618 HD13 ILE 618 5.328 -3.067 8.655 932 H MET 619 HN MET 619 10.503 -5.816 7.027 933 HA MET 619 HA MET 619 10.676 -6.512 4.259 934 HB2 MET 619 HB2 MET 619 12.543 -6.594 6.003 935 HB3 MET 619 HB3 MET 619 11.800 -8.082 6.569 936 HG2 MET 619 HG2 MET 619 13.255 -9.014 5.139 937 HG3 MET 619 HG3 MET 619 11.993 -8.659 3.963 938 HE1 MET 619 HE1 MET 619 12.331 -5.408 4.026 939 HE2 MET 619 HE2 MET 619 13.421 -5.112 2.664 940 HE3 MET 619 HE3 MET 619 12.073 -6.235 2.486 941 H ALA 620 HN ALA 620 9.727 -8.087 3.170 942 HA ALA 620 HA ALA 620 8.461 -10.300 4.642 943 HB1 ALA 620 HB1 ALA 620 6.701 -8.823 3.771 944 HB2 ALA 620 HB2 ALA 620 7.377 -8.971 2.149 945 HB3 ALA 620 HB3 ALA 620 6.690 -10.383 2.950 946 H THR 621 HN THR 621 8.054 -12.168 2.873 947 HA THR 621 HA THR 621 10.684 -12.682 1.784 948 HB THR 621 HB THR 621 9.219 -14.447 2.941 949 HG1 THR 621 HG1 THR 621 9.899 -15.663 0.573 950 HG21 THR 621 HG21 THR 621 7.966 -14.588 0.193 951 HG22 THR 621 HG22 THR 621 7.160 -13.989 1.646 952 HG23 THR 621 HG23 THR 621 7.662 -15.675 1.552 953 H ASN 622 HN ASN 622 7.689 -11.480 0.604 954 HA ASN 622 HA ASN 622 8.593 -11.939 -2.155 955 HB2 ASN 622 HB2 ASN 622 6.248 -11.865 -2.847 956 HB3 ASN 622 HB3 ASN 622 6.525 -13.138 -1.669 957 HD21 ASN 622 HD21 ASN 622 4.085 -11.819 -2.437 958 HD22 ASN 622 HD22 ASN 622 3.422 -11.126 -0.998 959 H GLY 623 HN GLY 623 9.092 -9.665 -0.206 960 HA2 GLY 623 HA2 GLY 623 9.586 -7.622 -1.784 961 HA3 GLY 623 HA3 GLY 623 7.842 -7.464 -1.656 962 H VAL 624 HN VAL 624 7.980 -5.487 -0.667 963 HA VAL 624 HA VAL 624 8.748 -5.588 2.162 964 HB VAL 624 HB VAL 624 10.527 -4.444 0.722 965 HG11 VAL 624 HG11 VAL 624 8.380 -2.342 0.542 966 HG12 VAL 624 HG12 VAL 624 10.070 -2.117 0.084 967 HG13 VAL 624 HG13 VAL 624 9.063 -3.263 -0.802 968 HG21 VAL 624 HG21 VAL 624 9.228 -2.864 2.940 969 HG22 VAL 624 HG22 VAL 624 10.452 -4.121 3.126 970 HG23 VAL 624 HG23 VAL 624 10.858 -2.603 2.322 971 H VAL 625 HN VAL 625 7.697 -3.952 3.434 972 HA VAL 625 HA VAL 625 5.209 -2.906 2.247 973 HB VAL 625 HB VAL 625 5.534 -3.925 5.084 974 HG11 VAL 625 HG11 VAL 625 3.903 -2.117 4.857 975 HG12 VAL 625 HG12 VAL 625 3.060 -3.032 3.609 976 HG13 VAL 625 HG13 VAL 625 3.126 -3.648 5.262 977 HG21 VAL 625 HG21 VAL 625 5.593 -5.784 3.519 978 HG22 VAL 625 HG22 VAL 625 4.070 -5.780 4.409 979 HG23 VAL 625 HG23 VAL 625 4.120 -5.203 2.743 980 H HIS 626 HN HIS 626 4.792 -0.790 2.641 981 HA HIS 626 HA HIS 626 6.428 0.564 4.669 982 HB2 HIS 626 HB2 HIS 626 5.488 1.601 1.989 983 HB3 HIS 626 HB3 HIS 626 6.225 2.597 3.226 984 HD2 HIS 626 HD2 HIS 626 7.205 0.622 0.211 985 HE1 HIS 626 HE1 HIS 626 10.722 1.080 2.514 986 HE2 HIS 626 HE2 HIS 626 9.797 0.659 0.193 987 H VAL 627 HN VAL 627 5.246 1.315 6.288 988 HA VAL 627 HA VAL 627 2.399 1.362 6.255 989 HB VAL 627 HB VAL 627 4.274 2.650 8.247 990 HG11 VAL 627 HG11 VAL 627 1.998 3.503 8.408 991 HG12 VAL 627 HG12 VAL 627 1.378 1.857 8.531 992 HG13 VAL 627 HG13 VAL 627 2.405 2.511 9.808 993 HG21 VAL 627 HG21 VAL 627 4.751 0.293 8.041 994 HG22 VAL 627 HG22 VAL 627 3.930 0.603 9.571 995 HG23 VAL 627 HG23 VAL 627 3.041 -0.100 8.220 996 H ILE 628 HN ILE 628 1.012 2.922 5.717 997 HA ILE 628 HA ILE 628 1.996 5.694 5.565 998 HB ILE 628 HB ILE 628 0.246 6.002 3.710 999 HG12 ILE 628 HG12 ILE 628 0.657 3.012 3.516 1000 HG13 ILE 628 HG13 ILE 628 -0.841 3.810 3.978 1001 HG21 ILE 628 HG21 ILE 628 1.867 5.355 1.979 1002 HG22 ILE 628 HG22 ILE 628 2.618 6.198 3.339 1003 HG23 ILE 628 HG23 ILE 628 2.770 4.446 3.192 1004 HD11 ILE 628 HD11 ILE 628 -0.953 4.832 1.744 1005 HD12 ILE 628 HD12 ILE 628 0.519 3.968 1.296 1006 HD13 ILE 628 HD13 ILE 628 -0.947 3.069 1.685 1007 H THR 629 HN THR 629 0.482 7.322 6.018 1008 HA THR 629 HA THR 629 -1.527 6.421 7.937 1009 HB THR 629 HB THR 629 -1.583 8.912 8.510 1010 HG1 THR 629 HG1 THR 629 -0.356 10.197 7.354 1011 HG21 THR 629 HG21 THR 629 1.007 7.393 8.803 1012 HG22 THR 629 HG22 THR 629 -0.395 7.263 9.866 1013 HG23 THR 629 HG23 THR 629 0.509 8.775 9.783 1014 H ASN 630 HN ASN 630 -1.596 6.955 4.772 1015 HA ASN 630 HA ASN 630 -4.355 7.881 4.796 1016 HB2 ASN 630 HB2 ASN 630 -2.108 9.313 3.419 1017 HB3 ASN 630 HB3 ASN 630 -3.714 9.324 2.712 1018 HD21 ASN 630 HD21 ASN 630 -2.036 11.475 3.893 1019 HD22 ASN 630 HD22 ASN 630 -3.050 12.204 5.099 1020 H VAL 631 HN VAL 631 -5.312 7.687 2.595 1021 HA VAL 631 HA VAL 631 -4.387 5.232 1.320 1022 HB VAL 631 HB VAL 631 -6.990 6.755 1.024 1023 HG11 VAL 631 HG11 VAL 631 -7.782 4.784 -0.209 1024 HG12 VAL 631 HG12 VAL 631 -6.457 5.609 -1.032 1025 HG13 VAL 631 HG13 VAL 631 -6.150 4.114 -0.150 1026 HG21 VAL 631 HG21 VAL 631 -6.774 5.677 3.202 1027 HG22 VAL 631 HG22 VAL 631 -7.992 4.862 2.221 1028 HG23 VAL 631 HG23 VAL 631 -6.393 4.144 2.420 1029 H LEU 632 HN LEU 632 -3.411 5.266 -0.622 1030 HA LEU 632 HA LEU 632 -2.604 7.780 -1.675 1031 HB2 LEU 632 HB2 LEU 632 -2.197 4.988 -2.743 1032 HB3 LEU 632 HB3 LEU 632 -1.402 6.428 -3.356 1033 HG LEU 632 HG LEU 632 -1.085 5.279 -0.580 1034 HD11 LEU 632 HD11 LEU 632 1.196 4.783 -1.290 1035 HD12 LEU 632 HD12 LEU 632 0.014 3.937 -2.289 1036 HD13 LEU 632 HD13 LEU 632 0.825 5.375 -2.910 1037 HD21 LEU 632 HD21 LEU 632 0.304 7.624 -1.871 1038 HD22 LEU 632 HD22 LEU 632 -0.941 7.733 -0.627 1039 HD23 LEU 632 HD23 LEU 632 0.613 6.983 -0.257 1040 H GLN 633 HN GLN 633 -3.738 8.998 -2.921 1041 HA GLN 633 HA GLN 633 -5.873 7.827 -4.554 1042 HB2 GLN 633 HB2 GLN 633 -5.438 10.633 -3.526 1043 HB3 GLN 633 HB3 GLN 633 -6.719 10.195 -4.647 1044 HG2 GLN 633 HG2 GLN 633 -6.368 9.021 -1.896 1045 HG3 GLN 633 HG3 GLN 633 -7.471 10.337 -2.302 1046 HE21 GLN 633 HE21 GLN 633 -8.006 7.648 -1.247 1047 HE22 GLN 633 HE22 GLN 633 -9.107 6.923 -2.363 1048 HA PRO 634 HA PRO 634 -3.478 8.882 -8.176 1049 HB2 PRO 634 HB2 PRO 634 -5.848 8.211 -9.726 1050 HB3 PRO 634 HB3 PRO 634 -4.311 7.348 -9.623 1051 HG2 PRO 634 HG2 PRO 634 -6.637 6.375 -8.602 1052 HG3 PRO 634 HG3 PRO 634 -5.044 5.989 -7.928 1053 HD2 PRO 634 HD2 PRO 634 -7.077 7.973 -6.972 1054 HD3 PRO 634 HD3 PRO 634 -6.066 6.856 -6.030 Start of MODEL 3 1 H1 ALA 500 H1 ALA 500 11.512 -10.055 12.496 2 H2 ALA 500 H2 ALA 500 10.157 -9.110 12.104 3 H3 ALA 500 H3 ALA 500 11.660 -8.782 11.383 4 HA ALA 500 HA ALA 500 10.200 -9.922 9.844 5 HB1 ALA 500 HB1 ALA 500 12.498 -11.619 10.816 6 HB2 ALA 500 HB2 ALA 500 11.725 -11.741 9.235 7 HB3 ALA 500 HB3 ALA 500 12.610 -10.280 9.675 8 H GLY 501 HN GLY 501 10.318 -12.791 9.641 9 HA2 GLY 501 HA2 GLY 501 9.386 -14.450 11.467 10 HA3 GLY 501 HA3 GLY 501 8.000 -13.381 11.319 11 H MET 502 HN MET 502 9.451 -13.440 8.375 12 HA MET 502 HA MET 502 9.113 -14.445 6.384 13 HB2 MET 502 HB2 MET 502 8.335 -16.796 8.109 14 HB3 MET 502 HB3 MET 502 8.432 -16.871 6.356 15 HG2 MET 502 HG2 MET 502 10.692 -16.252 8.246 16 HG3 MET 502 HG3 MET 502 10.434 -17.762 7.374 17 HE1 MET 502 HE1 MET 502 12.897 -17.705 6.384 18 HE2 MET 502 HE2 MET 502 13.588 -16.300 5.571 19 HE3 MET 502 HE3 MET 502 13.197 -16.222 7.290 20 H GLY 503 HN GLY 503 7.196 -15.952 5.280 21 HA2 GLY 503 HA2 GLY 503 4.848 -16.109 4.945 22 HA3 GLY 503 HA3 GLY 503 4.622 -14.749 6.040 23 H THR 504 HN THR 504 3.361 -14.789 3.594 24 HA THR 504 HA THR 504 4.929 -13.251 1.724 25 HB THR 504 HB THR 504 2.786 -13.068 0.442 26 HG1 THR 504 HG1 THR 504 1.076 -14.469 1.190 27 HG21 THR 504 HG21 THR 504 2.706 -15.452 -0.185 28 HG22 THR 504 HG22 THR 504 3.665 -15.842 1.243 29 HG23 THR 504 HG23 THR 504 4.357 -14.853 -0.041 30 H VAL 505 HN VAL 505 4.276 -11.144 0.976 31 HA VAL 505 HA VAL 505 4.327 -9.248 2.944 32 HB VAL 505 HB VAL 505 4.954 -8.784 0.659 33 HG11 VAL 505 HG11 VAL 505 3.276 -10.049 -0.521 34 HG12 VAL 505 HG12 VAL 505 2.022 -8.927 0.009 35 HG13 VAL 505 HG13 VAL 505 3.289 -8.381 -1.090 36 HG21 VAL 505 HG21 VAL 505 4.021 -6.557 0.412 37 HG22 VAL 505 HG22 VAL 505 2.714 -6.967 1.524 38 HG23 VAL 505 HG23 VAL 505 4.378 -6.896 2.105 39 H MET 506 HN MET 506 1.456 -10.590 1.390 40 HA MET 506 HA MET 506 -0.278 -8.692 2.718 41 HB2 MET 506 HB2 MET 506 -2.064 -9.670 1.521 42 HB3 MET 506 HB3 MET 506 -0.717 -9.532 0.411 43 HG2 MET 506 HG2 MET 506 -1.524 -11.615 -0.092 44 HG3 MET 506 HG3 MET 506 -0.278 -12.012 1.090 45 HE1 MET 506 HE1 MET 506 -4.141 -11.169 0.748 46 HE2 MET 506 HE2 MET 506 -4.666 -11.543 2.393 47 HE3 MET 506 HE3 MET 506 -3.531 -10.225 2.108 48 H ASP 507 HN ASP 507 0.971 -11.807 3.361 49 HA ASP 507 HA ASP 507 -1.155 -12.530 5.196 50 HB2 ASP 507 HB2 ASP 507 0.247 -14.151 3.716 51 HB3 ASP 507 HB3 ASP 507 1.453 -14.015 5.002 52 H VAL 508 HN VAL 508 2.061 -11.211 5.282 53 HA VAL 508 HA VAL 508 2.587 -11.412 8.030 54 HB VAL 508 HB VAL 508 3.459 -9.296 6.046 55 HG11 VAL 508 HG11 VAL 508 5.260 -8.762 7.607 56 HG12 VAL 508 HG12 VAL 508 3.679 -8.433 8.317 57 HG13 VAL 508 HG13 VAL 508 4.574 -9.879 8.788 58 HG21 VAL 508 HG21 VAL 508 4.896 -11.726 7.098 59 HG22 VAL 508 HG22 VAL 508 4.163 -11.575 5.500 60 HG23 VAL 508 HG23 VAL 508 5.532 -10.556 5.940 61 H LEU 509 HN LEU 509 0.484 -9.337 6.221 62 HA LEU 509 HA LEU 509 0.164 -7.229 8.061 63 HB2 LEU 509 HB2 LEU 509 -1.946 -8.234 6.165 64 HB3 LEU 509 HB3 LEU 509 -1.742 -6.602 6.776 65 HG LEU 509 HG LEU 509 0.138 -8.014 4.892 66 HD11 LEU 509 HD11 LEU 509 -0.690 -6.386 3.230 67 HD12 LEU 509 HD12 LEU 509 -1.951 -7.483 3.794 68 HD13 LEU 509 HD13 LEU 509 -1.883 -5.828 4.402 69 HD21 LEU 509 HD21 LEU 509 1.174 -5.789 4.639 70 HD22 LEU 509 HD22 LEU 509 0.136 -5.180 5.928 71 HD23 LEU 509 HD23 LEU 509 1.332 -6.430 6.275 72 H LYS 510 HN LYS 510 -0.955 -10.445 8.119 73 HA LYS 510 HA LYS 510 -3.307 -9.979 9.695 74 HB2 LYS 510 HB2 LYS 510 -1.827 -12.449 8.856 75 HB3 LYS 510 HB3 LYS 510 -3.060 -12.539 10.105 76 HG2 LYS 510 HG2 LYS 510 -4.525 -12.832 8.466 77 HG3 LYS 510 HG3 LYS 510 -4.286 -11.130 8.070 78 HD2 LYS 510 HD2 LYS 510 -2.624 -11.668 6.440 79 HD3 LYS 510 HD3 LYS 510 -2.597 -13.361 6.945 80 HE2 LYS 510 HE2 LYS 510 -4.979 -13.538 6.245 81 HE3 LYS 510 HE3 LYS 510 -4.877 -11.890 5.628 82 HZ1 LYS 510 HZ1 LYS 510 -3.155 -12.612 4.087 83 HZ2 LYS 510 HZ2 LYS 510 -4.570 -13.521 3.874 84 HZ3 LYS 510 HZ3 LYS 510 -3.245 -14.195 4.685 85 H GLY 511 HN GLY 511 0.050 -10.440 10.268 86 HA2 GLY 511 HA2 GLY 511 -0.268 -11.122 13.057 87 HA3 GLY 511 HA3 GLY 511 1.243 -10.739 12.240 88 H ASP 512 HN ASP 512 -0.597 -8.321 11.260 89 HA ASP 512 HA ASP 512 0.203 -6.659 13.570 90 HB2 ASP 512 HB2 ASP 512 1.583 -6.229 11.585 91 HB3 ASP 512 HB3 ASP 512 0.131 -5.847 10.662 92 H ASN 513 HN ASN 513 -1.164 -5.193 14.383 93 HA ASN 513 HA ASN 513 -3.961 -5.577 13.859 94 HB2 ASN 513 HB2 ASN 513 -4.323 -4.037 15.735 95 HB3 ASN 513 HB3 ASN 513 -3.161 -5.289 16.158 96 HD21 ASN 513 HD21 ASN 513 -1.061 -4.733 16.606 97 HD22 ASN 513 HD22 ASN 513 -0.514 -3.095 16.727 98 H ARG 514 HN ARG 514 -1.625 -3.390 12.665 99 HA ARG 514 HA ARG 514 -3.501 -1.170 12.455 100 HB2 ARG 514 HB2 ARG 514 -1.033 -0.994 13.130 101 HB3 ARG 514 HB3 ARG 514 -0.669 -1.250 11.430 102 HG2 ARG 514 HG2 ARG 514 -0.618 1.102 11.981 103 HG3 ARG 514 HG3 ARG 514 -1.931 0.761 10.854 104 HD2 ARG 514 HD2 ARG 514 -2.568 2.323 12.662 105 HD3 ARG 514 HD3 ARG 514 -3.547 0.859 12.636 106 HE ARG 514 HE ARG 514 -1.770 0.149 14.433 107 HH11 ARG 514 HH12 ARG 514 -3.226 3.322 14.040 108 HH12 ARG 514 HH11 ARG 514 -3.255 3.643 15.754 109 HH21 ARG 514 HH22 ARG 514 -1.788 0.612 16.692 110 HH22 ARG 514 HH21 ARG 514 -2.465 2.123 17.239 111 H PHE 515 HN PHE 515 -2.009 -3.611 10.444 112 HA PHE 515 HA PHE 515 -2.995 -2.419 7.968 113 HB2 PHE 515 HB2 PHE 515 -1.605 -5.068 8.394 114 HB3 PHE 515 HB3 PHE 515 -1.766 -4.166 6.899 115 HD1 PHE 515 HD2 PHE 515 -1.100 -1.432 7.944 116 HD2 PHE 515 HD1 PHE 515 0.697 -5.235 8.572 117 HE1 PHE 515 HE2 PHE 515 1.049 -0.333 8.409 118 HE2 PHE 515 HE1 PHE 515 2.851 -4.148 9.034 119 HZ PHE 515 HZ PHE 515 3.033 -1.696 8.956 120 H SER 516 HN SER 516 -4.528 -3.881 10.338 121 HA SER 516 HA SER 516 -5.640 -6.246 9.433 122 HB2 SER 516 HB2 SER 516 -7.552 -5.622 11.005 123 HB3 SER 516 HB3 SER 516 -5.933 -5.664 11.704 124 HG SER 516 HG SER 516 -6.105 -3.625 12.139 125 H MET 517 HN MET 517 -6.870 -2.931 8.957 126 HA MET 517 HA MET 517 -9.219 -3.683 7.602 127 HB2 MET 517 HB2 MET 517 -7.623 -1.132 7.341 128 HB3 MET 517 HB3 MET 517 -9.231 -1.375 6.679 129 HG2 MET 517 HG2 MET 517 -9.555 -0.180 8.655 130 HG3 MET 517 HG3 MET 517 -9.977 -1.845 9.053 131 HE1 MET 517 HE1 MET 517 -6.327 -0.625 8.518 132 HE2 MET 517 HE2 MET 517 -7.078 0.824 9.189 133 HE3 MET 517 HE3 MET 517 -5.867 -0.059 10.123 134 H LEU 518 HN LEU 518 -5.915 -3.326 6.483 135 HA LEU 518 HA LEU 518 -6.604 -3.256 3.720 136 HB2 LEU 518 HB2 LEU 518 -4.432 -2.439 4.580 137 HB3 LEU 518 HB3 LEU 518 -3.995 -4.089 4.985 138 HG LEU 518 HG LEU 518 -4.091 -4.703 2.610 139 HD11 LEU 518 HD11 LEU 518 -4.751 -1.791 2.229 140 HD12 LEU 518 HD12 LEU 518 -4.236 -2.871 0.932 141 HD13 LEU 518 HD13 LEU 518 -5.743 -3.186 1.796 142 HD21 LEU 518 HD21 LEU 518 -2.098 -3.507 1.889 143 HD22 LEU 518 HD22 LEU 518 -2.350 -2.298 3.149 144 HD23 LEU 518 HD23 LEU 518 -1.971 -3.966 3.587 145 H VAL 519 HN VAL 519 -5.802 -5.797 6.010 146 HA VAL 519 HA VAL 519 -5.731 -7.978 4.251 147 HB VAL 519 HB VAL 519 -6.821 -7.915 7.080 148 HG11 VAL 519 HG11 VAL 519 -6.208 -10.305 7.123 149 HG12 VAL 519 HG12 VAL 519 -7.477 -9.941 5.954 150 HG13 VAL 519 HG13 VAL 519 -5.824 -10.213 5.403 151 HG21 VAL 519 HG21 VAL 519 -4.553 -7.035 6.960 152 HG22 VAL 519 HG22 VAL 519 -4.580 -8.602 7.768 153 HG23 VAL 519 HG23 VAL 519 -4.027 -8.480 6.098 154 H ALA 520 HN ALA 520 -8.374 -6.209 5.718 155 HA ALA 520 HA ALA 520 -10.437 -8.028 4.951 156 HB1 ALA 520 HB1 ALA 520 -11.968 -6.203 5.605 157 HB2 ALA 520 HB2 ALA 520 -10.756 -6.546 6.842 158 HB3 ALA 520 HB3 ALA 520 -10.575 -5.135 5.799 159 H ALA 521 HN ALA 521 -9.135 -5.024 3.610 160 HA ALA 521 HA ALA 521 -10.979 -4.755 1.500 161 HB1 ALA 521 HB1 ALA 521 -9.521 -2.938 2.226 162 HB2 ALA 521 HB2 ALA 521 -8.116 -3.816 1.625 163 HB3 ALA 521 HB3 ALA 521 -9.348 -3.246 0.499 164 H ILE 522 HN ILE 522 -7.714 -6.190 1.552 165 HA ILE 522 HA ILE 522 -7.678 -7.055 -1.116 166 HB ILE 522 HB ILE 522 -6.284 -8.267 1.276 167 HG12 ILE 522 HG12 ILE 522 -5.317 -6.256 -0.771 168 HG13 ILE 522 HG13 ILE 522 -5.761 -5.888 0.891 169 HG21 ILE 522 HG21 ILE 522 -5.719 -8.613 -1.667 170 HG22 ILE 522 HG22 ILE 522 -4.715 -9.226 -0.354 171 HG23 ILE 522 HG23 ILE 522 -6.353 -9.843 -0.574 172 HD11 ILE 522 HD11 ILE 522 -3.929 -7.305 1.684 173 HD12 ILE 522 HD12 ILE 522 -3.479 -7.636 0.010 174 HD13 ILE 522 HD13 ILE 522 -3.361 -5.995 0.644 175 H GLN 523 HN GLN 523 -8.819 -8.652 1.830 176 HA GLN 523 HA GLN 523 -9.409 -11.164 0.729 177 HB2 GLN 523 HB2 GLN 523 -9.340 -10.730 3.146 178 HB3 GLN 523 HB3 GLN 523 -10.770 -9.720 3.011 179 HG2 GLN 523 HG2 GLN 523 -12.035 -11.702 2.233 180 HG3 GLN 523 HG3 GLN 523 -10.601 -12.685 2.528 181 HE21 GLN 523 HE21 GLN 523 -11.611 -13.932 4.078 182 HE22 GLN 523 HE22 GLN 523 -12.014 -13.319 5.646 183 H SER 524 HN SER 524 -11.409 -8.263 1.097 184 HA SER 524 HA SER 524 -13.785 -9.413 0.076 185 HB2 SER 524 HB2 SER 524 -12.992 -6.497 0.176 186 HB3 SER 524 HB3 SER 524 -14.629 -7.121 -0.012 187 HG SER 524 HG SER 524 -12.919 -7.411 2.244 188 H ALA 525 HN ALA 525 -11.312 -7.338 -1.444 189 HA ALA 525 HA ALA 525 -12.607 -7.288 -3.980 190 HB1 ALA 525 HB1 ALA 525 -10.551 -6.271 -4.800 191 HB2 ALA 525 HB2 ALA 525 -11.063 -5.536 -3.281 192 HB3 ALA 525 HB3 ALA 525 -9.732 -6.693 -3.295 193 H GLY 526 HN GLY 526 -10.321 -9.449 -2.481 194 HA2 GLY 526 HA2 GLY 526 -9.916 -11.656 -3.118 195 HA3 GLY 526 HA3 GLY 526 -10.728 -11.344 -4.643 196 H LEU 527 HN LEU 527 -8.002 -9.620 -3.172 197 HA LEU 527 HA LEU 527 -6.492 -10.124 -5.644 198 HB2 LEU 527 HB2 LEU 527 -6.558 -7.906 -3.674 199 HB3 LEU 527 HB3 LEU 527 -5.006 -8.262 -4.405 200 HG LEU 527 HG LEU 527 -6.165 -6.471 -5.588 201 HD11 LEU 527 HD11 LEU 527 -4.656 -7.894 -6.843 202 HD12 LEU 527 HD12 LEU 527 -5.969 -9.021 -7.182 203 HD13 LEU 527 HD13 LEU 527 -6.011 -7.390 -7.852 204 HD21 LEU 527 HD21 LEU 527 -8.200 -6.941 -6.872 205 HD22 LEU 527 HD22 LEU 527 -8.288 -8.542 -6.135 206 HD23 LEU 527 HD23 LEU 527 -8.464 -7.098 -5.136 207 H THR 528 HN THR 528 -6.818 -11.757 -3.032 208 HA THR 528 HA THR 528 -4.311 -11.833 -1.742 209 HB THR 528 HB THR 528 -6.306 -14.093 -1.954 210 HG1 THR 528 HG1 THR 528 -7.598 -12.796 -0.904 211 HG21 THR 528 HG21 THR 528 -4.139 -14.688 -0.944 212 HG22 THR 528 HG22 THR 528 -5.440 -14.729 0.245 213 HG23 THR 528 HG23 THR 528 -4.320 -13.368 0.212 214 H GLU 529 HN GLU 529 -5.594 -13.440 -4.574 215 HA GLU 529 HA GLU 529 -3.865 -15.589 -4.829 216 HB2 GLU 529 HB2 GLU 529 -5.012 -13.937 -7.086 217 HB3 GLU 529 HB3 GLU 529 -4.446 -15.597 -7.193 218 HG2 GLU 529 HG2 GLU 529 -6.851 -14.571 -5.720 219 HG3 GLU 529 HG3 GLU 529 -6.813 -15.650 -7.113 220 H THR 530 HN THR 530 -3.433 -12.258 -5.943 221 HA THR 530 HA THR 530 -1.102 -12.747 -7.458 222 HB THR 530 HB THR 530 -1.911 -10.129 -6.186 223 HG1 THR 530 HG1 THR 530 -3.370 -9.940 -7.765 224 HG21 THR 530 HG21 THR 530 -0.299 -10.774 -8.667 225 HG22 THR 530 HG22 THR 530 0.344 -10.144 -7.149 226 HG23 THR 530 HG23 THR 530 -0.743 -9.156 -8.125 227 H LEU 531 HN LEU 531 -1.609 -11.710 -4.115 228 HA LEU 531 HA LEU 531 1.239 -11.340 -3.713 229 HB2 LEU 531 HB2 LEU 531 -1.050 -11.062 -1.770 230 HB3 LEU 531 HB3 LEU 531 0.596 -10.510 -1.520 231 HG LEU 531 HG LEU 531 -1.321 -9.458 -3.598 232 HD11 LEU 531 HD11 LEU 531 -0.276 -8.257 -1.044 233 HD12 LEU 531 HD12 LEU 531 -1.209 -7.391 -2.265 234 HD13 LEU 531 HD13 LEU 531 -1.937 -8.739 -1.392 235 HD21 LEU 531 HD21 LEU 531 0.998 -9.458 -4.368 236 HD22 LEU 531 HD22 LEU 531 0.397 -7.821 -4.094 237 HD23 LEU 531 HD23 LEU 531 1.477 -8.573 -2.918 238 H ASN 532 HN ASN 532 -0.328 -13.985 -4.053 239 HA ASN 532 HA ASN 532 0.433 -15.393 -1.620 240 HB2 ASN 532 HB2 ASN 532 -1.719 -15.899 -2.795 241 HB3 ASN 532 HB3 ASN 532 -0.790 -16.481 -4.172 242 HD21 ASN 532 HD21 ASN 532 -1.835 -17.128 -0.942 243 HD22 ASN 532 HD22 ASN 532 -1.322 -18.776 -0.881 244 H ARG 533 HN ARG 533 1.485 -14.892 -4.881 245 HA ARG 533 HA ARG 533 3.500 -16.977 -4.795 246 HB2 ARG 533 HB2 ARG 533 2.484 -16.659 -6.924 247 HB3 ARG 533 HB3 ARG 533 2.679 -14.917 -6.844 248 HG2 ARG 533 HG2 ARG 533 4.227 -15.828 -8.433 249 HG3 ARG 533 HG3 ARG 533 5.117 -15.208 -7.044 250 HD2 ARG 533 HD2 ARG 533 6.101 -17.285 -7.639 251 HD3 ARG 533 HD3 ARG 533 5.188 -17.546 -6.156 252 HE ARG 533 HE ARG 533 3.397 -18.480 -7.675 253 HH11 ARG 533 HH12 ARG 533 6.800 -18.521 -8.526 254 HH12 ARG 533 HH11 ARG 533 6.664 -19.918 -9.558 255 HH21 ARG 533 HH22 ARG 533 3.216 -20.328 -9.045 256 HH22 ARG 533 HH21 ARG 533 4.631 -20.917 -9.868 257 H GLU 534 HN GLU 534 5.706 -16.635 -4.610 258 HA GLU 534 HA GLU 534 6.515 -14.180 -3.351 259 HB2 GLU 534 HB2 GLU 534 7.441 -16.275 -2.528 260 HB3 GLU 534 HB3 GLU 534 8.127 -16.625 -4.111 261 HG2 GLU 534 HG2 GLU 534 9.634 -14.760 -3.920 262 HG3 GLU 534 HG3 GLU 534 8.880 -14.259 -2.409 263 H GLY 535 HN GLY 535 8.063 -12.745 -4.094 264 HA2 GLY 535 HA2 GLY 535 9.448 -12.687 -6.463 265 HA3 GLY 535 HA3 GLY 535 7.833 -12.102 -6.861 266 H VAL 536 HN VAL 536 8.167 -9.941 -7.135 267 HA VAL 536 HA VAL 536 9.222 -8.535 -4.779 268 HB VAL 536 HB VAL 536 10.108 -6.785 -6.266 269 HG11 VAL 536 HG11 VAL 536 11.055 -9.594 -6.828 270 HG12 VAL 536 HG12 VAL 536 11.956 -8.138 -7.269 271 HG13 VAL 536 HG13 VAL 536 11.634 -8.497 -5.573 272 HG21 VAL 536 HG21 VAL 536 9.291 -8.637 -8.509 273 HG22 VAL 536 HG22 VAL 536 8.601 -7.050 -8.164 274 HG23 VAL 536 HG23 VAL 536 10.281 -7.188 -8.686 275 H TYR 537 HN TYR 537 7.922 -7.062 -3.914 276 HA TYR 537 HA TYR 537 5.865 -5.722 -5.441 277 HB2 TYR 537 HB2 TYR 537 5.168 -7.604 -3.172 278 HB3 TYR 537 HB3 TYR 537 4.068 -6.391 -3.810 279 HD1 TYR 537 HD1 TYR 537 3.471 -6.554 -6.310 280 HD2 TYR 537 HD2 TYR 537 5.244 -9.736 -4.112 281 HE1 TYR 537 HE1 TYR 537 2.700 -8.153 -8.008 282 HE2 TYR 537 HE2 TYR 537 4.479 -11.345 -5.808 283 HH TYR 537 HH TYR 537 3.331 -10.393 -8.839 284 H THR 538 HN THR 538 5.197 -3.823 -4.457 285 HA THR 538 HA THR 538 6.122 -3.321 -1.715 286 HB THR 538 HB THR 538 6.427 -1.348 -3.988 287 HG1 THR 538 HG1 THR 538 8.109 -2.691 -4.259 288 HG21 THR 538 HG21 THR 538 5.966 -0.257 -1.859 289 HG22 THR 538 HG22 THR 538 7.643 0.007 -2.343 290 HG23 THR 538 HG23 THR 538 7.260 -1.178 -1.094 291 H VAL 539 HN VAL 539 4.138 -3.298 -0.765 292 HA VAL 539 HA VAL 539 2.138 -1.517 -1.956 293 HB VAL 539 HB VAL 539 1.195 -3.627 -2.087 294 HG11 VAL 539 HG11 VAL 539 2.810 -4.863 -0.858 295 HG12 VAL 539 HG12 VAL 539 2.238 -4.184 0.668 296 HG13 VAL 539 HG13 VAL 539 1.203 -5.270 -0.260 297 HG21 VAL 539 HG21 VAL 539 -0.373 -2.081 -1.068 298 HG22 VAL 539 HG22 VAL 539 -0.625 -3.703 -0.423 299 HG23 VAL 539 HG23 VAL 539 0.232 -2.495 0.537 300 H PHE 540 HN PHE 540 1.361 0.084 -0.830 301 HA PHE 540 HA PHE 540 2.473 0.623 1.798 302 HB2 PHE 540 HB2 PHE 540 0.743 2.304 -0.035 303 HB3 PHE 540 HB3 PHE 540 1.470 2.864 1.467 304 HD1 PHE 540 HD2 PHE 540 2.236 1.647 -1.944 305 HD2 PHE 540 HD1 PHE 540 3.687 3.628 1.529 306 HE1 PHE 540 HE2 PHE 540 4.260 2.308 -3.177 307 HE2 PHE 540 HE1 PHE 540 5.711 4.295 0.302 308 HZ PHE 540 HZ PHE 540 6.000 3.637 -2.052 309 H ALA 541 HN ALA 541 1.402 0.011 3.565 310 HA ALA 541 HA ALA 541 -1.451 -0.598 3.366 311 HB1 ALA 541 HB1 ALA 541 -1.166 -1.646 5.595 312 HB2 ALA 541 HB2 ALA 541 -0.084 -2.319 4.366 313 HB3 ALA 541 HB3 ALA 541 0.540 -1.180 5.555 314 HA PRO 542 HA PRO 542 -2.200 3.374 5.319 315 HB2 PRO 542 HB2 PRO 542 -5.016 2.720 4.938 316 HB3 PRO 542 HB3 PRO 542 -4.071 4.020 4.206 317 HG2 PRO 542 HG2 PRO 542 -4.979 1.896 2.787 318 HG3 PRO 542 HG3 PRO 542 -3.469 2.738 2.391 319 HD2 PRO 542 HD2 PRO 542 -3.874 0.164 3.875 320 HD3 PRO 542 HD3 PRO 542 -2.663 0.577 2.640 321 H THR 543 HN THR 543 -2.382 3.737 7.406 322 HA THR 543 HA THR 543 -3.072 1.682 9.249 323 HB THR 543 HB THR 543 -2.728 3.431 10.961 324 HG1 THR 543 HG1 THR 543 -2.319 5.531 10.356 325 HG21 THR 543 HG21 THR 543 -0.639 3.454 8.785 326 HG22 THR 543 HG22 THR 543 -0.797 2.234 10.047 327 HG23 THR 543 HG23 THR 543 -0.380 3.893 10.474 328 H ASN 544 HN ASN 544 -4.675 2.387 11.167 329 HA ASN 544 HA ASN 544 -7.241 2.669 9.922 330 HB2 ASN 544 HB2 ASN 544 -8.235 2.354 12.062 331 HB3 ASN 544 HB3 ASN 544 -6.845 1.282 11.998 332 HD21 ASN 544 HD21 ASN 544 -5.289 1.475 13.492 333 HD22 ASN 544 HD22 ASN 544 -5.272 2.666 14.744 334 H GLU 545 HN GLU 545 -4.938 4.781 11.333 335 HA GLU 545 HA GLU 545 -6.562 7.013 11.855 336 HB2 GLU 545 HB2 GLU 545 -3.742 7.091 10.759 337 HB3 GLU 545 HB3 GLU 545 -4.560 8.361 11.652 338 HG2 GLU 545 HG2 GLU 545 -3.213 7.477 13.265 339 HG3 GLU 545 HG3 GLU 545 -4.695 6.560 13.533 340 H ALA 546 HN ALA 546 -5.168 5.735 8.891 341 HA ALA 546 HA ALA 546 -5.839 7.941 7.224 342 HB1 ALA 546 HB1 ALA 546 -4.135 6.385 6.522 343 HB2 ALA 546 HB2 ALA 546 -5.302 5.060 6.529 344 HB3 ALA 546 HB3 ALA 546 -5.464 6.369 5.358 345 H PHE 547 HN PHE 547 -7.345 4.830 7.850 346 HA PHE 547 HA PHE 547 -9.497 5.203 6.067 347 HB2 PHE 547 HB2 PHE 547 -9.025 3.303 8.352 348 HB3 PHE 547 HB3 PHE 547 -10.501 3.289 7.411 349 HD1 PHE 547 HD2 PHE 547 -10.306 2.947 4.884 350 HD2 PHE 547 HD1 PHE 547 -7.141 2.137 7.611 351 HE1 PHE 547 HE2 PHE 547 -9.228 1.505 3.202 352 HE2 PHE 547 HE1 PHE 547 -6.061 0.698 5.937 353 HZ PHE 547 HZ PHE 547 -7.103 0.377 3.729 354 H ARG 548 HN ARG 548 -8.949 6.190 9.357 355 HA ARG 548 HA ARG 548 -11.720 6.868 9.773 356 HB2 ARG 548 HB2 ARG 548 -9.206 7.135 11.387 357 HB3 ARG 548 HB3 ARG 548 -10.674 7.964 11.859 358 HG2 ARG 548 HG2 ARG 548 -11.836 5.748 11.825 359 HG3 ARG 548 HG3 ARG 548 -10.250 5.008 11.601 360 HD2 ARG 548 HD2 ARG 548 -10.975 6.816 13.898 361 HD3 ARG 548 HD3 ARG 548 -11.045 5.057 13.964 362 HE ARG 548 HE ARG 548 -8.599 5.103 13.532 363 HH11 ARG 548 HH12 ARG 548 -10.147 7.983 14.785 364 HH12 ARG 548 HH11 ARG 548 -8.742 8.503 15.671 365 HH21 ARG 548 HH22 ARG 548 -6.758 5.777 14.705 366 HH22 ARG 548 HH21 ARG 548 -6.819 7.246 15.624 367 H ALA 549 HN ALA 549 -8.860 8.334 8.533 368 HA ALA 549 HA ALA 549 -9.850 11.043 8.814 369 HB1 ALA 549 HB1 ALA 549 -7.446 10.574 8.964 370 HB2 ALA 549 HB2 ALA 549 -7.462 10.011 7.293 371 HB3 ALA 549 HB3 ALA 549 -7.820 11.699 7.658 372 H LEU 550 HN LEU 550 -10.457 8.492 6.798 373 HA LEU 550 HA LEU 550 -10.851 9.893 4.332 374 HB2 LEU 550 HB2 LEU 550 -11.887 7.223 5.297 375 HB3 LEU 550 HB3 LEU 550 -12.138 7.849 3.680 376 HG LEU 550 HG LEU 550 -9.460 7.215 4.910 377 HD11 LEU 550 HD11 LEU 550 -10.814 5.223 4.426 378 HD12 LEU 550 HD12 LEU 550 -10.998 5.770 2.760 379 HD13 LEU 550 HD13 LEU 550 -9.402 5.345 3.377 380 HD21 LEU 550 HD21 LEU 550 -8.597 7.577 2.633 381 HD22 LEU 550 HD22 LEU 550 -10.205 8.108 2.123 382 HD23 LEU 550 HD23 LEU 550 -9.302 9.041 3.319 383 HA PRO 551 HA PRO 551 -14.721 11.758 5.416 384 HB2 PRO 551 HB2 PRO 551 -15.179 12.055 2.538 385 HB3 PRO 551 HB3 PRO 551 -14.913 13.303 3.758 386 HG2 PRO 551 HG2 PRO 551 -13.077 12.730 1.869 387 HG3 PRO 551 HG3 PRO 551 -12.629 13.258 3.501 388 HD2 PRO 551 HD2 PRO 551 -12.662 10.482 2.352 389 HD3 PRO 551 HD3 PRO 551 -11.442 11.266 3.388 390 HA PRO 552 HA PRO 552 -17.665 8.489 5.143 391 HB2 PRO 552 HB2 PRO 552 -19.641 10.663 4.601 392 HB3 PRO 552 HB3 PRO 552 -19.693 9.370 5.805 393 HG2 PRO 552 HG2 PRO 552 -19.090 11.859 6.533 394 HG3 PRO 552 HG3 PRO 552 -18.244 10.476 7.251 395 HD2 PRO 552 HD2 PRO 552 -17.307 12.411 5.182 396 HD3 PRO 552 HD3 PRO 552 -16.398 11.618 6.487 397 H ARG 553 HN ARG 553 -18.029 11.097 2.745 398 HA ARG 553 HA ARG 553 -19.453 9.683 0.823 399 HB2 ARG 553 HB2 ARG 553 -19.048 12.125 0.768 400 HB3 ARG 553 HB3 ARG 553 -17.366 11.822 0.347 401 HG2 ARG 553 HG2 ARG 553 -18.614 12.401 -1.628 402 HG3 ARG 553 HG3 ARG 553 -18.109 10.714 -1.721 403 HD2 ARG 553 HD2 ARG 553 -20.358 10.062 -0.882 404 HD3 ARG 553 HD3 ARG 553 -20.838 11.755 -0.990 405 HE ARG 553 HE ARG 553 -19.786 10.772 -3.453 406 HH11 ARG 553 HH12 ARG 553 -22.657 10.901 -1.467 407 HH12 ARG 553 HH11 ARG 553 -23.740 10.629 -2.793 408 HH21 ARG 553 HH22 ARG 553 -21.219 10.382 -5.206 409 HH22 ARG 553 HH21 ARG 553 -22.930 10.336 -4.900 410 H GLU 554 HN GLU 554 -15.909 10.064 1.104 411 HA GLU 554 HA GLU 554 -15.352 8.541 -1.207 412 HB2 GLU 554 HB2 GLU 554 -13.611 9.309 1.134 413 HB3 GLU 554 HB3 GLU 554 -13.005 8.427 -0.259 414 HG2 GLU 554 HG2 GLU 554 -13.835 10.318 -1.688 415 HG3 GLU 554 HG3 GLU 554 -14.146 11.203 -0.197 416 H ARG 555 HN ARG 555 -15.044 7.663 2.251 417 HA ARG 555 HA ARG 555 -14.197 5.042 1.670 418 HB2 ARG 555 HB2 ARG 555 -14.717 4.513 4.049 419 HB3 ARG 555 HB3 ARG 555 -13.658 5.888 3.812 420 HG2 ARG 555 HG2 ARG 555 -15.448 7.416 4.322 421 HG3 ARG 555 HG3 ARG 555 -16.601 6.078 4.421 422 HD2 ARG 555 HD2 ARG 555 -15.556 5.188 6.342 423 HD3 ARG 555 HD3 ARG 555 -14.137 6.209 6.138 424 HE ARG 555 HE ARG 555 -16.390 7.837 6.537 425 HH11 ARG 555 HH12 ARG 555 -14.390 5.550 8.271 426 HH12 ARG 555 HH11 ARG 555 -14.654 6.281 9.822 427 HH21 ARG 555 HH22 ARG 555 -16.709 8.846 8.581 428 HH22 ARG 555 HH21 ARG 555 -15.954 8.176 9.989 429 H SER 556 HN SER 556 -17.459 6.342 2.037 430 HA SER 556 HA SER 556 -18.683 3.755 2.194 431 HB2 SER 556 HB2 SER 556 -19.936 6.409 1.453 432 HB3 SER 556 HB3 SER 556 -20.803 4.942 1.908 433 HG SER 556 HG SER 556 -19.235 6.659 3.491 434 H ARG 557 HN ARG 557 -17.824 5.955 -0.400 435 HA ARG 557 HA ARG 557 -19.236 4.580 -2.453 436 HB2 ARG 557 HB2 ARG 557 -18.508 6.851 -2.845 437 HB3 ARG 557 HB3 ARG 557 -16.829 6.410 -2.565 438 HG2 ARG 557 HG2 ARG 557 -16.900 4.973 -4.567 439 HG3 ARG 557 HG3 ARG 557 -18.555 5.507 -4.863 440 HD2 ARG 557 HD2 ARG 557 -17.789 7.800 -5.117 441 HD3 ARG 557 HD3 ARG 557 -16.136 7.308 -4.745 442 HE ARG 557 HE ARG 557 -17.201 5.854 -6.959 443 HH11 ARG 557 HH12 ARG 557 -15.756 8.928 -6.052 444 HH12 ARG 557 HH11 ARG 557 -15.158 9.253 -7.659 445 HH21 ARG 557 HH22 ARG 557 -16.425 6.272 -9.037 446 HH22 ARG 557 HH21 ARG 557 -15.537 7.734 -9.354 447 H LEU 558 HN LEU 558 -15.901 4.495 -1.302 448 HA LEU 558 HA LEU 558 -14.900 2.648 -3.136 449 HB2 LEU 558 HB2 LEU 558 -13.535 4.092 -1.671 450 HB3 LEU 558 HB3 LEU 558 -14.015 3.125 -0.289 451 HG LEU 558 HG LEU 558 -12.880 1.177 -1.234 452 HD11 LEU 558 HD11 LEU 558 -13.185 1.685 -3.590 453 HD12 LEU 558 HD12 LEU 558 -12.080 3.054 -3.451 454 HD13 LEU 558 HD13 LEU 558 -11.484 1.411 -3.222 455 HD21 LEU 558 HD21 LEU 558 -11.130 3.631 -1.157 456 HD22 LEU 558 HD22 LEU 558 -11.629 2.671 0.235 457 HD23 LEU 558 HD23 LEU 558 -10.580 1.962 -0.992 458 H LEU 559 HN LEU 559 -16.310 2.137 0.084 459 HA LEU 559 HA LEU 559 -15.984 -0.725 -0.090 460 HB2 LEU 559 HB2 LEU 559 -17.443 1.002 1.910 461 HB3 LEU 559 HB3 LEU 559 -17.219 -0.730 2.064 462 HG LEU 559 HG LEU 559 -14.985 1.295 1.972 463 HD11 LEU 559 HD11 LEU 559 -14.707 0.810 4.343 464 HD12 LEU 559 HD12 LEU 559 -16.299 1.494 4.012 465 HD13 LEU 559 HD13 LEU 559 -16.127 -0.236 4.301 466 HD21 LEU 559 HD21 LEU 559 -13.580 -0.580 2.670 467 HD22 LEU 559 HD22 LEU 559 -14.963 -1.667 2.544 468 HD23 LEU 559 HD23 LEU 559 -14.323 -0.879 1.099 469 H GLY 560 HN GLY 560 -17.951 1.248 -1.671 470 HA2 GLY 560 HA2 GLY 560 -20.445 -0.174 -1.285 471 HA3 GLY 560 HA3 GLY 560 -20.153 1.145 -2.411 472 H ASP 561 HN ASP 561 -17.669 -0.389 -3.336 473 HA ASP 561 HA ASP 561 -19.008 -2.531 -4.828 474 HB2 ASP 561 HB2 ASP 561 -19.078 -0.373 -6.149 475 HB3 ASP 561 HB3 ASP 561 -17.320 -0.448 -6.226 476 H ALA 562 HN ALA 562 -17.670 -4.184 -5.503 477 HA ALA 562 HA ALA 562 -15.294 -4.475 -3.915 478 HB1 ALA 562 HB1 ALA 562 -16.908 -6.317 -4.266 479 HB2 ALA 562 HB2 ALA 562 -16.426 -6.375 -5.961 480 HB3 ALA 562 HB3 ALA 562 -15.253 -6.748 -4.697 481 H LYS 563 HN LYS 563 -16.008 -3.736 -7.249 482 HA LYS 563 HA LYS 563 -13.430 -4.461 -8.265 483 HB2 LYS 563 HB2 LYS 563 -15.271 -4.449 -9.805 484 HB3 LYS 563 HB3 LYS 563 -15.672 -2.784 -9.400 485 HG2 LYS 563 HG2 LYS 563 -13.632 -2.001 -10.420 486 HG3 LYS 563 HG3 LYS 563 -13.126 -3.656 -10.757 487 HD2 LYS 563 HD2 LYS 563 -14.029 -2.680 -12.768 488 HD3 LYS 563 HD3 LYS 563 -15.139 -3.923 -12.185 489 HE2 LYS 563 HE2 LYS 563 -16.394 -1.990 -12.886 490 HE3 LYS 563 HE3 LYS 563 -16.509 -2.160 -11.135 491 HZ1 LYS 563 HZ1 LYS 563 -14.978 -0.389 -10.823 492 HZ2 LYS 563 HZ2 LYS 563 -16.116 0.150 -11.955 493 HZ3 LYS 563 HZ3 LYS 563 -14.579 -0.344 -12.473 494 H GLU 564 HN GLU 564 -14.969 -1.504 -7.158 495 HA GLU 564 HA GLU 564 -12.905 0.275 -7.849 496 HB2 GLU 564 HB2 GLU 564 -14.711 0.575 -5.448 497 HB3 GLU 564 HB3 GLU 564 -13.950 1.851 -6.387 498 HG2 GLU 564 HG2 GLU 564 -16.154 0.023 -7.308 499 HG3 GLU 564 HG3 GLU 564 -16.307 1.726 -6.888 500 H LEU 565 HN LEU 565 -13.553 -1.590 -4.913 501 HA LEU 565 HA LEU 565 -11.395 -0.832 -3.352 502 HB2 LEU 565 HB2 LEU 565 -12.849 -3.451 -3.644 503 HB3 LEU 565 HB3 LEU 565 -11.578 -3.218 -2.471 504 HG LEU 565 HG LEU 565 -14.116 -1.597 -2.562 505 HD11 LEU 565 HD11 LEU 565 -14.793 -2.888 -0.607 506 HD12 LEU 565 HD12 LEU 565 -14.574 -3.934 -2.010 507 HD13 LEU 565 HD13 LEU 565 -13.341 -3.879 -0.751 508 HD21 LEU 565 HD21 LEU 565 -11.927 -1.798 -0.499 509 HD22 LEU 565 HD22 LEU 565 -12.216 -0.431 -1.574 510 HD23 LEU 565 HD23 LEU 565 -13.409 -0.853 -0.345 511 H ALA 566 HN ALA 566 -11.637 -3.471 -5.704 512 HA ALA 566 HA ALA 566 -9.043 -4.457 -5.465 513 HB1 ALA 566 HB1 ALA 566 -10.849 -5.650 -6.606 514 HB2 ALA 566 HB2 ALA 566 -10.806 -4.463 -7.911 515 HB3 ALA 566 HB3 ALA 566 -9.416 -5.514 -7.630 516 H ASN 567 HN ASN 567 -10.329 -1.946 -7.613 517 HA ASN 567 HA ASN 567 -7.927 -1.613 -9.087 518 HB2 ASN 567 HB2 ASN 567 -10.279 -0.870 -9.759 519 HB3 ASN 567 HB3 ASN 567 -10.013 0.535 -8.730 520 HD21 ASN 567 HD21 ASN 567 -8.496 2.091 -9.362 521 HD22 ASN 567 HD22 ASN 567 -7.853 2.141 -10.963 522 H ILE 568 HN ILE 568 -9.141 -0.135 -6.139 523 HA ILE 568 HA ILE 568 -7.081 1.840 -5.977 524 HB ILE 568 HB ILE 568 -8.843 0.680 -3.813 525 HG12 ILE 568 HG12 ILE 568 -10.074 1.822 -5.602 526 HG13 ILE 568 HG13 ILE 568 -10.157 2.718 -4.092 527 HG21 ILE 568 HG21 ILE 568 -6.820 1.670 -2.873 528 HG22 ILE 568 HG22 ILE 568 -7.139 3.166 -3.750 529 HG23 ILE 568 HG23 ILE 568 -8.246 2.633 -2.485 530 HD11 ILE 568 HD11 ILE 568 -8.423 4.239 -4.923 531 HD12 ILE 568 HD12 ILE 568 -8.398 3.355 -6.449 532 HD13 ILE 568 HD13 ILE 568 -9.852 4.222 -5.955 533 H LEU 569 HN LEU 569 -7.508 -1.426 -4.701 534 HA LEU 569 HA LEU 569 -5.216 -1.497 -3.070 535 HB2 LEU 569 HB2 LEU 569 -6.652 -3.726 -4.511 536 HB3 LEU 569 HB3 LEU 569 -5.412 -3.975 -3.296 537 HG LEU 569 HG LEU 569 -8.069 -2.621 -2.828 538 HD11 LEU 569 HD11 LEU 569 -7.070 -5.340 -1.991 539 HD12 LEU 569 HD12 LEU 569 -8.622 -4.625 -1.562 540 HD13 LEU 569 HD13 LEU 569 -8.268 -5.025 -3.246 541 HD21 LEU 569 HD21 LEU 569 -7.448 -2.658 -0.483 542 HD22 LEU 569 HD22 LEU 569 -5.901 -3.407 -0.883 543 HD23 LEU 569 HD23 LEU 569 -6.248 -1.761 -1.415 544 H LYS 570 HN LYS 570 -5.692 -2.368 -6.471 545 HA LYS 570 HA LYS 570 -3.045 -3.340 -6.832 546 HB2 LYS 570 HB2 LYS 570 -3.565 -3.402 -9.202 547 HB3 LYS 570 HB3 LYS 570 -4.904 -4.046 -8.268 548 HG2 LYS 570 HG2 LYS 570 -5.957 -1.743 -8.477 549 HG3 LYS 570 HG3 LYS 570 -4.726 -1.417 -9.698 550 HD2 LYS 570 HD2 LYS 570 -6.789 -3.615 -9.752 551 HD3 LYS 570 HD3 LYS 570 -6.761 -2.172 -10.768 552 HE2 LYS 570 HE2 LYS 570 -4.761 -2.921 -11.869 553 HE3 LYS 570 HE3 LYS 570 -4.595 -4.273 -10.749 554 HZ1 LYS 570 HZ1 LYS 570 -5.515 -5.042 -12.813 555 HZ2 LYS 570 HZ2 LYS 570 -6.755 -3.890 -12.753 556 HZ3 LYS 570 HZ3 LYS 570 -6.711 -5.147 -11.612 557 H TYR 571 HN TYR 571 -4.229 -0.232 -6.448 558 HA TYR 571 HA TYR 571 -2.039 1.012 -7.931 559 HB2 TYR 571 HB2 TYR 571 -4.260 2.082 -8.001 560 HB3 TYR 571 HB3 TYR 571 -4.226 2.262 -6.252 561 HD1 TYR 571 HD2 TYR 571 -2.096 3.132 -9.200 562 HD2 TYR 571 HD1 TYR 571 -3.640 4.333 -5.428 563 HE1 TYR 571 HE2 TYR 571 -0.999 5.315 -9.456 564 HE2 TYR 571 HE1 TYR 571 -2.547 6.524 -5.667 565 HH TYR 571 HH TYR 571 -1.227 7.600 -8.626 566 H HIS 572 HN HIS 572 -2.785 -0.119 -4.798 567 HA HIS 572 HA HIS 572 -0.783 1.554 -3.504 568 HB2 HIS 572 HB2 HIS 572 -2.817 -0.417 -2.513 569 HB3 HIS 572 HB3 HIS 572 -1.481 0.072 -1.477 570 HD1 HIS 572 HD1 HIS 572 -4.431 1.616 -3.328 571 HD2 HIS 572 HD2 HIS 572 -1.819 2.422 -0.194 572 HE1 HIS 572 HE1 HIS 572 -5.283 3.721 -2.215 573 H ILE 573 HN ILE 573 -1.092 -1.529 -4.930 574 HA ILE 573 HA ILE 573 1.369 -2.544 -3.691 575 HB ILE 573 HB ILE 573 -0.313 -3.904 -5.809 576 HG12 ILE 573 HG12 ILE 573 -0.520 -4.217 -2.803 577 HG13 ILE 573 HG13 ILE 573 -1.686 -3.357 -3.804 578 HG21 ILE 573 HG21 ILE 573 0.743 -5.937 -4.905 579 HG22 ILE 573 HG22 ILE 573 1.931 -4.790 -5.525 580 HG23 ILE 573 HG23 ILE 573 1.675 -4.942 -3.786 581 HD11 ILE 573 HD11 ILE 573 -1.023 -6.288 -3.974 582 HD12 ILE 573 HD12 ILE 573 -2.473 -5.582 -3.261 583 HD13 ILE 573 HD13 ILE 573 -2.180 -5.433 -4.994 584 H GLY 574 HN GLY 574 3.218 -1.909 -4.634 585 HA2 GLY 574 HA2 GLY 574 3.309 -1.168 -7.450 586 HA3 GLY 574 HA3 GLY 574 4.623 -1.031 -6.288 587 H ASP 575 HN ASP 575 4.891 -2.046 -8.893 588 HA ASP 575 HA ASP 575 4.733 -4.930 -8.851 589 HB2 ASP 575 HB2 ASP 575 4.169 -3.628 -10.849 590 HB3 ASP 575 HB3 ASP 575 5.807 -2.998 -10.915 591 H GLU 576 HN GLU 576 6.970 -2.876 -7.551 592 HA GLU 576 HA GLU 576 9.067 -4.810 -7.659 593 HB2 GLU 576 HB2 GLU 576 10.724 -3.122 -8.484 594 HB3 GLU 576 HB3 GLU 576 9.563 -3.646 -9.696 595 HG2 GLU 576 HG2 GLU 576 8.228 -1.561 -8.952 596 HG3 GLU 576 HG3 GLU 576 9.766 -1.031 -8.272 597 H ILE 577 HN ILE 577 10.839 -4.228 -6.249 598 HA ILE 577 HA ILE 577 9.673 -3.071 -3.848 599 HB ILE 577 HB ILE 577 12.176 -4.727 -4.171 600 HG12 ILE 577 HG12 ILE 577 9.441 -5.471 -3.107 601 HG13 ILE 577 HG13 ILE 577 10.086 -5.950 -4.672 602 HG21 ILE 577 HG21 ILE 577 12.336 -3.272 -2.242 603 HG22 ILE 577 HG22 ILE 577 10.748 -3.800 -1.682 604 HG23 ILE 577 HG23 ILE 577 12.094 -4.940 -1.719 605 HD11 ILE 577 HD11 ILE 577 10.264 -7.757 -3.076 606 HD12 ILE 577 HD12 ILE 577 11.865 -7.193 -3.553 607 HD13 ILE 577 HD13 ILE 577 11.197 -6.730 -1.988 608 H LEU 578 HN LEU 578 10.083 -1.060 -3.335 609 HA LEU 578 HA LEU 578 12.800 -0.016 -3.750 610 HB2 LEU 578 HB2 LEU 578 10.154 1.263 -4.260 611 HB3 LEU 578 HB3 LEU 578 11.453 2.276 -3.667 612 HG LEU 578 HG LEU 578 11.428 2.492 -6.027 613 HD11 LEU 578 HD11 LEU 578 13.622 1.637 -6.675 614 HD12 LEU 578 HD12 LEU 578 13.649 2.333 -5.056 615 HD13 LEU 578 HD13 LEU 578 13.630 0.581 -5.264 616 HD21 LEU 578 HD21 LEU 578 11.472 -0.519 -6.175 617 HD22 LEU 578 HD22 LEU 578 10.121 0.533 -6.598 618 HD23 LEU 578 HD23 LEU 578 11.604 0.577 -7.551 619 H VAL 579 HN VAL 579 13.674 -0.244 -1.779 620 HA VAL 579 HA VAL 579 12.132 0.556 0.582 621 HB VAL 579 HB VAL 579 13.965 -0.429 1.902 622 HG11 VAL 579 HG11 VAL 579 12.861 -2.241 -0.239 623 HG12 VAL 579 HG12 VAL 579 13.593 -2.779 1.273 624 HG13 VAL 579 HG13 VAL 579 12.100 -1.842 1.301 625 HG21 VAL 579 HG21 VAL 579 15.748 -1.693 0.817 626 HG22 VAL 579 HG22 VAL 579 15.161 -1.181 -0.765 627 HG23 VAL 579 HG23 VAL 579 15.814 0.010 0.361 628 H SER 580 HN SER 580 13.497 1.671 2.333 629 HA SER 580 HA SER 580 14.151 4.253 1.549 630 HB2 SER 580 HB2 SER 580 15.160 2.777 3.993 631 HB3 SER 580 HB3 SER 580 15.074 4.528 3.795 632 HG SER 580 HG SER 580 12.931 2.665 3.954 633 H GLY 581 HN GLY 581 16.254 1.437 1.866 634 HA2 GLY 581 HA2 GLY 581 18.660 2.978 1.477 635 HA3 GLY 581 HA3 GLY 581 18.543 1.227 1.560 636 H GLY 582 HN GLY 582 16.287 2.156 -0.651 637 HA2 GLY 582 HA2 GLY 582 18.214 1.709 -2.844 638 HA3 GLY 582 HA3 GLY 582 16.567 1.101 -2.843 639 H ILE 583 HN ILE 583 15.319 3.479 -1.893 640 HA ILE 583 HA ILE 583 14.744 4.697 -4.343 641 HB ILE 583 HB ILE 583 14.213 5.813 -1.583 642 HG12 ILE 583 HG12 ILE 583 12.464 4.066 -3.334 643 HG13 ILE 583 HG13 ILE 583 13.376 3.492 -1.940 644 HG21 ILE 583 HG21 ILE 583 12.924 6.377 -4.256 645 HG22 ILE 583 HG22 ILE 583 12.337 6.976 -2.704 646 HG23 ILE 583 HG23 ILE 583 13.911 7.489 -3.306 647 HD11 ILE 583 HD11 ILE 583 12.066 4.968 -0.492 648 HD12 ILE 583 HD12 ILE 583 11.149 5.516 -1.896 649 HD13 ILE 583 HD13 ILE 583 11.048 3.833 -1.380 650 H GLY 584 HN GLY 584 16.401 6.179 -1.536 651 HA2 GLY 584 HA2 GLY 584 18.274 7.545 -1.528 652 HA3 GLY 584 HA3 GLY 584 18.360 7.380 -3.270 653 H ALA 585 HN ALA 585 16.422 8.545 -4.411 654 HA ALA 585 HA ALA 585 16.060 11.175 -3.139 655 HB1 ALA 585 HB1 ALA 585 16.583 12.314 -5.207 656 HB2 ALA 585 HB2 ALA 585 17.938 11.292 -4.727 657 HB3 ALA 585 HB3 ALA 585 16.855 10.773 -6.020 658 H LEU 586 HN LEU 586 15.136 9.651 -6.240 659 HA LEU 586 HA LEU 586 12.338 9.732 -5.500 660 HB2 LEU 586 HB2 LEU 586 12.597 11.982 -6.301 661 HB3 LEU 586 HB3 LEU 586 13.442 11.432 -7.736 662 HG LEU 586 HG LEU 586 11.310 10.248 -8.405 663 HD11 LEU 586 HD11 LEU 586 9.232 11.010 -7.403 664 HD12 LEU 586 HD12 LEU 586 10.246 10.201 -6.209 665 HD13 LEU 586 HD13 LEU 586 10.135 11.961 -6.223 666 HD21 LEU 586 HD21 LEU 586 11.261 13.252 -8.136 667 HD22 LEU 586 HD22 LEU 586 11.989 12.326 -9.450 668 HD23 LEU 586 HD23 LEU 586 10.242 12.305 -9.223 669 H VAL 587 HN VAL 587 11.343 8.033 -6.341 670 HA VAL 587 HA VAL 587 12.286 6.895 -8.882 671 HB VAL 587 HB VAL 587 11.672 5.233 -6.418 672 HG11 VAL 587 HG11 VAL 587 12.545 4.403 -9.188 673 HG12 VAL 587 HG12 VAL 587 12.367 3.326 -7.803 674 HG13 VAL 587 HG13 VAL 587 10.956 4.144 -8.471 675 HG21 VAL 587 HG21 VAL 587 13.856 6.315 -6.246 676 HG22 VAL 587 HG22 VAL 587 14.026 4.576 -6.485 677 HG23 VAL 587 HG23 VAL 587 14.302 5.681 -7.831 678 H ARG 588 HN ARG 588 10.616 6.581 -10.240 679 HA ARG 588 HA ARG 588 7.915 6.811 -9.209 680 HB2 ARG 588 HB2 ARG 588 9.083 6.732 -11.974 681 HB3 ARG 588 HB3 ARG 588 7.354 6.516 -11.721 682 HG2 ARG 588 HG2 ARG 588 7.224 8.682 -10.624 683 HG3 ARG 588 HG3 ARG 588 8.965 8.898 -10.825 684 HD2 ARG 588 HD2 ARG 588 8.755 8.993 -13.193 685 HD3 ARG 588 HD3 ARG 588 7.068 8.484 -13.127 686 HE ARG 588 HE ARG 588 6.827 10.714 -11.803 687 HH11 ARG 588 HH12 ARG 588 8.997 10.188 -14.515 688 HH12 ARG 588 HH11 ARG 588 8.847 11.824 -15.102 689 HH21 ARG 588 HH22 ARG 588 6.655 12.844 -12.559 690 HH22 ARG 588 HH21 ARG 588 7.517 13.333 -13.988 691 H LEU 589 HN LEU 589 7.013 5.138 -8.374 692 HA LEU 589 HA LEU 589 7.857 2.442 -9.087 693 HB2 LEU 589 HB2 LEU 589 7.733 3.087 -6.727 694 HB3 LEU 589 HB3 LEU 589 6.046 3.515 -6.915 695 HG LEU 589 HG LEU 589 5.626 1.076 -7.492 696 HD11 LEU 589 HD11 LEU 589 7.942 0.496 -8.008 697 HD12 LEU 589 HD12 LEU 589 8.386 0.784 -6.325 698 HD13 LEU 589 HD13 LEU 589 7.280 -0.528 -6.732 699 HD21 LEU 589 HD21 LEU 589 5.619 0.390 -5.149 700 HD22 LEU 589 HD22 LEU 589 6.661 1.753 -4.741 701 HD23 LEU 589 HD23 LEU 589 5.026 2.041 -5.339 702 H LYS 590 HN LYS 590 6.786 1.480 -10.716 703 HA LYS 590 HA LYS 590 4.125 2.287 -11.420 704 HB2 LYS 590 HB2 LYS 590 4.254 0.679 -13.207 705 HB3 LYS 590 HB3 LYS 590 5.796 1.514 -13.114 706 HG2 LYS 590 HG2 LYS 590 6.778 -0.393 -11.973 707 HG3 LYS 590 HG3 LYS 590 5.224 -1.228 -12.013 708 HD2 LYS 590 HD2 LYS 590 5.321 -0.948 -14.545 709 HD3 LYS 590 HD3 LYS 590 7.014 -0.502 -14.321 710 HE2 LYS 590 HE2 LYS 590 5.759 -3.081 -13.394 711 HE3 LYS 590 HE3 LYS 590 6.697 -2.891 -14.870 712 HZ1 LYS 590 HZ1 LYS 590 8.647 -2.668 -13.717 713 HZ2 LYS 590 HZ2 LYS 590 7.810 -3.748 -12.703 714 HZ3 LYS 590 HZ3 LYS 590 7.898 -2.100 -12.305 715 H SER 591 HN SER 591 2.237 1.316 -10.945 716 HA SER 591 HA SER 591 2.349 -0.732 -8.851 717 HB2 SER 591 HB2 SER 591 0.028 -0.021 -8.358 718 HB3 SER 591 HB3 SER 591 1.149 1.336 -8.314 719 HG SER 591 HG SER 591 0.409 2.025 -10.270 720 H LEU 592 HN LEU 592 0.531 -2.381 -8.901 721 HA LEU 592 HA LEU 592 0.541 -3.818 -11.305 722 HB2 LEU 592 HB2 LEU 592 -1.037 -4.001 -8.774 723 HB3 LEU 592 HB3 LEU 592 -1.423 -5.044 -10.128 724 HG LEU 592 HG LEU 592 0.945 -5.844 -10.077 725 HD11 LEU 592 HD11 LEU 592 2.264 -5.502 -8.072 726 HD12 LEU 592 HD12 LEU 592 1.946 -3.974 -8.895 727 HD13 LEU 592 HD13 LEU 592 1.034 -4.401 -7.447 728 HD21 LEU 592 HD21 LEU 592 0.602 -7.311 -8.138 729 HD22 LEU 592 HD22 LEU 592 -0.711 -6.263 -7.601 730 HD23 LEU 592 HD23 LEU 592 -0.859 -7.153 -9.116 731 H GLN 593 HN GLN 593 -1.380 -1.147 -10.401 732 HA GLN 593 HA GLN 593 -3.600 -1.763 -12.125 733 HB2 GLN 593 HB2 GLN 593 -3.755 -0.170 -10.206 734 HB3 GLN 593 HB3 GLN 593 -2.710 0.938 -11.089 735 HG2 GLN 593 HG2 GLN 593 -4.493 0.710 -12.960 736 HG3 GLN 593 HG3 GLN 593 -5.525 0.141 -11.651 737 HE21 GLN 593 HE21 GLN 593 -4.191 1.866 -9.688 738 HE22 GLN 593 HE22 GLN 593 -4.767 3.464 -10.001 739 H GLY 594 HN GLY 594 -0.468 -0.351 -12.439 740 HA2 GLY 594 HA2 GLY 594 0.535 -0.158 -14.637 741 HA3 GLY 594 HA3 GLY 594 -1.040 0.333 -15.253 742 H ASP 595 HN ASP 595 -1.237 1.921 -12.598 743 HA ASP 595 HA ASP 595 -0.277 4.387 -13.719 744 HB2 ASP 595 HB2 ASP 595 -2.410 3.924 -12.262 745 HB3 ASP 595 HB3 ASP 595 -1.310 4.177 -10.917 746 H LYS 596 HN LYS 596 0.693 5.902 -11.758 747 HA LYS 596 HA LYS 596 3.177 4.462 -11.076 748 HB2 LYS 596 HB2 LYS 596 2.967 7.214 -12.302 749 HB3 LYS 596 HB3 LYS 596 4.458 6.450 -11.768 750 HG2 LYS 596 HG2 LYS 596 4.238 4.734 -13.435 751 HG3 LYS 596 HG3 LYS 596 2.651 5.343 -13.906 752 HD2 LYS 596 HD2 LYS 596 3.710 7.464 -14.596 753 HD3 LYS 596 HD3 LYS 596 5.286 6.780 -14.192 754 HE2 LYS 596 HE2 LYS 596 4.807 6.633 -16.596 755 HE3 LYS 596 HE3 LYS 596 4.987 5.040 -15.860 756 HZ1 LYS 596 HZ1 LYS 596 2.609 4.807 -15.809 757 HZ2 LYS 596 HZ2 LYS 596 3.092 5.163 -17.386 758 HZ3 LYS 596 HZ3 LYS 596 2.388 6.370 -16.428 759 H LEU 597 HN LEU 597 3.605 4.539 -9.028 760 HA LEU 597 HA LEU 597 2.628 6.701 -7.332 761 HB2 LEU 597 HB2 LEU 597 4.194 4.189 -6.698 762 HB3 LEU 597 HB3 LEU 597 3.645 5.347 -5.501 763 HG LEU 597 HG LEU 597 1.747 3.867 -7.315 764 HD11 LEU 597 HD11 LEU 597 1.356 2.331 -5.481 765 HD12 LEU 597 HD12 LEU 597 3.049 2.269 -5.966 766 HD13 LEU 597 HD13 LEU 597 2.582 3.142 -4.505 767 HD21 LEU 597 HD21 LEU 597 0.102 4.538 -5.659 768 HD22 LEU 597 HD22 LEU 597 1.361 5.313 -4.695 769 HD23 LEU 597 HD23 LEU 597 0.950 5.954 -6.284 770 H GLU 598 HN GLU 598 3.829 8.477 -7.088 771 HA GLU 598 HA GLU 598 6.633 8.359 -7.877 772 HB2 GLU 598 HB2 GLU 598 4.926 10.748 -7.155 773 HB3 GLU 598 HB3 GLU 598 6.580 10.819 -7.751 774 HG2 GLU 598 HG2 GLU 598 5.789 9.621 -9.805 775 HG3 GLU 598 HG3 GLU 598 4.145 9.847 -9.218 776 H VAL 599 HN VAL 599 7.674 7.363 -6.275 777 HA VAL 599 HA VAL 599 7.305 8.278 -3.524 778 HB VAL 599 HB VAL 599 8.952 5.943 -4.511 779 HG11 VAL 599 HG11 VAL 599 8.764 5.166 -2.192 780 HG12 VAL 599 HG12 VAL 599 9.572 6.731 -2.302 781 HG13 VAL 599 HG13 VAL 599 7.890 6.642 -1.779 782 HG21 VAL 599 HG21 VAL 599 7.072 4.514 -3.858 783 HG22 VAL 599 HG22 VAL 599 6.111 5.946 -3.492 784 HG23 VAL 599 HG23 VAL 599 6.617 5.625 -5.151 785 H SER 600 HN SER 600 8.721 9.568 -2.588 786 HA SER 600 HA SER 600 11.399 9.819 -3.783 787 HB2 SER 600 HB2 SER 600 11.293 12.251 -3.100 788 HB3 SER 600 HB3 SER 600 10.255 11.797 -4.444 789 HG SER 600 HG SER 600 8.493 11.879 -3.129 790 H LEU 601 HN LEU 601 13.031 10.551 -2.332 791 HA LEU 601 HA LEU 601 12.397 10.053 0.492 792 HB2 LEU 601 HB2 LEU 601 13.810 8.318 -1.085 793 HB3 LEU 601 HB3 LEU 601 15.092 9.270 -0.358 794 HG LEU 601 HG LEU 601 12.977 8.171 1.428 795 HD11 LEU 601 HD11 LEU 601 13.508 6.262 0.055 796 HD12 LEU 601 HD12 LEU 601 15.236 6.563 0.251 797 HD13 LEU 601 HD13 LEU 601 14.261 6.082 1.639 798 HD21 LEU 601 HD21 LEU 601 14.920 7.925 2.926 799 HD22 LEU 601 HD22 LEU 601 15.937 8.637 1.673 800 HD23 LEU 601 HD23 LEU 601 14.640 9.588 2.402 801 H LYS 602 HN LYS 602 12.716 11.839 1.548 802 HA LYS 602 HA LYS 602 14.853 13.675 0.681 803 HB2 LYS 602 HB2 LYS 602 12.055 14.477 1.504 804 HB3 LYS 602 HB3 LYS 602 13.345 15.561 1.000 805 HG2 LYS 602 HG2 LYS 602 13.212 14.868 -1.228 806 HG3 LYS 602 HG3 LYS 602 12.292 13.421 -0.814 807 HD2 LYS 602 HD2 LYS 602 11.326 16.271 -0.624 808 HD3 LYS 602 HD3 LYS 602 10.851 15.087 -1.843 809 HE2 LYS 602 HE2 LYS 602 10.316 14.945 1.119 810 HE3 LYS 602 HE3 LYS 602 9.130 15.258 -0.146 811 HZ1 LYS 602 HZ1 LYS 602 9.572 13.033 -1.031 812 HZ2 LYS 602 HZ2 LYS 602 9.017 12.967 0.573 813 HZ3 LYS 602 HZ3 LYS 602 10.658 12.741 0.234 814 H ASN 603 HN ASN 603 16.180 14.112 2.319 815 HA ASN 603 HA ASN 603 16.992 14.506 4.411 816 HB2 ASN 603 HB2 ASN 603 14.097 14.892 5.229 817 HB3 ASN 603 HB3 ASN 603 15.512 15.397 6.145 818 HD21 ASN 603 HD21 ASN 603 16.655 17.229 5.491 819 HD22 ASN 603 HD22 ASN 603 16.013 18.348 4.335 820 H ASN 604 HN ASN 604 16.144 11.871 3.469 821 HA ASN 604 HA ASN 604 16.084 9.724 4.163 822 HB2 ASN 604 HB2 ASN 604 16.648 10.981 6.839 823 HB3 ASN 604 HB3 ASN 604 16.394 9.246 6.664 824 HD21 ASN 604 HD21 ASN 604 18.778 10.758 7.463 825 HD22 ASN 604 HD22 ASN 604 20.027 10.280 6.369 826 H VAL 605 HN VAL 605 13.752 11.780 4.376 827 HA VAL 605 HA VAL 605 11.870 9.927 5.675 828 HB VAL 605 HB VAL 605 11.363 12.783 4.807 829 HG11 VAL 605 HG11 VAL 605 9.333 11.482 4.829 830 HG12 VAL 605 HG12 VAL 605 9.713 10.853 6.432 831 HG13 VAL 605 HG13 VAL 605 9.340 12.565 6.220 832 HG21 VAL 605 HG21 VAL 605 12.962 12.777 6.615 833 HG22 VAL 605 HG22 VAL 605 11.395 13.303 7.229 834 HG23 VAL 605 HG23 VAL 605 11.961 11.660 7.541 835 H VAL 606 HN VAL 606 10.766 8.619 4.366 836 HA VAL 606 HA VAL 606 10.806 9.077 1.504 837 HB VAL 606 HB VAL 606 11.322 6.848 2.235 838 HG11 VAL 606 HG11 VAL 606 10.160 6.862 4.373 839 HG12 VAL 606 HG12 VAL 606 8.605 6.793 3.541 840 HG13 VAL 606 HG13 VAL 606 9.729 5.439 3.426 841 HG21 VAL 606 HG21 VAL 606 9.722 5.547 0.942 842 HG22 VAL 606 HG22 VAL 606 8.574 6.885 0.995 843 HG23 VAL 606 HG23 VAL 606 10.099 7.066 0.127 844 H SER 607 HN SER 607 9.053 9.475 0.222 845 HA SER 607 HA SER 607 6.415 9.718 1.476 846 HB2 SER 607 HB2 SER 607 7.493 11.910 -0.294 847 HB3 SER 607 HB3 SER 607 6.083 11.952 0.766 848 HG SER 607 HG SER 607 7.711 11.630 2.518 849 H VAL 608 HN VAL 608 4.784 9.094 0.151 850 HA VAL 608 HA VAL 608 5.458 8.556 -2.668 851 HB VAL 608 HB VAL 608 4.916 6.481 -1.554 852 HG11 VAL 608 HG11 VAL 608 3.732 7.306 0.376 853 HG12 VAL 608 HG12 VAL 608 2.386 7.840 -0.634 854 HG13 VAL 608 HG13 VAL 608 2.735 6.117 -0.461 855 HG21 VAL 608 HG21 VAL 608 2.896 5.769 -2.829 856 HG22 VAL 608 HG22 VAL 608 2.617 7.458 -3.260 857 HG23 VAL 608 HG23 VAL 608 4.079 6.634 -3.810 858 H ASN 609 HN ASN 609 4.540 9.906 -4.069 859 HA ASN 609 HA ASN 609 3.085 11.374 -5.042 860 HB2 ASN 609 HB2 ASN 609 1.055 9.913 -3.328 861 HB3 ASN 609 HB3 ASN 609 0.672 10.994 -4.658 862 HD21 ASN 609 HD21 ASN 609 -0.490 9.100 -5.395 863 HD22 ASN 609 HD22 ASN 609 0.354 7.911 -6.314 864 H LYS 610 HN LYS 610 4.493 12.244 -2.785 865 HA LYS 610 HA LYS 610 4.695 14.169 -1.593 866 HB2 LYS 610 HB2 LYS 610 1.807 14.603 -2.342 867 HB3 LYS 610 HB3 LYS 610 2.701 15.708 -1.309 868 HG2 LYS 610 HG2 LYS 610 3.481 14.984 -4.130 869 HG3 LYS 610 HG3 LYS 610 2.588 16.434 -3.666 870 HD2 LYS 610 HD2 LYS 610 4.484 17.091 -2.222 871 HD3 LYS 610 HD3 LYS 610 5.377 15.685 -2.799 872 HE2 LYS 610 HE2 LYS 610 6.075 17.658 -4.016 873 HE3 LYS 610 HE3 LYS 610 5.230 16.549 -5.095 874 HZ1 LYS 610 HZ1 LYS 610 4.654 18.987 -5.276 875 HZ2 LYS 610 HZ2 LYS 610 3.849 18.827 -3.790 876 HZ3 LYS 610 HZ3 LYS 610 3.343 17.919 -5.128 877 H GLU 611 HN GLU 611 2.511 11.667 -0.852 878 HA GLU 611 HA GLU 611 1.909 12.615 1.816 879 HB2 GLU 611 HB2 GLU 611 1.340 9.987 0.449 880 HB3 GLU 611 HB3 GLU 611 0.789 10.404 2.064 881 HG2 GLU 611 HG2 GLU 611 0.005 11.711 -0.525 882 HG3 GLU 611 HG3 GLU 611 -1.005 10.730 0.537 883 HA PRO 612 HA PRO 612 5.511 10.827 3.608 884 HB2 PRO 612 HB2 PRO 612 4.449 11.168 6.236 885 HB3 PRO 612 HB3 PRO 612 5.560 12.230 5.370 886 HG2 PRO 612 HG2 PRO 612 2.956 12.870 6.051 887 HG3 PRO 612 HG3 PRO 612 3.901 13.662 4.780 888 HD2 PRO 612 HD2 PRO 612 1.808 11.547 4.550 889 HD3 PRO 612 HD3 PRO 612 2.144 12.927 3.483 890 H VAL 613 HN VAL 613 6.164 8.827 4.052 891 HA VAL 613 HA VAL 613 4.263 6.788 4.797 892 HB VAL 613 HB VAL 613 7.225 6.715 4.200 893 HG11 VAL 613 HG11 VAL 613 7.093 4.274 4.334 894 HG12 VAL 613 HG12 VAL 613 6.771 5.022 5.900 895 HG13 VAL 613 HG13 VAL 613 5.438 4.399 4.928 896 HG21 VAL 613 HG21 VAL 613 4.819 5.598 2.773 897 HG22 VAL 613 HG22 VAL 613 5.771 6.997 2.270 898 HG23 VAL 613 HG23 VAL 613 6.494 5.387 2.269 899 H ALA 614 HN ALA 614 3.964 5.950 6.760 900 HA ALA 614 HA ALA 614 4.919 7.390 9.025 901 HB1 ALA 614 HB1 ALA 614 3.304 4.846 8.856 902 HB2 ALA 614 HB2 ALA 614 3.566 5.799 10.318 903 HB3 ALA 614 HB3 ALA 614 2.668 6.487 8.966 904 H GLU 615 HN GLU 615 5.562 4.180 7.671 905 HA GLU 615 HA GLU 615 8.130 4.069 8.917 906 HB2 GLU 615 HB2 GLU 615 6.547 3.415 10.793 907 HB3 GLU 615 HB3 GLU 615 6.174 1.973 9.859 908 HG2 GLU 615 HG2 GLU 615 8.483 1.263 9.964 909 HG3 GLU 615 HG3 GLU 615 8.925 2.751 10.799 910 HA PRO 616 HA PRO 616 8.056 1.569 5.179 911 HB2 PRO 616 HB2 PRO 616 10.385 2.411 4.215 912 HB3 PRO 616 HB3 PRO 616 8.982 3.489 4.245 913 HG2 PRO 616 HG2 PRO 616 11.359 3.415 6.051 914 HG3 PRO 616 HG3 PRO 616 10.459 4.812 5.437 915 HD2 PRO 616 HD2 PRO 616 10.148 3.618 7.953 916 HD3 PRO 616 HD3 PRO 616 9.030 4.768 7.195 917 H ASP 617 HN ASP 617 9.392 -0.145 4.319 918 HA ASP 617 HA ASP 617 11.235 -1.478 4.055 919 HB2 ASP 617 HB2 ASP 617 12.248 0.143 6.365 920 HB3 ASP 617 HB3 ASP 617 13.088 -1.324 5.884 921 H ILE 618 HN ILE 618 8.828 -1.903 5.626 922 HA ILE 618 HA ILE 618 9.474 -3.914 7.554 923 HB ILE 618 HB ILE 618 7.005 -2.995 6.131 924 HG12 ILE 618 HG12 ILE 618 7.803 -3.178 9.050 925 HG13 ILE 618 HG13 ILE 618 7.778 -1.722 8.063 926 HG21 ILE 618 HG21 ILE 618 7.183 -5.439 7.930 927 HG22 ILE 618 HG22 ILE 618 5.682 -4.692 7.382 928 HG23 ILE 618 HG23 ILE 618 6.775 -5.434 6.213 929 HD11 ILE 618 HD11 ILE 618 5.360 -1.900 7.860 930 HD12 ILE 618 HD12 ILE 618 5.382 -3.375 8.826 931 HD13 ILE 618 HD13 ILE 618 5.862 -1.837 9.547 932 H MET 619 HN MET 619 10.600 -5.626 6.863 933 HA MET 619 HA MET 619 10.597 -6.412 4.118 934 HB2 MET 619 HB2 MET 619 12.570 -6.370 5.760 935 HB3 MET 619 HB3 MET 619 11.934 -7.889 6.373 936 HG2 MET 619 HG2 MET 619 13.341 -8.764 4.863 937 HG3 MET 619 HG3 MET 619 12.002 -8.460 3.757 938 HE1 MET 619 HE1 MET 619 13.174 -4.896 2.336 939 HE2 MET 619 HE2 MET 619 11.889 -6.102 2.254 940 HE3 MET 619 HE3 MET 619 12.171 -5.216 3.754 941 H ALA 620 HN ALA 620 9.529 -7.985 3.155 942 HA ALA 620 HA ALA 620 8.575 -10.267 4.751 943 HB1 ALA 620 HB1 ALA 620 7.150 -8.992 2.403 944 HB2 ALA 620 HB2 ALA 620 6.646 -10.468 3.230 945 HB3 ALA 620 HB3 ALA 620 6.636 -8.927 4.091 946 H THR 621 HN THR 621 8.133 -12.189 3.019 947 HA THR 621 HA THR 621 10.762 -12.613 1.961 948 HB THR 621 HB THR 621 9.314 -14.400 3.062 949 HG1 THR 621 HG1 THR 621 10.273 -15.247 0.515 950 HG21 THR 621 HG21 THR 621 8.083 -14.522 0.304 951 HG22 THR 621 HG22 THR 621 7.260 -14.039 1.787 952 HG23 THR 621 HG23 THR 621 7.836 -15.695 1.601 953 H ASN 622 HN ASN 622 7.651 -11.768 0.598 954 HA ASN 622 HA ASN 622 8.852 -11.947 -2.080 955 HB2 ASN 622 HB2 ASN 622 6.666 -12.382 -3.003 956 HB3 ASN 622 HB3 ASN 622 6.998 -13.540 -1.726 957 HD21 ASN 622 HD21 ASN 622 4.468 -12.743 -2.856 958 HD22 ASN 622 HD22 ASN 622 3.524 -12.121 -1.546 959 H GLY 623 HN GLY 623 8.719 -9.656 -0.073 960 HA2 GLY 623 HA2 GLY 623 8.664 -7.563 -1.825 961 HA3 GLY 623 HA3 GLY 623 6.996 -7.726 -1.302 962 H VAL 624 HN VAL 624 7.500 -5.497 -0.593 963 HA VAL 624 HA VAL 624 8.412 -5.580 2.198 964 HB VAL 624 HB VAL 624 10.122 -4.505 0.615 965 HG11 VAL 624 HG11 VAL 624 9.686 -2.192 -0.043 966 HG12 VAL 624 HG12 VAL 624 8.540 -3.304 -0.795 967 HG13 VAL 624 HG13 VAL 624 8.043 -2.330 0.590 968 HG21 VAL 624 HG21 VAL 624 10.199 -4.163 3.021 969 HG22 VAL 624 HG22 VAL 624 10.617 -2.675 2.172 970 HG23 VAL 624 HG23 VAL 624 9.018 -2.859 2.890 971 H VAL 625 HN VAL 625 7.438 -3.953 3.538 972 HA VAL 625 HA VAL 625 4.896 -2.922 2.470 973 HB VAL 625 HB VAL 625 5.416 -3.843 5.303 974 HG11 VAL 625 HG11 VAL 625 2.906 -2.873 3.948 975 HG12 VAL 625 HG12 VAL 625 2.972 -3.587 5.559 976 HG13 VAL 625 HG13 VAL 625 3.798 -2.062 5.236 977 HG21 VAL 625 HG21 VAL 625 5.336 -5.738 3.779 978 HG22 VAL 625 HG22 VAL 625 3.900 -5.697 4.803 979 HG23 VAL 625 HG23 VAL 625 3.802 -5.160 3.126 980 H HIS 626 HN HIS 626 4.688 -0.783 2.568 981 HA HIS 626 HA HIS 626 6.324 0.690 4.513 982 HB2 HIS 626 HB2 HIS 626 5.197 1.589 1.855 983 HB3 HIS 626 HB3 HIS 626 6.037 2.634 2.989 984 HD2 HIS 626 HD2 HIS 626 6.959 1.399 -0.164 985 HE1 HIS 626 HE1 HIS 626 10.340 0.367 2.164 986 HE2 HIS 626 HE2 HIS 626 9.498 0.853 -0.175 987 H VAL 627 HN VAL 627 5.149 1.179 6.220 988 HA VAL 627 HA VAL 627 2.324 1.271 6.284 989 HB VAL 627 HB VAL 627 4.205 2.582 8.249 990 HG11 VAL 627 HG11 VAL 627 1.409 1.501 8.547 991 HG12 VAL 627 HG12 VAL 627 2.410 2.108 9.865 992 HG13 VAL 627 HG13 VAL 627 1.893 3.198 8.580 993 HG21 VAL 627 HG21 VAL 627 4.888 0.274 7.875 994 HG22 VAL 627 HG22 VAL 627 4.195 0.484 9.483 995 HG23 VAL 627 HG23 VAL 627 3.243 -0.270 8.205 996 H ILE 628 HN ILE 628 0.975 2.860 5.627 997 HA ILE 628 HA ILE 628 2.040 5.609 5.614 998 HB ILE 628 HB ILE 628 0.150 6.081 3.947 999 HG12 ILE 628 HG12 ILE 628 0.410 3.101 3.490 1000 HG13 ILE 628 HG13 ILE 628 -0.986 3.887 4.225 1001 HG21 ILE 628 HG21 ILE 628 2.497 6.186 3.392 1002 HG22 ILE 628 HG22 ILE 628 2.529 4.446 3.099 1003 HG23 ILE 628 HG23 ILE 628 1.573 5.499 2.052 1004 HD11 ILE 628 HD11 ILE 628 0.017 4.311 1.418 1005 HD12 ILE 628 HD12 ILE 628 -1.402 3.377 1.894 1006 HD13 ILE 628 HD13 ILE 628 -1.365 5.124 2.150 1007 H THR 629 HN THR 629 0.825 7.223 6.409 1008 HA THR 629 HA THR 629 -1.277 6.392 8.269 1009 HB THR 629 HB THR 629 0.624 7.684 9.163 1010 HG1 THR 629 HG1 THR 629 -0.820 8.399 10.506 1011 HG21 THR 629 HG21 THR 629 1.167 8.978 7.168 1012 HG22 THR 629 HG22 THR 629 0.938 10.038 8.561 1013 HG23 THR 629 HG23 THR 629 -0.329 9.898 7.341 1014 H ASN 630 HN ASN 630 -1.309 6.950 5.260 1015 HA ASN 630 HA ASN 630 -3.732 8.591 5.189 1016 HB2 ASN 630 HB2 ASN 630 -2.891 9.782 3.197 1017 HB3 ASN 630 HB3 ASN 630 -1.851 10.080 4.586 1018 HD21 ASN 630 HD21 ASN 630 -2.133 8.694 1.469 1019 HD22 ASN 630 HD22 ASN 630 -0.479 8.247 1.269 1020 H VAL 631 HN VAL 631 -4.649 8.419 2.860 1021 HA VAL 631 HA VAL 631 -4.131 5.728 1.768 1022 HB VAL 631 HB VAL 631 -6.693 7.338 1.582 1023 HG11 VAL 631 HG11 VAL 631 -7.648 5.274 0.641 1024 HG12 VAL 631 HG12 VAL 631 -6.365 5.941 -0.369 1025 HG13 VAL 631 HG13 VAL 631 -6.044 4.543 0.658 1026 HG21 VAL 631 HG21 VAL 631 -6.055 4.887 3.219 1027 HG22 VAL 631 HG22 VAL 631 -6.345 6.513 3.841 1028 HG23 VAL 631 HG23 VAL 631 -7.649 5.622 3.054 1029 H LEU 632 HN LEU 632 -3.863 5.585 -0.494 1030 HA LEU 632 HA LEU 632 -3.121 8.134 -1.720 1031 HB2 LEU 632 HB2 LEU 632 -2.506 5.286 -2.499 1032 HB3 LEU 632 HB3 LEU 632 -1.962 6.696 -3.387 1033 HG LEU 632 HG LEU 632 -1.246 6.155 -0.508 1034 HD11 LEU 632 HD11 LEU 632 -0.323 4.431 -2.011 1035 HD12 LEU 632 HD12 LEU 632 0.422 5.701 -2.979 1036 HD13 LEU 632 HD13 LEU 632 0.927 5.455 -1.305 1037 HD21 LEU 632 HD21 LEU 632 0.411 7.892 -0.845 1038 HD22 LEU 632 HD22 LEU 632 -0.101 8.082 -2.522 1039 HD23 LEU 632 HD23 LEU 632 -1.201 8.511 -1.211 1040 H GLN 633 HN GLN 633 -4.457 9.088 -3.051 1041 HA GLN 633 HA GLN 633 -6.662 7.553 -4.212 1042 HB2 GLN 633 HB2 GLN 633 -6.228 10.536 -3.975 1043 HB3 GLN 633 HB3 GLN 633 -7.600 9.801 -4.786 1044 HG2 GLN 633 HG2 GLN 633 -8.380 10.404 -2.675 1045 HG3 GLN 633 HG3 GLN 633 -8.111 8.666 -2.580 1046 HE21 GLN 633 HE21 GLN 633 -7.945 8.724 -0.357 1047 HE22 GLN 633 HE22 GLN 633 -6.546 9.351 0.443 1048 HA PRO 634 HA PRO 634 -4.631 8.031 -8.183 1049 HB2 PRO 634 HB2 PRO 634 -6.023 5.975 -9.349 1050 HB3 PRO 634 HB3 PRO 634 -4.529 5.766 -8.436 1051 HG2 PRO 634 HG2 PRO 634 -7.237 4.981 -7.727 1052 HG3 PRO 634 HG3 PRO 634 -5.712 4.537 -6.949 1053 HD2 PRO 634 HD2 PRO 634 -7.671 6.513 -6.125 1054 HD3 PRO 634 HD3 PRO 634 -6.238 5.935 -5.256 Start of MODEL 4 1 H1 ALA 500 H1 ALA 500 14.028 -20.867 6.447 2 H2 ALA 500 H2 ALA 500 13.906 -21.884 7.795 3 H3 ALA 500 H3 ALA 500 13.664 -20.211 7.967 4 HA ALA 500 HA ALA 500 11.945 -22.110 6.476 5 HB1 ALA 500 HB1 ALA 500 11.680 -22.229 8.907 6 HB2 ALA 500 HB2 ALA 500 11.390 -20.491 8.961 7 HB3 ALA 500 HB3 ALA 500 10.248 -21.549 8.134 8 H GLY 501 HN GLY 501 12.302 -18.736 7.597 9 HA2 GLY 501 HA2 GLY 501 12.125 -17.375 5.315 10 HA3 GLY 501 HA3 GLY 501 10.447 -17.849 5.537 11 H MET 502 HN MET 502 9.233 -16.423 6.527 12 HA MET 502 HA MET 502 9.819 -15.086 8.905 13 HB2 MET 502 HB2 MET 502 11.440 -13.835 7.471 14 HB3 MET 502 HB3 MET 502 10.104 -13.318 6.456 15 HG2 MET 502 HG2 MET 502 9.117 -12.132 8.347 16 HG3 MET 502 HG3 MET 502 10.455 -12.648 9.369 17 HE1 MET 502 HE1 MET 502 12.967 -11.913 8.987 18 HE2 MET 502 HE2 MET 502 12.916 -12.395 7.292 19 HE3 MET 502 HE3 MET 502 13.488 -10.788 7.729 20 H GLY 503 HN GLY 503 8.221 -14.906 5.790 21 HA2 GLY 503 HA2 GLY 503 5.713 -15.418 6.157 22 HA3 GLY 503 HA3 GLY 503 5.772 -13.903 7.053 23 H THR 504 HN THR 504 4.298 -14.607 4.564 24 HA THR 504 HA THR 504 5.591 -13.157 2.452 25 HB THR 504 HB THR 504 3.377 -13.311 1.308 26 HG1 THR 504 HG1 THR 504 2.037 -14.992 2.687 27 HG21 THR 504 HG21 THR 504 5.044 -15.107 1.076 28 HG22 THR 504 HG22 THR 504 3.397 -15.735 1.018 29 HG23 THR 504 HG23 THR 504 4.357 -15.916 2.486 30 H VAL 505 HN VAL 505 4.495 -11.257 1.431 31 HA VAL 505 HA VAL 505 4.368 -9.118 3.231 32 HB VAL 505 HB VAL 505 4.921 -8.879 0.835 33 HG11 VAL 505 HG11 VAL 505 1.975 -9.297 0.383 34 HG12 VAL 505 HG12 VAL 505 3.116 -8.710 -0.827 35 HG13 VAL 505 HG13 VAL 505 3.291 -10.335 -0.166 36 HG21 VAL 505 HG21 VAL 505 4.361 -6.902 2.096 37 HG22 VAL 505 HG22 VAL 505 3.723 -6.759 0.458 38 HG23 VAL 505 HG23 VAL 505 2.641 -7.157 1.793 39 H MET 506 HN MET 506 1.888 -11.212 1.937 40 HA MET 506 HA MET 506 -0.336 -9.692 2.756 41 HB2 MET 506 HB2 MET 506 -0.937 -11.207 1.173 42 HB3 MET 506 HB3 MET 506 0.240 -12.393 1.709 43 HG2 MET 506 HG2 MET 506 -1.936 -13.249 2.024 44 HG3 MET 506 HG3 MET 506 -1.214 -12.942 3.595 45 HE1 MET 506 HE1 MET 506 -4.354 -10.125 1.713 46 HE2 MET 506 HE2 MET 506 -2.703 -10.310 1.122 47 HE3 MET 506 HE3 MET 506 -3.857 -11.631 0.935 48 H ASP 507 HN ASP 507 1.525 -12.333 4.248 49 HA ASP 507 HA ASP 507 -0.203 -12.619 6.477 50 HB2 ASP 507 HB2 ASP 507 1.420 -14.366 5.749 51 HB3 ASP 507 HB3 ASP 507 2.729 -13.350 6.346 52 H VAL 508 HN VAL 508 2.574 -10.596 5.818 53 HA VAL 508 HA VAL 508 2.993 -9.587 8.408 54 HB VAL 508 HB VAL 508 3.420 -8.206 5.741 55 HG11 VAL 508 HG11 VAL 508 3.381 -6.569 7.519 56 HG12 VAL 508 HG12 VAL 508 4.505 -7.537 8.472 57 HG13 VAL 508 HG13 VAL 508 5.037 -6.802 6.959 58 HG21 VAL 508 HG21 VAL 508 5.350 -9.743 7.478 59 HG22 VAL 508 HG22 VAL 508 4.653 -10.311 5.959 60 HG23 VAL 508 HG23 VAL 508 5.738 -8.921 5.967 61 H LEU 509 HN LEU 509 0.687 -8.733 5.903 62 HA LEU 509 HA LEU 509 -0.226 -6.330 7.157 63 HB2 LEU 509 HB2 LEU 509 -1.641 -8.013 5.090 64 HB3 LEU 509 HB3 LEU 509 -1.963 -6.334 5.472 65 HG LEU 509 HG LEU 509 0.565 -7.391 4.215 66 HD11 LEU 509 HD11 LEU 509 -1.762 -5.865 3.057 67 HD12 LEU 509 HD12 LEU 509 -0.227 -6.138 2.229 68 HD13 LEU 509 HD13 LEU 509 -1.254 -7.507 2.653 69 HD21 LEU 509 HD21 LEU 509 -0.302 -4.563 4.802 70 HD22 LEU 509 HD22 LEU 509 1.015 -5.437 5.584 71 HD23 LEU 509 HD23 LEU 509 1.125 -5.026 3.872 72 H LYS 510 HN LYS 510 -1.246 -9.675 7.153 73 HA LYS 510 HA LYS 510 -3.669 -9.100 8.635 74 HB2 LYS 510 HB2 LYS 510 -3.889 -11.635 8.665 75 HB3 LYS 510 HB3 LYS 510 -3.932 -10.868 7.082 76 HG2 LYS 510 HG2 LYS 510 -1.610 -11.473 6.713 77 HG3 LYS 510 HG3 LYS 510 -1.532 -12.205 8.316 78 HD2 LYS 510 HD2 LYS 510 -3.492 -13.097 6.215 79 HD3 LYS 510 HD3 LYS 510 -1.871 -13.780 6.350 80 HE2 LYS 510 HE2 LYS 510 -4.012 -13.799 8.473 81 HE3 LYS 510 HE3 LYS 510 -3.464 -15.179 7.519 82 HZ1 LYS 510 HZ1 LYS 510 -2.382 -15.328 9.592 83 HZ2 LYS 510 HZ2 LYS 510 -1.961 -13.690 9.592 84 HZ3 LYS 510 HZ3 LYS 510 -1.200 -14.752 8.518 85 H GLY 511 HN GLY 511 -0.422 -9.736 9.289 86 HA2 GLY 511 HA2 GLY 511 -0.869 -10.682 11.991 87 HA3 GLY 511 HA3 GLY 511 0.682 -10.277 11.262 88 H ASP 512 HN ASP 512 -0.942 -7.717 10.375 89 HA ASP 512 HA ASP 512 -0.269 -6.248 12.843 90 HB2 ASP 512 HB2 ASP 512 0.996 -5.444 10.957 91 HB3 ASP 512 HB3 ASP 512 -0.467 -5.269 9.990 92 H ASN 513 HN ASN 513 -1.637 -4.528 13.549 93 HA ASN 513 HA ASN 513 -4.393 -5.316 13.516 94 HB2 ASN 513 HB2 ASN 513 -3.068 -2.936 14.824 95 HB3 ASN 513 HB3 ASN 513 -4.713 -3.483 15.129 96 HD21 ASN 513 HD21 ASN 513 -1.364 -3.998 15.723 97 HD22 ASN 513 HD22 ASN 513 -1.542 -5.236 16.920 98 H ARG 514 HN ARG 514 -2.503 -2.773 12.016 99 HA ARG 514 HA ARG 514 -4.853 -1.208 11.349 100 HB2 ARG 514 HB2 ARG 514 -2.007 -0.858 10.389 101 HB3 ARG 514 HB3 ARG 514 -3.309 0.311 10.250 102 HG2 ARG 514 HG2 ARG 514 -2.051 -0.636 12.815 103 HG3 ARG 514 HG3 ARG 514 -1.763 0.909 12.018 104 HD2 ARG 514 HD2 ARG 514 -4.204 1.399 12.269 105 HD3 ARG 514 HD3 ARG 514 -4.337 -0.064 13.246 106 HE ARG 514 HE ARG 514 -2.332 1.317 14.441 107 HH11 ARG 514 HH12 ARG 514 -5.673 2.025 13.657 108 HH12 ARG 514 HH11 ARG 514 -5.810 3.284 14.843 109 HH21 ARG 514 HH22 ARG 514 -2.540 2.934 16.023 110 HH22 ARG 514 HH21 ARG 514 -4.047 3.774 16.208 111 H PHE 515 HN PHE 515 -2.359 -3.061 9.646 112 HA PHE 515 HA PHE 515 -3.410 -2.717 7.046 113 HB2 PHE 515 HB2 PHE 515 -1.721 -5.022 8.013 114 HB3 PHE 515 HB3 PHE 515 -1.825 -4.372 6.392 115 HD1 PHE 515 HD1 PHE 515 -1.755 -1.408 7.654 116 HD2 PHE 515 HD2 PHE 515 0.704 -4.878 7.831 117 HE1 PHE 515 HE1 PHE 515 0.203 0.003 8.121 118 HE2 PHE 515 HE2 PHE 515 2.663 -3.471 8.297 119 HZ PHE 515 HZ PHE 515 2.412 -1.031 8.448 120 H SER 516 HN SER 516 -4.359 -4.676 9.671 121 HA SER 516 HA SER 516 -5.253 -7.018 8.480 122 HB2 SER 516 HB2 SER 516 -5.046 -6.588 10.940 123 HB3 SER 516 HB3 SER 516 -6.527 -5.634 10.851 124 HG SER 516 HG SER 516 -6.160 -8.404 10.479 125 H MET 517 HN MET 517 -6.952 -3.922 8.877 126 HA MET 517 HA MET 517 -9.393 -4.998 7.815 127 HB2 MET 517 HB2 MET 517 -10.176 -2.625 7.846 128 HB3 MET 517 HB3 MET 517 -9.636 -3.240 9.397 129 HG2 MET 517 HG2 MET 517 -8.806 -1.073 9.286 130 HG3 MET 517 HG3 MET 517 -7.422 -2.089 8.893 131 HE1 MET 517 HE1 MET 517 -10.321 0.121 7.353 132 HE2 MET 517 HE2 MET 517 -9.898 0.054 5.643 133 HE3 MET 517 HE3 MET 517 -10.413 -1.411 6.484 134 H LEU 518 HN LEU 518 -6.604 -3.373 6.516 135 HA LEU 518 HA LEU 518 -7.624 -2.955 3.923 136 HB2 LEU 518 HB2 LEU 518 -5.549 -1.915 4.518 137 HB3 LEU 518 HB3 LEU 518 -4.823 -3.462 4.916 138 HG LEU 518 HG LEU 518 -4.868 -4.110 2.555 139 HD11 LEU 518 HD11 LEU 518 -6.038 -1.369 2.109 140 HD12 LEU 518 HD12 LEU 518 -5.381 -2.400 0.837 141 HD13 LEU 518 HD13 LEU 518 -6.792 -2.926 1.757 142 HD21 LEU 518 HD21 LEU 518 -3.164 -2.548 1.758 143 HD22 LEU 518 HD22 LEU 518 -3.577 -1.438 3.062 144 HD23 LEU 518 HD23 LEU 518 -2.893 -3.020 3.435 145 H VAL 519 HN VAL 519 -6.122 -5.745 5.497 146 HA VAL 519 HA VAL 519 -6.063 -7.478 3.304 147 HB VAL 519 HB VAL 519 -6.650 -8.182 6.190 148 HG11 VAL 519 HG11 VAL 519 -5.792 -10.412 5.602 149 HG12 VAL 519 HG12 VAL 519 -7.269 -10.010 4.729 150 HG13 VAL 519 HG13 VAL 519 -5.709 -9.921 3.910 151 HG21 VAL 519 HG21 VAL 519 -4.560 -6.997 5.985 152 HG22 VAL 519 HG22 VAL 519 -4.243 -8.702 6.303 153 HG23 VAL 519 HG23 VAL 519 -4.049 -8.057 4.672 154 H ALA 520 HN ALA 520 -8.710 -6.494 5.397 155 HA ALA 520 HA ALA 520 -10.620 -8.372 4.500 156 HB1 ALA 520 HB1 ALA 520 -10.947 -7.020 6.522 157 HB2 ALA 520 HB2 ALA 520 -11.090 -5.570 5.530 158 HB3 ALA 520 HB3 ALA 520 -12.300 -6.849 5.401 159 H ALA 521 HN ALA 521 -9.665 -5.181 3.338 160 HA ALA 521 HA ALA 521 -11.509 -5.025 1.203 161 HB1 ALA 521 HB1 ALA 521 -10.253 -3.082 2.053 162 HB2 ALA 521 HB2 ALA 521 -8.770 -3.770 1.396 163 HB3 ALA 521 HB3 ALA 521 -10.070 -3.281 0.310 164 H ILE 522 HN ILE 522 -8.194 -6.227 1.449 165 HA ILE 522 HA ILE 522 -7.800 -6.978 -1.215 166 HB ILE 522 HB ILE 522 -6.689 -8.262 1.287 167 HG12 ILE 522 HG12 ILE 522 -5.511 -6.148 -0.533 168 HG13 ILE 522 HG13 ILE 522 -6.213 -5.840 1.054 169 HG21 ILE 522 HG21 ILE 522 -5.738 -8.446 -1.568 170 HG22 ILE 522 HG22 ILE 522 -4.883 -9.079 -0.160 171 HG23 ILE 522 HG23 ILE 522 -6.450 -9.748 -0.616 172 HD11 ILE 522 HD11 ILE 522 -4.476 -7.220 2.078 173 HD12 ILE 522 HD12 ILE 522 -3.780 -7.522 0.486 174 HD13 ILE 522 HD13 ILE 522 -3.789 -5.887 1.151 175 H GLN 523 HN GLN 523 -9.291 -8.757 1.466 176 HA GLN 523 HA GLN 523 -9.674 -11.210 0.179 177 HB2 GLN 523 HB2 GLN 523 -11.184 -9.816 2.387 178 HB3 GLN 523 HB3 GLN 523 -11.527 -11.452 1.880 179 HG2 GLN 523 HG2 GLN 523 -8.878 -10.513 2.925 180 HG3 GLN 523 HG3 GLN 523 -10.114 -11.319 3.886 181 HE21 GLN 523 HE21 GLN 523 -10.505 -13.501 3.585 182 HE22 GLN 523 HE22 GLN 523 -9.381 -14.527 2.748 183 H SER 524 HN SER 524 -11.519 -8.223 0.130 184 HA SER 524 HA SER 524 -13.759 -9.417 -1.241 185 HB2 SER 524 HB2 SER 524 -13.896 -7.451 0.374 186 HB3 SER 524 HB3 SER 524 -13.192 -6.465 -0.908 187 HG SER 524 HG SER 524 -15.665 -7.840 -0.894 188 H ALA 525 HN ALA 525 -10.928 -7.502 -2.056 189 HA ALA 525 HA ALA 525 -11.720 -7.058 -4.779 190 HB1 ALA 525 HB1 ALA 525 -10.260 -5.517 -3.526 191 HB2 ALA 525 HB2 ALA 525 -9.004 -6.755 -3.506 192 HB3 ALA 525 HB3 ALA 525 -9.534 -6.059 -5.039 193 H GLY 526 HN GLY 526 -9.821 -9.468 -3.080 194 HA2 GLY 526 HA2 GLY 526 -9.321 -11.616 -3.848 195 HA3 GLY 526 HA3 GLY 526 -9.817 -11.133 -5.461 196 H LEU 527 HN LEU 527 -7.340 -9.858 -3.229 197 HA LEU 527 HA LEU 527 -5.359 -10.279 -5.376 198 HB2 LEU 527 HB2 LEU 527 -5.652 -8.126 -3.317 199 HB3 LEU 527 HB3 LEU 527 -4.050 -8.532 -3.896 200 HG LEU 527 HG LEU 527 -4.841 -6.639 -5.121 201 HD11 LEU 527 HD11 LEU 527 -4.773 -7.479 -7.419 202 HD12 LEU 527 HD12 LEU 527 -3.549 -8.234 -6.398 203 HD13 LEU 527 HD13 LEU 527 -5.015 -9.119 -6.817 204 HD21 LEU 527 HD21 LEU 527 -6.880 -6.706 -6.488 205 HD22 LEU 527 HD22 LEU 527 -7.269 -8.284 -5.804 206 HD23 LEU 527 HD23 LEU 527 -7.221 -6.860 -4.763 207 H THR 528 HN THR 528 -6.403 -11.782 -2.789 208 HA THR 528 HA THR 528 -4.263 -11.974 -0.992 209 HB THR 528 HB THR 528 -6.261 -14.169 -1.516 210 HG1 THR 528 HG1 THR 528 -7.292 -12.645 0.295 211 HG21 THR 528 HG21 THR 528 -4.547 -14.655 0.157 212 HG22 THR 528 HG22 THR 528 -6.118 -14.442 0.930 213 HG23 THR 528 HG23 THR 528 -4.921 -13.149 0.997 214 H GLU 529 HN GLU 529 -5.211 -14.114 -3.690 215 HA GLU 529 HA GLU 529 -3.161 -15.993 -3.441 216 HB2 GLU 529 HB2 GLU 529 -4.611 -15.006 -5.904 217 HB3 GLU 529 HB3 GLU 529 -3.517 -16.381 -5.905 218 HG2 GLU 529 HG2 GLU 529 -5.754 -17.188 -5.800 219 HG3 GLU 529 HG3 GLU 529 -4.978 -17.491 -4.249 220 H THR 530 HN THR 530 -3.239 -12.900 -5.093 221 HA THR 530 HA THR 530 -0.836 -13.138 -6.507 222 HB THR 530 HB THR 530 -2.120 -10.604 -5.474 223 HG1 THR 530 HG1 THR 530 -3.642 -11.568 -6.733 224 HG21 THR 530 HG21 THR 530 -0.256 -11.068 -7.806 225 HG22 THR 530 HG22 THR 530 0.173 -10.277 -6.289 226 HG23 THR 530 HG23 THR 530 -1.003 -9.531 -7.373 227 H LEU 531 HN LEU 531 -1.516 -11.770 -3.292 228 HA LEU 531 HA LEU 531 1.227 -10.960 -2.919 229 HB2 LEU 531 HB2 LEU 531 -1.057 -10.988 -0.955 230 HB3 LEU 531 HB3 LEU 531 0.463 -10.126 -0.775 231 HG LEU 531 HG LEU 531 -1.674 -9.577 -2.835 232 HD11 LEU 531 HD11 LEU 531 -2.261 -8.810 -0.619 233 HD12 LEU 531 HD12 LEU 531 -0.701 -8.004 -0.459 234 HD13 LEU 531 HD13 LEU 531 -1.867 -7.439 -1.654 235 HD21 LEU 531 HD21 LEU 531 0.584 -9.254 -3.733 236 HD22 LEU 531 HD22 LEU 531 -0.277 -7.722 -3.547 237 HD23 LEU 531 HD23 LEU 531 0.964 -8.186 -2.380 238 H ASN 532 HN ASN 532 -0.325 -13.852 -2.629 239 HA ASN 532 HA ASN 532 1.160 -14.777 -0.299 240 HB2 ASN 532 HB2 ASN 532 -1.217 -15.518 -0.815 241 HB3 ASN 532 HB3 ASN 532 -0.548 -16.450 -2.152 242 HD21 ASN 532 HD21 ASN 532 -1.150 -18.415 -1.312 243 HD22 ASN 532 HD22 ASN 532 -0.391 -19.118 0.074 244 H ARG 533 HN ARG 533 1.531 -14.579 -3.668 245 HA ARG 533 HA ARG 533 3.320 -16.838 -3.912 246 HB2 ARG 533 HB2 ARG 533 2.922 -14.612 -5.904 247 HB3 ARG 533 HB3 ARG 533 3.525 -16.235 -6.211 248 HG2 ARG 533 HG2 ARG 533 1.294 -17.122 -5.609 249 HG3 ARG 533 HG3 ARG 533 0.719 -15.462 -5.446 250 HD2 ARG 533 HD2 ARG 533 0.076 -16.108 -7.606 251 HD3 ARG 533 HD3 ARG 533 1.522 -15.128 -7.840 252 HE ARG 533 HE ARG 533 2.760 -17.163 -8.221 253 HH11 ARG 533 HH12 ARG 533 -0.725 -17.432 -8.217 254 HH12 ARG 533 HH11 ARG 533 -0.748 -18.943 -9.068 255 HH21 ARG 533 HH22 ARG 533 2.751 -19.129 -9.362 256 HH22 ARG 533 HH21 ARG 533 1.233 -19.897 -9.754 257 H GLU 534 HN GLU 534 5.501 -16.776 -3.871 258 HA GLU 534 HA GLU 534 6.808 -14.500 -2.778 259 HB2 GLU 534 HB2 GLU 534 8.859 -15.848 -3.015 260 HB3 GLU 534 HB3 GLU 534 7.559 -16.738 -2.234 261 HG2 GLU 534 HG2 GLU 534 7.073 -17.897 -4.311 262 HG3 GLU 534 HG3 GLU 534 8.324 -16.973 -5.137 263 H GLY 535 HN GLY 535 8.622 -13.389 -3.739 264 HA2 GLY 535 HA2 GLY 535 9.647 -13.166 -6.150 265 HA3 GLY 535 HA3 GLY 535 7.991 -12.672 -6.495 266 H VAL 536 HN VAL 536 8.192 -10.527 -6.849 267 HA VAL 536 HA VAL 536 9.325 -8.973 -4.628 268 HB VAL 536 HB VAL 536 10.059 -7.260 -6.231 269 HG11 VAL 536 HG11 VAL 536 11.913 -8.573 -7.256 270 HG12 VAL 536 HG12 VAL 536 11.673 -8.894 -5.538 271 HG13 VAL 536 HG13 VAL 536 11.090 -10.048 -6.739 272 HG21 VAL 536 HG21 VAL 536 8.504 -7.608 -8.047 273 HG22 VAL 536 HG22 VAL 536 10.148 -7.815 -8.650 274 HG23 VAL 536 HG23 VAL 536 9.140 -9.228 -8.331 275 H TYR 537 HN TYR 537 8.042 -7.535 -3.748 276 HA TYR 537 HA TYR 537 5.900 -6.235 -5.211 277 HB2 TYR 537 HB2 TYR 537 5.354 -7.961 -2.770 278 HB3 TYR 537 HB3 TYR 537 4.219 -6.788 -3.427 279 HD1 TYR 537 HD2 TYR 537 3.436 -7.164 -5.858 280 HD2 TYR 537 HD1 TYR 537 5.344 -10.158 -3.517 281 HE1 TYR 537 HE2 TYR 537 2.498 -8.900 -7.325 282 HE2 TYR 537 HE1 TYR 537 4.411 -11.903 -4.975 283 HH TYR 537 HH TYR 537 2.424 -12.143 -6.508 284 H THR 538 HN THR 538 5.320 -4.286 -4.272 285 HA THR 538 HA THR 538 6.526 -3.653 -1.667 286 HB THR 538 HB THR 538 6.503 -1.809 -4.065 287 HG1 THR 538 HG1 THR 538 8.382 -2.691 -4.480 288 HG21 THR 538 HG21 THR 538 7.670 -1.447 -1.303 289 HG22 THR 538 HG22 THR 538 6.255 -0.607 -1.941 290 HG23 THR 538 HG23 THR 538 7.845 -0.323 -2.653 291 H VAL 539 HN VAL 539 4.771 -3.516 -0.401 292 HA VAL 539 HA VAL 539 2.343 -2.315 -1.552 293 HB VAL 539 HB VAL 539 2.554 -4.198 0.807 294 HG11 VAL 539 HG11 VAL 539 0.110 -4.355 0.596 295 HG12 VAL 539 HG12 VAL 539 0.639 -2.716 0.977 296 HG13 VAL 539 HG13 VAL 539 0.152 -3.125 -0.668 297 HG21 VAL 539 HG21 VAL 539 1.627 -5.892 -0.651 298 HG22 VAL 539 HG22 VAL 539 1.575 -4.745 -1.991 299 HG23 VAL 539 HG23 VAL 539 3.127 -5.266 -1.336 300 H PHE 540 HN PHE 540 1.811 -0.379 -0.880 301 HA PHE 540 HA PHE 540 2.745 0.630 1.692 302 HB2 PHE 540 HB2 PHE 540 1.104 1.971 -0.482 303 HB3 PHE 540 HB3 PHE 540 1.744 2.761 0.950 304 HD1 PHE 540 HD2 PHE 540 2.586 1.291 -2.302 305 HD2 PHE 540 HD1 PHE 540 4.047 3.388 1.099 306 HE1 PHE 540 HE2 PHE 540 4.644 1.835 -3.531 307 HE2 PHE 540 HE1 PHE 540 6.113 3.939 -0.128 308 HZ PHE 540 HZ PHE 540 6.413 3.158 -2.443 309 H ALA 541 HN ALA 541 1.550 -0.051 3.383 310 HA ALA 541 HA ALA 541 -1.302 -0.555 2.965 311 HB1 ALA 541 HB1 ALA 541 0.467 -1.316 5.281 312 HB2 ALA 541 HB2 ALA 541 -1.234 -1.765 5.091 313 HB3 ALA 541 HB3 ALA 541 -0.019 -2.372 3.955 314 HA PRO 542 HA PRO 542 -2.020 3.354 5.045 315 HB2 PRO 542 HB2 PRO 542 -4.820 2.823 4.424 316 HB3 PRO 542 HB3 PRO 542 -3.782 4.118 3.828 317 HG2 PRO 542 HG2 PRO 542 -4.661 2.101 2.252 318 HG3 PRO 542 HG3 PRO 542 -3.102 2.905 1.999 319 HD2 PRO 542 HD2 PRO 542 -3.691 0.280 3.315 320 HD3 PRO 542 HD3 PRO 542 -2.379 0.708 2.197 321 H THR 543 HN THR 543 -2.540 3.744 7.119 322 HA THR 543 HA THR 543 -3.368 1.567 8.778 323 HB THR 543 HB THR 543 -3.303 3.230 10.623 324 HG1 THR 543 HG1 THR 543 -3.174 5.309 10.219 325 HG21 THR 543 HG21 THR 543 -0.888 3.667 10.505 326 HG22 THR 543 HG22 THR 543 -0.904 3.251 8.791 327 HG23 THR 543 HG23 THR 543 -1.281 2.026 10.002 328 H ASN 544 HN ASN 544 -5.095 2.329 10.585 329 HA ASN 544 HA ASN 544 -7.604 2.233 9.310 330 HB2 ASN 544 HB2 ASN 544 -7.019 3.083 12.157 331 HB3 ASN 544 HB3 ASN 544 -8.568 2.531 11.534 332 HD21 ASN 544 HD21 ASN 544 -7.268 0.441 9.890 333 HD22 ASN 544 HD22 ASN 544 -6.834 -0.802 11.011 334 H GLU 545 HN GLU 545 -5.633 4.795 10.545 335 HA GLU 545 HA GLU 545 -7.519 6.867 10.624 336 HB2 GLU 545 HB2 GLU 545 -4.518 6.922 10.271 337 HB3 GLU 545 HB3 GLU 545 -5.500 8.357 10.530 338 HG2 GLU 545 HG2 GLU 545 -4.433 7.616 12.591 339 HG3 GLU 545 HG3 GLU 545 -6.188 7.540 12.702 340 H ALA 546 HN ALA 546 -5.728 5.480 7.973 341 HA ALA 546 HA ALA 546 -5.952 7.613 6.144 342 HB1 ALA 546 HB1 ALA 546 -4.422 5.778 5.749 343 HB2 ALA 546 HB2 ALA 546 -5.773 4.653 5.618 344 HB3 ALA 546 HB3 ALA 546 -5.556 5.915 4.403 345 H PHE 547 HN PHE 547 -7.883 4.676 6.466 346 HA PHE 547 HA PHE 547 -9.894 5.527 4.658 347 HB2 PHE 547 HB2 PHE 547 -9.897 3.357 6.765 348 HB3 PHE 547 HB3 PHE 547 -11.118 3.555 5.522 349 HD1 PHE 547 HD1 PHE 547 -10.468 3.282 3.113 350 HD2 PHE 547 HD2 PHE 547 -7.870 2.239 6.320 351 HE1 PHE 547 HE1 PHE 547 -9.142 1.883 1.582 352 HE2 PHE 547 HE2 PHE 547 -6.542 0.841 4.799 353 HZ PHE 547 HZ PHE 547 -7.178 0.657 2.424 354 H ARG 548 HN ARG 548 -9.268 6.069 7.981 355 HA ARG 548 HA ARG 548 -11.917 6.792 8.782 356 HB2 ARG 548 HB2 ARG 548 -10.165 6.044 10.359 357 HB3 ARG 548 HB3 ARG 548 -9.243 7.494 10.009 358 HG2 ARG 548 HG2 ARG 548 -10.996 8.868 10.961 359 HG3 ARG 548 HG3 ARG 548 -11.975 7.433 11.269 360 HD2 ARG 548 HD2 ARG 548 -10.257 6.570 12.769 361 HD3 ARG 548 HD3 ARG 548 -9.247 7.977 12.442 362 HE ARG 548 HE ARG 548 -11.630 8.997 13.363 363 HH11 ARG 548 HH12 ARG 548 -9.193 6.791 14.598 364 HH12 ARG 548 HH11 ARG 548 -9.478 7.199 16.261 365 HH21 ARG 548 HH22 ARG 548 -11.985 9.560 15.539 366 HH22 ARG 548 HH21 ARG 548 -11.073 8.781 16.800 367 H ALA 549 HN ALA 549 -9.074 8.469 7.592 368 HA ALA 549 HA ALA 549 -9.965 11.114 7.866 369 HB1 ALA 549 HB1 ALA 549 -7.650 10.549 7.385 370 HB2 ALA 549 HB2 ALA 549 -8.115 9.910 5.807 371 HB3 ALA 549 HB3 ALA 549 -8.283 11.635 6.146 372 H LEU 550 HN LEU 550 -10.522 8.684 5.402 373 HA LEU 550 HA LEU 550 -11.844 10.338 3.538 374 HB2 LEU 550 HB2 LEU 550 -11.968 7.381 4.079 375 HB3 LEU 550 HB3 LEU 550 -12.881 8.141 2.789 376 HG LEU 550 HG LEU 550 -9.876 8.258 3.027 377 HD11 LEU 550 HD11 LEU 550 -11.558 6.548 1.203 378 HD12 LEU 550 HD12 LEU 550 -9.797 6.626 1.246 379 HD13 LEU 550 HD13 LEU 550 -10.687 5.962 2.619 380 HD21 LEU 550 HD21 LEU 550 -9.940 9.156 0.798 381 HD22 LEU 550 HD22 LEU 550 -11.694 8.949 0.723 382 HD23 LEU 550 HD23 LEU 550 -10.989 10.129 1.834 383 HA PRO 551 HA PRO 551 -15.427 11.356 5.804 384 HB2 PRO 551 HB2 PRO 551 -16.769 11.748 3.212 385 HB3 PRO 551 HB3 PRO 551 -16.396 12.927 4.472 386 HG2 PRO 551 HG2 PRO 551 -15.073 12.914 2.144 387 HG3 PRO 551 HG3 PRO 551 -14.267 13.314 3.670 388 HD2 PRO 551 HD2 PRO 551 -14.235 10.737 2.132 389 HD3 PRO 551 HD3 PRO 551 -12.886 11.582 2.928 390 HA PRO 552 HA PRO 552 -17.930 7.788 6.269 391 HB2 PRO 552 HB2 PRO 552 -20.168 9.758 6.487 392 HB3 PRO 552 HB3 PRO 552 -19.757 8.402 7.544 393 HG2 PRO 552 HG2 PRO 552 -19.147 10.872 8.270 394 HG3 PRO 552 HG3 PRO 552 -17.998 9.550 8.547 395 HD2 PRO 552 HD2 PRO 552 -17.951 11.702 6.477 396 HD3 PRO 552 HD3 PRO 552 -16.601 10.934 7.339 397 H ARG 553 HN ARG 553 -19.154 10.306 4.085 398 HA ARG 553 HA ARG 553 -20.959 8.551 2.735 399 HB2 ARG 553 HB2 ARG 553 -21.166 11.065 2.827 400 HB3 ARG 553 HB3 ARG 553 -19.831 11.149 1.686 401 HG2 ARG 553 HG2 ARG 553 -21.185 9.781 0.101 402 HG3 ARG 553 HG3 ARG 553 -22.535 9.908 1.228 403 HD2 ARG 553 HD2 ARG 553 -22.828 11.588 -0.444 404 HD3 ARG 553 HD3 ARG 553 -22.344 12.396 1.046 405 HE ARG 553 HE ARG 553 -20.068 11.792 -0.550 406 HH11 ARG 553 HH12 ARG 553 -22.793 14.018 -0.405 407 HH12 ARG 553 HH11 ARG 553 -21.935 15.300 -1.215 408 HH21 ARG 553 HH22 ARG 553 -18.988 13.447 -1.638 409 HH22 ARG 553 HH21 ARG 553 -19.780 14.961 -1.945 410 H GLU 554 HN GLU 554 -17.693 9.769 2.030 411 HA GLU 554 HA GLU 554 -17.610 8.560 -0.554 412 HB2 GLU 554 HB2 GLU 554 -15.357 9.682 1.114 413 HB3 GLU 554 HB3 GLU 554 -15.254 9.251 -0.587 414 HG2 GLU 554 HG2 GLU 554 -16.782 11.496 0.681 415 HG3 GLU 554 HG3 GLU 554 -15.524 11.576 -0.550 416 H ARG 555 HN ARG 555 -16.234 7.742 2.614 417 HA ARG 555 HA ARG 555 -14.817 5.463 1.765 418 HB2 ARG 555 HB2 ARG 555 -14.745 4.787 4.073 419 HB3 ARG 555 HB3 ARG 555 -14.576 6.535 4.015 420 HG2 ARG 555 HG2 ARG 555 -16.794 6.869 4.753 421 HG3 ARG 555 HG3 ARG 555 -17.198 5.169 4.528 422 HD2 ARG 555 HD2 ARG 555 -16.906 5.462 6.842 423 HD3 ARG 555 HD3 ARG 555 -15.451 4.654 6.270 424 HE ARG 555 HE ARG 555 -14.654 7.187 6.212 425 HH11 ARG 555 HH12 ARG 555 -16.496 5.457 8.631 426 HH12 ARG 555 HH11 ARG 555 -15.860 6.376 9.959 427 HH21 ARG 555 HH22 ARG 555 -13.805 8.393 7.951 428 HH22 ARG 555 HH21 ARG 555 -14.309 8.030 9.577 429 H SER 556 HN SER 556 -18.195 5.971 2.550 430 HA SER 556 HA SER 556 -18.927 3.219 2.635 431 HB2 SER 556 HB2 SER 556 -20.199 5.203 3.636 432 HB3 SER 556 HB3 SER 556 -20.762 5.534 2.001 433 HG SER 556 HG SER 556 -21.511 3.558 3.771 434 H ARG 557 HN ARG 557 -18.847 5.715 0.155 435 HA ARG 557 HA ARG 557 -20.083 4.314 -1.942 436 HB2 ARG 557 HB2 ARG 557 -17.959 6.454 -1.903 437 HB3 ARG 557 HB3 ARG 557 -18.630 5.825 -3.400 438 HG2 ARG 557 HG2 ARG 557 -20.812 6.633 -2.828 439 HG3 ARG 557 HG3 ARG 557 -20.260 7.105 -1.217 440 HD2 ARG 557 HD2 ARG 557 -18.972 8.864 -2.044 441 HD3 ARG 557 HD3 ARG 557 -18.962 8.212 -3.681 442 HE ARG 557 HE ARG 557 -21.597 8.874 -2.853 443 HH11 ARG 557 HH12 ARG 557 -18.597 10.404 -3.791 444 HH12 ARG 557 HH11 ARG 557 -19.378 11.683 -4.676 445 HH21 ARG 557 HH22 ARG 557 -22.631 10.594 -3.933 446 HH22 ARG 557 HH21 ARG 557 -21.669 11.814 -4.724 447 H LEU 558 HN LEU 558 -16.693 4.605 -1.014 448 HA LEU 558 HA LEU 558 -15.553 3.063 -3.035 449 HB2 LEU 558 HB2 LEU 558 -14.461 4.579 -1.257 450 HB3 LEU 558 HB3 LEU 558 -14.513 3.180 -0.212 451 HG LEU 558 HG LEU 558 -12.305 3.605 -1.326 452 HD11 LEU 558 HD11 LEU 558 -12.844 1.413 -0.419 453 HD12 LEU 558 HD12 LEU 558 -13.615 0.958 -1.938 454 HD13 LEU 558 HD13 LEU 558 -11.877 1.266 -1.887 455 HD21 LEU 558 HD21 LEU 558 -13.791 2.736 -3.802 456 HD22 LEU 558 HD22 LEU 558 -13.136 4.343 -3.490 457 HD23 LEU 558 HD23 LEU 558 -12.047 2.969 -3.671 458 H LEU 559 HN LEU 559 -16.570 2.092 0.237 459 HA LEU 559 HA LEU 559 -15.816 -0.645 -0.174 460 HB2 LEU 559 HB2 LEU 559 -17.441 0.635 2.026 461 HB3 LEU 559 HB3 LEU 559 -16.809 -0.999 2.049 462 HG LEU 559 HG LEU 559 -15.114 1.501 1.984 463 HD11 LEU 559 HD11 LEU 559 -15.748 -0.383 4.254 464 HD12 LEU 559 HD12 LEU 559 -14.593 0.949 4.314 465 HD13 LEU 559 HD13 LEU 559 -16.312 1.279 4.096 466 HD21 LEU 559 HD21 LEU 559 -14.380 -1.401 2.349 467 HD22 LEU 559 HD22 LEU 559 -14.052 -0.420 0.921 468 HD23 LEU 559 HD23 LEU 559 -13.270 -0.034 2.452 469 H GLY 560 HN GLY 560 -18.382 1.119 -1.263 470 HA2 GLY 560 HA2 GLY 560 -20.546 -0.680 -0.798 471 HA3 GLY 560 HA3 GLY 560 -20.521 0.642 -1.957 472 H ASP 561 HN ASP 561 -17.976 -0.583 -3.115 473 HA ASP 561 HA ASP 561 -19.121 -2.977 -4.363 474 HB2 ASP 561 HB2 ASP 561 -19.663 -0.898 -5.757 475 HB3 ASP 561 HB3 ASP 561 -17.936 -0.806 -6.091 476 H ALA 562 HN ALA 562 -17.682 -4.528 -4.530 477 HA ALA 562 HA ALA 562 -15.112 -4.316 -3.465 478 HB1 ALA 562 HB1 ALA 562 -16.167 -6.458 -5.298 479 HB2 ALA 562 HB2 ALA 562 -14.777 -6.592 -4.220 480 HB3 ALA 562 HB3 ALA 562 -16.397 -6.397 -3.551 481 H LYS 563 HN LYS 563 -16.217 -3.716 -6.688 482 HA LYS 563 HA LYS 563 -13.815 -4.160 -8.101 483 HB2 LYS 563 HB2 LYS 563 -16.037 -3.845 -9.160 484 HB3 LYS 563 HB3 LYS 563 -16.000 -2.153 -8.688 485 HG2 LYS 563 HG2 LYS 563 -13.933 -1.881 -10.048 486 HG3 LYS 563 HG3 LYS 563 -14.154 -3.539 -10.607 487 HD2 LYS 563 HD2 LYS 563 -16.389 -2.901 -11.478 488 HD3 LYS 563 HD3 LYS 563 -16.057 -1.231 -11.010 489 HE2 LYS 563 HE2 LYS 563 -15.593 -1.505 -13.360 490 HE3 LYS 563 HE3 LYS 563 -14.078 -1.251 -12.494 491 HZ1 LYS 563 HZ1 LYS 563 -13.747 -3.678 -12.528 492 HZ2 LYS 563 HZ2 LYS 563 -13.805 -3.006 -14.083 493 HZ3 LYS 563 HZ3 LYS 563 -15.149 -3.846 -13.470 494 H GLU 564 HN GLU 564 -15.096 -1.394 -6.368 495 HA GLU 564 HA GLU 564 -13.116 0.462 -7.199 496 HB2 GLU 564 HB2 GLU 564 -14.843 0.552 -4.717 497 HB3 GLU 564 HB3 GLU 564 -14.026 1.910 -5.471 498 HG2 GLU 564 HG2 GLU 564 -16.279 0.305 -6.646 499 HG3 GLU 564 HG3 GLU 564 -16.376 1.944 -6.003 500 H LEU 565 HN LEU 565 -13.500 -1.616 -4.355 501 HA LEU 565 HA LEU 565 -11.236 -0.882 -2.940 502 HB2 LEU 565 HB2 LEU 565 -12.696 -3.492 -3.233 503 HB3 LEU 565 HB3 LEU 565 -11.272 -3.355 -2.233 504 HG LEU 565 HG LEU 565 -12.496 -1.481 -1.024 505 HD11 LEU 565 HD11 LEU 565 -14.242 -1.036 -2.579 506 HD12 LEU 565 HD12 LEU 565 -14.818 -2.702 -2.474 507 HD13 LEU 565 HD13 LEU 565 -14.945 -1.634 -1.077 508 HD21 LEU 565 HD21 LEU 565 -13.514 -4.307 -0.839 509 HD22 LEU 565 HD22 LEU 565 -12.104 -3.644 -0.014 510 HD23 LEU 565 HD23 LEU 565 -13.718 -3.066 0.399 511 H ALA 566 HN ALA 566 -11.674 -3.265 -5.504 512 HA ALA 566 HA ALA 566 -9.089 -4.321 -5.528 513 HB1 ALA 566 HB1 ALA 566 -11.023 -4.099 -7.829 514 HB2 ALA 566 HB2 ALA 566 -9.634 -5.183 -7.738 515 HB3 ALA 566 HB3 ALA 566 -10.991 -5.392 -6.631 516 H ASN 567 HN ASN 567 -10.450 -1.536 -7.228 517 HA ASN 567 HA ASN 567 -8.136 -1.206 -8.876 518 HB2 ASN 567 HB2 ASN 567 -10.451 -0.469 -9.500 519 HB3 ASN 567 HB3 ASN 567 -10.296 0.827 -8.317 520 HD21 ASN 567 HD21 ASN 567 -7.663 -0.336 -10.294 521 HD22 ASN 567 HD22 ASN 567 -7.499 1.087 -11.253 522 H ILE 568 HN ILE 568 -9.389 0.489 -6.012 523 HA ILE 568 HA ILE 568 -7.360 2.442 -5.922 524 HB ILE 568 HB ILE 568 -9.243 1.405 -3.822 525 HG12 ILE 568 HG12 ILE 568 -10.212 2.650 -5.711 526 HG13 ILE 568 HG13 ILE 568 -10.385 3.528 -4.198 527 HG21 ILE 568 HG21 ILE 568 -7.278 2.214 -2.656 528 HG22 ILE 568 HG22 ILE 568 -7.323 3.714 -3.582 529 HG23 ILE 568 HG23 ILE 568 -8.617 3.343 -2.445 530 HD11 ILE 568 HD11 ILE 568 -8.374 4.074 -6.374 531 HD12 ILE 568 HD12 ILE 568 -9.788 5.046 -5.966 532 HD13 ILE 568 HD13 ILE 568 -8.445 4.926 -4.829 533 H LEU 569 HN LEU 569 -7.662 -0.654 -4.145 534 HA LEU 569 HA LEU 569 -5.267 -0.171 -2.663 535 HB2 LEU 569 HB2 LEU 569 -5.734 -2.076 -1.526 536 HB3 LEU 569 HB3 LEU 569 -7.324 -1.701 -2.143 537 HG LEU 569 HG LEU 569 -6.616 -3.326 -4.094 538 HD11 LEU 569 HD11 LEU 569 -4.292 -3.490 -3.146 539 HD12 LEU 569 HD12 LEU 569 -4.980 -4.418 -1.814 540 HD13 LEU 569 HD13 LEU 569 -5.090 -5.037 -3.466 541 HD21 LEU 569 HD21 LEU 569 -7.372 -4.316 -1.346 542 HD22 LEU 569 HD22 LEU 569 -8.487 -3.660 -2.544 543 HD23 LEU 569 HD23 LEU 569 -7.631 -5.167 -2.869 544 H LYS 570 HN LYS 570 -5.943 -1.428 -5.767 545 HA LYS 570 HA LYS 570 -3.613 -2.992 -6.171 546 HB2 LYS 570 HB2 LYS 570 -5.781 -2.900 -7.542 547 HB3 LYS 570 HB3 LYS 570 -5.097 -1.476 -8.307 548 HG2 LYS 570 HG2 LYS 570 -3.249 -2.776 -9.157 549 HG3 LYS 570 HG3 LYS 570 -3.836 -4.210 -8.302 550 HD2 LYS 570 HD2 LYS 570 -5.950 -4.038 -9.595 551 HD3 LYS 570 HD3 LYS 570 -5.237 -2.719 -10.519 552 HE2 LYS 570 HE2 LYS 570 -3.472 -4.225 -11.295 553 HE3 LYS 570 HE3 LYS 570 -4.187 -5.539 -10.361 554 HZ1 LYS 570 HZ1 LYS 570 -4.873 -5.720 -12.633 555 HZ2 LYS 570 HZ2 LYS 570 -5.417 -4.117 -12.659 556 HZ3 LYS 570 HZ3 LYS 570 -6.221 -5.275 -11.703 557 H TYR 571 HN TYR 571 -4.236 0.391 -6.151 558 HA TYR 571 HA TYR 571 -1.887 1.199 -7.581 559 HB2 TYR 571 HB2 TYR 571 -3.974 2.570 -7.386 560 HB3 TYR 571 HB3 TYR 571 -3.620 2.796 -5.677 561 HD1 TYR 571 HD2 TYR 571 -1.392 2.911 -8.655 562 HD2 TYR 571 HD1 TYR 571 -3.108 5.041 -5.402 563 HE1 TYR 571 HE2 TYR 571 -0.032 4.866 -9.232 564 HE2 TYR 571 HE1 TYR 571 -1.753 7.011 -5.963 565 HH TYR 571 HH TYR 571 -0.030 7.231 -8.946 566 H HIS 572 HN HIS 572 -2.533 0.087 -4.432 567 HA HIS 572 HA HIS 572 -0.349 1.539 -3.174 568 HB2 HIS 572 HB2 HIS 572 -2.382 -0.437 -2.135 569 HB3 HIS 572 HB3 HIS 572 -1.073 0.198 -1.144 570 HD1 HIS 572 HD1 HIS 572 -4.155 1.434 -3.023 571 HD2 HIS 572 HD2 HIS 572 -1.546 2.598 -0.004 572 HE1 HIS 572 HE1 HIS 572 -5.140 3.522 -2.000 573 H ILE 573 HN ILE 573 -0.794 -1.312 -4.893 574 HA ILE 573 HA ILE 573 1.527 -2.605 -3.644 575 HB ILE 573 HB ILE 573 -0.376 -3.775 -5.681 576 HG12 ILE 573 HG12 ILE 573 -0.340 -4.204 -2.681 577 HG13 ILE 573 HG13 ILE 573 -1.495 -3.177 -3.527 578 HG21 ILE 573 HG21 ILE 573 1.835 -4.826 -5.605 579 HG22 ILE 573 HG22 ILE 573 1.656 -5.085 -3.870 580 HG23 ILE 573 HG23 ILE 573 0.586 -5.914 -5.000 581 HD11 ILE 573 HD11 ILE 573 -2.425 -5.363 -2.974 582 HD12 ILE 573 HD12 ILE 573 -2.354 -5.103 -4.718 583 HD13 ILE 573 HD13 ILE 573 -1.165 -6.141 -3.933 584 H GLY 574 HN GLY 574 3.397 -2.096 -4.561 585 HA2 GLY 574 HA2 GLY 574 3.492 -1.548 -7.443 586 HA3 GLY 574 HA3 GLY 574 4.752 -1.160 -6.278 587 H ASP 575 HN ASP 575 5.077 -2.543 -8.788 588 HA ASP 575 HA ASP 575 5.493 -5.340 -8.014 589 HB2 ASP 575 HB2 ASP 575 5.788 -5.785 -10.394 590 HB3 ASP 575 HB3 ASP 575 4.291 -4.904 -10.118 591 H GLU 576 HN GLU 576 7.216 -2.910 -7.316 592 HA GLU 576 HA GLU 576 9.768 -4.122 -8.030 593 HB2 GLU 576 HB2 GLU 576 9.224 -1.153 -8.255 594 HB3 GLU 576 HB3 GLU 576 10.738 -1.968 -8.603 595 HG2 GLU 576 HG2 GLU 576 9.816 -3.039 -10.515 596 HG3 GLU 576 HG3 GLU 576 8.195 -2.479 -10.113 597 H ILE 577 HN ILE 577 10.925 -4.426 -6.231 598 HA ILE 577 HA ILE 577 10.053 -3.193 -3.775 599 HB ILE 577 HB ILE 577 12.409 -5.038 -4.229 600 HG12 ILE 577 HG12 ILE 577 9.624 -5.620 -3.203 601 HG13 ILE 577 HG13 ILE 577 10.246 -6.072 -4.786 602 HG21 ILE 577 HG21 ILE 577 11.054 -4.147 -1.680 603 HG22 ILE 577 HG22 ILE 577 12.297 -5.394 -1.788 604 HG23 ILE 577 HG23 ILE 577 12.683 -3.724 -2.204 605 HD11 ILE 577 HD11 ILE 577 11.289 -7.055 -2.139 606 HD12 ILE 577 HD12 ILE 577 10.257 -7.957 -3.249 607 HD13 ILE 577 HD13 ILE 577 11.898 -7.519 -3.727 608 H LEU 578 HN LEU 578 10.521 -1.116 -3.652 609 HA LEU 578 HA LEU 578 13.345 -0.337 -3.899 610 HB2 LEU 578 HB2 LEU 578 10.888 1.359 -4.384 611 HB3 LEU 578 HB3 LEU 578 12.539 1.951 -4.407 612 HG LEU 578 HG LEU 578 11.383 -0.086 -6.317 613 HD11 LEU 578 HD11 LEU 578 12.100 2.817 -6.710 614 HD12 LEU 578 HD12 LEU 578 11.610 1.699 -7.985 615 HD13 LEU 578 HD13 LEU 578 10.476 2.129 -6.706 616 HD21 LEU 578 HD21 LEU 578 13.781 -0.408 -5.866 617 HD22 LEU 578 HD22 LEU 578 13.480 0.128 -7.519 618 HD23 LEU 578 HD23 LEU 578 14.078 1.271 -6.316 619 H VAL 579 HN VAL 579 14.053 -0.443 -1.881 620 HA VAL 579 HA VAL 579 12.446 0.572 0.318 621 HB VAL 579 HB VAL 579 14.276 -0.242 1.766 622 HG11 VAL 579 HG11 VAL 579 12.441 -1.733 1.223 623 HG12 VAL 579 HG12 VAL 579 13.281 -2.258 -0.239 624 HG13 VAL 579 HG13 VAL 579 13.952 -2.636 1.348 625 HG21 VAL 579 HG21 VAL 579 16.160 0.082 0.247 626 HG22 VAL 579 HG22 VAL 579 16.090 -1.590 0.806 627 HG23 VAL 579 HG23 VAL 579 15.531 -1.177 -0.815 628 H SER 580 HN SER 580 13.942 1.775 2.032 629 HA SER 580 HA SER 580 14.342 4.342 1.106 630 HB2 SER 580 HB2 SER 580 15.769 3.110 3.472 631 HB3 SER 580 HB3 SER 580 15.361 4.810 3.242 632 HG SER 580 HG SER 580 13.910 3.572 4.638 633 H GLY 581 HN GLY 581 16.671 1.704 1.372 634 HA2 GLY 581 HA2 GLY 581 18.881 3.404 0.573 635 HA3 GLY 581 HA3 GLY 581 18.960 1.692 0.956 636 H GLY 582 HN GLY 582 16.551 2.753 -1.290 637 HA2 GLY 582 HA2 GLY 582 18.292 2.054 -3.559 638 HA3 GLY 582 HA3 GLY 582 16.750 1.239 -3.364 639 H ILE 583 HN ILE 583 16.497 4.391 -2.278 640 HA ILE 583 HA ILE 583 14.888 5.104 -4.571 641 HB ILE 583 HB ILE 583 15.471 6.780 -2.126 642 HG12 ILE 583 HG12 ILE 583 13.203 4.836 -2.610 643 HG13 ILE 583 HG13 ILE 583 14.537 4.589 -1.491 644 HG21 ILE 583 HG21 ILE 583 14.548 8.009 -4.024 645 HG22 ILE 583 HG22 ILE 583 13.207 6.868 -4.117 646 HG23 ILE 583 HG23 ILE 583 13.382 7.909 -2.705 647 HD11 ILE 583 HD11 ILE 583 12.532 5.281 -0.321 648 HD12 ILE 583 HD12 ILE 583 13.792 6.505 -0.179 649 HD13 ILE 583 HD13 ILE 583 12.452 6.746 -1.298 650 H GLY 584 HN GLY 584 17.755 6.388 -2.926 651 HA2 GLY 584 HA2 GLY 584 19.539 7.567 -3.815 652 HA3 GLY 584 HA3 GLY 584 18.776 7.463 -5.397 653 H ALA 585 HN ALA 585 16.731 8.831 -5.591 654 HA ALA 585 HA ALA 585 16.842 11.290 -4.018 655 HB1 ALA 585 HB1 ALA 585 18.315 11.777 -5.890 656 HB2 ALA 585 HB2 ALA 585 17.070 11.265 -7.030 657 HB3 ALA 585 HB3 ALA 585 16.821 12.705 -6.042 658 H LEU 586 HN LEU 586 15.295 10.281 -7.061 659 HA LEU 586 HA LEU 586 12.746 9.991 -5.725 660 HB2 LEU 586 HB2 LEU 586 13.131 12.474 -6.494 661 HB3 LEU 586 HB3 LEU 586 12.792 11.833 -8.090 662 HG LEU 586 HG LEU 586 10.886 11.395 -5.815 663 HD11 LEU 586 HD11 LEU 586 10.967 13.759 -7.691 664 HD12 LEU 586 HD12 LEU 586 9.649 13.379 -6.585 665 HD13 LEU 586 HD13 LEU 586 11.239 13.800 -5.950 666 HD21 LEU 586 HD21 LEU 586 10.496 11.518 -8.797 667 HD22 LEU 586 HD22 LEU 586 10.587 10.048 -7.825 668 HD23 LEU 586 HD23 LEU 586 9.255 11.178 -7.590 669 H VAL 587 HN VAL 587 11.569 8.442 -6.684 670 HA VAL 587 HA VAL 587 12.253 7.612 -9.397 671 HB VAL 587 HB VAL 587 13.819 6.363 -8.022 672 HG11 VAL 587 HG11 VAL 587 12.562 6.387 -5.930 673 HG12 VAL 587 HG12 VAL 587 11.405 5.243 -6.612 674 HG13 VAL 587 HG13 VAL 587 13.082 4.757 -6.357 675 HG21 VAL 587 HG21 VAL 587 12.935 5.287 -10.016 676 HG22 VAL 587 HG22 VAL 587 13.246 4.099 -8.751 677 HG23 VAL 587 HG23 VAL 587 11.595 4.624 -9.082 678 H ARG 588 HN ARG 588 10.570 6.751 -10.505 679 HA ARG 588 HA ARG 588 8.004 6.685 -9.137 680 HB2 ARG 588 HB2 ARG 588 7.087 6.349 -11.444 681 HB3 ARG 588 HB3 ARG 588 8.012 7.828 -11.236 682 HG2 ARG 588 HG2 ARG 588 9.938 6.782 -12.306 683 HG3 ARG 588 HG3 ARG 588 9.016 5.291 -12.512 684 HD2 ARG 588 HD2 ARG 588 7.402 6.496 -13.907 685 HD3 ARG 588 HD3 ARG 588 8.336 7.977 -13.705 686 HE ARG 588 HE ARG 588 10.091 6.093 -14.707 687 HH11 ARG 588 HH12 ARG 588 7.117 7.616 -15.785 688 HH12 ARG 588 HH11 ARG 588 7.504 7.449 -17.464 689 HH21 ARG 588 HH22 ARG 588 10.612 5.919 -16.891 690 HH22 ARG 588 HH21 ARG 588 9.499 6.495 -18.106 691 H LEU 589 HN LEU 589 7.503 4.905 -8.092 692 HA LEU 589 HA LEU 589 8.485 2.300 -8.982 693 HB2 LEU 589 HB2 LEU 589 8.447 3.255 -6.554 694 HB3 LEU 589 HB3 LEU 589 6.751 2.832 -6.582 695 HG LEU 589 HG LEU 589 9.025 0.880 -6.958 696 HD11 LEU 589 HD11 LEU 589 8.973 1.813 -4.708 697 HD12 LEU 589 HD12 LEU 589 7.264 1.400 -4.570 698 HD13 LEU 589 HD13 LEU 589 8.474 0.121 -4.708 699 HD21 LEU 589 HD21 LEU 589 7.282 -0.828 -6.597 700 HD22 LEU 589 HD22 LEU 589 6.056 0.440 -6.628 701 HD23 LEU 589 HD23 LEU 589 7.016 0.103 -8.070 702 H LYS 590 HN LYS 590 7.245 1.161 -10.364 703 HA LYS 590 HA LYS 590 4.619 2.103 -10.998 704 HB2 LYS 590 HB2 LYS 590 6.087 -0.365 -11.926 705 HB3 LYS 590 HB3 LYS 590 4.581 0.228 -12.610 706 HG2 LYS 590 HG2 LYS 590 5.674 2.253 -13.354 707 HG3 LYS 590 HG3 LYS 590 7.185 1.739 -12.597 708 HD2 LYS 590 HD2 LYS 590 5.793 0.108 -14.710 709 HD3 LYS 590 HD3 LYS 590 6.960 1.364 -15.113 710 HE2 LYS 590 HE2 LYS 590 8.026 -0.821 -15.081 711 HE3 LYS 590 HE3 LYS 590 8.669 0.199 -13.799 712 HZ1 LYS 590 HZ1 LYS 590 6.507 -1.765 -13.304 713 HZ2 LYS 590 HZ2 LYS 590 7.527 -1.012 -12.174 714 HZ3 LYS 590 HZ3 LYS 590 8.141 -2.193 -13.221 715 H SER 591 HN SER 591 2.666 1.037 -10.829 716 HA SER 591 HA SER 591 2.540 -0.921 -8.641 717 HB2 SER 591 HB2 SER 591 0.246 -0.049 -8.263 718 HB3 SER 591 HB3 SER 591 1.488 1.192 -8.085 719 HG SER 591 HG SER 591 1.015 1.803 -10.285 720 H LEU 592 HN LEU 592 0.857 -2.543 -8.763 721 HA LEU 592 HA LEU 592 0.688 -3.835 -11.231 722 HB2 LEU 592 HB2 LEU 592 -0.773 -4.143 -8.638 723 HB3 LEU 592 HB3 LEU 592 -1.207 -5.117 -10.025 724 HG LEU 592 HG LEU 592 1.159 -5.916 -10.111 725 HD11 LEU 592 HD11 LEU 592 2.529 -5.681 -8.097 726 HD12 LEU 592 HD12 LEU 592 2.254 -4.140 -8.909 727 HD13 LEU 592 HD13 LEU 592 1.352 -4.540 -7.447 728 HD21 LEU 592 HD21 LEU 592 -0.340 -6.471 -7.561 729 HD22 LEU 592 HD22 LEU 592 -0.631 -7.248 -9.118 730 HD23 LEU 592 HD23 LEU 592 0.903 -7.493 -8.282 731 H GLN 593 HN GLN 593 -1.254 -1.293 -9.926 732 HA GLN 593 HA GLN 593 -3.565 -1.751 -11.515 733 HB2 GLN 593 HB2 GLN 593 -3.707 -0.273 -9.597 734 HB3 GLN 593 HB3 GLN 593 -2.504 0.806 -10.296 735 HG2 GLN 593 HG2 GLN 593 -4.083 1.167 -12.209 736 HG3 GLN 593 HG3 GLN 593 -5.294 0.285 -11.284 737 HE21 GLN 593 HE21 GLN 593 -2.997 2.299 -9.672 738 HE22 GLN 593 HE22 GLN 593 -4.081 3.582 -9.283 739 H GLY 594 HN GLY 594 -0.459 -0.288 -12.133 740 HA2 GLY 594 HA2 GLY 594 0.221 -0.214 -14.481 741 HA3 GLY 594 HA3 GLY 594 -1.391 0.380 -14.858 742 H ASP 595 HN ASP 595 -0.748 1.930 -12.094 743 HA ASP 595 HA ASP 595 0.469 4.200 -13.503 744 HB2 ASP 595 HB2 ASP 595 -1.759 4.444 -12.251 745 HB3 ASP 595 HB3 ASP 595 -0.807 4.318 -10.773 746 H LYS 596 HN LYS 596 1.499 5.580 -11.266 747 HA LYS 596 HA LYS 596 3.622 3.760 -10.378 748 HB2 LYS 596 HB2 LYS 596 5.371 5.231 -11.101 749 HB3 LYS 596 HB3 LYS 596 4.334 4.928 -12.484 750 HG2 LYS 596 HG2 LYS 596 4.073 7.388 -10.770 751 HG3 LYS 596 HG3 LYS 596 5.138 7.309 -12.173 752 HD2 LYS 596 HD2 LYS 596 3.390 7.222 -13.661 753 HD3 LYS 596 HD3 LYS 596 2.282 6.511 -12.488 754 HE2 LYS 596 HE2 LYS 596 3.300 9.340 -12.316 755 HE3 LYS 596 HE3 LYS 596 1.796 8.897 -13.119 756 HZ1 LYS 596 HZ1 LYS 596 2.422 8.373 -10.264 757 HZ2 LYS 596 HZ2 LYS 596 0.961 8.017 -11.045 758 HZ3 LYS 596 HZ3 LYS 596 1.440 9.635 -10.832 759 H LEU 597 HN LEU 597 4.119 4.028 -8.283 760 HA LEU 597 HA LEU 597 3.217 6.356 -6.831 761 HB2 LEU 597 HB2 LEU 597 4.956 4.028 -6.026 762 HB3 LEU 597 HB3 LEU 597 4.450 5.302 -4.938 763 HG LEU 597 HG LEU 597 3.023 3.557 -4.470 764 HD11 LEU 597 HD11 LEU 597 1.547 5.247 -6.457 765 HD12 LEU 597 HD12 LEU 597 0.812 4.245 -5.204 766 HD13 LEU 597 HD13 LEU 597 1.811 5.625 -4.754 767 HD21 LEU 597 HD21 LEU 597 3.602 2.110 -6.288 768 HD22 LEU 597 HD22 LEU 597 1.851 2.220 -6.127 769 HD23 LEU 597 HD23 LEU 597 2.677 3.109 -7.406 770 H GLU 598 HN GLU 598 4.327 8.217 -6.947 771 HA GLU 598 HA GLU 598 7.102 8.124 -7.756 772 HB2 GLU 598 HB2 GLU 598 5.253 10.437 -7.197 773 HB3 GLU 598 HB3 GLU 598 6.942 10.628 -7.647 774 HG2 GLU 598 HG2 GLU 598 6.465 9.321 -9.712 775 HG3 GLU 598 HG3 GLU 598 4.759 9.378 -9.283 776 H VAL 599 HN VAL 599 8.221 7.238 -6.167 777 HA VAL 599 HA VAL 599 7.939 8.233 -3.438 778 HB VAL 599 HB VAL 599 9.607 5.949 -4.511 779 HG11 VAL 599 HG11 VAL 599 10.513 6.810 -2.438 780 HG12 VAL 599 HG12 VAL 599 8.925 6.720 -1.676 781 HG13 VAL 599 HG13 VAL 599 9.757 5.240 -2.160 782 HG21 VAL 599 HG21 VAL 599 6.932 5.896 -3.116 783 HG22 VAL 599 HG22 VAL 599 7.236 5.507 -4.808 784 HG23 VAL 599 HG23 VAL 599 7.900 4.484 -3.537 785 H SER 600 HN SER 600 9.392 9.497 -2.484 786 HA SER 600 HA SER 600 11.969 9.879 -3.829 787 HB2 SER 600 HB2 SER 600 10.454 11.741 -4.414 788 HB3 SER 600 HB3 SER 600 10.257 12.096 -2.699 789 HG SER 600 HG SER 600 12.791 12.052 -3.964 790 H LEU 601 HN LEU 601 13.498 11.036 -2.409 791 HA LEU 601 HA LEU 601 13.150 10.359 0.415 792 HB2 LEU 601 HB2 LEU 601 14.304 8.472 -0.732 793 HB3 LEU 601 HB3 LEU 601 15.567 9.585 -1.222 794 HG LEU 601 HG LEU 601 16.012 10.006 1.223 795 HD11 LEU 601 HD11 LEU 601 13.854 9.241 2.071 796 HD12 LEU 601 HD12 LEU 601 14.221 7.602 1.535 797 HD13 LEU 601 HD13 LEU 601 15.185 8.349 2.808 798 HD21 LEU 601 HD21 LEU 601 17.258 7.918 1.515 799 HD22 LEU 601 HD22 LEU 601 16.346 7.189 0.193 800 HD23 LEU 601 HD23 LEU 601 17.427 8.549 -0.124 801 H LYS 602 HN LYS 602 13.345 12.286 1.337 802 HA LYS 602 HA LYS 602 15.671 13.921 0.636 803 HB2 LYS 602 HB2 LYS 602 14.171 15.948 0.902 804 HB3 LYS 602 HB3 LYS 602 13.935 14.998 -0.556 805 HG2 LYS 602 HG2 LYS 602 12.048 13.838 0.704 806 HG3 LYS 602 HG3 LYS 602 12.187 15.150 1.875 807 HD2 LYS 602 HD2 LYS 602 11.663 15.475 -1.078 808 HD3 LYS 602 HD3 LYS 602 10.454 15.600 0.199 809 HE2 LYS 602 HE2 LYS 602 12.888 17.366 -0.062 810 HE3 LYS 602 HE3 LYS 602 11.268 17.796 -0.612 811 HZ1 LYS 602 HZ1 LYS 602 10.494 17.584 1.681 812 HZ2 LYS 602 HZ2 LYS 602 11.709 18.751 1.543 813 HZ3 LYS 602 HZ3 LYS 602 12.067 17.225 2.200 814 H ASN 603 HN ASN 603 16.857 14.278 2.370 815 HA ASN 603 HA ASN 603 17.538 14.383 4.541 816 HB2 ASN 603 HB2 ASN 603 15.842 16.284 4.561 817 HB3 ASN 603 HB3 ASN 603 14.691 15.142 5.248 818 HD21 ASN 603 HD21 ASN 603 18.124 15.228 5.967 819 HD22 ASN 603 HD22 ASN 603 17.958 15.720 7.613 820 H ASN 604 HN ASN 604 16.465 11.970 3.373 821 HA ASN 604 HA ASN 604 16.045 9.814 3.897 822 HB2 ASN 604 HB2 ASN 604 16.871 10.890 6.529 823 HB3 ASN 604 HB3 ASN 604 15.978 9.371 6.548 824 HD21 ASN 604 HD21 ASN 604 17.783 8.236 7.258 825 HD22 ASN 604 HD22 ASN 604 19.098 7.850 6.197 826 H VAL 605 HN VAL 605 13.997 12.216 4.372 827 HA VAL 605 HA VAL 605 11.850 10.691 5.590 828 HB VAL 605 HB VAL 605 11.719 13.392 4.228 829 HG11 VAL 605 HG11 VAL 605 9.619 13.660 5.436 830 HG12 VAL 605 HG12 VAL 605 9.564 12.252 4.377 831 HG13 VAL 605 HG13 VAL 605 9.792 12.040 6.113 832 HG21 VAL 605 HG21 VAL 605 13.242 13.480 6.121 833 HG22 VAL 605 HG22 VAL 605 11.745 14.336 6.493 834 HG23 VAL 605 HG23 VAL 605 12.027 12.726 7.155 835 H VAL 606 HN VAL 606 11.014 9.129 4.402 836 HA VAL 606 HA VAL 606 11.029 9.262 1.520 837 HB VAL 606 HB VAL 606 11.622 7.146 2.515 838 HG11 VAL 606 HG11 VAL 606 8.891 7.160 3.788 839 HG12 VAL 606 HG12 VAL 606 10.035 5.819 3.818 840 HG13 VAL 606 HG13 VAL 606 10.434 7.335 4.622 841 HG21 VAL 606 HG21 VAL 606 8.919 7.024 1.192 842 HG22 VAL 606 HG22 VAL 606 10.489 7.013 0.390 843 HG23 VAL 606 HG23 VAL 606 10.008 5.652 1.403 844 H SER 607 HN SER 607 9.338 9.603 0.213 845 HA SER 607 HA SER 607 6.664 9.781 1.376 846 HB2 SER 607 HB2 SER 607 6.428 11.954 -0.048 847 HB3 SER 607 HB3 SER 607 7.222 12.040 1.525 848 HG SER 607 HG SER 607 9.235 11.794 0.355 849 H VAL 608 HN VAL 608 5.007 9.296 -0.016 850 HA VAL 608 HA VAL 608 5.789 8.542 -2.756 851 HB VAL 608 HB VAL 608 5.443 6.482 -1.582 852 HG11 VAL 608 HG11 VAL 608 2.810 7.622 -0.638 853 HG12 VAL 608 HG12 VAL 608 3.343 5.954 -0.406 854 HG13 VAL 608 HG13 VAL 608 4.232 7.277 0.350 855 HG21 VAL 608 HG21 VAL 608 4.519 6.566 -3.838 856 HG22 VAL 608 HG22 VAL 608 3.559 5.501 -2.811 857 HG23 VAL 608 HG23 VAL 608 2.972 7.121 -3.199 858 H ASN 609 HN ASN 609 4.896 9.894 -4.126 859 HA ASN 609 HA ASN 609 3.444 11.337 -5.132 860 HB2 ASN 609 HB2 ASN 609 1.397 9.603 -3.742 861 HB3 ASN 609 HB3 ASN 609 1.015 10.805 -4.966 862 HD21 ASN 609 HD21 ASN 609 0.492 8.007 -4.995 863 HD22 ASN 609 HD22 ASN 609 1.284 7.367 -6.390 864 H LYS 610 HN LYS 610 4.573 12.299 -2.839 865 HA LYS 610 HA LYS 610 4.451 14.232 -1.632 866 HB2 LYS 610 HB2 LYS 610 2.723 15.052 -3.195 867 HB3 LYS 610 HB3 LYS 610 1.490 14.249 -2.238 868 HG2 LYS 610 HG2 LYS 610 2.243 15.683 -0.296 869 HG3 LYS 610 HG3 LYS 610 3.191 16.598 -1.471 870 HD2 LYS 610 HD2 LYS 610 1.115 17.006 -2.762 871 HD3 LYS 610 HD3 LYS 610 0.201 16.194 -1.490 872 HE2 LYS 610 HE2 LYS 610 0.043 18.546 -1.126 873 HE3 LYS 610 HE3 LYS 610 1.101 17.877 0.116 874 HZ1 LYS 610 HZ1 LYS 610 3.009 18.573 -1.291 875 HZ2 LYS 610 HZ2 LYS 610 2.077 19.863 -0.714 876 HZ3 LYS 610 HZ3 LYS 610 1.915 19.353 -2.325 877 H GLU 611 HN GLU 611 2.342 11.536 -1.048 878 HA GLU 611 HA GLU 611 1.653 12.330 1.631 879 HB2 GLU 611 HB2 GLU 611 1.377 9.610 0.347 880 HB3 GLU 611 HB3 GLU 611 0.559 10.169 1.800 881 HG2 GLU 611 HG2 GLU 611 0.169 11.237 -0.986 882 HG3 GLU 611 HG3 GLU 611 -0.933 10.173 -0.116 883 HA PRO 612 HA PRO 612 5.391 10.820 3.437 884 HB2 PRO 612 HB2 PRO 612 4.234 11.048 6.060 885 HB3 PRO 612 HB3 PRO 612 5.358 12.147 5.260 886 HG2 PRO 612 HG2 PRO 612 2.742 12.761 5.850 887 HG3 PRO 612 HG3 PRO 612 3.690 13.539 4.570 888 HD2 PRO 612 HD2 PRO 612 1.645 11.362 4.366 889 HD3 PRO 612 HD3 PRO 612 1.937 12.744 3.285 890 H VAL 613 HN VAL 613 6.212 8.894 3.997 891 HA VAL 613 HA VAL 613 4.418 6.709 4.632 892 HB VAL 613 HB VAL 613 7.428 6.756 4.297 893 HG11 VAL 613 HG11 VAL 613 6.787 4.958 5.795 894 HG12 VAL 613 HG12 VAL 613 5.562 4.416 4.649 895 HG13 VAL 613 HG13 VAL 613 7.272 4.305 4.231 896 HG21 VAL 613 HG21 VAL 613 5.225 5.776 2.495 897 HG22 VAL 613 HG22 VAL 613 6.251 7.186 2.228 898 HG23 VAL 613 HG23 VAL 613 6.951 5.568 2.199 899 H ALA 614 HN ALA 614 3.984 6.021 6.603 900 HA ALA 614 HA ALA 614 4.928 7.536 8.843 901 HB1 ALA 614 HB1 ALA 614 2.596 6.852 8.676 902 HB2 ALA 614 HB2 ALA 614 3.082 5.157 8.731 903 HB3 ALA 614 HB3 ALA 614 3.342 6.194 10.133 904 H GLU 615 HN GLU 615 5.587 4.384 7.484 905 HA GLU 615 HA GLU 615 7.837 4.020 9.215 906 HB2 GLU 615 HB2 GLU 615 5.902 3.343 10.665 907 HB3 GLU 615 HB3 GLU 615 5.561 2.059 9.513 908 HG2 GLU 615 HG2 GLU 615 7.577 0.945 10.005 909 HG3 GLU 615 HG3 GLU 615 8.206 2.327 10.903 910 HA PRO 616 HA PRO 616 8.278 1.862 5.257 911 HB2 PRO 616 HB2 PRO 616 10.618 2.904 4.568 912 HB3 PRO 616 HB3 PRO 616 9.153 3.894 4.526 913 HG2 PRO 616 HG2 PRO 616 11.329 3.814 6.583 914 HG3 PRO 616 HG3 PRO 616 10.477 5.215 5.914 915 HD2 PRO 616 HD2 PRO 616 9.885 3.967 8.327 916 HD3 PRO 616 HD3 PRO 616 8.789 5.033 7.426 917 H ASP 617 HN ASP 617 9.660 0.186 4.542 918 HA ASP 617 HA ASP 617 11.530 -1.115 4.386 919 HB2 ASP 617 HB2 ASP 617 12.833 0.850 5.239 920 HB3 ASP 617 HB3 ASP 617 12.562 0.263 6.875 921 H ILE 618 HN ILE 618 9.164 -1.773 5.554 922 HA ILE 618 HA ILE 618 9.773 -3.575 7.737 923 HB ILE 618 HB ILE 618 7.313 -2.731 6.256 924 HG12 ILE 618 HG12 ILE 618 8.077 -2.842 9.187 925 HG13 ILE 618 HG13 ILE 618 8.072 -1.409 8.163 926 HG21 ILE 618 HG21 ILE 618 7.090 -5.160 6.388 927 HG22 ILE 618 HG22 ILE 618 7.511 -5.137 8.100 928 HG23 ILE 618 HG23 ILE 618 5.999 -4.411 7.555 929 HD11 ILE 618 HD11 ILE 618 6.132 -1.484 9.623 930 HD12 ILE 618 HD12 ILE 618 5.657 -1.584 7.928 931 HD13 ILE 618 HD13 ILE 618 5.658 -3.035 8.929 932 H MET 619 HN MET 619 10.794 -5.386 7.240 933 HA MET 619 HA MET 619 11.040 -6.310 4.561 934 HB2 MET 619 HB2 MET 619 11.962 -7.581 7.137 935 HB3 MET 619 HB3 MET 619 12.469 -8.059 5.523 936 HG2 MET 619 HG2 MET 619 12.905 -5.267 6.507 937 HG3 MET 619 HG3 MET 619 14.011 -6.565 6.943 938 HE1 MET 619 HE1 MET 619 12.228 -5.651 3.298 939 HE2 MET 619 HE2 MET 619 12.579 -4.256 4.321 940 HE3 MET 619 HE3 MET 619 13.525 -4.544 2.860 941 H ALA 620 HN ALA 620 9.983 -7.839 3.505 942 HA ALA 620 HA ALA 620 8.572 -9.921 5.027 943 HB1 ALA 620 HB1 ALA 620 7.546 -8.585 2.517 944 HB2 ALA 620 HB2 ALA 620 6.770 -9.921 3.369 945 HB3 ALA 620 HB3 ALA 620 6.908 -8.340 4.145 946 H THR 621 HN THR 621 8.171 -11.901 3.514 947 HA THR 621 HA THR 621 10.786 -12.589 2.589 948 HB THR 621 HB THR 621 9.008 -14.155 3.703 949 HG1 THR 621 HG1 THR 621 10.881 -14.750 1.679 950 HG21 THR 621 HG21 THR 621 8.361 -14.593 0.776 951 HG22 THR 621 HG22 THR 621 7.278 -13.850 1.956 952 HG23 THR 621 HG23 THR 621 7.755 -15.538 2.141 953 H ASN 622 HN ASN 622 7.809 -11.659 1.001 954 HA ASN 622 HA ASN 622 9.126 -12.090 -1.594 955 HB2 ASN 622 HB2 ASN 622 6.898 -12.419 -2.570 956 HB3 ASN 622 HB3 ASN 622 7.228 -13.592 -1.303 957 HD21 ASN 622 HD21 ASN 622 4.678 -12.811 -2.348 958 HD22 ASN 622 HD22 ASN 622 3.771 -12.144 -1.030 959 H GLY 623 HN GLY 623 9.080 -9.692 0.223 960 HA2 GLY 623 HA2 GLY 623 9.197 -7.709 -1.618 961 HA3 GLY 623 HA3 GLY 623 7.493 -7.755 -1.188 962 H VAL 624 HN VAL 624 7.829 -5.584 -0.463 963 HA VAL 624 HA VAL 624 8.791 -5.534 2.310 964 HB VAL 624 HB VAL 624 10.462 -4.473 0.705 965 HG11 VAL 624 HG11 VAL 624 8.302 -2.394 0.515 966 HG12 VAL 624 HG12 VAL 624 9.964 -2.201 -0.052 967 HG13 VAL 624 HG13 VAL 624 8.913 -3.404 -0.801 968 HG21 VAL 624 HG21 VAL 624 9.291 -2.737 2.871 969 HG22 VAL 624 HG22 VAL 624 10.501 -4.002 3.085 970 HG23 VAL 624 HG23 VAL 624 10.896 -2.552 2.160 971 H VAL 625 HN VAL 625 7.803 -3.840 3.572 972 HA VAL 625 HA VAL 625 5.212 -2.942 2.494 973 HB VAL 625 HB VAL 625 5.771 -3.802 5.345 974 HG11 VAL 625 HG11 VAL 625 3.379 -3.530 5.702 975 HG12 VAL 625 HG12 VAL 625 4.123 -2.010 5.204 976 HG13 VAL 625 HG13 VAL 625 3.187 -2.954 4.046 977 HG21 VAL 625 HG21 VAL 625 5.702 -5.713 3.849 978 HG22 VAL 625 HG22 VAL 625 4.268 -5.677 4.875 979 HG23 VAL 625 HG23 VAL 625 4.160 -5.165 3.192 980 H HIS 626 HN HIS 626 4.787 -0.819 2.706 981 HA HIS 626 HA HIS 626 6.424 0.729 4.590 982 HB2 HIS 626 HB2 HIS 626 5.349 1.575 1.888 983 HB3 HIS 626 HB3 HIS 626 6.125 2.651 3.035 984 HD2 HIS 626 HD2 HIS 626 7.032 0.724 0.020 985 HE1 HIS 626 HE1 HIS 626 10.601 0.995 2.275 986 HE2 HIS 626 HE2 HIS 626 9.624 0.647 -0.038 987 H VAL 627 HN VAL 627 5.203 1.295 6.252 988 HA VAL 627 HA VAL 627 2.362 1.293 6.228 989 HB VAL 627 HB VAL 627 4.166 2.648 8.236 990 HG11 VAL 627 HG11 VAL 627 2.311 2.221 9.797 991 HG12 VAL 627 HG12 VAL 627 1.853 3.290 8.470 992 HG13 VAL 627 HG13 VAL 627 1.349 1.601 8.454 993 HG21 VAL 627 HG21 VAL 627 4.873 0.358 7.975 994 HG22 VAL 627 HG22 VAL 627 4.033 0.546 9.513 995 HG23 VAL 627 HG23 VAL 627 3.212 -0.210 8.145 996 H ILE 628 HN ILE 628 0.970 2.856 5.640 997 HA ILE 628 HA ILE 628 1.952 5.636 5.625 998 HB ILE 628 HB ILE 628 0.236 6.009 3.744 999 HG12 ILE 628 HG12 ILE 628 0.720 3.041 3.399 1000 HG13 ILE 628 HG13 ILE 628 -0.803 3.771 3.901 1001 HG21 ILE 628 HG21 ILE 628 2.815 4.542 3.250 1002 HG22 ILE 628 HG22 ILE 628 1.913 5.440 2.027 1003 HG23 ILE 628 HG23 ILE 628 2.594 6.283 3.421 1004 HD11 ILE 628 HD11 ILE 628 -0.968 4.905 1.747 1005 HD12 ILE 628 HD12 ILE 628 0.560 4.174 1.248 1006 HD13 ILE 628 HD13 ILE 628 -0.844 3.155 1.556 1007 H THR 629 HN THR 629 0.516 7.227 6.204 1008 HA THR 629 HA THR 629 -1.734 6.273 7.811 1009 HB THR 629 HB THR 629 -1.739 8.647 8.675 1010 HG1 THR 629 HG1 THR 629 -0.679 9.665 6.943 1011 HG21 THR 629 HG21 THR 629 -0.633 6.905 9.943 1012 HG22 THR 629 HG22 THR 629 0.344 8.373 9.996 1013 HG23 THR 629 HG23 THR 629 0.807 7.043 8.935 1014 H ASN 630 HN ASN 630 -1.268 7.162 4.749 1015 HA ASN 630 HA ASN 630 -3.835 8.581 4.506 1016 HB2 ASN 630 HB2 ASN 630 -1.326 9.111 2.893 1017 HB3 ASN 630 HB3 ASN 630 -2.885 9.859 2.613 1018 HD21 ASN 630 HD21 ASN 630 -1.994 11.905 2.860 1019 HD22 ASN 630 HD22 ASN 630 -1.567 12.535 4.421 1020 H VAL 631 HN VAL 631 -4.881 8.265 2.433 1021 HA VAL 631 HA VAL 631 -4.328 5.641 1.305 1022 HB VAL 631 HB VAL 631 -6.650 7.359 0.487 1023 HG11 VAL 631 HG11 VAL 631 -7.735 5.211 0.224 1024 HG12 VAL 631 HG12 VAL 631 -6.214 5.263 -0.667 1025 HG13 VAL 631 HG13 VAL 631 -6.307 4.406 0.872 1026 HG21 VAL 631 HG21 VAL 631 -7.991 6.476 2.319 1027 HG22 VAL 631 HG22 VAL 631 -6.563 5.696 2.997 1028 HG23 VAL 631 HG23 VAL 631 -6.657 7.454 2.928 1029 H LEU 632 HN LEU 632 -3.265 5.479 -0.593 1030 HA LEU 632 HA LEU 632 -2.418 7.845 -1.925 1031 HB2 LEU 632 HB2 LEU 632 -2.098 4.936 -2.665 1032 HB3 LEU 632 HB3 LEU 632 -1.325 6.273 -3.504 1033 HG LEU 632 HG LEU 632 -0.902 5.604 -0.586 1034 HD11 LEU 632 HD11 LEU 632 0.023 3.880 -2.059 1035 HD12 LEU 632 HD12 LEU 632 0.916 5.120 -2.942 1036 HD13 LEU 632 HD13 LEU 632 1.284 4.808 -1.246 1037 HD21 LEU 632 HD21 LEU 632 0.516 7.554 -2.400 1038 HD22 LEU 632 HD22 LEU 632 -0.619 7.974 -1.116 1039 HD23 LEU 632 HD23 LEU 632 0.923 7.213 -0.718 1040 H GLN 633 HN GLN 633 -3.628 8.964 -3.179 1041 HA GLN 633 HA GLN 633 -5.645 7.631 -4.867 1042 HB2 GLN 633 HB2 GLN 633 -6.679 8.866 -3.010 1043 HB3 GLN 633 HB3 GLN 633 -5.803 10.315 -3.469 1044 HG2 GLN 633 HG2 GLN 633 -8.073 10.493 -4.207 1045 HG3 GLN 633 HG3 GLN 633 -7.023 10.339 -5.613 1046 HE21 GLN 633 HE21 GLN 633 -7.840 7.638 -3.560 1047 HE22 GLN 633 HE22 GLN 633 -8.855 6.828 -4.700 1048 HA PRO 634 HA PRO 634 -3.140 9.542 -8.048 1049 HB2 PRO 634 HB2 PRO 634 -5.293 8.641 -9.847 1050 HB3 PRO 634 HB3 PRO 634 -3.583 8.197 -9.836 1051 HG2 PRO 634 HG2 PRO 634 -5.490 6.465 -9.080 1052 HG3 PRO 634 HG3 PRO 634 -3.897 6.499 -8.300 1053 HD2 PRO 634 HD2 PRO 634 -6.495 7.661 -7.352 1054 HD3 PRO 634 HD3 PRO 634 -5.267 6.762 -6.436 Start of MODEL 5 1 H1 ALA 500 H1 ALA 500 5.784 -17.205 12.556 2 H2 ALA 500 H2 ALA 500 5.937 -16.901 10.899 3 H3 ALA 500 H3 ALA 500 4.397 -16.966 11.607 4 HA ALA 500 HA ALA 500 4.953 -14.705 11.211 5 HB1 ALA 500 HB1 ALA 500 5.232 -15.362 14.141 6 HB2 ALA 500 HB2 ALA 500 4.739 -13.811 13.461 7 HB3 ALA 500 HB3 ALA 500 3.710 -15.231 13.260 8 H GLY 501 HN GLY 501 6.708 -13.902 10.282 9 HA2 GLY 501 HA2 GLY 501 8.793 -12.710 11.560 10 HA3 GLY 501 HA3 GLY 501 9.356 -14.357 11.318 11 H MET 502 HN MET 502 9.400 -15.186 9.129 12 HA MET 502 HA MET 502 9.584 -13.052 7.117 13 HB2 MET 502 HB2 MET 502 11.425 -15.421 7.448 14 HB3 MET 502 HB3 MET 502 11.408 -14.379 6.033 15 HG2 MET 502 HG2 MET 502 12.021 -13.496 8.849 16 HG3 MET 502 HG3 MET 502 13.213 -13.812 7.590 17 HE1 MET 502 HE1 MET 502 13.392 -12.354 5.343 18 HE2 MET 502 HE2 MET 502 11.676 -12.616 5.031 19 HE3 MET 502 HE3 MET 502 12.340 -10.982 4.991 20 H GLY 503 HN GLY 503 7.457 -13.537 6.491 21 HA2 GLY 503 HA2 GLY 503 7.283 -15.982 4.847 22 HA3 GLY 503 HA3 GLY 503 5.926 -15.424 5.822 23 H THR 504 HN THR 504 4.655 -15.283 3.894 24 HA THR 504 HA THR 504 5.408 -13.509 1.784 25 HB THR 504 HB THR 504 2.996 -13.675 1.108 26 HG1 THR 504 HG1 THR 504 2.820 -15.518 3.288 27 HG21 THR 504 HG21 THR 504 4.590 -15.264 0.213 28 HG22 THR 504 HG22 THR 504 3.075 -16.096 0.569 29 HG23 THR 504 HG23 THR 504 4.453 -16.263 1.658 30 H VAL 505 HN VAL 505 3.746 -11.674 1.236 31 HA VAL 505 HA VAL 505 4.008 -9.598 3.060 32 HB VAL 505 HB VAL 505 1.706 -9.787 1.120 33 HG11 VAL 505 HG11 VAL 505 2.064 -7.358 0.918 34 HG12 VAL 505 HG12 VAL 505 1.681 -7.844 2.570 35 HG13 VAL 505 HG13 VAL 505 3.343 -7.462 2.128 36 HG21 VAL 505 HG21 VAL 505 3.690 -10.494 -0.071 37 HG22 VAL 505 HG22 VAL 505 3.208 -8.882 -0.599 38 HG23 VAL 505 HG23 VAL 505 4.569 -9.076 0.503 39 H MET 506 HN MET 506 1.418 -11.934 2.641 40 HA MET 506 HA MET 506 -0.486 -10.737 4.333 41 HB2 MET 506 HB2 MET 506 -0.096 -13.541 3.339 42 HB3 MET 506 HB3 MET 506 -1.372 -13.155 4.491 43 HG2 MET 506 HG2 MET 506 -1.005 -11.873 1.794 44 HG3 MET 506 HG3 MET 506 -2.179 -13.130 2.190 45 HE1 MET 506 HE1 MET 506 -2.406 -9.919 1.053 46 HE2 MET 506 HE2 MET 506 -3.712 -11.097 0.923 47 HE3 MET 506 HE3 MET 506 -3.999 -9.542 1.706 48 H ASP 507 HN ASP 507 2.197 -12.903 4.983 49 HA ASP 507 HA ASP 507 1.441 -13.734 7.570 50 HB2 ASP 507 HB2 ASP 507 3.250 -14.735 6.098 51 HB3 ASP 507 HB3 ASP 507 4.276 -13.387 6.571 52 H VAL 508 HN VAL 508 2.935 -10.851 6.348 53 HA VAL 508 HA VAL 508 3.674 -9.871 8.980 54 HB VAL 508 HB VAL 508 3.772 -8.440 6.314 55 HG11 VAL 508 HG11 VAL 508 5.062 -7.799 8.965 56 HG12 VAL 508 HG12 VAL 508 5.371 -6.950 7.451 57 HG13 VAL 508 HG13 VAL 508 3.766 -6.892 8.184 58 HG21 VAL 508 HG21 VAL 508 6.156 -8.987 6.306 59 HG22 VAL 508 HG22 VAL 508 5.949 -9.907 7.796 60 HG23 VAL 508 HG23 VAL 508 5.167 -10.449 6.312 61 H LEU 509 HN LEU 509 1.284 -9.182 6.457 62 HA LEU 509 HA LEU 509 0.209 -6.850 7.627 63 HB2 LEU 509 HB2 LEU 509 -1.204 -8.794 5.806 64 HB3 LEU 509 HB3 LEU 509 -1.654 -7.127 6.104 65 HG LEU 509 HG LEU 509 0.862 -8.045 4.710 66 HD11 LEU 509 HD11 LEU 509 -1.118 -8.424 3.355 67 HD12 LEU 509 HD12 LEU 509 -1.661 -6.771 3.640 68 HD13 LEU 509 HD13 LEU 509 -0.194 -7.071 2.706 69 HD21 LEU 509 HD21 LEU 509 1.189 -5.674 4.191 70 HD22 LEU 509 HD22 LEU 509 -0.227 -5.263 5.159 71 HD23 LEU 509 HD23 LEU 509 1.201 -5.955 5.932 72 H LYS 510 HN LYS 510 -0.270 -10.165 8.344 73 HA LYS 510 HA LYS 510 -2.856 -9.773 9.578 74 HB2 LYS 510 HB2 LYS 510 -1.063 -12.177 9.279 75 HB3 LYS 510 HB3 LYS 510 -2.517 -12.212 10.262 76 HG2 LYS 510 HG2 LYS 510 -3.840 -11.624 8.265 77 HG3 LYS 510 HG3 LYS 510 -2.360 -11.713 7.300 78 HD2 LYS 510 HD2 LYS 510 -2.068 -14.044 7.928 79 HD3 LYS 510 HD3 LYS 510 -3.491 -13.958 8.965 80 HE2 LYS 510 HE2 LYS 510 -4.861 -13.456 6.965 81 HE3 LYS 510 HE3 LYS 510 -3.427 -13.696 5.960 82 HZ1 LYS 510 HZ1 LYS 510 -4.783 -15.701 6.057 83 HZ2 LYS 510 HZ2 LYS 510 -4.661 -15.729 7.746 84 HZ3 LYS 510 HZ3 LYS 510 -3.278 -15.968 6.793 85 H GLY 511 HN GLY 511 0.455 -9.757 10.430 86 HA2 GLY 511 HA2 GLY 511 0.035 -10.301 13.234 87 HA3 GLY 511 HA3 GLY 511 1.545 -9.795 12.482 88 H ASP 512 HN ASP 512 -0.474 -7.663 11.239 89 HA ASP 512 HA ASP 512 -0.026 -5.783 13.478 90 HB2 ASP 512 HB2 ASP 512 1.275 -5.115 11.586 91 HB3 ASP 512 HB3 ASP 512 -0.116 -5.262 10.510 92 H ASN 513 HN ASN 513 -1.573 -4.233 13.988 93 HA ASN 513 HA ASN 513 -4.253 -5.238 13.812 94 HB2 ASN 513 HB2 ASN 513 -3.008 -2.877 15.204 95 HB3 ASN 513 HB3 ASN 513 -4.750 -3.127 15.193 96 HD21 ASN 513 HD21 ASN 513 -5.626 -4.846 16.306 97 HD22 ASN 513 HD22 ASN 513 -4.733 -5.707 17.521 98 H ARG 514 HN ARG 514 -2.455 -2.902 12.028 99 HA ARG 514 HA ARG 514 -4.858 -1.463 11.194 100 HB2 ARG 514 HB2 ARG 514 -2.212 -1.010 9.891 101 HB3 ARG 514 HB3 ARG 514 -3.465 0.149 10.298 102 HG2 ARG 514 HG2 ARG 514 -1.618 -1.160 12.283 103 HG3 ARG 514 HG3 ARG 514 -1.397 0.449 11.596 104 HD2 ARG 514 HD2 ARG 514 -3.390 1.242 12.640 105 HD3 ARG 514 HD3 ARG 514 -3.837 -0.388 13.148 106 HE ARG 514 HE ARG 514 -1.455 -0.075 14.342 107 HH11 ARG 514 HH12 ARG 514 -4.225 2.083 14.166 108 HH12 ARG 514 HH11 ARG 514 -3.972 2.725 15.765 109 HH21 ARG 514 HH22 ARG 514 -1.127 0.772 16.427 110 HH22 ARG 514 HH21 ARG 514 -2.204 1.989 17.041 111 H PHE 515 HN PHE 515 -2.236 -3.361 9.796 112 HA PHE 515 HA PHE 515 -3.107 -3.340 7.137 113 HB2 PHE 515 HB2 PHE 515 -1.464 -5.464 8.520 114 HB3 PHE 515 HB3 PHE 515 -1.517 -5.131 6.804 115 HD1 PHE 515 HD2 PHE 515 -1.548 -1.969 7.594 116 HD2 PHE 515 HD1 PHE 515 0.982 -5.318 8.304 117 HE1 PHE 515 HE2 PHE 515 0.371 -0.457 7.871 118 HE2 PHE 515 HE1 PHE 515 2.901 -3.809 8.583 119 HZ PHE 515 HZ PHE 515 2.597 -1.378 8.368 120 H SER 516 HN SER 516 -4.041 -5.321 9.862 121 HA SER 516 HA SER 516 -4.928 -7.592 8.476 122 HB2 SER 516 HB2 SER 516 -6.386 -7.841 10.638 123 HB3 SER 516 HB3 SER 516 -4.626 -7.965 10.731 124 HG SER 516 HG SER 516 -4.539 -6.154 11.810 125 H MET 517 HN MET 517 -6.485 -4.512 8.992 126 HA MET 517 HA MET 517 -9.079 -5.494 8.146 127 HB2 MET 517 HB2 MET 517 -8.924 -3.563 9.666 128 HB3 MET 517 HB3 MET 517 -8.068 -2.653 8.429 129 HG2 MET 517 HG2 MET 517 -10.014 -2.708 6.991 130 HG3 MET 517 HG3 MET 517 -10.878 -3.702 8.162 131 HE1 MET 517 HE1 MET 517 -9.544 0.619 9.067 132 HE2 MET 517 HE2 MET 517 -8.457 -0.771 9.040 133 HE3 MET 517 HE3 MET 517 -9.190 -0.197 7.544 134 H LEU 518 HN LEU 518 -6.374 -3.705 6.722 135 HA LEU 518 HA LEU 518 -7.380 -3.439 4.135 136 HB2 LEU 518 HB2 LEU 518 -5.278 -2.416 4.792 137 HB3 LEU 518 HB3 LEU 518 -4.560 -3.993 5.051 138 HG LEU 518 HG LEU 518 -4.770 -4.466 2.627 139 HD11 LEU 518 HD11 LEU 518 -5.726 -1.612 2.510 140 HD12 LEU 518 HD12 LEU 518 -5.240 -2.572 1.111 141 HD13 LEU 518 HD13 LEU 518 -6.635 -3.062 2.073 142 HD21 LEU 518 HD21 LEU 518 -2.682 -3.593 3.530 143 HD22 LEU 518 HD22 LEU 518 -2.973 -2.980 1.903 144 HD23 LEU 518 HD23 LEU 518 -3.260 -1.943 3.301 145 H VAL 519 HN VAL 519 -5.809 -6.197 5.701 146 HA VAL 519 HA VAL 519 -5.679 -7.989 3.591 147 HB VAL 519 HB VAL 519 -6.437 -8.603 6.457 148 HG11 VAL 519 HG11 VAL 519 -5.428 -10.435 4.281 149 HG12 VAL 519 HG12 VAL 519 -5.580 -10.875 5.982 150 HG13 VAL 519 HG13 VAL 519 -7.017 -10.474 5.042 151 HG21 VAL 519 HG21 VAL 519 -4.292 -7.439 6.246 152 HG22 VAL 519 HG22 VAL 519 -4.079 -9.106 6.788 153 HG23 VAL 519 HG23 VAL 519 -3.738 -8.671 5.110 154 H ALA 520 HN ALA 520 -8.442 -7.012 5.522 155 HA ALA 520 HA ALA 520 -10.226 -9.031 4.561 156 HB1 ALA 520 HB1 ALA 520 -11.975 -7.500 5.594 157 HB2 ALA 520 HB2 ALA 520 -10.721 -8.104 6.681 158 HB3 ALA 520 HB3 ALA 520 -10.632 -6.453 6.067 159 H ALA 521 HN ALA 521 -9.449 -5.725 3.644 160 HA ALA 521 HA ALA 521 -11.488 -5.442 1.693 161 HB1 ALA 521 HB1 ALA 521 -10.143 -3.554 0.867 162 HB2 ALA 521 HB2 ALA 521 -10.349 -3.506 2.619 163 HB3 ALA 521 HB3 ALA 521 -8.822 -4.050 1.925 164 H ILE 522 HN ILE 522 -8.049 -6.316 1.482 165 HA ILE 522 HA ILE 522 -7.927 -6.821 -1.268 166 HB ILE 522 HB ILE 522 -6.359 -8.155 0.951 167 HG12 ILE 522 HG12 ILE 522 -5.702 -5.758 -0.782 168 HG13 ILE 522 HG13 ILE 522 -6.157 -5.696 0.916 169 HG21 ILE 522 HG21 ILE 522 -6.237 -9.440 -1.110 170 HG22 ILE 522 HG22 ILE 522 -5.780 -7.993 -2.006 171 HG23 ILE 522 HG23 ILE 522 -4.693 -8.652 -0.783 172 HD11 ILE 522 HD11 ILE 522 -4.146 -6.946 1.499 173 HD12 ILE 522 HD12 ILE 522 -3.686 -7.001 -0.202 174 HD13 ILE 522 HD13 ILE 522 -3.762 -5.453 0.644 175 H GLN 523 HN GLN 523 -8.917 -8.877 1.414 176 HA GLN 523 HA GLN 523 -9.164 -11.301 0.024 177 HB2 GLN 523 HB2 GLN 523 -9.213 -10.957 2.522 178 HB3 GLN 523 HB3 GLN 523 -10.855 -10.363 2.354 179 HG2 GLN 523 HG2 GLN 523 -10.117 -13.074 1.336 180 HG3 GLN 523 HG3 GLN 523 -10.423 -12.819 3.050 181 HE21 GLN 523 HE21 GLN 523 -12.511 -12.262 3.723 182 HE22 GLN 523 HE22 GLN 523 -13.887 -12.527 2.716 183 H SER 524 HN SER 524 -11.610 -8.817 0.768 184 HA SER 524 HA SER 524 -13.735 -10.049 -0.581 185 HB2 SER 524 HB2 SER 524 -13.302 -7.104 -0.046 186 HB3 SER 524 HB3 SER 524 -14.840 -7.869 -0.443 187 HG SER 524 HG SER 524 -13.275 -8.157 1.897 188 H ALA 525 HN ALA 525 -11.214 -7.875 -1.729 189 HA ALA 525 HA ALA 525 -12.443 -7.445 -4.290 190 HB1 ALA 525 HB1 ALA 525 -9.597 -6.916 -3.439 191 HB2 ALA 525 HB2 ALA 525 -10.402 -6.280 -4.874 192 HB3 ALA 525 HB3 ALA 525 -10.943 -5.787 -3.270 193 H GLY 526 HN GLY 526 -10.717 -10.007 -2.933 194 HA2 GLY 526 HA2 GLY 526 -10.125 -12.031 -3.847 195 HA3 GLY 526 HA3 GLY 526 -10.781 -11.472 -5.376 196 H LEU 527 HN LEU 527 -8.225 -9.865 -3.570 197 HA LEU 527 HA LEU 527 -6.401 -10.444 -5.817 198 HB2 LEU 527 HB2 LEU 527 -6.357 -8.180 -3.816 199 HB3 LEU 527 HB3 LEU 527 -5.180 -8.416 -5.091 200 HG LEU 527 HG LEU 527 -8.115 -7.830 -5.504 201 HD11 LEU 527 HD11 LEU 527 -5.677 -6.096 -5.882 202 HD12 LEU 527 HD12 LEU 527 -7.329 -5.662 -6.316 203 HD13 LEU 527 HD13 LEU 527 -6.900 -5.910 -4.624 204 HD21 LEU 527 HD21 LEU 527 -5.854 -8.047 -7.488 205 HD22 LEU 527 HD22 LEU 527 -7.155 -9.219 -7.280 206 HD23 LEU 527 HD23 LEU 527 -7.519 -7.592 -7.854 207 H THR 528 HN THR 528 -7.042 -11.829 -3.098 208 HA THR 528 HA THR 528 -4.950 -11.523 -1.305 209 HB THR 528 HB THR 528 -6.444 -14.099 -1.761 210 HG1 THR 528 HG1 THR 528 -7.306 -11.953 -0.104 211 HG21 THR 528 HG21 THR 528 -5.294 -12.811 0.719 212 HG22 THR 528 HG22 THR 528 -4.626 -14.206 -0.129 213 HG23 THR 528 HG23 THR 528 -6.193 -14.330 0.672 214 H GLU 529 HN GLU 529 -5.194 -13.763 -4.062 215 HA GLU 529 HA GLU 529 -2.921 -15.284 -3.278 216 HB2 GLU 529 HB2 GLU 529 -3.097 -16.335 -5.495 217 HB3 GLU 529 HB3 GLU 529 -4.633 -16.299 -4.640 218 HG2 GLU 529 HG2 GLU 529 -5.387 -14.451 -5.996 219 HG3 GLU 529 HG3 GLU 529 -3.820 -14.371 -6.803 220 H THR 530 HN THR 530 -3.245 -12.285 -4.865 221 HA THR 530 HA THR 530 -0.948 -12.302 -6.486 222 HB THR 530 HB THR 530 -2.217 -9.953 -5.057 223 HG1 THR 530 HG1 THR 530 -3.781 -10.396 -6.423 224 HG21 THR 530 HG21 THR 530 -0.418 -10.025 -7.484 225 HG22 THR 530 HG22 THR 530 0.028 -9.430 -5.885 226 HG23 THR 530 HG23 THR 530 -1.207 -8.591 -6.824 227 H LEU 531 HN LEU 531 -1.411 -11.163 -3.126 228 HA LEU 531 HA LEU 531 1.349 -10.664 -2.681 229 HB2 LEU 531 HB2 LEU 531 -0.922 -11.032 -0.734 230 HB3 LEU 531 HB3 LEU 531 0.640 -10.348 -0.358 231 HG LEU 531 HG LEU 531 -0.731 -8.515 -0.558 232 HD11 LEU 531 HD11 LEU 531 0.544 -8.877 -3.241 233 HD12 LEU 531 HD12 LEU 531 -0.036 -7.339 -2.596 234 HD13 LEU 531 HD13 LEU 531 1.295 -8.185 -1.803 235 HD21 LEU 531 HD21 LEU 531 -2.456 -8.141 -2.077 236 HD22 LEU 531 HD22 LEU 531 -1.893 -9.421 -3.148 237 HD23 LEU 531 HD23 LEU 531 -2.611 -9.829 -1.590 238 H ASN 532 HN ASN 532 -0.542 -13.450 -2.737 239 HA ASN 532 HA ASN 532 0.928 -14.981 -0.793 240 HB2 ASN 532 HB2 ASN 532 -1.400 -15.535 -1.227 241 HB3 ASN 532 HB3 ASN 532 -1.042 -15.823 -2.927 242 HD21 ASN 532 HD21 ASN 532 -0.804 -17.064 0.300 243 HD22 ASN 532 HD22 ASN 532 -0.363 -18.676 -0.137 244 H ARG 533 HN ARG 533 1.031 -14.465 -4.254 245 HA ARG 533 HA ARG 533 2.819 -16.569 -4.887 246 HB2 ARG 533 HB2 ARG 533 2.415 -13.927 -6.308 247 HB3 ARG 533 HB3 ARG 533 3.262 -15.320 -6.963 248 HG2 ARG 533 HG2 ARG 533 0.338 -15.148 -6.291 249 HG3 ARG 533 HG3 ARG 533 1.058 -15.202 -7.902 250 HD2 ARG 533 HD2 ARG 533 1.159 -17.377 -5.817 251 HD3 ARG 533 HD3 ARG 533 0.186 -17.383 -7.287 252 HE ARG 533 HE ARG 533 2.737 -17.067 -8.196 253 HH11 ARG 533 HH12 ARG 533 1.107 -19.399 -6.177 254 HH12 ARG 533 HH11 ARG 533 2.176 -20.711 -6.574 255 HH21 ARG 533 HH22 ARG 533 4.160 -18.779 -8.753 256 HH22 ARG 533 HH21 ARG 533 3.924 -20.354 -8.051 257 H GLU 534 HN GLU 534 4.896 -16.764 -4.325 258 HA GLU 534 HA GLU 534 6.322 -14.615 -3.169 259 HB2 GLU 534 HB2 GLU 534 8.253 -16.197 -3.238 260 HB3 GLU 534 HB3 GLU 534 6.834 -16.773 -2.386 261 HG2 GLU 534 HG2 GLU 534 6.213 -18.039 -4.453 262 HG3 GLU 534 HG3 GLU 534 7.791 -17.602 -5.107 263 H GLY 535 HN GLY 535 6.494 -13.002 -4.440 264 HA2 GLY 535 HA2 GLY 535 8.532 -12.947 -6.461 265 HA3 GLY 535 HA3 GLY 535 6.905 -12.637 -7.083 266 H VAL 536 HN VAL 536 8.365 -10.467 -7.389 267 HA VAL 536 HA VAL 536 8.735 -9.110 -4.853 268 HB VAL 536 HB VAL 536 9.967 -7.417 -6.129 269 HG11 VAL 536 HG11 VAL 536 11.179 -9.336 -5.321 270 HG12 VAL 536 HG12 VAL 536 10.721 -10.271 -6.746 271 HG13 VAL 536 HG13 VAL 536 11.803 -8.887 -6.907 272 HG21 VAL 536 HG21 VAL 536 10.409 -7.726 -8.520 273 HG22 VAL 536 HG22 VAL 536 9.290 -9.089 -8.552 274 HG23 VAL 536 HG23 VAL 536 8.693 -7.464 -8.213 275 H TYR 537 HN TYR 537 7.579 -7.520 -4.084 276 HA TYR 537 HA TYR 537 5.860 -5.879 -5.755 277 HB2 TYR 537 HB2 TYR 537 4.769 -7.544 -3.468 278 HB3 TYR 537 HB3 TYR 537 3.897 -6.237 -4.252 279 HD1 TYR 537 HD1 TYR 537 3.328 -6.490 -6.726 280 HD2 TYR 537 HD2 TYR 537 4.681 -9.726 -4.318 281 HE1 TYR 537 HE1 TYR 537 2.382 -8.085 -8.344 282 HE2 TYR 537 HE2 TYR 537 3.746 -11.330 -5.929 283 HH TYR 537 HH TYR 537 2.041 -11.417 -7.669 284 H THR 538 HN THR 538 5.511 -3.862 -4.869 285 HA THR 538 HA THR 538 6.679 -3.370 -2.207 286 HB THR 538 HB THR 538 6.030 -1.263 -4.291 287 HG1 THR 538 HG1 THR 538 7.785 -2.858 -4.875 288 HG21 THR 538 HG21 THR 538 7.827 -1.193 -1.874 289 HG22 THR 538 HG22 THR 538 6.193 -0.524 -1.935 290 HG23 THR 538 HG23 THR 538 7.464 0.155 -2.955 291 H VAL 539 HN VAL 539 5.064 -3.550 -0.735 292 HA VAL 539 HA VAL 539 2.368 -2.709 -1.542 293 HB VAL 539 HB VAL 539 3.181 -4.416 0.816 294 HG11 VAL 539 HG11 VAL 539 1.071 -3.249 1.180 295 HG12 VAL 539 HG12 VAL 539 0.463 -3.838 -0.366 296 HG13 VAL 539 HG13 VAL 539 0.789 -4.974 0.942 297 HG21 VAL 539 HG21 VAL 539 2.068 -5.197 -1.878 298 HG22 VAL 539 HG22 VAL 539 3.681 -5.553 -1.261 299 HG23 VAL 539 HG23 VAL 539 2.267 -6.287 -0.506 300 H PHE 540 HN PHE 540 1.600 -0.849 -0.835 301 HA PHE 540 HA PHE 540 2.648 0.300 1.652 302 HB2 PHE 540 HB2 PHE 540 0.977 1.521 -0.560 303 HB3 PHE 540 HB3 PHE 540 1.492 2.371 0.887 304 HD1 PHE 540 HD1 PHE 540 2.538 0.995 -2.331 305 HD2 PHE 540 HD2 PHE 540 3.801 3.080 1.163 306 HE1 PHE 540 HE1 PHE 540 4.609 1.658 -3.479 307 HE2 PHE 540 HE2 PHE 540 5.873 3.748 0.013 308 HZ PHE 540 HZ PHE 540 6.277 3.037 -2.310 309 H ALA 541 HN ALA 541 1.508 -0.271 3.402 310 HA ALA 541 HA ALA 541 -1.336 -0.912 3.052 311 HB1 ALA 541 HB1 ALA 541 0.540 -1.708 5.276 312 HB2 ALA 541 HB2 ALA 541 -1.153 -2.194 5.135 313 HB3 ALA 541 HB3 ALA 541 0.028 -2.731 3.936 314 HA PRO 542 HA PRO 542 -2.020 2.954 5.231 315 HB2 PRO 542 HB2 PRO 542 -4.837 2.372 4.717 316 HB3 PRO 542 HB3 PRO 542 -3.858 3.721 4.140 317 HG2 PRO 542 HG2 PRO 542 -4.725 1.761 2.498 318 HG3 PRO 542 HG3 PRO 542 -3.178 2.592 2.252 319 HD2 PRO 542 HD2 PRO 542 -3.718 -0.092 3.475 320 HD3 PRO 542 HD3 PRO 542 -2.436 0.393 2.342 321 H THR 543 HN THR 543 -2.564 3.389 7.295 322 HA THR 543 HA THR 543 -3.293 1.214 9.021 323 HB THR 543 HB THR 543 -3.152 2.944 10.817 324 HG1 THR 543 HG1 THR 543 -2.751 5.022 10.324 325 HG21 THR 543 HG21 THR 543 -1.176 1.665 10.156 326 HG22 THR 543 HG22 THR 543 -0.734 3.312 10.607 327 HG23 THR 543 HG23 THR 543 -0.815 2.854 8.905 328 H ASN 544 HN ASN 544 -5.008 1.888 10.851 329 HA ASN 544 HA ASN 544 -7.479 1.939 9.398 330 HB2 ASN 544 HB2 ASN 544 -8.582 1.581 11.527 331 HB3 ASN 544 HB3 ASN 544 -7.195 0.508 11.397 332 HD21 ASN 544 HD21 ASN 544 -8.619 3.175 13.073 333 HD22 ASN 544 HD22 ASN 544 -7.435 3.278 14.332 334 H GLU 545 HN GLU 545 -5.556 4.253 11.091 335 HA GLU 545 HA GLU 545 -7.545 6.208 11.548 336 HB2 GLU 545 HB2 GLU 545 -4.699 6.883 10.833 337 HB3 GLU 545 HB3 GLU 545 -5.801 7.776 11.865 338 HG2 GLU 545 HG2 GLU 545 -4.380 6.842 13.397 339 HG3 GLU 545 HG3 GLU 545 -5.684 5.651 13.364 340 H ALA 546 HN ALA 546 -5.660 5.350 8.731 341 HA ALA 546 HA ALA 546 -6.213 7.554 7.102 342 HB1 ALA 546 HB1 ALA 546 -4.563 5.820 6.547 343 HB2 ALA 546 HB2 ALA 546 -5.879 4.682 6.255 344 HB3 ALA 546 HB3 ALA 546 -5.698 6.104 5.226 345 H PHE 547 HN PHE 547 -7.923 4.496 7.455 346 HA PHE 547 HA PHE 547 -10.014 5.134 5.658 347 HB2 PHE 547 HB2 PHE 547 -9.773 3.052 7.839 348 HB3 PHE 547 HB3 PHE 547 -11.110 3.136 6.708 349 HD1 PHE 547 HD2 PHE 547 -10.599 2.939 4.238 350 HD2 PHE 547 HD1 PHE 547 -7.796 1.902 7.266 351 HE1 PHE 547 HE2 PHE 547 -9.343 1.583 2.613 352 HE2 PHE 547 HE1 PHE 547 -6.537 0.556 5.647 353 HZ PHE 547 HZ PHE 547 -7.308 0.391 3.316 354 H ARG 548 HN ARG 548 -9.382 5.899 8.928 355 HA ARG 548 HA ARG 548 -12.100 6.442 9.693 356 HB2 ARG 548 HB2 ARG 548 -10.410 5.754 11.337 357 HB3 ARG 548 HB3 ARG 548 -9.472 7.198 10.989 358 HG2 ARG 548 HG2 ARG 548 -11.256 8.591 11.876 359 HG3 ARG 548 HG3 ARG 548 -12.237 7.155 12.177 360 HD2 ARG 548 HD2 ARG 548 -9.553 7.746 13.426 361 HD3 ARG 548 HD3 ARG 548 -11.117 7.939 14.219 362 HE ARG 548 HE ARG 548 -10.711 5.287 13.202 363 HH11 ARG 548 HH12 ARG 548 -9.890 7.414 15.862 364 HH12 ARG 548 HH11 ARG 548 -9.802 6.114 17.021 365 HH21 ARG 548 HH22 ARG 548 -10.580 3.588 14.723 366 HH22 ARG 548 HH21 ARG 548 -10.184 3.956 16.375 367 H ALA 549 HN ALA 549 -9.488 8.195 8.211 368 HA ALA 549 HA ALA 549 -10.774 10.772 8.728 369 HB1 ALA 549 HB1 ALA 549 -8.361 10.565 9.128 370 HB2 ALA 549 HB2 ALA 549 -8.123 10.175 7.424 371 HB3 ALA 549 HB3 ALA 549 -8.727 11.765 7.888 372 H LEU 550 HN LEU 550 -11.108 8.414 6.514 373 HA LEU 550 HA LEU 550 -10.986 9.826 4.062 374 HB2 LEU 550 HB2 LEU 550 -12.549 7.361 4.826 375 HB3 LEU 550 HB3 LEU 550 -12.416 7.973 3.189 376 HG LEU 550 HG LEU 550 -10.165 6.908 4.892 377 HD11 LEU 550 HD11 LEU 550 -11.465 5.863 2.387 378 HD12 LEU 550 HD12 LEU 550 -10.066 5.156 3.195 379 HD13 LEU 550 HD13 LEU 550 -11.633 5.188 4.007 380 HD21 LEU 550 HD21 LEU 550 -8.750 7.230 2.939 381 HD22 LEU 550 HD22 LEU 550 -10.097 7.976 2.073 382 HD23 LEU 550 HD23 LEU 550 -9.410 8.771 3.492 383 HA PRO 551 HA PRO 551 -14.631 12.317 4.380 384 HB2 PRO 551 HB2 PRO 551 -14.663 12.335 1.442 385 HB3 PRO 551 HB3 PRO 551 -14.400 13.670 2.566 386 HG2 PRO 551 HG2 PRO 551 -12.413 12.673 1.049 387 HG3 PRO 551 HG3 PRO 551 -12.128 13.304 2.683 388 HD2 PRO 551 HD2 PRO 551 -12.391 10.461 1.762 389 HD3 PRO 551 HD3 PRO 551 -11.241 11.169 2.922 390 HA PRO 552 HA PRO 552 -18.237 9.859 4.107 391 HB2 PRO 552 HB2 PRO 552 -19.796 11.629 2.509 392 HB3 PRO 552 HB3 PRO 552 -19.812 11.462 4.266 393 HG2 PRO 552 HG2 PRO 552 -18.391 13.426 2.560 394 HG3 PRO 552 HG3 PRO 552 -19.012 13.608 4.212 395 HD2 PRO 552 HD2 PRO 552 -16.395 13.378 3.736 396 HD3 PRO 552 HD3 PRO 552 -17.135 12.599 5.152 397 H ARG 553 HN ARG 553 -17.827 11.542 0.965 398 HA ARG 553 HA ARG 553 -19.086 9.508 -0.520 399 HB2 ARG 553 HB2 ARG 553 -17.820 10.615 -2.500 400 HB3 ARG 553 HB3 ARG 553 -19.062 11.523 -1.654 401 HG2 ARG 553 HG2 ARG 553 -17.489 12.883 -0.571 402 HG3 ARG 553 HG3 ARG 553 -16.160 11.781 -0.934 403 HD2 ARG 553 HD2 ARG 553 -17.708 13.266 -3.057 404 HD3 ARG 553 HD3 ARG 553 -16.233 13.894 -2.315 405 HE ARG 553 HE ARG 553 -15.491 11.419 -3.125 406 HH11 ARG 553 HH12 ARG 553 -17.035 14.082 -4.843 407 HH12 ARG 553 HH11 ARG 553 -16.308 13.664 -6.365 408 HH21 ARG 553 HH22 ARG 553 -14.561 10.893 -5.088 409 HH22 ARG 553 HH21 ARG 553 -14.893 11.850 -6.501 410 H GLU 554 HN GLU 554 -15.703 10.001 0.330 411 HA GLU 554 HA GLU 554 -14.708 8.119 -1.580 412 HB2 GLU 554 HB2 GLU 554 -13.322 9.206 0.875 413 HB3 GLU 554 HB3 GLU 554 -12.558 8.449 -0.517 414 HG2 GLU 554 HG2 GLU 554 -14.039 11.069 -0.489 415 HG3 GLU 554 HG3 GLU 554 -12.296 10.841 -0.630 416 H ARG 555 HN ARG 555 -15.148 8.042 1.950 417 HA ARG 555 HA ARG 555 -14.261 5.367 2.222 418 HB2 ARG 555 HB2 ARG 555 -15.214 5.445 4.478 419 HB3 ARG 555 HB3 ARG 555 -14.268 6.881 4.127 420 HG2 ARG 555 HG2 ARG 555 -16.388 8.088 3.656 421 HG3 ARG 555 HG3 ARG 555 -17.269 6.654 4.187 422 HD2 ARG 555 HD2 ARG 555 -16.167 6.811 6.380 423 HD3 ARG 555 HD3 ARG 555 -15.323 8.261 5.844 424 HE ARG 555 HE ARG 555 -18.248 8.262 5.806 425 HH11 ARG 555 HH12 ARG 555 -15.258 9.391 7.239 426 HH12 ARG 555 HH11 ARG 555 -16.032 10.636 8.174 427 HH21 ARG 555 HH22 ARG 555 -19.261 9.905 6.983 428 HH22 ARG 555 HH21 ARG 555 -18.316 10.948 8.012 429 H SER 556 HN SER 556 -17.360 6.741 1.385 430 HA SER 556 HA SER 556 -18.865 4.373 1.908 431 HB2 SER 556 HB2 SER 556 -19.973 6.558 1.837 432 HB3 SER 556 HB3 SER 556 -19.527 6.749 0.144 433 HG SER 556 HG SER 556 -20.754 4.435 0.321 434 H ARG 557 HN ARG 557 -17.021 5.583 -0.789 435 HA ARG 557 HA ARG 557 -18.089 3.624 -2.629 436 HB2 ARG 557 HB2 ARG 557 -15.807 5.584 -2.890 437 HB3 ARG 557 HB3 ARG 557 -16.332 4.505 -4.176 438 HG2 ARG 557 HG2 ARG 557 -18.510 5.561 -4.205 439 HG3 ARG 557 HG3 ARG 557 -18.036 6.617 -2.872 440 HD2 ARG 557 HD2 ARG 557 -17.834 7.837 -4.932 441 HD3 ARG 557 HD3 ARG 557 -16.223 7.514 -4.300 442 HE ARG 557 HE ARG 557 -16.325 5.529 -5.959 443 HH11 ARG 557 HH12 ARG 557 -17.800 8.661 -6.459 444 HH12 ARG 557 HH11 ARG 557 -17.648 8.614 -8.188 445 HH21 ARG 557 HH22 ARG 557 -16.084 5.459 -8.229 446 HH22 ARG 557 HH21 ARG 557 -16.662 6.790 -9.204 447 H LEU 558 HN LEU 558 -14.925 4.200 -1.073 448 HA LEU 558 HA LEU 558 -13.698 1.961 -2.261 449 HB2 LEU 558 HB2 LEU 558 -12.431 3.836 -1.352 450 HB3 LEU 558 HB3 LEU 558 -12.963 3.428 0.269 451 HG LEU 558 HG LEU 558 -11.711 1.332 0.178 452 HD11 LEU 558 HD11 LEU 558 -10.226 0.849 -1.706 453 HD12 LEU 558 HD12 LEU 558 -11.914 0.888 -2.213 454 HD13 LEU 558 HD13 LEU 558 -10.856 2.254 -2.566 455 HD21 LEU 558 HD21 LEU 558 -10.028 3.688 -0.659 456 HD22 LEU 558 HD22 LEU 558 -10.618 3.383 0.975 457 HD23 LEU 558 HD23 LEU 558 -9.478 2.265 0.224 458 H LEU 559 HN LEU 559 -15.358 2.339 0.843 459 HA LEU 559 HA LEU 559 -14.768 -0.445 1.497 460 HB2 LEU 559 HB2 LEU 559 -16.236 1.661 3.092 461 HB3 LEU 559 HB3 LEU 559 -15.753 0.078 3.673 462 HG LEU 559 HG LEU 559 -13.820 2.218 2.783 463 HD11 LEU 559 HD11 LEU 559 -14.642 1.410 5.568 464 HD12 LEU 559 HD12 LEU 559 -13.366 2.553 5.152 465 HD13 LEU 559 HD13 LEU 559 -15.044 2.926 4.762 466 HD21 LEU 559 HD21 LEU 559 -12.150 0.810 3.886 467 HD22 LEU 559 HD22 LEU 559 -13.395 -0.389 4.245 468 HD23 LEU 559 HD23 LEU 559 -12.951 -0.051 2.572 469 H GLY 560 HN GLY 560 -16.785 0.727 -0.562 470 HA2 GLY 560 HA2 GLY 560 -19.062 -0.926 0.343 471 HA3 GLY 560 HA3 GLY 560 -19.298 0.616 -0.466 472 H ASP 561 HN ASP 561 -17.469 0.489 -2.496 473 HA ASP 561 HA ASP 561 -18.860 -1.355 -4.257 474 HB2 ASP 561 HB2 ASP 561 -18.426 1.076 -4.811 475 HB3 ASP 561 HB3 ASP 561 -16.724 0.660 -4.969 476 H ALA 562 HN ALA 562 -18.112 -3.315 -4.629 477 HA ALA 562 HA ALA 562 -15.585 -4.193 -3.684 478 HB1 ALA 562 HB1 ALA 562 -17.563 -5.603 -5.480 479 HB2 ALA 562 HB2 ALA 562 -16.189 -6.358 -4.670 480 HB3 ALA 562 HB3 ALA 562 -17.509 -5.679 -3.717 481 H LYS 563 HN LYS 563 -16.607 -2.844 -6.678 482 HA LYS 563 HA LYS 563 -14.490 -4.052 -8.234 483 HB2 LYS 563 HB2 LYS 563 -16.666 -3.471 -9.265 484 HB3 LYS 563 HB3 LYS 563 -16.358 -1.774 -8.928 485 HG2 LYS 563 HG2 LYS 563 -14.324 -1.933 -10.356 486 HG3 LYS 563 HG3 LYS 563 -14.836 -3.565 -10.800 487 HD2 LYS 563 HD2 LYS 563 -16.958 -2.655 -11.644 488 HD3 LYS 563 HD3 LYS 563 -16.411 -1.029 -11.236 489 HE2 LYS 563 HE2 LYS 563 -14.471 -1.383 -12.760 490 HE3 LYS 563 HE3 LYS 563 -15.205 -2.905 -13.262 491 HZ1 LYS 563 HZ1 LYS 563 -17.202 -1.585 -13.915 492 HZ2 LYS 563 HZ2 LYS 563 -15.817 -1.251 -14.836 493 HZ3 LYS 563 HZ3 LYS 563 -16.305 -0.173 -13.623 494 H GLU 564 HN GLU 564 -15.293 -0.846 -6.918 495 HA GLU 564 HA GLU 564 -12.838 0.326 -7.741 496 HB2 GLU 564 HB2 GLU 564 -14.787 1.214 -5.608 497 HB3 GLU 564 HB3 GLU 564 -13.418 2.167 -6.174 498 HG2 GLU 564 HG2 GLU 564 -14.451 1.883 -8.503 499 HG3 GLU 564 HG3 GLU 564 -15.908 1.394 -7.641 500 H LEU 565 HN LEU 565 -13.802 -1.531 -4.944 501 HA LEU 565 HA LEU 565 -11.568 -1.105 -3.321 502 HB2 LEU 565 HB2 LEU 565 -13.603 -3.176 -3.622 503 HB3 LEU 565 HB3 LEU 565 -12.056 -3.826 -3.119 504 HG LEU 565 HG LEU 565 -13.548 -1.624 -1.696 505 HD11 LEU 565 HD11 LEU 565 -14.682 -3.798 -1.532 506 HD12 LEU 565 HD12 LEU 565 -13.192 -4.514 -0.921 507 HD13 LEU 565 HD13 LEU 565 -14.022 -3.267 0.016 508 HD21 LEU 565 HD21 LEU 565 -11.063 -3.150 -0.932 509 HD22 LEU 565 HD22 LEU 565 -11.129 -1.463 -1.442 510 HD23 LEU 565 HD23 LEU 565 -11.894 -1.957 0.069 511 H ALA 566 HN ALA 566 -12.051 -3.611 -5.793 512 HA ALA 566 HA ALA 566 -9.408 -4.564 -5.789 513 HB1 ALA 566 HB1 ALA 566 -11.440 -4.624 -8.018 514 HB2 ALA 566 HB2 ALA 566 -9.978 -5.607 -7.930 515 HB3 ALA 566 HB3 ALA 566 -11.264 -5.829 -6.742 516 H ASN 567 HN ASN 567 -10.899 -1.830 -7.306 517 HA ASN 567 HA ASN 567 -8.859 -1.322 -9.235 518 HB2 ASN 567 HB2 ASN 567 -11.274 -0.479 -9.242 519 HB3 ASN 567 HB3 ASN 567 -10.750 0.710 -8.061 520 HD21 ASN 567 HD21 ASN 567 -8.108 1.051 -9.346 521 HD22 ASN 567 HD22 ASN 567 -8.419 1.991 -10.763 522 H ILE 568 HN ILE 568 -9.657 0.232 -6.105 523 HA ILE 568 HA ILE 568 -7.441 2.011 -6.212 524 HB ILE 568 HB ILE 568 -9.109 1.205 -3.822 525 HG12 ILE 568 HG12 ILE 568 -10.445 2.170 -5.642 526 HG13 ILE 568 HG13 ILE 568 -10.360 3.268 -4.271 527 HG21 ILE 568 HG21 ILE 568 -7.049 2.205 -3.079 528 HG22 ILE 568 HG22 ILE 568 -7.239 3.538 -4.217 529 HG23 ILE 568 HG23 ILE 568 -8.360 3.365 -2.866 530 HD11 ILE 568 HD11 ILE 568 -10.151 4.473 -6.359 531 HD12 ILE 568 HD12 ILE 568 -8.650 4.579 -5.442 532 HD13 ILE 568 HD13 ILE 568 -8.768 3.481 -6.820 533 H LEU 569 HN LEU 569 -7.900 -1.166 -4.753 534 HA LEU 569 HA LEU 569 -5.593 -1.165 -3.135 535 HB2 LEU 569 HB2 LEU 569 -7.086 -3.445 -4.423 536 HB3 LEU 569 HB3 LEU 569 -5.782 -3.667 -3.271 537 HG LEU 569 HG LEU 569 -8.398 -2.266 -2.717 538 HD11 LEU 569 HD11 LEU 569 -7.348 -4.934 -1.804 539 HD12 LEU 569 HD12 LEU 569 -8.850 -4.177 -1.273 540 HD13 LEU 569 HD13 LEU 569 -8.657 -4.667 -2.956 541 HD21 LEU 569 HD21 LEU 569 -6.551 -1.305 -1.427 542 HD22 LEU 569 HD22 LEU 569 -7.652 -2.216 -0.393 543 HD23 LEU 569 HD23 LEU 569 -6.105 -2.918 -0.867 544 H LYS 570 HN LYS 570 -6.006 -1.602 -6.547 545 HA LYS 570 HA LYS 570 -3.511 -2.865 -7.063 546 HB2 LYS 570 HB2 LYS 570 -5.342 -1.235 -8.823 547 HB3 LYS 570 HB3 LYS 570 -3.869 -1.989 -9.410 548 HG2 LYS 570 HG2 LYS 570 -4.779 -4.189 -8.741 549 HG3 LYS 570 HG3 LYS 570 -6.289 -3.388 -8.294 550 HD2 LYS 570 HD2 LYS 570 -6.526 -2.573 -10.599 551 HD3 LYS 570 HD3 LYS 570 -5.023 -3.387 -11.037 552 HE2 LYS 570 HE2 LYS 570 -6.804 -4.788 -11.735 553 HE3 LYS 570 HE3 LYS 570 -6.092 -5.534 -10.307 554 HZ1 LYS 570 HZ1 LYS 570 -8.387 -5.665 -9.979 555 HZ2 LYS 570 HZ2 LYS 570 -8.662 -4.092 -10.536 556 HZ3 LYS 570 HZ3 LYS 570 -7.916 -4.336 -9.032 557 H TYR 571 HN TYR 571 -4.286 0.259 -6.062 558 HA TYR 571 HA TYR 571 -1.992 1.504 -7.378 559 HB2 TYR 571 HB2 TYR 571 -4.258 2.604 -7.278 560 HB3 TYR 571 HB3 TYR 571 -4.030 2.773 -5.541 561 HD1 TYR 571 HD2 TYR 571 -1.788 3.342 -8.476 562 HD2 TYR 571 HD1 TYR 571 -3.639 4.990 -5.022 563 HE1 TYR 571 HE2 TYR 571 -0.628 5.470 -8.881 564 HE2 TYR 571 HE1 TYR 571 -2.486 7.127 -5.419 565 HH TYR 571 HH TYR 571 -0.837 7.809 -8.349 566 H HIS 572 HN HIS 572 -2.661 -0.173 -4.592 567 HA HIS 572 HA HIS 572 -0.710 1.310 -2.984 568 HB2 HIS 572 HB2 HIS 572 -2.777 -0.769 -2.253 569 HB3 HIS 572 HB3 HIS 572 -1.528 -0.235 -1.132 570 HD1 HIS 572 HD1 HIS 572 -4.638 1.022 -2.887 571 HD2 HIS 572 HD2 HIS 572 -1.916 2.224 0.018 572 HE1 HIS 572 HE1 HIS 572 -5.626 3.075 -1.796 573 H ILE 573 HN ILE 573 -0.915 -1.316 -5.031 574 HA ILE 573 HA ILE 573 1.433 -2.607 -3.802 575 HB ILE 573 HB ILE 573 -0.377 -3.773 -5.920 576 HG12 ILE 573 HG12 ILE 573 -0.428 -4.430 -2.970 577 HG13 ILE 573 HG13 ILE 573 -1.531 -3.276 -3.710 578 HG21 ILE 573 HG21 ILE 573 0.646 -5.895 -5.239 579 HG22 ILE 573 HG22 ILE 573 1.850 -4.749 -5.831 580 HG23 ILE 573 HG23 ILE 573 1.673 -5.029 -4.098 581 HD11 ILE 573 HD11 ILE 573 -2.569 -5.454 -3.465 582 HD12 ILE 573 HD12 ILE 573 -2.390 -5.030 -5.167 583 HD13 ILE 573 HD13 ILE 573 -1.286 -6.187 -4.427 584 H GLY 574 HN GLY 574 3.323 -2.209 -4.772 585 HA2 GLY 574 HA2 GLY 574 3.311 -1.277 -7.560 586 HA3 GLY 574 HA3 GLY 574 4.653 -1.122 -6.436 587 H ASP 575 HN ASP 575 5.295 -2.014 -8.872 588 HA ASP 575 HA ASP 575 4.880 -4.896 -9.038 589 HB2 ASP 575 HB2 ASP 575 5.552 -4.708 -11.332 590 HB3 ASP 575 HB3 ASP 575 4.416 -3.413 -10.979 591 H GLU 576 HN GLU 576 7.269 -2.976 -7.739 592 HA GLU 576 HA GLU 576 9.254 -5.080 -8.112 593 HB2 GLU 576 HB2 GLU 576 9.694 -2.095 -8.175 594 HB3 GLU 576 HB3 GLU 576 11.002 -3.244 -7.933 595 HG2 GLU 576 HG2 GLU 576 9.218 -3.114 -10.356 596 HG3 GLU 576 HG3 GLU 576 10.848 -2.450 -10.243 597 H ILE 577 HN ILE 577 11.131 -4.298 -6.357 598 HA ILE 577 HA ILE 577 9.668 -3.719 -3.865 599 HB ILE 577 HB ILE 577 12.374 -5.040 -4.196 600 HG12 ILE 577 HG12 ILE 577 9.757 -6.206 -3.220 601 HG13 ILE 577 HG13 ILE 577 10.413 -6.438 -4.837 602 HG21 ILE 577 HG21 ILE 577 10.771 -4.438 -1.713 603 HG22 ILE 577 HG22 ILE 577 12.224 -5.436 -1.762 604 HG23 ILE 577 HG23 ILE 577 12.316 -3.722 -2.171 605 HD11 ILE 577 HD11 ILE 577 10.856 -8.358 -3.439 606 HD12 ILE 577 HD12 ILE 577 12.361 -7.555 -3.889 607 HD13 ILE 577 HD13 ILE 577 11.694 -7.338 -2.271 608 H LEU 578 HN LEU 578 9.729 -1.576 -3.600 609 HA LEU 578 HA LEU 578 12.247 -0.163 -4.114 610 HB2 LEU 578 HB2 LEU 578 9.776 0.516 -4.887 611 HB3 LEU 578 HB3 LEU 578 9.771 1.283 -3.310 612 HG LEU 578 HG LEU 578 10.417 2.805 -5.174 613 HD11 LEU 578 HD11 LEU 578 11.112 3.322 -2.906 614 HD12 LEU 578 HD12 LEU 578 12.546 2.312 -3.096 615 HD13 LEU 578 HD13 LEU 578 12.371 3.780 -4.055 616 HD21 LEU 578 HD21 LEU 578 12.860 1.042 -5.311 617 HD22 LEU 578 HD22 LEU 578 11.608 1.178 -6.545 618 HD23 LEU 578 HD23 LEU 578 12.635 2.564 -6.170 619 H VAL 579 HN VAL 579 13.560 0.053 -2.444 620 HA VAL 579 HA VAL 579 12.428 0.307 0.267 621 HB VAL 579 HB VAL 579 14.588 -0.541 1.110 622 HG11 VAL 579 HG11 VAL 579 14.328 -2.887 0.352 623 HG12 VAL 579 HG12 VAL 579 12.803 -2.128 0.814 624 HG13 VAL 579 HG13 VAL 579 13.207 -2.325 -0.891 625 HG21 VAL 579 HG21 VAL 579 15.248 -0.943 -1.807 626 HG22 VAL 579 HG22 VAL 579 16.041 0.173 -0.696 627 HG23 VAL 579 HG23 VAL 579 16.191 -1.567 -0.455 628 H SER 580 HN SER 580 13.804 1.636 1.784 629 HA SER 580 HA SER 580 14.137 4.228 0.725 630 HB2 SER 580 HB2 SER 580 15.161 4.761 2.949 631 HB3 SER 580 HB3 SER 580 13.599 3.953 3.056 632 HG SER 580 HG SER 580 14.506 2.347 4.042 633 H GLY 581 HN GLY 581 16.408 1.617 1.292 634 HA2 GLY 581 HA2 GLY 581 18.750 3.209 0.815 635 HA3 GLY 581 HA3 GLY 581 18.686 1.459 0.929 636 H GLY 582 HN GLY 582 16.549 3.010 -1.282 637 HA2 GLY 582 HA2 GLY 582 18.416 2.634 -3.514 638 HA3 GLY 582 HA3 GLY 582 16.852 1.832 -3.569 639 H ILE 583 HN ILE 583 17.103 4.921 -2.041 640 HA ILE 583 HA ILE 583 15.857 6.172 -4.394 641 HB ILE 583 HB ILE 583 15.270 7.169 -1.635 642 HG12 ILE 583 HG12 ILE 583 13.846 4.866 -2.986 643 HG13 ILE 583 HG13 ILE 583 14.796 4.769 -1.511 644 HG21 ILE 583 HG21 ILE 583 13.716 7.120 -4.221 645 HG22 ILE 583 HG22 ILE 583 13.173 7.859 -2.715 646 HG23 ILE 583 HG23 ILE 583 14.589 8.498 -3.549 647 HD11 ILE 583 HD11 ILE 583 12.452 4.765 -0.979 648 HD12 ILE 583 HD12 ILE 583 13.182 6.262 -0.405 649 HD13 ILE 583 HD13 ILE 583 12.209 6.265 -1.876 650 H GLY 584 HN GLY 584 17.623 7.207 -5.185 651 HA2 GLY 584 HA2 GLY 584 19.338 8.781 -3.471 652 HA3 GLY 584 HA3 GLY 584 19.427 8.672 -5.224 653 H ALA 585 HN ALA 585 16.456 9.255 -5.254 654 HA ALA 585 HA ALA 585 16.143 11.900 -4.217 655 HB1 ALA 585 HB1 ALA 585 16.427 11.603 -7.209 656 HB2 ALA 585 HB2 ALA 585 15.912 13.061 -6.361 657 HB3 ALA 585 HB3 ALA 585 17.548 12.442 -6.138 658 H LEU 586 HN LEU 586 14.870 10.553 -7.229 659 HA LEU 586 HA LEU 586 12.320 9.996 -5.894 660 HB2 LEU 586 HB2 LEU 586 12.047 12.184 -6.903 661 HB3 LEU 586 HB3 LEU 586 12.681 11.600 -8.431 662 HG LEU 586 HG LEU 586 10.699 10.059 -8.572 663 HD11 LEU 586 HD11 LEU 586 9.698 11.727 -6.275 664 HD12 LEU 586 HD12 LEU 586 8.760 10.546 -7.189 665 HD13 LEU 586 HD13 LEU 586 10.126 10.019 -6.204 666 HD21 LEU 586 HD21 LEU 586 10.091 13.007 -8.429 667 HD22 LEU 586 HD22 LEU 586 10.799 12.162 -9.807 668 HD23 LEU 586 HD23 LEU 586 9.154 11.788 -9.295 669 H VAL 587 HN VAL 587 11.449 8.116 -6.485 670 HA VAL 587 HA VAL 587 12.377 6.868 -8.987 671 HB VAL 587 HB VAL 587 11.756 5.384 -6.426 672 HG11 VAL 587 HG11 VAL 587 12.864 4.431 -9.066 673 HG12 VAL 587 HG12 VAL 587 12.690 3.443 -7.616 674 HG13 VAL 587 HG13 VAL 587 11.259 4.088 -8.421 675 HG21 VAL 587 HG21 VAL 587 14.161 4.900 -6.314 676 HG22 VAL 587 HG22 VAL 587 14.432 5.958 -7.699 677 HG23 VAL 587 HG23 VAL 587 13.836 6.628 -6.180 678 H ARG 588 HN ARG 588 10.693 6.717 -10.336 679 HA ARG 588 HA ARG 588 7.991 6.615 -9.291 680 HB2 ARG 588 HB2 ARG 588 9.110 6.796 -12.082 681 HB3 ARG 588 HB3 ARG 588 7.399 6.519 -11.783 682 HG2 ARG 588 HG2 ARG 588 7.350 8.612 -10.452 683 HG3 ARG 588 HG3 ARG 588 9.021 8.905 -10.931 684 HD2 ARG 588 HD2 ARG 588 8.405 9.052 -13.240 685 HD3 ARG 588 HD3 ARG 588 6.759 8.529 -12.885 686 HE ARG 588 HE ARG 588 7.278 10.841 -11.392 687 HH11 ARG 588 HH12 ARG 588 6.848 9.866 -14.737 688 HH12 ARG 588 HH11 ARG 588 6.265 11.425 -15.241 689 HH21 ARG 588 HH22 ARG 588 6.487 12.866 -12.053 690 HH22 ARG 588 HH21 ARG 588 6.070 13.129 -13.720 691 H LEU 589 HN LEU 589 7.414 4.743 -8.489 692 HA LEU 589 HA LEU 589 8.241 2.247 -9.798 693 HB2 LEU 589 HB2 LEU 589 8.523 2.909 -7.247 694 HB3 LEU 589 HB3 LEU 589 6.853 2.396 -7.147 695 HG LEU 589 HG LEU 589 8.534 0.666 -6.482 696 HD11 LEU 589 HD11 LEU 589 6.811 -0.052 -8.842 697 HD12 LEU 589 HD12 LEU 589 7.447 -1.168 -7.635 698 HD13 LEU 589 HD13 LEU 589 6.266 0.057 -7.168 699 HD21 LEU 589 HD21 LEU 589 9.747 -0.499 -8.259 700 HD22 LEU 589 HD22 LEU 589 9.166 0.686 -9.429 701 HD23 LEU 589 HD23 LEU 589 10.247 1.186 -8.128 702 H LYS 590 HN LYS 590 6.766 1.141 -10.957 703 HA LYS 590 HA LYS 590 4.204 2.178 -11.450 704 HB2 LYS 590 HB2 LYS 590 5.516 -0.457 -12.089 705 HB3 LYS 590 HB3 LYS 590 3.877 -0.081 -12.591 706 HG2 LYS 590 HG2 LYS 590 5.579 0.255 -14.327 707 HG3 LYS 590 HG3 LYS 590 4.635 1.696 -13.985 708 HD2 LYS 590 HD2 LYS 590 6.459 2.678 -12.811 709 HD3 LYS 590 HD3 LYS 590 7.359 1.156 -12.815 710 HE2 LYS 590 HE2 LYS 590 6.606 2.742 -15.271 711 HE3 LYS 590 HE3 LYS 590 8.191 2.764 -14.496 712 HZ1 LYS 590 HZ1 LYS 590 8.605 0.572 -15.098 713 HZ2 LYS 590 HZ2 LYS 590 7.845 1.210 -16.479 714 HZ3 LYS 590 HZ3 LYS 590 6.977 0.234 -15.402 715 H SER 591 HN SER 591 2.173 1.402 -10.935 716 HA SER 591 HA SER 591 2.073 -0.463 -8.662 717 HB2 SER 591 HB2 SER 591 -0.179 0.543 -8.207 718 HB3 SER 591 HB3 SER 591 1.144 1.694 -8.069 719 HG SER 591 HG SER 591 0.628 2.327 -10.268 720 H LEU 592 HN LEU 592 0.270 -1.987 -8.661 721 HA LEU 592 HA LEU 592 0.011 -3.397 -11.049 722 HB2 LEU 592 HB2 LEU 592 -1.364 -3.474 -8.405 723 HB3 LEU 592 HB3 LEU 592 -1.977 -4.456 -9.718 724 HG LEU 592 HG LEU 592 -0.419 -5.597 -8.111 725 HD11 LEU 592 HD11 LEU 592 0.386 -5.536 -11.010 726 HD12 LEU 592 HD12 LEU 592 0.745 -6.830 -9.866 727 HD13 LEU 592 HD13 LEU 592 -0.925 -6.493 -10.322 728 HD21 LEU 592 HD21 LEU 592 1.970 -5.271 -8.391 729 HD22 LEU 592 HD22 LEU 592 1.669 -3.950 -9.520 730 HD23 LEU 592 HD23 LEU 592 1.195 -3.792 -7.828 731 H GLN 593 HN GLN 593 -1.763 -0.671 -9.920 732 HA GLN 593 HA GLN 593 -4.131 -1.102 -11.451 733 HB2 GLN 593 HB2 GLN 593 -3.954 0.516 -9.548 734 HB3 GLN 593 HB3 GLN 593 -2.950 1.537 -10.568 735 HG2 GLN 593 HG2 GLN 593 -4.954 1.436 -12.207 736 HG3 GLN 593 HG3 GLN 593 -5.866 0.934 -10.783 737 HE21 GLN 593 HE21 GLN 593 -4.064 2.590 -9.071 738 HE22 GLN 593 HE22 GLN 593 -4.605 4.212 -9.295 739 H GLY 594 HN GLY 594 -0.957 0.070 -12.161 740 HA2 GLY 594 HA2 GLY 594 -0.224 0.238 -14.453 741 HA3 GLY 594 HA3 GLY 594 -1.843 0.780 -14.880 742 H ASP 595 HN ASP 595 -1.407 2.325 -12.117 743 HA ASP 595 HA ASP 595 -0.420 4.739 -13.407 744 HB2 ASP 595 HB2 ASP 595 -2.486 4.576 -11.832 745 HB3 ASP 595 HB3 ASP 595 -1.302 4.557 -10.529 746 H LYS 596 HN LYS 596 0.800 6.084 -11.358 747 HA LYS 596 HA LYS 596 3.196 4.414 -10.956 748 HB2 LYS 596 HB2 LYS 596 4.611 6.331 -11.482 749 HB3 LYS 596 HB3 LYS 596 3.548 5.968 -12.833 750 HG2 LYS 596 HG2 LYS 596 2.872 8.089 -10.819 751 HG3 LYS 596 HG3 LYS 596 3.894 8.420 -12.216 752 HD2 LYS 596 HD2 LYS 596 2.147 7.953 -13.733 753 HD3 LYS 596 HD3 LYS 596 1.172 7.171 -12.487 754 HE2 LYS 596 HE2 LYS 596 1.872 10.108 -12.539 755 HE3 LYS 596 HE3 LYS 596 0.347 9.425 -13.099 756 HZ1 LYS 596 HZ1 LYS 596 0.012 10.194 -10.902 757 HZ2 LYS 596 HZ2 LYS 596 1.414 9.433 -10.333 758 HZ3 LYS 596 HZ3 LYS 596 0.075 8.495 -10.808 759 H LEU 597 HN LEU 597 4.018 4.382 -8.981 760 HA LEU 597 HA LEU 597 3.106 6.384 -7.039 761 HB2 LEU 597 HB2 LEU 597 4.634 3.815 -6.581 762 HB3 LEU 597 HB3 LEU 597 4.001 4.877 -5.343 763 HG LEU 597 HG LEU 597 2.230 3.484 -7.334 764 HD11 LEU 597 HD11 LEU 597 3.427 1.806 -6.054 765 HD12 LEU 597 HD12 LEU 597 2.996 2.624 -4.551 766 HD13 LEU 597 HD13 LEU 597 1.740 1.886 -5.545 767 HD21 LEU 597 HD21 LEU 597 0.469 4.097 -5.846 768 HD22 LEU 597 HD22 LEU 597 1.621 4.680 -4.642 769 HD23 LEU 597 HD23 LEU 597 1.431 5.545 -6.167 770 H GLU 598 HN GLU 598 4.387 8.083 -6.798 771 HA GLU 598 HA GLU 598 7.168 7.856 -7.618 772 HB2 GLU 598 HB2 GLU 598 5.544 10.255 -6.777 773 HB3 GLU 598 HB3 GLU 598 7.226 10.318 -7.291 774 HG2 GLU 598 HG2 GLU 598 6.540 9.353 -9.471 775 HG3 GLU 598 HG3 GLU 598 4.863 9.461 -8.943 776 H VAL 599 HN VAL 599 8.104 6.664 -6.060 777 HA VAL 599 HA VAL 599 7.875 7.455 -3.276 778 HB VAL 599 HB VAL 599 9.689 5.333 -4.439 779 HG11 VAL 599 HG11 VAL 599 10.247 6.034 -2.178 780 HG12 VAL 599 HG12 VAL 599 8.585 5.750 -1.664 781 HG13 VAL 599 HG13 VAL 599 9.593 4.397 -2.175 782 HG21 VAL 599 HG21 VAL 599 7.389 4.849 -5.094 783 HG22 VAL 599 HG22 VAL 599 7.943 3.706 -3.871 784 HG23 VAL 599 HG23 VAL 599 6.865 5.027 -3.420 785 H SER 600 HN SER 600 9.190 8.864 -2.369 786 HA SER 600 HA SER 600 11.743 9.462 -3.692 787 HB2 SER 600 HB2 SER 600 11.182 11.908 -3.019 788 HB3 SER 600 HB3 SER 600 10.430 11.230 -4.459 789 HG SER 600 HG SER 600 8.558 10.843 -3.255 790 H LEU 601 HN LEU 601 13.318 10.451 -2.387 791 HA LEU 601 HA LEU 601 12.821 10.314 0.507 792 HB2 LEU 601 HB2 LEU 601 14.277 8.441 -0.421 793 HB3 LEU 601 HB3 LEU 601 15.457 9.675 -0.813 794 HG LEU 601 HG LEU 601 15.558 10.278 1.606 795 HD11 LEU 601 HD11 LEU 601 13.346 9.444 2.229 796 HD12 LEU 601 HD12 LEU 601 13.887 7.792 1.930 797 HD13 LEU 601 HD13 LEU 601 14.612 8.733 3.233 798 HD21 LEU 601 HD21 LEU 601 17.222 8.800 0.605 799 HD22 LEU 601 HD22 LEU 601 16.873 8.324 2.267 800 HD23 LEU 601 HD23 LEU 601 16.189 7.406 0.925 801 H LYS 602 HN LYS 602 12.747 12.351 1.119 802 HA LYS 602 HA LYS 602 14.744 14.221 0.034 803 HB2 LYS 602 HB2 LYS 602 12.493 14.579 -0.975 804 HB3 LYS 602 HB3 LYS 602 11.847 14.857 0.635 805 HG2 LYS 602 HG2 LYS 602 13.433 16.760 0.869 806 HG3 LYS 602 HG3 LYS 602 13.874 16.529 -0.822 807 HD2 LYS 602 HD2 LYS 602 12.229 18.290 -0.635 808 HD3 LYS 602 HD3 LYS 602 11.523 16.899 -1.459 809 HE2 LYS 602 HE2 LYS 602 10.319 16.256 0.495 810 HE3 LYS 602 HE3 LYS 602 11.200 17.412 1.490 811 HZ1 LYS 602 HZ1 LYS 602 9.389 18.167 -0.739 812 HZ2 LYS 602 HZ2 LYS 602 10.144 19.212 0.354 813 HZ3 LYS 602 HZ3 LYS 602 8.940 18.152 0.895 814 H ASN 603 HN ASN 603 16.000 14.948 1.611 815 HA ASN 603 HA ASN 603 16.750 15.648 3.643 816 HB2 ASN 603 HB2 ASN 603 13.815 16.235 4.127 817 HB3 ASN 603 HB3 ASN 603 15.130 16.787 5.152 818 HD21 ASN 603 HD21 ASN 603 16.506 18.417 4.402 819 HD22 ASN 603 HD22 ASN 603 16.083 19.420 3.058 820 H ASN 604 HN ASN 604 16.178 12.929 3.202 821 HA ASN 604 HA ASN 604 16.311 10.964 4.318 822 HB2 ASN 604 HB2 ASN 604 16.185 12.664 6.816 823 HB3 ASN 604 HB3 ASN 604 16.455 10.926 6.808 824 HD21 ASN 604 HD21 ASN 604 18.110 11.040 4.384 825 HD22 ASN 604 HD22 ASN 604 19.622 11.705 4.885 826 H VAL 605 HN VAL 605 13.676 12.788 4.056 827 HA VAL 605 HA VAL 605 11.943 10.968 5.582 828 HB VAL 605 HB VAL 605 11.232 13.590 4.244 829 HG11 VAL 605 HG11 VAL 605 9.123 13.408 5.476 830 HG12 VAL 605 HG12 VAL 605 9.341 12.067 4.351 831 HG13 VAL 605 HG13 VAL 605 9.616 11.823 6.074 832 HG21 VAL 605 HG21 VAL 605 12.706 13.932 6.151 833 HG22 VAL 605 HG22 VAL 605 11.073 14.485 6.518 834 HG23 VAL 605 HG23 VAL 605 11.650 12.948 7.162 835 H VAL 606 HN VAL 606 10.912 9.401 4.539 836 HA VAL 606 HA VAL 606 11.012 9.317 1.641 837 HB VAL 606 HB VAL 606 11.662 7.307 2.849 838 HG11 VAL 606 HG11 VAL 606 8.845 7.252 3.917 839 HG12 VAL 606 HG12 VAL 606 10.064 5.997 4.145 840 HG13 VAL 606 HG13 VAL 606 10.303 7.596 4.848 841 HG21 VAL 606 HG21 VAL 606 9.043 6.888 1.412 842 HG22 VAL 606 HG22 VAL 606 10.618 7.073 0.639 843 HG23 VAL 606 HG23 VAL 606 10.300 5.679 1.674 844 H SER 607 HN SER 607 9.352 9.718 0.340 845 HA SER 607 HA SER 607 6.635 9.773 1.455 846 HB2 SER 607 HB2 SER 607 6.342 11.816 -0.157 847 HB3 SER 607 HB3 SER 607 7.074 12.055 1.430 848 HG SER 607 HG SER 607 8.468 11.713 -1.038 849 H VAL 608 HN VAL 608 4.955 9.433 -0.053 850 HA VAL 608 HA VAL 608 5.764 8.429 -2.690 851 HB VAL 608 HB VAL 608 5.536 6.419 -1.416 852 HG11 VAL 608 HG11 VAL 608 3.390 5.890 -0.202 853 HG12 VAL 608 HG12 VAL 608 4.399 7.135 0.543 854 HG13 VAL 608 HG13 VAL 608 2.958 7.595 -0.375 855 HG21 VAL 608 HG21 VAL 608 4.549 6.301 -3.629 856 HG22 VAL 608 HG22 VAL 608 3.622 5.309 -2.505 857 HG23 VAL 608 HG23 VAL 608 3.008 6.888 -3.002 858 H ASN 609 HN ASN 609 4.860 9.889 -3.973 859 HA ASN 609 HA ASN 609 3.346 11.270 -4.954 860 HB2 ASN 609 HB2 ASN 609 1.413 9.222 -3.853 861 HB3 ASN 609 HB3 ASN 609 0.976 10.481 -5.003 862 HD21 ASN 609 HD21 ASN 609 0.924 7.560 -5.218 863 HD22 ASN 609 HD22 ASN 609 1.850 7.190 -6.626 864 H LYS 610 HN LYS 610 4.130 12.672 -3.095 865 HA LYS 610 HA LYS 610 3.604 14.521 -1.884 866 HB2 LYS 610 HB2 LYS 610 1.571 14.838 -3.115 867 HB3 LYS 610 HB3 LYS 610 0.770 13.547 -2.234 868 HG2 LYS 610 HG2 LYS 610 -0.024 15.700 -1.487 869 HG3 LYS 610 HG3 LYS 610 0.856 14.893 -0.191 870 HD2 LYS 610 HD2 LYS 610 2.815 16.252 -0.633 871 HD3 LYS 610 HD3 LYS 610 2.002 17.019 -1.999 872 HE2 LYS 610 HE2 LYS 610 0.358 17.999 -0.522 873 HE3 LYS 610 HE3 LYS 610 1.042 17.142 0.859 874 HZ1 LYS 610 HZ1 LYS 610 1.721 19.496 0.709 875 HZ2 LYS 610 HZ2 LYS 610 2.517 19.160 -0.753 876 HZ3 LYS 610 HZ3 LYS 610 3.032 18.423 0.688 877 H GLU 611 HN GLU 611 2.053 11.504 -0.791 878 HA GLU 611 HA GLU 611 1.998 12.509 1.939 879 HB2 GLU 611 HB2 GLU 611 1.070 9.852 0.833 880 HB3 GLU 611 HB3 GLU 611 0.784 10.444 2.465 881 HG2 GLU 611 HG2 GLU 611 -0.271 11.661 -0.078 882 HG3 GLU 611 HG3 GLU 611 -1.188 10.710 1.086 883 HA PRO 612 HA PRO 612 5.783 10.483 3.030 884 HB2 PRO 612 HB2 PRO 612 5.145 10.842 5.824 885 HB3 PRO 612 HB3 PRO 612 6.301 11.740 4.838 886 HG2 PRO 612 HG2 PRO 612 3.979 12.814 5.842 887 HG3 PRO 612 HG3 PRO 612 4.809 13.413 4.396 888 HD2 PRO 612 HD2 PRO 612 2.408 11.644 4.607 889 HD3 PRO 612 HD3 PRO 612 2.749 12.954 3.457 890 H VAL 613 HN VAL 613 6.545 8.583 3.959 891 HA VAL 613 HA VAL 613 4.475 6.620 4.591 892 HB VAL 613 HB VAL 613 7.360 6.363 3.770 893 HG11 VAL 613 HG11 VAL 613 7.199 3.944 4.050 894 HG12 VAL 613 HG12 VAL 613 7.000 4.757 5.602 895 HG13 VAL 613 HG13 VAL 613 5.592 4.118 4.754 896 HG21 VAL 613 HG21 VAL 613 6.384 4.994 1.988 897 HG22 VAL 613 HG22 VAL 613 4.779 5.274 2.664 898 HG23 VAL 613 HG23 VAL 613 5.711 6.623 2.010 899 H ALA 614 HN ALA 614 4.254 5.668 6.520 900 HA ALA 614 HA ALA 614 5.322 7.053 8.777 901 HB1 ALA 614 HB1 ALA 614 3.868 5.622 10.086 902 HB2 ALA 614 HB2 ALA 614 3.001 6.239 8.678 903 HB3 ALA 614 HB3 ALA 614 3.600 4.578 8.686 904 H GLU 615 HN GLU 615 5.680 3.771 7.480 905 HA GLU 615 HA GLU 615 8.209 3.504 8.885 906 HB2 GLU 615 HB2 GLU 615 6.566 2.656 10.516 907 HB3 GLU 615 HB3 GLU 615 5.980 1.506 9.323 908 HG2 GLU 615 HG2 GLU 615 8.159 0.417 9.294 909 HG3 GLU 615 HG3 GLU 615 8.761 1.583 10.470 910 HA PRO 616 HA PRO 616 8.537 1.534 4.853 911 HB2 PRO 616 HB2 PRO 616 10.950 2.486 4.247 912 HB3 PRO 616 HB3 PRO 616 9.527 3.531 4.226 913 HG2 PRO 616 HG2 PRO 616 11.706 3.336 6.240 914 HG3 PRO 616 HG3 PRO 616 10.791 4.757 5.703 915 HD2 PRO 616 HD2 PRO 616 10.328 3.238 8.031 916 HD3 PRO 616 HD3 PRO 616 9.249 4.461 7.336 917 H ASP 617 HN ASP 617 9.727 -0.220 4.030 918 HA ASP 617 HA ASP 617 11.532 -1.583 3.667 919 HB2 ASP 617 HB2 ASP 617 12.730 -0.293 6.125 920 HB3 ASP 617 HB3 ASP 617 13.550 -1.474 5.111 921 H ILE 618 HN ILE 618 9.183 -2.012 5.290 922 HA ILE 618 HA ILE 618 9.815 -3.957 7.265 923 HB ILE 618 HB ILE 618 7.364 -3.120 5.757 924 HG12 ILE 618 HG12 ILE 618 8.100 -3.150 8.693 925 HG13 ILE 618 HG13 ILE 618 8.079 -1.747 7.631 926 HG21 ILE 618 HG21 ILE 618 6.032 -4.763 7.043 927 HG22 ILE 618 HG22 ILE 618 7.177 -5.558 5.963 928 HG23 ILE 618 HG23 ILE 618 7.519 -5.457 7.691 929 HD11 ILE 618 HD11 ILE 618 5.670 -1.982 7.366 930 HD12 ILE 618 HD12 ILE 618 5.688 -3.389 8.433 931 HD13 ILE 618 HD13 ILE 618 6.123 -1.800 9.061 932 H MET 619 HN MET 619 10.829 -5.773 6.756 933 HA MET 619 HA MET 619 11.009 -6.650 4.037 934 HB2 MET 619 HB2 MET 619 12.164 -7.872 6.544 935 HB3 MET 619 HB3 MET 619 12.598 -8.307 4.900 936 HG2 MET 619 HG2 MET 619 12.933 -5.506 5.877 937 HG3 MET 619 HG3 MET 619 14.134 -6.739 6.239 938 HE1 MET 619 HE1 MET 619 12.109 -5.999 2.667 939 HE2 MET 619 HE2 MET 619 12.342 -4.595 3.711 940 HE3 MET 619 HE3 MET 619 13.265 -4.747 2.215 941 H ALA 620 HN ALA 620 9.844 -8.133 3.053 942 HA ALA 620 HA ALA 620 8.691 -10.337 4.648 943 HB1 ALA 620 HB1 ALA 620 6.923 -9.018 3.594 944 HB2 ALA 620 HB2 ALA 620 7.696 -9.211 2.021 945 HB3 ALA 620 HB3 ALA 620 7.025 -10.615 2.853 946 H THR 621 HN THR 621 8.434 -12.370 3.034 947 HA THR 621 HA THR 621 11.141 -12.939 2.259 948 HB THR 621 HB THR 621 9.530 -14.658 3.238 949 HG1 THR 621 HG1 THR 621 11.178 -15.030 0.979 950 HG21 THR 621 HG21 THR 621 7.613 -14.185 1.749 951 HG22 THR 621 HG22 THR 621 8.106 -15.878 1.681 952 HG23 THR 621 HG23 THR 621 8.548 -14.777 0.375 953 H ASN 622 HN ASN 622 8.318 -11.819 0.613 954 HA ASN 622 HA ASN 622 9.647 -12.349 -1.954 955 HB2 ASN 622 HB2 ASN 622 7.390 -12.380 -2.974 956 HB3 ASN 622 HB3 ASN 622 7.624 -13.649 -1.782 957 HD21 ASN 622 HD21 ASN 622 5.133 -12.637 -2.746 958 HD22 ASN 622 HD22 ASN 622 4.293 -11.974 -1.392 959 H GLY 623 HN GLY 623 8.819 -9.843 0.124 960 HA2 GLY 623 HA2 GLY 623 9.370 -7.867 -1.852 961 HA3 GLY 623 HA3 GLY 623 7.653 -7.932 -1.491 962 H VAL 624 HN VAL 624 7.899 -5.745 -0.796 963 HA VAL 624 HA VAL 624 8.915 -5.576 1.959 964 HB VAL 624 HB VAL 624 10.422 -4.444 0.230 965 HG11 VAL 624 HG11 VAL 624 9.728 -2.222 -0.522 966 HG12 VAL 624 HG12 VAL 624 8.679 -3.485 -1.165 967 HG13 VAL 624 HG13 VAL 624 8.133 -2.491 0.186 968 HG21 VAL 624 HG21 VAL 624 9.279 -2.758 2.453 969 HG22 VAL 624 HG22 VAL 624 10.544 -3.974 2.623 970 HG23 VAL 624 HG23 VAL 624 10.842 -2.519 1.672 971 H VAL 625 HN VAL 625 7.845 -3.992 3.248 972 HA VAL 625 HA VAL 625 5.226 -3.137 2.219 973 HB VAL 625 HB VAL 625 5.768 -4.161 5.015 974 HG11 VAL 625 HG11 VAL 625 4.071 -2.399 4.950 975 HG12 VAL 625 HG12 VAL 625 3.175 -3.306 3.733 976 HG13 VAL 625 HG13 VAL 625 3.365 -3.963 5.359 977 HG21 VAL 625 HG21 VAL 625 4.211 -5.431 2.767 978 HG22 VAL 625 HG22 VAL 625 5.752 -5.991 3.414 979 HG23 VAL 625 HG23 VAL 625 4.305 -6.038 4.420 980 H HIS 626 HN HIS 626 4.704 -1.071 2.600 981 HA HIS 626 HA HIS 626 6.391 0.451 4.466 982 HB2 HIS 626 HB2 HIS 626 5.194 1.314 1.824 983 HB3 HIS 626 HB3 HIS 626 5.919 2.418 2.979 984 HD2 HIS 626 HD2 HIS 626 6.992 -0.405 0.500 985 HE1 HIS 626 HE1 HIS 626 10.402 1.764 1.737 986 HE2 HIS 626 HE2 HIS 626 9.481 0.158 0.010 987 H VAL 627 HN VAL 627 5.256 0.935 6.198 988 HA VAL 627 HA VAL 627 2.420 0.948 6.332 989 HB VAL 627 HB VAL 627 4.318 2.330 8.238 990 HG11 VAL 627 HG11 VAL 627 2.569 1.963 9.892 991 HG12 VAL 627 HG12 VAL 627 1.964 2.914 8.535 992 HG13 VAL 627 HG13 VAL 627 1.555 1.203 8.665 993 HG21 VAL 627 HG21 VAL 627 5.000 0.007 7.903 994 HG22 VAL 627 HG22 VAL 627 4.352 0.264 9.523 995 HG23 VAL 627 HG23 VAL 627 3.365 -0.526 8.294 996 H ILE 628 HN ILE 628 1.047 2.484 5.651 997 HA ILE 628 HA ILE 628 2.008 5.269 5.632 998 HB ILE 628 HB ILE 628 0.156 5.610 3.859 999 HG12 ILE 628 HG12 ILE 628 0.721 2.660 3.483 1000 HG13 ILE 628 HG13 ILE 628 -0.802 3.349 4.033 1001 HG21 ILE 628 HG21 ILE 628 2.741 4.222 3.186 1002 HG22 ILE 628 HG22 ILE 628 1.758 5.160 2.060 1003 HG23 ILE 628 HG23 ILE 628 2.508 5.952 3.450 1004 HD11 ILE 628 HD11 ILE 628 -1.100 4.444 1.888 1005 HD12 ILE 628 HD12 ILE 628 0.456 3.817 1.339 1006 HD13 ILE 628 HD13 ILE 628 -0.870 2.707 1.681 1007 H THR 629 HN THR 629 0.681 6.825 6.426 1008 HA THR 629 HA THR 629 -1.396 5.855 8.214 1009 HB THR 629 HB THR 629 -1.408 8.229 9.026 1010 HG1 THR 629 HG1 THR 629 -0.651 9.272 7.158 1011 HG21 THR 629 HG21 THR 629 1.274 6.847 8.962 1012 HG22 THR 629 HG22 THR 629 -0.021 6.549 10.121 1013 HG23 THR 629 HG23 THR 629 0.799 8.110 10.099 1014 H ASN 630 HN ASN 630 -1.282 6.897 5.087 1015 HA ASN 630 HA ASN 630 -4.025 7.942 5.169 1016 HB2 ASN 630 HB2 ASN 630 -1.730 9.047 3.528 1017 HB3 ASN 630 HB3 ASN 630 -3.408 9.498 3.297 1018 HD21 ASN 630 HD21 ASN 630 -2.849 11.674 3.714 1019 HD22 ASN 630 HD22 ASN 630 -2.586 12.225 5.331 1020 H VAL 631 HN VAL 631 -5.140 7.718 3.081 1021 HA VAL 631 HA VAL 631 -4.383 5.198 1.811 1022 HB VAL 631 HB VAL 631 -6.968 6.764 1.598 1023 HG11 VAL 631 HG11 VAL 631 -6.223 4.035 0.546 1024 HG12 VAL 631 HG12 VAL 631 -7.857 4.701 0.554 1025 HG13 VAL 631 HG13 VAL 631 -6.596 5.469 -0.410 1026 HG21 VAL 631 HG21 VAL 631 -6.638 5.831 3.820 1027 HG22 VAL 631 HG22 VAL 631 -7.920 4.968 2.974 1028 HG23 VAL 631 HG23 VAL 631 -6.318 4.245 3.123 1029 H LEU 632 HN LEU 632 -3.615 5.115 -0.239 1030 HA LEU 632 HA LEU 632 -3.090 7.621 -1.567 1031 HB2 LEU 632 HB2 LEU 632 -2.420 4.782 -2.320 1032 HB3 LEU 632 HB3 LEU 632 -1.910 6.196 -3.224 1033 HG LEU 632 HG LEU 632 -1.142 5.590 -0.365 1034 HD11 LEU 632 HD11 LEU 632 -0.106 4.067 -1.993 1035 HD12 LEU 632 HD12 LEU 632 0.509 5.461 -2.880 1036 HD13 LEU 632 HD13 LEU 632 1.070 5.145 -1.238 1037 HD21 LEU 632 HD21 LEU 632 0.364 7.478 -0.589 1038 HD22 LEU 632 HD22 LEU 632 -0.212 7.768 -2.231 1039 HD23 LEU 632 HD23 LEU 632 -1.302 7.989 -0.860 1040 H GLN 633 HN GLN 633 -4.561 8.535 -2.727 1041 HA GLN 633 HA GLN 633 -6.438 6.885 -4.281 1042 HB2 GLN 633 HB2 GLN 633 -6.719 9.673 -3.161 1043 HB3 GLN 633 HB3 GLN 633 -7.842 8.988 -4.322 1044 HG2 GLN 633 HG2 GLN 633 -8.338 7.181 -2.717 1045 HG3 GLN 633 HG3 GLN 633 -7.284 7.973 -1.545 1046 HE21 GLN 633 HE21 GLN 633 -10.276 8.185 -3.307 1047 HE22 GLN 633 HE22 GLN 633 -10.998 9.441 -2.366 1048 HA PRO 634 HA PRO 634 -4.513 8.774 -7.860 1049 HB2 PRO 634 HB2 PRO 634 -6.443 7.402 -9.504 1050 HB3 PRO 634 HB3 PRO 634 -4.733 7.022 -9.282 1051 HG2 PRO 634 HG2 PRO 634 -6.792 5.432 -8.398 1052 HG3 PRO 634 HG3 PRO 634 -5.168 5.441 -7.691 1053 HD2 PRO 634 HD2 PRO 634 -7.662 6.789 -6.729 1054 HD3 PRO 634 HD3 PRO 634 -6.392 5.967 -5.794 Start of MODEL 6 1 H1 ALA 500 H1 ALA 500 10.857 -16.364 -0.121 2 H2 ALA 500 H2 ALA 500 10.979 -17.738 -1.093 3 H3 ALA 500 H3 ALA 500 12.382 -17.013 -0.471 4 HA ALA 500 HA ALA 500 10.257 -18.429 1.023 5 HB1 ALA 500 HB1 ALA 500 12.016 -19.989 1.621 6 HB2 ALA 500 HB2 ALA 500 11.853 -19.875 -0.130 7 HB3 ALA 500 HB3 ALA 500 13.187 -19.058 0.686 8 H GLY 501 HN GLY 501 9.998 -17.951 3.078 9 HA2 GLY 501 HA2 GLY 501 12.150 -16.946 4.716 10 HA3 GLY 501 HA3 GLY 501 10.877 -15.768 4.413 11 H MET 502 HN MET 502 9.027 -15.874 5.533 12 HA MET 502 HA MET 502 8.255 -18.349 6.839 13 HB2 MET 502 HB2 MET 502 9.708 -17.271 8.525 14 HB3 MET 502 HB3 MET 502 8.693 -15.836 8.465 15 HG2 MET 502 HG2 MET 502 6.785 -17.176 9.245 16 HG3 MET 502 HG3 MET 502 7.847 -18.579 9.366 17 HE1 MET 502 HE1 MET 502 6.012 -17.457 11.710 18 HE2 MET 502 HE2 MET 502 7.046 -18.871 11.926 19 HE3 MET 502 HE3 MET 502 7.102 -17.549 13.093 20 H GLY 503 HN GLY 503 7.376 -14.936 7.379 21 HA2 GLY 503 HA2 GLY 503 4.631 -15.661 6.609 22 HA3 GLY 503 HA3 GLY 503 5.068 -14.311 7.648 23 H THR 504 HN THR 504 3.732 -14.847 4.859 24 HA THR 504 HA THR 504 5.195 -13.233 3.030 25 HB THR 504 HB THR 504 2.982 -13.131 1.801 26 HG1 THR 504 HG1 THR 504 1.761 -15.106 3.156 27 HG21 THR 504 HG21 THR 504 4.614 -14.893 1.327 28 HG22 THR 504 HG22 THR 504 2.965 -15.507 1.204 29 HG23 THR 504 HG23 THR 504 3.940 -15.874 2.627 30 H VAL 505 HN VAL 505 3.983 -11.192 2.092 31 HA VAL 505 HA VAL 505 3.871 -9.201 4.051 32 HB VAL 505 HB VAL 505 2.680 -7.798 2.338 33 HG11 VAL 505 HG11 VAL 505 4.577 -7.712 0.793 34 HG12 VAL 505 HG12 VAL 505 5.108 -7.855 2.468 35 HG13 VAL 505 HG13 VAL 505 5.148 -9.264 1.407 36 HG21 VAL 505 HG21 VAL 505 2.426 -8.699 0.080 37 HG22 VAL 505 HG22 VAL 505 2.931 -10.289 0.654 38 HG23 VAL 505 HG23 VAL 505 1.425 -9.578 1.236 39 H MET 506 HN MET 506 1.381 -11.320 2.800 40 HA MET 506 HA MET 506 -0.867 -10.046 3.901 41 HB2 MET 506 HB2 MET 506 -0.249 -12.839 3.034 42 HB3 MET 506 HB3 MET 506 -1.737 -12.527 3.919 43 HG2 MET 506 HG2 MET 506 -0.917 -11.123 1.390 44 HG3 MET 506 HG3 MET 506 -2.031 -12.488 1.479 45 HE1 MET 506 HE1 MET 506 -2.284 -9.222 0.472 46 HE2 MET 506 HE2 MET 506 -3.423 -10.479 -0.012 47 HE3 MET 506 HE3 MET 506 -4.009 -9.011 0.772 48 H ASP 507 HN ASP 507 1.319 -12.498 5.245 49 HA ASP 507 HA ASP 507 -0.058 -12.924 7.663 50 HB2 ASP 507 HB2 ASP 507 1.677 -14.462 6.982 51 HB3 ASP 507 HB3 ASP 507 2.888 -13.185 7.012 52 H VAL 508 HN VAL 508 2.522 -10.678 6.810 53 HA VAL 508 HA VAL 508 2.926 -9.530 9.331 54 HB VAL 508 HB VAL 508 3.253 -8.216 6.624 55 HG11 VAL 508 HG11 VAL 508 4.478 -7.559 9.304 56 HG12 VAL 508 HG12 VAL 508 4.916 -6.801 7.771 57 HG13 VAL 508 HG13 VAL 508 3.291 -6.594 8.428 58 HG21 VAL 508 HG21 VAL 508 5.233 -9.802 8.265 59 HG22 VAL 508 HG22 VAL 508 4.494 -10.311 6.744 60 HG23 VAL 508 HG23 VAL 508 5.598 -8.934 6.772 61 H LEU 509 HN LEU 509 0.772 -8.612 6.674 62 HA LEU 509 HA LEU 509 -0.210 -6.255 7.907 63 HB2 LEU 509 HB2 LEU 509 -1.514 -7.947 5.774 64 HB3 LEU 509 HB3 LEU 509 -1.923 -6.291 6.171 65 HG LEU 509 HG LEU 509 0.692 -7.228 4.994 66 HD11 LEU 509 HD11 LEU 509 -1.567 -5.662 3.758 67 HD12 LEU 509 HD12 LEU 509 -0.027 -6.050 2.989 68 HD13 LEU 509 HD13 LEU 509 -1.154 -7.340 3.408 69 HD21 LEU 509 HD21 LEU 509 -0.282 -4.441 5.599 70 HD22 LEU 509 HD22 LEU 509 0.997 -5.303 6.453 71 HD23 LEU 509 HD23 LEU 509 1.214 -4.854 4.763 72 H LYS 510 HN LYS 510 -1.256 -9.600 7.945 73 HA LYS 510 HA LYS 510 -3.778 -9.032 9.193 74 HB2 LYS 510 HB2 LYS 510 -2.291 -11.589 8.614 75 HB3 LYS 510 HB3 LYS 510 -3.775 -11.578 9.552 76 HG2 LYS 510 HG2 LYS 510 -5.025 -10.727 7.688 77 HG3 LYS 510 HG3 LYS 510 -3.551 -10.509 6.744 78 HD2 LYS 510 HD2 LYS 510 -3.170 -12.920 6.750 79 HD3 LYS 510 HD3 LYS 510 -4.609 -13.155 7.743 80 HE2 LYS 510 HE2 LYS 510 -4.774 -11.788 5.078 81 HE3 LYS 510 HE3 LYS 510 -4.776 -13.547 5.193 82 HZ1 LYS 510 HZ1 LYS 510 -6.705 -11.831 6.673 83 HZ2 LYS 510 HZ2 LYS 510 -6.780 -13.510 6.417 84 HZ3 LYS 510 HZ3 LYS 510 -7.019 -12.449 5.124 85 H GLY 511 HN GLY 511 -0.560 -9.781 10.172 86 HA2 GLY 511 HA2 GLY 511 -1.128 -10.436 12.883 87 HA3 GLY 511 HA3 GLY 511 0.432 -9.940 12.238 88 H ASP 512 HN ASP 512 -1.198 -7.527 11.132 89 HA ASP 512 HA ASP 512 -0.924 -5.964 13.623 90 HB2 ASP 512 HB2 ASP 512 0.598 -5.183 11.929 91 HB3 ASP 512 HB3 ASP 512 -0.703 -5.086 10.741 92 H ASN 513 HN ASN 513 -2.488 -4.439 14.196 93 HA ASN 513 HA ASN 513 -5.148 -5.335 13.595 94 HB2 ASN 513 HB2 ASN 513 -4.174 -4.449 15.851 95 HB3 ASN 513 HB3 ASN 513 -4.547 -2.862 15.189 96 HD21 ASN 513 HD21 ASN 513 -5.682 -4.153 17.513 97 HD22 ASN 513 HD22 ASN 513 -7.384 -4.264 17.230 98 H ARG 514 HN ARG 514 -3.108 -2.772 12.449 99 HA ARG 514 HA ARG 514 -5.359 -1.199 11.469 100 HB2 ARG 514 HB2 ARG 514 -2.415 -0.769 10.920 101 HB3 ARG 514 HB3 ARG 514 -3.715 0.376 10.644 102 HG2 ARG 514 HG2 ARG 514 -2.852 1.213 12.574 103 HG3 ARG 514 HG3 ARG 514 -4.054 0.106 13.241 104 HD2 ARG 514 HD2 ARG 514 -2.373 -1.564 13.652 105 HD3 ARG 514 HD3 ARG 514 -1.157 -0.612 12.800 106 HE ARG 514 HE ARG 514 -2.187 0.914 14.925 107 HH11 ARG 514 HH12 ARG 514 -0.175 -1.915 14.361 108 HH12 ARG 514 HH11 ARG 514 0.731 -1.688 15.832 109 HH21 ARG 514 HH22 ARG 514 -0.982 1.182 16.843 110 HH22 ARG 514 HH21 ARG 514 0.277 0.043 17.239 111 H PHE 515 HN PHE 515 -2.619 -3.023 10.174 112 HA PHE 515 HA PHE 515 -3.214 -2.598 7.455 113 HB2 PHE 515 HB2 PHE 515 -1.644 -4.859 8.696 114 HB3 PHE 515 HB3 PHE 515 -1.554 -4.293 7.039 115 HD1 PHE 515 HD1 PHE 515 -1.768 -1.287 8.015 116 HD2 PHE 515 HD2 PHE 515 0.759 -4.584 8.948 117 HE1 PHE 515 HE1 PHE 515 0.027 0.270 8.625 118 HE2 PHE 515 HE2 PHE 515 2.561 -3.026 9.564 119 HZ PHE 515 HZ PHE 515 2.196 -0.598 9.398 120 H SER 516 HN SER 516 -4.391 -4.937 9.776 121 HA SER 516 HA SER 516 -5.209 -6.939 7.983 122 HB2 SER 516 HB2 SER 516 -6.864 -7.502 9.886 123 HB3 SER 516 HB3 SER 516 -5.135 -7.598 10.222 124 HG SER 516 HG SER 516 -5.257 -5.914 11.502 125 H MET 517 HN MET 517 -6.728 -3.932 8.936 126 HA MET 517 HA MET 517 -9.284 -4.501 7.807 127 HB2 MET 517 HB2 MET 517 -7.914 -1.850 8.307 128 HB3 MET 517 HB3 MET 517 -9.610 -2.047 7.886 129 HG2 MET 517 HG2 MET 517 -9.998 -3.262 9.957 130 HG3 MET 517 HG3 MET 517 -8.289 -3.116 10.372 131 HE1 MET 517 HE1 MET 517 -7.969 0.813 10.642 132 HE2 MET 517 HE2 MET 517 -7.091 -0.712 10.768 133 HE3 MET 517 HE3 MET 517 -7.748 -0.195 9.214 134 H LEU 518 HN LEU 518 -6.281 -3.122 6.598 135 HA LEU 518 HA LEU 518 -7.230 -2.526 3.997 136 HB2 LEU 518 HB2 LEU 518 -5.143 -1.570 4.727 137 HB3 LEU 518 HB3 LEU 518 -4.461 -3.159 5.019 138 HG LEU 518 HG LEU 518 -4.616 -3.618 2.575 139 HD11 LEU 518 HD11 LEU 518 -6.343 -2.112 1.919 140 HD12 LEU 518 HD12 LEU 518 -5.415 -0.718 2.485 141 HD13 LEU 518 HD13 LEU 518 -4.859 -1.639 1.089 142 HD21 LEU 518 HD21 LEU 518 -2.978 -1.224 3.388 143 HD22 LEU 518 HD22 LEU 518 -2.520 -2.917 3.576 144 HD23 LEU 518 HD23 LEU 518 -2.700 -2.223 1.962 145 H VAL 519 HN VAL 519 -5.750 -5.399 5.431 146 HA VAL 519 HA VAL 519 -5.628 -7.019 3.176 147 HB VAL 519 HB VAL 519 -6.345 -7.851 5.997 148 HG11 VAL 519 HG11 VAL 519 -5.524 -10.079 5.307 149 HG12 VAL 519 HG12 VAL 519 -6.973 -9.580 4.432 150 HG13 VAL 519 HG13 VAL 519 -5.395 -9.487 3.650 151 HG21 VAL 519 HG21 VAL 519 -3.996 -8.385 6.249 152 HG22 VAL 519 HG22 VAL 519 -3.674 -7.865 4.594 153 HG23 VAL 519 HG23 VAL 519 -4.180 -6.688 5.808 154 H ALA 520 HN ALA 520 -8.346 -6.162 5.227 155 HA ALA 520 HA ALA 520 -10.203 -8.035 4.210 156 HB1 ALA 520 HB1 ALA 520 -10.598 -6.875 6.310 157 HB2 ALA 520 HB2 ALA 520 -10.678 -5.325 5.473 158 HB3 ALA 520 HB3 ALA 520 -11.919 -6.547 5.189 159 H ALA 521 HN ALA 521 -9.312 -4.753 3.216 160 HA ALA 521 HA ALA 521 -11.263 -4.517 1.171 161 HB1 ALA 521 HB1 ALA 521 -10.089 -2.573 2.114 162 HB2 ALA 521 HB2 ALA 521 -8.584 -3.139 1.389 163 HB3 ALA 521 HB3 ALA 521 -9.928 -2.647 0.359 164 H ILE 522 HN ILE 522 -7.799 -5.349 1.078 165 HA ILE 522 HA ILE 522 -7.595 -5.943 -1.642 166 HB ILE 522 HB ILE 522 -6.119 -7.307 0.623 167 HG12 ILE 522 HG12 ILE 522 -5.364 -4.838 -0.955 168 HG13 ILE 522 HG13 ILE 522 -5.937 -4.842 0.709 169 HG21 ILE 522 HG21 ILE 522 -4.363 -7.687 -1.053 170 HG22 ILE 522 HG22 ILE 522 -5.874 -8.497 -1.474 171 HG23 ILE 522 HG23 ILE 522 -5.416 -7.000 -2.289 172 HD11 ILE 522 HD11 ILE 522 -3.522 -4.594 0.598 173 HD12 ILE 522 HD12 ILE 522 -3.960 -6.108 1.384 174 HD13 ILE 522 HD13 ILE 522 -3.394 -6.115 -0.288 175 H GLN 523 HN GLN 523 -8.605 -7.951 1.060 176 HA GLN 523 HA GLN 523 -8.640 -10.419 -0.341 177 HB2 GLN 523 HB2 GLN 523 -8.450 -10.027 2.158 178 HB3 GLN 523 HB3 GLN 523 -10.178 -9.725 2.162 179 HG2 GLN 523 HG2 GLN 523 -10.632 -11.967 1.459 180 HG3 GLN 523 HG3 GLN 523 -8.915 -12.280 1.203 181 HE21 GLN 523 HE21 GLN 523 -11.426 -11.808 3.564 182 HE22 GLN 523 HE22 GLN 523 -10.542 -12.435 4.920 183 H SER 524 HN SER 524 -11.104 -7.991 0.405 184 HA SER 524 HA SER 524 -13.258 -9.502 -0.698 185 HB2 SER 524 HB2 SER 524 -13.063 -6.522 -0.190 186 HB3 SER 524 HB3 SER 524 -14.545 -7.424 -0.506 187 HG SER 524 HG SER 524 -12.831 -7.578 1.743 188 H ALA 525 HN ALA 525 -10.956 -7.181 -1.967 189 HA ALA 525 HA ALA 525 -12.245 -6.871 -4.500 190 HB1 ALA 525 HB1 ALA 525 -10.657 -5.226 -3.520 191 HB2 ALA 525 HB2 ALA 525 -9.352 -6.378 -3.807 192 HB3 ALA 525 HB3 ALA 525 -10.252 -5.705 -5.170 193 H GLY 526 HN GLY 526 -10.216 -9.244 -3.068 194 HA2 GLY 526 HA2 GLY 526 -9.890 -11.401 -3.880 195 HA3 GLY 526 HA3 GLY 526 -10.501 -10.876 -5.441 196 H LEU 527 HN LEU 527 -7.860 -9.357 -3.658 197 HA LEU 527 HA LEU 527 -6.041 -10.263 -5.794 198 HB2 LEU 527 HB2 LEU 527 -6.105 -7.731 -4.186 199 HB3 LEU 527 HB3 LEU 527 -4.612 -8.277 -4.923 200 HG LEU 527 HG LEU 527 -5.860 -8.291 -7.140 201 HD11 LEU 527 HD11 LEU 527 -8.127 -8.249 -6.195 202 HD12 LEU 527 HD12 LEU 527 -7.826 -6.624 -5.582 203 HD13 LEU 527 HD13 LEU 527 -7.843 -6.921 -7.321 204 HD21 LEU 527 HD21 LEU 527 -4.232 -6.585 -6.529 205 HD22 LEU 527 HD22 LEU 527 -5.565 -5.889 -7.451 206 HD23 LEU 527 HD23 LEU 527 -5.492 -5.668 -5.705 207 H THR 528 HN THR 528 -6.834 -11.408 -3.040 208 HA THR 528 HA THR 528 -4.632 -11.256 -1.314 209 HB THR 528 HB THR 528 -6.509 -13.604 -1.600 210 HG1 THR 528 HG1 THR 528 -6.878 -11.224 -0.059 211 HG21 THR 528 HG21 THR 528 -6.119 -13.882 0.793 212 HG22 THR 528 HG22 THR 528 -5.060 -12.471 0.800 213 HG23 THR 528 HG23 THR 528 -4.588 -13.923 -0.085 214 H GLU 529 HN GLU 529 -5.271 -13.295 -4.094 215 HA GLU 529 HA GLU 529 -3.269 -15.231 -3.558 216 HB2 GLU 529 HB2 GLU 529 -3.617 -15.948 -5.884 217 HB3 GLU 529 HB3 GLU 529 -5.136 -15.747 -5.022 218 HG2 GLU 529 HG2 GLU 529 -5.535 -13.641 -6.126 219 HG3 GLU 529 HG3 GLU 529 -3.954 -13.714 -6.905 220 H THR 530 HN THR 530 -3.190 -12.083 -5.006 221 HA THR 530 HA THR 530 -0.843 -12.319 -6.531 222 HB THR 530 HB THR 530 -1.738 -9.828 -5.075 223 HG1 THR 530 HG1 THR 530 -3.047 -9.465 -6.939 224 HG21 THR 530 HG21 THR 530 -0.758 -8.669 -6.985 225 HG22 THR 530 HG22 THR 530 -0.315 -10.212 -7.715 226 HG23 THR 530 HG23 THR 530 0.443 -9.697 -6.207 227 H LEU 531 HN LEU 531 -1.309 -11.077 -3.216 228 HA LEU 531 HA LEU 531 1.489 -10.900 -2.707 229 HB2 LEU 531 HB2 LEU 531 -0.873 -10.717 -0.844 230 HB3 LEU 531 HB3 LEU 531 0.759 -10.213 -0.483 231 HG LEU 531 HG LEU 531 -0.362 -8.253 -0.947 232 HD11 LEU 531 HD11 LEU 531 1.750 -8.321 -2.087 233 HD12 LEU 531 HD12 LEU 531 0.986 -9.067 -3.492 234 HD13 LEU 531 HD13 LEU 531 0.581 -7.409 -3.043 235 HD21 LEU 531 HD21 LEU 531 -2.354 -9.390 -1.951 236 HD22 LEU 531 HD22 LEU 531 -1.920 -7.822 -2.632 237 HD23 LEU 531 HD23 LEU 531 -1.500 -9.298 -3.492 238 H ASN 532 HN ASN 532 -0.292 -13.542 -3.032 239 HA ASN 532 HA ASN 532 0.551 -14.979 -0.648 240 HB2 ASN 532 HB2 ASN 532 -1.698 -15.278 -1.851 241 HB3 ASN 532 HB3 ASN 532 -0.795 -16.126 -3.099 242 HD21 ASN 532 HD21 ASN 532 -2.928 -17.080 -1.371 243 HD22 ASN 532 HD22 ASN 532 -2.274 -18.434 -0.516 244 H ARG 533 HN ARG 533 1.460 -14.518 -3.957 245 HA ARG 533 HA ARG 533 3.292 -16.738 -4.103 246 HB2 ARG 533 HB2 ARG 533 2.226 -15.928 -6.136 247 HB3 ARG 533 HB3 ARG 533 2.881 -14.318 -5.876 248 HG2 ARG 533 HG2 ARG 533 5.168 -15.318 -6.095 249 HG3 ARG 533 HG3 ARG 533 4.386 -16.817 -6.597 250 HD2 ARG 533 HD2 ARG 533 5.096 -15.499 -8.529 251 HD3 ARG 533 HD3 ARG 533 3.342 -15.660 -8.470 252 HE ARG 533 HE ARG 533 3.402 -13.349 -7.432 253 HH11 ARG 533 HH12 ARG 533 5.779 -14.464 -9.748 254 HH12 ARG 533 HH11 ARG 533 6.202 -12.860 -10.273 255 HH21 ARG 533 HH22 ARG 533 3.933 -11.248 -8.132 256 HH22 ARG 533 HH21 ARG 533 5.130 -11.029 -9.374 257 H GLU 534 HN GLU 534 5.475 -16.721 -3.657 258 HA GLU 534 HA GLU 534 6.596 -14.420 -2.351 259 HB2 GLU 534 HB2 GLU 534 8.024 -16.918 -3.282 260 HB3 GLU 534 HB3 GLU 534 8.643 -15.718 -2.158 261 HG2 GLU 534 HG2 GLU 534 6.738 -16.319 -0.639 262 HG3 GLU 534 HG3 GLU 534 6.419 -17.680 -1.717 263 H GLY 535 HN GLY 535 7.910 -12.900 -3.181 264 HA2 GLY 535 HA2 GLY 535 9.526 -13.042 -5.429 265 HA3 GLY 535 HA3 GLY 535 7.947 -12.484 -5.982 266 H VAL 536 HN VAL 536 8.351 -10.384 -6.417 267 HA VAL 536 HA VAL 536 9.330 -8.796 -4.140 268 HB VAL 536 HB VAL 536 10.221 -7.158 -5.733 269 HG11 VAL 536 HG11 VAL 536 11.724 -8.850 -4.907 270 HG12 VAL 536 HG12 VAL 536 11.181 -9.988 -6.144 271 HG13 VAL 536 HG13 VAL 536 12.087 -8.545 -6.606 272 HG21 VAL 536 HG21 VAL 536 10.418 -7.749 -8.131 273 HG22 VAL 536 HG22 VAL 536 9.372 -9.139 -7.848 274 HG23 VAL 536 HG23 VAL 536 8.746 -7.504 -7.624 275 H TYR 537 HN TYR 537 8.051 -7.289 -3.378 276 HA TYR 537 HA TYR 537 6.048 -5.986 -5.021 277 HB2 TYR 537 HB2 TYR 537 5.327 -7.546 -2.527 278 HB3 TYR 537 HB3 TYR 537 4.273 -6.364 -3.283 279 HD1 TYR 537 HD1 TYR 537 3.688 -6.821 -5.796 280 HD2 TYR 537 HD2 TYR 537 5.132 -9.771 -3.096 281 HE1 TYR 537 HE1 TYR 537 2.723 -8.582 -7.219 282 HE2 TYR 537 HE2 TYR 537 4.181 -11.539 -4.508 283 HH TYR 537 HH TYR 537 2.263 -11.707 -6.183 284 H THR 538 HN THR 538 5.559 -3.952 -4.266 285 HA THR 538 HA THR 538 6.666 -3.226 -1.633 286 HB THR 538 HB THR 538 6.273 -1.361 -3.986 287 HG1 THR 538 HG1 THR 538 8.035 -2.489 -4.575 288 HG21 THR 538 HG21 THR 538 7.550 0.213 -2.684 289 HG22 THR 538 HG22 THR 538 7.789 -0.982 -1.411 290 HG23 THR 538 HG23 THR 538 6.176 -0.330 -1.718 291 H VAL 539 HN VAL 539 4.950 -3.344 -0.304 292 HA VAL 539 HA VAL 539 2.339 -2.414 -1.287 293 HB VAL 539 HB VAL 539 2.955 -4.136 1.124 294 HG11 VAL 539 HG11 VAL 539 0.900 -2.897 1.406 295 HG12 VAL 539 HG12 VAL 539 0.338 -3.419 -0.183 296 HG13 VAL 539 HG13 VAL 539 0.538 -4.599 1.113 297 HG21 VAL 539 HG21 VAL 539 3.502 -5.321 -0.921 298 HG22 VAL 539 HG22 VAL 539 2.031 -5.990 -0.212 299 HG23 VAL 539 HG23 VAL 539 1.929 -4.910 -1.604 300 H PHE 540 HN PHE 540 1.509 -0.591 -0.549 301 HA PHE 540 HA PHE 540 2.651 0.634 1.850 302 HB2 PHE 540 HB2 PHE 540 0.843 1.770 -0.298 303 HB3 PHE 540 HB3 PHE 540 1.465 2.670 1.078 304 HD1 PHE 540 HD1 PHE 540 2.291 1.160 -2.145 305 HD2 PHE 540 HD2 PHE 540 3.771 3.376 1.172 306 HE1 PHE 540 HE1 PHE 540 4.293 1.755 -3.446 307 HE2 PHE 540 HE2 PHE 540 5.777 3.975 -0.125 308 HZ PHE 540 HZ PHE 540 6.038 3.165 -2.434 309 H ALA 541 HN ALA 541 1.602 0.186 3.693 310 HA ALA 541 HA ALA 541 -1.260 -0.480 3.531 311 HB1 ALA 541 HB1 ALA 541 0.709 -1.193 5.698 312 HB2 ALA 541 HB2 ALA 541 -0.988 -1.687 5.623 313 HB3 ALA 541 HB3 ALA 541 0.160 -2.269 4.410 314 HA PRO 542 HA PRO 542 -1.850 3.436 5.675 315 HB2 PRO 542 HB2 PRO 542 -4.680 2.797 5.313 316 HB3 PRO 542 HB3 PRO 542 -3.757 4.164 4.693 317 HG2 PRO 542 HG2 PRO 542 -4.663 2.203 3.084 318 HG3 PRO 542 HG3 PRO 542 -3.136 3.051 2.777 319 HD2 PRO 542 HD2 PRO 542 -3.593 0.362 4.019 320 HD3 PRO 542 HD3 PRO 542 -2.377 0.858 2.824 321 H THR 543 HN THR 543 -2.281 3.869 7.756 322 HA THR 543 HA THR 543 -2.899 1.686 9.517 323 HB THR 543 HB THR 543 -2.639 3.408 11.313 324 HG1 THR 543 HG1 THR 543 -1.491 5.286 9.719 325 HG21 THR 543 HG21 THR 543 -0.412 3.263 9.279 326 HG22 THR 543 HG22 THR 543 -0.728 2.091 10.560 327 HG23 THR 543 HG23 THR 543 -0.230 3.734 10.967 328 H ASN 544 HN ASN 544 -4.411 2.451 11.487 329 HA ASN 544 HA ASN 544 -7.041 2.364 10.490 330 HB2 ASN 544 HB2 ASN 544 -6.467 1.481 12.702 331 HB3 ASN 544 HB3 ASN 544 -6.054 3.097 13.260 332 HD21 ASN 544 HD21 ASN 544 -7.692 4.541 13.765 333 HD22 ASN 544 HD22 ASN 544 -9.352 4.068 13.905 334 H GLU 545 HN GLU 545 -4.980 4.997 11.495 335 HA GLU 545 HA GLU 545 -6.965 6.947 11.883 336 HB2 GLU 545 HB2 GLU 545 -4.492 7.009 12.549 337 HB3 GLU 545 HB3 GLU 545 -4.186 7.550 10.902 338 HG2 GLU 545 HG2 GLU 545 -4.323 9.459 12.335 339 HG3 GLU 545 HG3 GLU 545 -5.742 9.437 11.286 340 H ALA 546 HN ALA 546 -5.398 5.746 9.017 341 HA ALA 546 HA ALA 546 -6.071 7.843 7.258 342 HB1 ALA 546 HB1 ALA 546 -4.392 6.177 6.678 343 HB2 ALA 546 HB2 ALA 546 -5.636 4.924 6.665 344 HB3 ALA 546 HB3 ALA 546 -5.682 6.218 5.467 345 H PHE 547 HN PHE 547 -7.632 4.777 7.978 346 HA PHE 547 HA PHE 547 -9.823 5.154 6.232 347 HB2 PHE 547 HB2 PHE 547 -9.467 3.316 8.610 348 HB3 PHE 547 HB3 PHE 547 -10.773 3.212 7.446 349 HD1 PHE 547 HD1 PHE 547 -10.187 2.764 5.024 350 HD2 PHE 547 HD2 PHE 547 -7.438 2.250 8.223 351 HE1 PHE 547 HE1 PHE 547 -8.812 1.308 3.597 352 HE2 PHE 547 HE2 PHE 547 -6.050 0.796 6.803 353 HZ PHE 547 HZ PHE 547 -6.736 0.327 4.483 354 H ARG 548 HN ARG 548 -9.075 6.226 9.402 355 HA ARG 548 HA ARG 548 -11.820 6.703 10.204 356 HB2 ARG 548 HB2 ARG 548 -9.889 6.055 11.760 357 HB3 ARG 548 HB3 ARG 548 -9.310 7.701 11.559 358 HG2 ARG 548 HG2 ARG 548 -12.090 7.130 12.523 359 HG3 ARG 548 HG3 ARG 548 -10.711 7.144 13.627 360 HD2 ARG 548 HD2 ARG 548 -11.573 9.418 11.840 361 HD3 ARG 548 HD3 ARG 548 -11.876 9.300 13.575 362 HE ARG 548 HE ARG 548 -9.113 9.047 13.134 363 HH11 ARG 548 HH12 ARG 548 -11.638 11.462 12.862 364 HH12 ARG 548 HH11 ARG 548 -10.571 12.800 13.167 365 HH21 ARG 548 HH22 ARG 548 -7.727 10.764 13.568 366 HH22 ARG 548 HH21 ARG 548 -8.328 12.400 13.588 367 H ALA 549 HN ALA 549 -9.042 8.517 9.010 368 HA ALA 549 HA ALA 549 -10.230 11.092 9.213 369 HB1 ALA 549 HB1 ALA 549 -8.459 11.817 7.686 370 HB2 ALA 549 HB2 ALA 549 -7.815 10.803 8.977 371 HB3 ALA 549 HB3 ALA 549 -8.046 10.132 7.363 372 H LEU 550 HN LEU 550 -10.322 8.536 6.852 373 HA LEU 550 HA LEU 550 -11.516 9.963 4.736 374 HB2 LEU 550 HB2 LEU 550 -11.545 7.052 5.506 375 HB3 LEU 550 HB3 LEU 550 -12.382 7.651 4.084 376 HG LEU 550 HG LEU 550 -9.415 7.954 4.564 377 HD11 LEU 550 HD11 LEU 550 -10.044 5.601 4.274 378 HD12 LEU 550 HD12 LEU 550 -10.880 6.016 2.775 379 HD13 LEU 550 HD13 LEU 550 -9.130 6.213 2.897 380 HD21 LEU 550 HD21 LEU 550 -9.353 8.636 2.236 381 HD22 LEU 550 HD22 LEU 550 -11.100 8.415 2.104 382 HD23 LEU 550 HD23 LEU 550 -10.448 9.682 3.146 383 HA PRO 551 HA PRO 551 -15.459 10.723 6.534 384 HB2 PRO 551 HB2 PRO 551 -16.433 11.360 3.864 385 HB3 PRO 551 HB3 PRO 551 -16.128 12.445 5.222 386 HG2 PRO 551 HG2 PRO 551 -14.610 12.448 2.971 387 HG3 PRO 551 HG3 PRO 551 -13.968 12.872 4.569 388 HD2 PRO 551 HD2 PRO 551 -13.743 10.289 3.061 389 HD3 PRO 551 HD3 PRO 551 -12.503 11.156 4.001 390 HA PRO 552 HA PRO 552 -17.809 7.007 6.033 391 HB2 PRO 552 HB2 PRO 552 -20.156 8.799 6.429 392 HB3 PRO 552 HB3 PRO 552 -19.708 7.325 7.293 393 HG2 PRO 552 HG2 PRO 552 -19.363 9.711 8.415 394 HG3 PRO 552 HG3 PRO 552 -18.166 8.420 8.634 395 HD2 PRO 552 HD2 PRO 552 -18.050 10.842 6.892 396 HD3 PRO 552 HD3 PRO 552 -16.752 10.037 7.799 397 H ARG 553 HN ARG 553 -18.724 9.934 4.331 398 HA ARG 553 HA ARG 553 -20.455 8.762 2.425 399 HB2 ARG 553 HB2 ARG 553 -20.364 11.181 2.915 400 HB3 ARG 553 HB3 ARG 553 -18.754 11.256 2.219 401 HG2 ARG 553 HG2 ARG 553 -19.722 10.519 0.048 402 HG3 ARG 553 HG3 ARG 553 -21.323 10.651 0.776 403 HD2 ARG 553 HD2 ARG 553 -20.757 12.658 -0.497 404 HD3 ARG 553 HD3 ARG 553 -20.930 13.023 1.221 405 HE ARG 553 HE ARG 553 -18.222 12.433 0.449 406 HH11 ARG 553 HH12 ARG 553 -20.630 14.985 0.562 407 HH12 ARG 553 HH11 ARG 553 -19.452 16.252 0.692 408 HH21 ARG 553 HH22 ARG 553 -16.692 14.082 0.649 409 HH22 ARG 553 HH21 ARG 553 -17.216 15.749 0.722 410 H GLU 554 HN GLU 554 -17.025 9.719 2.203 411 HA GLU 554 HA GLU 554 -16.681 8.819 -0.445 412 HB2 GLU 554 HB2 GLU 554 -14.892 9.753 1.729 413 HB3 GLU 554 HB3 GLU 554 -14.150 8.814 0.442 414 HG2 GLU 554 HG2 GLU 554 -14.024 11.233 0.062 415 HG3 GLU 554 HG3 GLU 554 -14.899 10.388 -1.209 416 H ARG 555 HN ARG 555 -15.804 7.313 2.668 417 HA ARG 555 HA ARG 555 -14.459 5.118 1.552 418 HB2 ARG 555 HB2 ARG 555 -14.780 3.998 3.735 419 HB3 ARG 555 HB3 ARG 555 -14.175 5.637 3.895 420 HG2 ARG 555 HG2 ARG 555 -16.239 6.436 4.687 421 HG3 ARG 555 HG3 ARG 555 -17.092 4.980 4.170 422 HD2 ARG 555 HD2 ARG 555 -14.934 4.989 6.274 423 HD3 ARG 555 HD3 ARG 555 -16.649 5.154 6.646 424 HE ARG 555 HE ARG 555 -16.286 2.873 5.051 425 HH11 ARG 555 HH12 ARG 555 -15.625 4.024 8.281 426 HH12 ARG 555 HH11 ARG 555 -15.672 2.443 9.003 427 HH21 ARG 555 HH22 ARG 555 -16.319 0.775 5.974 428 HH22 ARG 555 HH21 ARG 555 -16.057 0.591 7.684 429 H SER 556 HN SER 556 -17.890 5.576 2.266 430 HA SER 556 HA SER 556 -18.571 2.828 1.931 431 HB2 SER 556 HB2 SER 556 -20.340 5.282 1.869 432 HB3 SER 556 HB3 SER 556 -20.905 3.610 1.984 433 HG SER 556 HG SER 556 -19.884 5.253 3.918 434 H ARG 557 HN ARG 557 -18.276 5.532 -0.248 435 HA ARG 557 HA ARG 557 -19.696 4.268 -2.404 436 HB2 ARG 557 HB2 ARG 557 -19.285 6.771 -2.137 437 HB3 ARG 557 HB3 ARG 557 -17.632 6.461 -2.644 438 HG2 ARG 557 HG2 ARG 557 -18.547 5.477 -4.752 439 HG3 ARG 557 HG3 ARG 557 -20.144 6.034 -4.244 440 HD2 ARG 557 HD2 ARG 557 -17.714 7.689 -4.879 441 HD3 ARG 557 HD3 ARG 557 -19.279 7.707 -5.692 442 HE ARG 557 HE ARG 557 -20.170 8.628 -3.535 443 HH11 ARG 557 HH12 ARG 557 -16.860 9.122 -4.545 444 HH12 ARG 557 HH11 ARG 557 -16.599 10.479 -3.492 445 HH21 ARG 557 HH22 ARG 557 -19.836 10.405 -2.144 446 HH22 ARG 557 HH21 ARG 557 -18.275 11.176 -2.080 447 H LEU 558 HN LEU 558 -16.324 4.670 -1.465 448 HA LEU 558 HA LEU 558 -15.173 3.394 -3.710 449 HB2 LEU 558 HB2 LEU 558 -14.117 4.954 -1.951 450 HB3 LEU 558 HB3 LEU 558 -13.954 3.522 -0.961 451 HG LEU 558 HG LEU 558 -11.896 4.239 -2.245 452 HD11 LEU 558 HD11 LEU 558 -12.947 1.457 -2.722 453 HD12 LEU 558 HD12 LEU 558 -11.261 1.956 -2.861 454 HD13 LEU 558 HD13 LEU 558 -12.071 2.015 -1.295 455 HD21 LEU 558 HD21 LEU 558 -13.466 3.147 -4.576 456 HD22 LEU 558 HD22 LEU 558 -13.010 4.833 -4.336 457 HD23 LEU 558 HD23 LEU 558 -11.764 3.613 -4.599 458 H LEU 559 HN LEU 559 -16.124 2.248 -0.498 459 HA LEU 559 HA LEU 559 -15.229 -0.450 -1.033 460 HB2 LEU 559 HB2 LEU 559 -16.786 0.745 1.264 461 HB3 LEU 559 HB3 LEU 559 -16.233 -0.918 1.200 462 HG LEU 559 HG LEU 559 -14.342 1.430 1.080 463 HD11 LEU 559 HD11 LEU 559 -15.220 -0.149 3.494 464 HD12 LEU 559 HD12 LEU 559 -13.921 1.042 3.460 465 HD13 LEU 559 HD13 LEU 559 -15.587 1.545 3.170 466 HD21 LEU 559 HD21 LEU 559 -13.971 -1.502 1.683 467 HD22 LEU 559 HD22 LEU 559 -13.436 -0.648 0.237 468 HD23 LEU 559 HD23 LEU 559 -12.711 -0.273 1.800 469 H GLY 560 HN GLY 560 -17.783 1.252 -2.110 470 HA2 GLY 560 HA2 GLY 560 -19.856 -0.747 -1.687 471 HA3 GLY 560 HA3 GLY 560 -20.040 0.787 -2.523 472 H ASP 561 HN ASP 561 -17.378 -0.251 -3.904 473 HA ASP 561 HA ASP 561 -18.736 -2.023 -5.828 474 HB2 ASP 561 HB2 ASP 561 -18.519 0.321 -6.698 475 HB3 ASP 561 HB3 ASP 561 -16.771 0.159 -6.559 476 H ALA 562 HN ALA 562 -17.628 -3.820 -6.340 477 HA ALA 562 HA ALA 562 -15.275 -4.401 -4.811 478 HB1 ALA 562 HB1 ALA 562 -15.481 -6.645 -5.703 479 HB2 ALA 562 HB2 ALA 562 -17.052 -6.056 -5.159 480 HB3 ALA 562 HB3 ALA 562 -16.670 -6.088 -6.881 481 H LYS 563 HN LYS 563 -15.921 -3.450 -8.096 482 HA LYS 563 HA LYS 563 -13.391 -4.440 -9.084 483 HB2 LYS 563 HB2 LYS 563 -15.587 -2.804 -10.359 484 HB3 LYS 563 HB3 LYS 563 -14.067 -3.136 -11.177 485 HG2 LYS 563 HG2 LYS 563 -15.621 -4.730 -11.960 486 HG3 LYS 563 HG3 LYS 563 -14.544 -5.584 -10.854 487 HD2 LYS 563 HD2 LYS 563 -16.256 -5.282 -9.070 488 HD3 LYS 563 HD3 LYS 563 -17.340 -4.608 -10.286 489 HE2 LYS 563 HE2 LYS 563 -16.136 -7.369 -10.322 490 HE3 LYS 563 HE3 LYS 563 -17.796 -6.975 -9.888 491 HZ1 LYS 563 HZ1 LYS 563 -16.520 -6.637 -12.547 492 HZ2 LYS 563 HZ2 LYS 563 -18.063 -6.059 -12.158 493 HZ3 LYS 563 HZ3 LYS 563 -17.755 -7.724 -12.134 494 H GLU 564 HN GLU 564 -14.825 -1.368 -8.118 495 HA GLU 564 HA GLU 564 -12.599 0.270 -8.641 496 HB2 GLU 564 HB2 GLU 564 -14.647 0.455 -6.420 497 HB3 GLU 564 HB3 GLU 564 -13.493 1.719 -6.814 498 HG2 GLU 564 HG2 GLU 564 -15.646 0.670 -8.632 499 HG3 GLU 564 HG3 GLU 564 -15.688 2.189 -7.742 500 H LEU 565 HN LEU 565 -13.461 -1.675 -5.802 501 HA LEU 565 HA LEU 565 -11.238 -1.151 -4.227 502 HB2 LEU 565 HB2 LEU 565 -12.940 -3.614 -4.530 503 HB3 LEU 565 HB3 LEU 565 -11.658 -3.497 -3.351 504 HG LEU 565 HG LEU 565 -14.097 -1.733 -3.470 505 HD11 LEU 565 HD11 LEU 565 -14.596 -4.013 -2.754 506 HD12 LEU 565 HD12 LEU 565 -13.332 -3.913 -1.529 507 HD13 LEU 565 HD13 LEU 565 -14.752 -2.873 -1.420 508 HD21 LEU 565 HD21 LEU 565 -12.117 -0.572 -2.628 509 HD22 LEU 565 HD22 LEU 565 -13.313 -0.831 -1.357 510 HD23 LEU 565 HD23 LEU 565 -11.875 -1.852 -1.440 511 H ALA 566 HN ALA 566 -11.733 -3.780 -6.571 512 HA ALA 566 HA ALA 566 -9.250 -5.004 -6.333 513 HB1 ALA 566 HB1 ALA 566 -11.161 -5.975 -7.533 514 HB2 ALA 566 HB2 ALA 566 -10.940 -4.796 -8.824 515 HB3 ALA 566 HB3 ALA 566 -9.692 -6.001 -8.507 516 H ASN 567 HN ASN 567 -10.138 -2.084 -7.912 517 HA ASN 567 HA ASN 567 -7.687 -1.929 -9.459 518 HB2 ASN 567 HB2 ASN 567 -10.072 -1.009 -10.080 519 HB3 ASN 567 HB3 ASN 567 -9.561 0.379 -9.125 520 HD21 ASN 567 HD21 ASN 567 -7.822 1.635 -9.845 521 HD22 ASN 567 HD22 ASN 567 -7.275 1.573 -11.488 522 H ILE 568 HN ILE 568 -9.077 -0.558 -6.536 523 HA ILE 568 HA ILE 568 -7.114 1.438 -6.122 524 HB ILE 568 HB ILE 568 -9.135 0.156 -4.308 525 HG12 ILE 568 HG12 ILE 568 -9.901 1.688 -6.106 526 HG13 ILE 568 HG13 ILE 568 -10.267 2.281 -4.494 527 HG21 ILE 568 HG21 ILE 568 -8.609 1.906 -2.646 528 HG22 ILE 568 HG22 ILE 568 -7.295 0.750 -2.870 529 HG23 ILE 568 HG23 ILE 568 -7.197 2.353 -3.602 530 HD11 ILE 568 HD11 ILE 568 -7.987 3.204 -6.229 531 HD12 ILE 568 HD12 ILE 568 -9.501 4.067 -5.962 532 HD13 ILE 568 HD13 ILE 568 -8.378 3.819 -4.623 533 H LEU 569 HN LEU 569 -7.520 -1.781 -4.512 534 HA LEU 569 HA LEU 569 -5.120 -1.601 -3.089 535 HB2 LEU 569 HB2 LEU 569 -6.737 -3.950 -4.036 536 HB3 LEU 569 HB3 LEU 569 -5.350 -4.103 -2.975 537 HG LEU 569 HG LEU 569 -7.131 -4.140 -1.530 538 HD11 LEU 569 HD11 LEU 569 -7.112 -2.055 -0.271 539 HD12 LEU 569 HD12 LEU 569 -5.495 -2.547 -0.774 540 HD13 LEU 569 HD13 LEU 569 -6.333 -1.259 -1.640 541 HD21 LEU 569 HD21 LEU 569 -8.463 -1.844 -2.898 542 HD22 LEU 569 HD22 LEU 569 -8.871 -3.544 -3.141 543 HD23 LEU 569 HD23 LEU 569 -9.094 -2.802 -1.560 544 H LYS 570 HN LYS 570 -5.803 -2.352 -6.368 545 HA LYS 570 HA LYS 570 -3.373 -3.667 -7.035 546 HB2 LYS 570 HB2 LYS 570 -5.461 -3.793 -8.349 547 HB3 LYS 570 HB3 LYS 570 -5.302 -2.094 -8.758 548 HG2 LYS 570 HG2 LYS 570 -3.146 -2.667 -9.898 549 HG3 LYS 570 HG3 LYS 570 -3.539 -4.368 -9.627 550 HD2 LYS 570 HD2 LYS 570 -5.322 -2.415 -11.084 551 HD3 LYS 570 HD3 LYS 570 -4.203 -3.529 -11.873 552 HE2 LYS 570 HE2 LYS 570 -6.115 -4.672 -9.919 553 HE3 LYS 570 HE3 LYS 570 -6.767 -4.123 -11.462 554 HZ1 LYS 570 HZ1 LYS 570 -6.043 -6.513 -11.361 555 HZ2 LYS 570 HZ2 LYS 570 -4.442 -5.958 -11.273 556 HZ3 LYS 570 HZ3 LYS 570 -5.389 -5.604 -12.634 557 H TYR 571 HN TYR 571 -4.074 -0.489 -6.194 558 HA TYR 571 HA TYR 571 -1.857 0.637 -7.746 559 HB2 TYR 571 HB2 TYR 571 -4.026 1.755 -7.928 560 HB3 TYR 571 HB3 TYR 571 -4.072 1.986 -6.185 561 HD1 TYR 571 HD1 TYR 571 -1.771 2.695 -9.034 562 HD2 TYR 571 HD2 TYR 571 -3.523 4.088 -5.418 563 HE1 TYR 571 HE1 TYR 571 -0.643 4.849 -9.328 564 HE2 TYR 571 HE2 TYR 571 -2.392 6.257 -5.690 565 HH TYR 571 HH TYR 571 -0.743 7.074 -8.658 566 H HIS 572 HN HIS 572 -2.679 -0.407 -4.612 567 HA HIS 572 HA HIS 572 -0.820 1.350 -3.245 568 HB2 HIS 572 HB2 HIS 572 -2.714 -0.799 -2.331 569 HB3 HIS 572 HB3 HIS 572 -1.476 -0.171 -1.248 570 HD1 HIS 572 HD1 HIS 572 -4.502 1.043 -3.215 571 HD2 HIS 572 HD2 HIS 572 -2.091 2.167 -0.018 572 HE1 HIS 572 HE1 HIS 572 -5.626 3.037 -2.143 573 H ILE 573 HN ILE 573 -0.538 -1.370 -5.051 574 HA ILE 573 HA ILE 573 1.837 -2.280 -3.566 575 HB ILE 573 HB ILE 573 0.227 -3.901 -5.545 576 HG12 ILE 573 HG12 ILE 573 0.168 -4.172 -2.539 577 HG13 ILE 573 HG13 ILE 573 -1.017 -3.209 -3.417 578 HG21 ILE 573 HG21 ILE 573 2.543 -4.608 -5.261 579 HG22 ILE 573 HG22 ILE 573 2.319 -4.687 -3.512 580 HG23 ILE 573 HG23 ILE 573 1.438 -5.795 -4.566 581 HD11 ILE 573 HD11 ILE 573 -1.712 -5.177 -4.649 582 HD12 ILE 573 HD12 ILE 573 -0.522 -6.153 -3.785 583 HD13 ILE 573 HD13 ILE 573 -1.868 -5.421 -2.910 584 H GLY 574 HN GLY 574 3.718 -1.930 -4.560 585 HA2 GLY 574 HA2 GLY 574 3.760 -1.129 -7.362 586 HA3 GLY 574 HA3 GLY 574 5.118 -1.099 -6.248 587 H ASP 575 HN ASP 575 5.188 -2.110 -8.906 588 HA ASP 575 HA ASP 575 4.721 -4.938 -8.921 589 HB2 ASP 575 HB2 ASP 575 4.399 -3.593 -10.926 590 HB3 ASP 575 HB3 ASP 575 6.097 -3.138 -10.928 591 H GLU 576 HN GLU 576 7.269 -3.120 -7.719 592 HA GLU 576 HA GLU 576 8.787 -5.439 -7.203 593 HB2 GLU 576 HB2 GLU 576 10.883 -4.629 -8.200 594 HB3 GLU 576 HB3 GLU 576 9.675 -4.993 -9.414 595 HG2 GLU 576 HG2 GLU 576 9.165 -2.587 -9.572 596 HG3 GLU 576 HG3 GLU 576 10.469 -2.271 -8.424 597 H ILE 577 HN ILE 577 10.726 -4.836 -5.898 598 HA ILE 577 HA ILE 577 9.650 -3.228 -3.780 599 HB ILE 577 HB ILE 577 12.238 -4.790 -3.895 600 HG12 ILE 577 HG12 ILE 577 9.572 -5.492 -2.650 601 HG13 ILE 577 HG13 ILE 577 10.203 -6.174 -4.145 602 HG21 ILE 577 HG21 ILE 577 12.257 -4.606 -1.466 603 HG22 ILE 577 HG22 ILE 577 12.291 -3.009 -2.213 604 HG23 ILE 577 HG23 ILE 577 10.791 -3.625 -1.516 605 HD11 ILE 577 HD11 ILE 577 11.430 -6.474 -1.415 606 HD12 ILE 577 HD12 ILE 577 10.511 -7.702 -2.284 607 HD13 ILE 577 HD13 ILE 577 12.068 -7.155 -2.910 608 H LEU 578 HN LEU 578 10.031 -1.211 -3.419 609 HA LEU 578 HA LEU 578 12.656 -0.085 -4.144 610 HB2 LEU 578 HB2 LEU 578 10.785 0.842 -5.517 611 HB3 LEU 578 HB3 LEU 578 10.023 1.399 -4.040 612 HG LEU 578 HG LEU 578 11.989 2.862 -3.616 613 HD11 LEU 578 HD11 LEU 578 12.836 1.955 -6.362 614 HD12 LEU 578 HD12 LEU 578 13.581 3.256 -5.432 615 HD13 LEU 578 HD13 LEU 578 13.662 1.594 -4.846 616 HD21 LEU 578 HD21 LEU 578 10.016 3.770 -4.689 617 HD22 LEU 578 HD22 LEU 578 11.467 4.491 -5.387 618 HD23 LEU 578 HD23 LEU 578 10.597 3.234 -6.266 619 H VAL 579 HN VAL 579 13.711 -0.130 -2.242 620 HA VAL 579 HA VAL 579 12.262 0.548 0.209 621 HB VAL 579 HB VAL 579 14.272 -0.271 1.404 622 HG11 VAL 579 HG11 VAL 579 12.423 -1.784 0.973 623 HG12 VAL 579 HG12 VAL 579 13.100 -2.193 -0.602 624 HG13 VAL 579 HG13 VAL 579 13.955 -2.650 0.872 625 HG21 VAL 579 HG21 VAL 579 15.954 0.223 -0.291 626 HG22 VAL 579 HG22 VAL 579 16.008 -1.482 0.159 627 HG23 VAL 579 HG23 VAL 579 15.254 -0.995 -1.359 628 H SER 580 HN SER 580 13.236 1.972 1.773 629 HA SER 580 HA SER 580 13.891 4.477 0.706 630 HB2 SER 580 HB2 SER 580 12.890 4.260 2.905 631 HB3 SER 580 HB3 SER 580 14.276 3.342 3.489 632 HG SER 580 HG SER 580 15.315 5.130 3.812 633 H GLY 581 HN GLY 581 15.894 1.883 1.984 634 HA2 GLY 581 HA2 GLY 581 18.336 3.355 1.865 635 HA3 GLY 581 HA3 GLY 581 18.176 1.623 2.096 636 H GLY 582 HN GLY 582 16.539 2.617 -0.684 637 HA2 GLY 582 HA2 GLY 582 18.812 2.684 -2.457 638 HA3 GLY 582 HA3 GLY 582 17.930 1.166 -2.512 639 H ILE 583 HN ILE 583 16.617 4.443 -2.091 640 HA ILE 583 HA ILE 583 14.787 4.011 -4.274 641 HB ILE 583 HB ILE 583 15.275 6.548 -2.700 642 HG12 ILE 583 HG12 ILE 583 13.279 4.308 -2.304 643 HG13 ILE 583 HG13 ILE 583 14.566 4.785 -1.204 644 HG21 ILE 583 HG21 ILE 583 12.974 5.742 -4.475 645 HG22 ILE 583 HG22 ILE 583 13.059 7.217 -3.512 646 HG23 ILE 583 HG23 ILE 583 14.195 6.961 -4.837 647 HD11 ILE 583 HD11 ILE 583 12.146 6.433 -1.908 648 HD12 ILE 583 HD12 ILE 583 12.412 5.547 -0.406 649 HD13 ILE 583 HD13 ILE 583 13.444 6.916 -0.816 650 H GLY 584 HN GLY 584 17.149 6.617 -3.649 651 HA2 GLY 584 HA2 GLY 584 18.779 7.348 -5.232 652 HA3 GLY 584 HA3 GLY 584 17.828 6.590 -6.502 653 H ALA 585 HN ALA 585 17.418 9.084 -4.009 654 HA ALA 585 HA ALA 585 16.597 11.184 -4.029 655 HB1 ALA 585 HB1 ALA 585 18.141 11.556 -5.894 656 HB2 ALA 585 HB2 ALA 585 16.879 11.071 -7.025 657 HB3 ALA 585 HB3 ALA 585 16.673 12.520 -6.040 658 H LEU 586 HN LEU 586 15.153 10.036 -7.082 659 HA LEU 586 HA LEU 586 12.544 9.858 -5.836 660 HB2 LEU 586 HB2 LEU 586 12.975 12.296 -6.474 661 HB3 LEU 586 HB3 LEU 586 12.907 11.767 -8.143 662 HG LEU 586 HG LEU 586 10.624 11.243 -6.257 663 HD11 LEU 586 HD11 LEU 586 11.078 13.712 -7.931 664 HD12 LEU 586 HD12 LEU 586 9.585 13.310 -7.080 665 HD13 LEU 586 HD13 LEU 586 11.059 13.636 -6.169 666 HD21 LEU 586 HD21 LEU 586 10.738 11.585 -9.251 667 HD22 LEU 586 HD22 LEU 586 10.651 10.044 -8.397 668 HD23 LEU 586 HD23 LEU 586 9.313 11.187 -8.293 669 H VAL 587 HN VAL 587 11.365 8.310 -6.776 670 HA VAL 587 HA VAL 587 12.078 7.445 -9.494 671 HB VAL 587 HB VAL 587 11.753 5.612 -7.105 672 HG11 VAL 587 HG11 VAL 587 12.122 4.946 -10.024 673 HG12 VAL 587 HG12 VAL 587 12.206 3.785 -8.699 674 HG13 VAL 587 HG13 VAL 587 10.692 4.621 -9.044 675 HG21 VAL 587 HG21 VAL 587 14.051 4.940 -7.598 676 HG22 VAL 587 HG22 VAL 587 14.109 6.104 -8.923 677 HG23 VAL 587 HG23 VAL 587 13.954 6.669 -7.260 678 H ARG 588 HN ARG 588 10.363 7.092 -10.755 679 HA ARG 588 HA ARG 588 7.701 7.174 -9.618 680 HB2 ARG 588 HB2 ARG 588 8.594 6.776 -12.485 681 HB3 ARG 588 HB3 ARG 588 6.933 7.006 -11.960 682 HG2 ARG 588 HG2 ARG 588 7.472 9.236 -11.166 683 HG3 ARG 588 HG3 ARG 588 9.156 9.010 -11.645 684 HD2 ARG 588 HD2 ARG 588 8.419 8.701 -13.978 685 HD3 ARG 588 HD3 ARG 588 6.757 9.010 -13.476 686 HE ARG 588 HE ARG 588 7.729 11.257 -12.694 687 HH11 ARG 588 HH12 ARG 588 8.824 9.471 -15.488 688 HH12 ARG 588 HH11 ARG 588 9.372 10.873 -16.349 689 HH21 ARG 588 HH22 ARG 588 8.446 13.114 -13.802 690 HH22 ARG 588 HH21 ARG 588 9.169 12.961 -15.376 691 H LEU 589 HN LEU 589 7.093 5.386 -8.591 692 HA LEU 589 HA LEU 589 8.136 2.812 -9.455 693 HB2 LEU 589 HB2 LEU 589 8.307 3.344 -7.098 694 HB3 LEU 589 HB3 LEU 589 6.581 3.633 -7.004 695 HG LEU 589 HG LEU 589 6.150 1.256 -7.453 696 HD11 LEU 589 HD11 LEU 589 9.148 0.946 -7.357 697 HD12 LEU 589 HD12 LEU 589 7.966 -0.362 -7.447 698 HD13 LEU 589 HD13 LEU 589 8.134 0.768 -8.790 699 HD21 LEU 589 HD21 LEU 589 6.977 0.387 -5.316 700 HD22 LEU 589 HD22 LEU 589 8.063 1.772 -5.183 701 HD23 LEU 589 HD23 LEU 589 6.316 2.016 -5.161 702 H LYS 590 HN LYS 590 7.062 1.808 -10.926 703 HA LYS 590 HA LYS 590 4.380 2.121 -11.632 704 HB2 LYS 590 HB2 LYS 590 4.707 -0.060 -12.822 705 HB3 LYS 590 HB3 LYS 590 6.004 1.096 -13.136 706 HG2 LYS 590 HG2 LYS 590 7.399 0.014 -11.482 707 HG3 LYS 590 HG3 LYS 590 6.090 -1.095 -11.089 708 HD2 LYS 590 HD2 LYS 590 6.255 -2.157 -13.220 709 HD3 LYS 590 HD3 LYS 590 7.380 -0.921 -13.806 710 HE2 LYS 590 HE2 LYS 590 9.087 -1.638 -12.344 711 HE3 LYS 590 HE3 LYS 590 7.971 -2.622 -11.403 712 HZ1 LYS 590 HZ1 LYS 590 9.445 -3.897 -12.884 713 HZ2 LYS 590 HZ2 LYS 590 8.696 -3.177 -14.227 714 HZ3 LYS 590 HZ3 LYS 590 7.795 -4.168 -13.175 715 H SER 591 HN SER 591 2.550 1.206 -10.929 716 HA SER 591 HA SER 591 2.665 -0.631 -8.655 717 HB2 SER 591 HB2 SER 591 0.223 -0.060 -8.459 718 HB3 SER 591 HB3 SER 591 1.299 1.331 -8.320 719 HG SER 591 HG SER 591 0.743 1.993 -10.325 720 H LEU 592 HN LEU 592 0.786 -2.315 -8.666 721 HA LEU 592 HA LEU 592 1.186 -4.136 -10.715 722 HB2 LEU 592 HB2 LEU 592 -0.811 -3.824 -8.531 723 HB3 LEU 592 HB3 LEU 592 -1.098 -5.042 -9.757 724 HG LEU 592 HG LEU 592 0.047 -5.794 -7.632 725 HD11 LEU 592 HD11 LEU 592 1.542 -7.311 -8.835 726 HD12 LEU 592 HD12 LEU 592 -0.010 -7.136 -9.655 727 HD13 LEU 592 HD13 LEU 592 1.409 -6.289 -10.267 728 HD21 LEU 592 HD21 LEU 592 2.417 -4.432 -8.890 729 HD22 LEU 592 HD22 LEU 592 1.614 -3.937 -7.399 730 HD23 LEU 592 HD23 LEU 592 2.449 -5.488 -7.477 731 H GLN 593 HN GLN 593 -1.034 -1.446 -10.630 732 HA GLN 593 HA GLN 593 -2.648 -2.518 -12.786 733 HB2 GLN 593 HB2 GLN 593 -3.835 -0.403 -12.721 734 HB3 GLN 593 HB3 GLN 593 -3.664 -1.050 -11.096 735 HG2 GLN 593 HG2 GLN 593 -2.156 0.565 -10.461 736 HG3 GLN 593 HG3 GLN 593 -1.655 0.896 -12.117 737 HE21 GLN 593 HE21 GLN 593 -3.955 1.570 -9.640 738 HE22 GLN 593 HE22 GLN 593 -4.723 2.884 -10.450 739 H GLY 594 HN GLY 594 0.101 -0.417 -12.407 740 HA2 GLY 594 HA2 GLY 594 1.494 -0.239 -14.451 741 HA3 GLY 594 HA3 GLY 594 0.010 0.147 -15.307 742 H ASP 595 HN ASP 595 -0.771 1.810 -12.786 743 HA ASP 595 HA ASP 595 0.197 4.285 -13.794 744 HB2 ASP 595 HB2 ASP 595 -1.959 3.979 -12.544 745 HB3 ASP 595 HB3 ASP 595 -1.023 3.819 -11.067 746 H LYS 596 HN LYS 596 1.252 5.898 -12.255 747 HA LYS 596 HA LYS 596 3.725 4.558 -11.375 748 HB2 LYS 596 HB2 LYS 596 3.521 7.417 -12.321 749 HB3 LYS 596 HB3 LYS 596 4.968 6.437 -12.143 750 HG2 LYS 596 HG2 LYS 596 4.287 5.050 -14.018 751 HG3 LYS 596 HG3 LYS 596 2.796 5.980 -14.183 752 HD2 LYS 596 HD2 LYS 596 4.283 8.023 -14.487 753 HD3 LYS 596 HD3 LYS 596 5.626 6.891 -14.655 754 HE2 LYS 596 HE2 LYS 596 3.145 6.930 -16.368 755 HE3 LYS 596 HE3 LYS 596 4.711 7.596 -16.823 756 HZ1 LYS 596 HZ1 LYS 596 4.312 5.390 -17.756 757 HZ2 LYS 596 HZ2 LYS 596 4.194 4.735 -16.198 758 HZ3 LYS 596 HZ3 LYS 596 5.661 5.399 -16.733 759 H LEU 597 HN LEU 597 3.875 4.528 -9.245 760 HA LEU 597 HA LEU 597 2.706 6.566 -7.567 761 HB2 LEU 597 HB2 LEU 597 4.564 4.265 -6.963 762 HB3 LEU 597 HB3 LEU 597 3.896 5.328 -5.744 763 HG LEU 597 HG LEU 597 2.132 3.700 -7.563 764 HD11 LEU 597 HD11 LEU 597 1.966 2.057 -5.764 765 HD12 LEU 597 HD12 LEU 597 3.623 2.164 -6.360 766 HD13 LEU 597 HD13 LEU 597 3.181 2.935 -4.837 767 HD21 LEU 597 HD21 LEU 597 1.114 5.595 -6.405 768 HD22 LEU 597 HD22 LEU 597 0.510 4.061 -5.776 769 HD23 LEU 597 HD23 LEU 597 1.712 4.974 -4.865 770 H GLU 598 HN GLU 598 3.673 8.448 -7.000 771 HA GLU 598 HA GLU 598 6.415 8.922 -7.759 772 HB2 GLU 598 HB2 GLU 598 4.452 10.643 -6.235 773 HB3 GLU 598 HB3 GLU 598 6.070 11.155 -6.682 774 HG2 GLU 598 HG2 GLU 598 5.441 10.799 -9.068 775 HG3 GLU 598 HG3 GLU 598 3.787 10.506 -8.523 776 H VAL 599 HN VAL 599 7.505 7.342 -6.487 777 HA VAL 599 HA VAL 599 7.468 7.801 -3.593 778 HB VAL 599 HB VAL 599 8.908 5.616 -5.104 779 HG11 VAL 599 HG11 VAL 599 8.287 5.967 -2.174 780 HG12 VAL 599 HG12 VAL 599 8.998 4.522 -2.893 781 HG13 VAL 599 HG13 VAL 599 9.877 6.050 -2.932 782 HG21 VAL 599 HG21 VAL 599 6.502 5.408 -5.439 783 HG22 VAL 599 HG22 VAL 599 7.092 4.131 -4.374 784 HG23 VAL 599 HG23 VAL 599 6.239 5.519 -3.698 785 H SER 600 HN SER 600 8.998 9.001 -2.685 786 HA SER 600 HA SER 600 11.562 9.298 -4.054 787 HB2 SER 600 HB2 SER 600 11.373 11.817 -3.597 788 HB3 SER 600 HB3 SER 600 10.444 11.163 -4.949 789 HG SER 600 HG SER 600 8.707 10.965 -3.235 790 H LEU 601 HN LEU 601 13.203 10.334 -2.741 791 HA LEU 601 HA LEU 601 12.742 9.887 0.136 792 HB2 LEU 601 HB2 LEU 601 14.234 8.215 -0.965 793 HB3 LEU 601 HB3 LEU 601 15.314 9.522 -1.405 794 HG LEU 601 HG LEU 601 15.665 9.999 1.008 795 HD11 LEU 601 HD11 LEU 601 14.095 7.454 1.411 796 HD12 LEU 601 HD12 LEU 601 14.932 8.376 2.662 797 HD13 LEU 601 HD13 LEU 601 13.546 9.079 1.828 798 HD21 LEU 601 HD21 LEU 601 16.272 7.166 0.167 799 HD22 LEU 601 HD22 LEU 601 17.218 8.592 -0.259 800 HD23 LEU 601 HD23 LEU 601 17.103 8.081 1.426 801 H LYS 602 HN LYS 602 12.590 11.820 1.067 802 HA LYS 602 HA LYS 602 14.583 13.867 0.333 803 HB2 LYS 602 HB2 LYS 602 11.698 14.220 1.160 804 HB3 LYS 602 HB3 LYS 602 12.860 15.536 1.163 805 HG2 LYS 602 HG2 LYS 602 12.021 13.935 -1.246 806 HG3 LYS 602 HG3 LYS 602 11.481 15.567 -0.843 807 HD2 LYS 602 HD2 LYS 602 13.927 16.237 -0.894 808 HD3 LYS 602 HD3 LYS 602 14.247 14.659 -1.617 809 HE2 LYS 602 HE2 LYS 602 12.457 16.815 -2.727 810 HE3 LYS 602 HE3 LYS 602 14.045 16.358 -3.336 811 HZ1 LYS 602 HZ1 LYS 602 13.093 14.115 -3.770 812 HZ2 LYS 602 HZ2 LYS 602 12.407 15.354 -4.702 813 HZ3 LYS 602 HZ3 LYS 602 11.561 14.728 -3.376 814 H ASN 603 HN ASN 603 16.027 14.053 1.910 815 HA ASN 603 HA ASN 603 16.994 14.182 3.968 816 HB2 ASN 603 HB2 ASN 603 14.183 14.999 4.749 817 HB3 ASN 603 HB3 ASN 603 15.582 15.135 5.808 818 HD21 ASN 603 HD21 ASN 603 17.089 16.727 5.445 819 HD22 ASN 603 HD22 ASN 603 16.815 18.042 4.350 820 H ASN 604 HN ASN 604 16.149 11.647 3.117 821 HA ASN 604 HA ASN 604 15.973 9.515 3.853 822 HB2 ASN 604 HB2 ASN 604 16.413 10.787 6.561 823 HB3 ASN 604 HB3 ASN 604 16.338 9.049 6.294 824 HD21 ASN 604 HD21 ASN 604 18.517 10.655 7.312 825 HD22 ASN 604 HD22 ASN 604 19.857 10.388 6.251 826 H VAL 605 HN VAL 605 13.663 11.560 3.911 827 HA VAL 605 HA VAL 605 11.768 9.836 5.360 828 HB VAL 605 HB VAL 605 11.347 12.663 4.356 829 HG11 VAL 605 HG11 VAL 605 9.288 12.578 5.711 830 HG12 VAL 605 HG12 VAL 605 9.277 11.415 4.385 831 HG13 VAL 605 HG13 VAL 605 9.594 10.871 6.031 832 HG21 VAL 605 HG21 VAL 605 12.928 12.602 6.211 833 HG22 VAL 605 HG22 VAL 605 11.395 13.309 6.720 834 HG23 VAL 605 HG23 VAL 605 11.790 11.650 7.163 835 H VAL 606 HN VAL 606 10.575 8.520 4.164 836 HA VAL 606 HA VAL 606 10.625 8.759 1.278 837 HB VAL 606 HB VAL 606 9.244 6.646 2.941 838 HG11 VAL 606 HG11 VAL 606 8.451 6.723 0.649 839 HG12 VAL 606 HG12 VAL 606 10.109 6.682 0.048 840 HG13 VAL 606 HG13 VAL 606 9.442 5.284 0.892 841 HG21 VAL 606 HG21 VAL 606 11.224 5.265 2.595 842 HG22 VAL 606 HG22 VAL 606 12.021 6.603 1.768 843 HG23 VAL 606 HG23 VAL 606 11.627 6.735 3.481 844 H SER 607 HN SER 607 9.025 9.511 0.060 845 HA SER 607 HA SER 607 6.341 9.713 1.237 846 HB2 SER 607 HB2 SER 607 7.672 11.833 -0.470 847 HB3 SER 607 HB3 SER 607 6.023 11.897 0.159 848 HG SER 607 HG SER 607 8.099 11.502 1.985 849 H VAL 608 HN VAL 608 4.759 8.938 -0.003 850 HA VAL 608 HA VAL 608 5.376 8.325 -2.820 851 HB VAL 608 HB VAL 608 5.132 6.256 -1.625 852 HG11 VAL 608 HG11 VAL 608 3.114 5.674 -0.362 853 HG12 VAL 608 HG12 VAL 608 3.945 7.061 0.339 854 HG13 VAL 608 HG13 VAL 608 2.485 7.302 -0.622 855 HG21 VAL 608 HG21 VAL 608 4.161 6.269 -3.840 856 HG22 VAL 608 HG22 VAL 608 3.192 5.255 -2.772 857 HG23 VAL 608 HG23 VAL 608 2.632 6.873 -3.199 858 H ASN 609 HN ASN 609 4.375 9.654 -4.130 859 HA ASN 609 HA ASN 609 2.891 11.133 -5.015 860 HB2 ASN 609 HB2 ASN 609 0.918 9.507 -3.393 861 HB3 ASN 609 HB3 ASN 609 0.455 10.749 -4.548 862 HD21 ASN 609 HD21 ASN 609 -0.210 7.962 -4.557 863 HD22 ASN 609 HD22 ASN 609 0.381 7.316 -6.048 864 H LYS 610 HN LYS 610 4.326 11.833 -2.735 865 HA LYS 610 HA LYS 610 4.578 13.647 -1.407 866 HB2 LYS 610 HB2 LYS 610 3.064 14.966 -2.730 867 HB3 LYS 610 HB3 LYS 610 1.667 14.183 -2.002 868 HG2 LYS 610 HG2 LYS 610 2.225 15.170 0.151 869 HG3 LYS 610 HG3 LYS 610 3.639 15.945 -0.565 870 HD2 LYS 610 HD2 LYS 610 2.263 17.305 -1.969 871 HD3 LYS 610 HD3 LYS 610 0.817 16.406 -1.507 872 HE2 LYS 610 HE2 LYS 610 1.018 17.210 0.775 873 HE3 LYS 610 HE3 LYS 610 2.509 18.061 0.360 874 HZ1 LYS 610 HZ1 LYS 610 -0.084 18.617 -0.970 875 HZ2 LYS 610 HZ2 LYS 610 1.335 19.553 -1.009 876 HZ3 LYS 610 HZ3 LYS 610 0.432 19.443 0.418 877 H GLU 611 HN GLU 611 2.115 11.281 -0.856 878 HA GLU 611 HA GLU 611 1.574 11.911 1.852 879 HB2 GLU 611 HB2 GLU 611 1.304 9.279 0.392 880 HB3 GLU 611 HB3 GLU 611 0.624 9.635 1.974 881 HG2 GLU 611 HG2 GLU 611 -0.109 10.923 -0.644 882 HG3 GLU 611 HG3 GLU 611 -1.098 9.830 0.325 883 HA PRO 612 HA PRO 612 5.432 10.632 3.505 884 HB2 PRO 612 HB2 PRO 612 4.297 10.887 6.154 885 HB3 PRO 612 HB3 PRO 612 5.439 11.951 5.333 886 HG2 PRO 612 HG2 PRO 612 2.861 12.653 5.906 887 HG3 PRO 612 HG3 PRO 612 3.793 13.331 4.560 888 HD2 PRO 612 HD2 PRO 612 1.707 11.185 4.530 889 HD3 PRO 612 HD3 PRO 612 1.989 12.502 3.370 890 H VAL 613 HN VAL 613 6.254 8.683 3.820 891 HA VAL 613 HA VAL 613 4.591 6.495 4.680 892 HB VAL 613 HB VAL 613 7.554 6.594 4.064 893 HG11 VAL 613 HG11 VAL 613 5.774 4.205 4.551 894 HG12 VAL 613 HG12 VAL 613 7.463 4.154 4.043 895 HG13 VAL 613 HG13 VAL 613 7.040 4.787 5.635 896 HG21 VAL 613 HG21 VAL 613 6.074 7.007 2.148 897 HG22 VAL 613 HG22 VAL 613 6.930 5.472 2.001 898 HG23 VAL 613 HG23 VAL 613 5.235 5.493 2.486 899 H ALA 614 HN ALA 614 4.367 5.774 6.654 900 HA ALA 614 HA ALA 614 5.521 7.258 8.832 901 HB1 ALA 614 HB1 ALA 614 3.993 6.020 10.218 902 HB2 ALA 614 HB2 ALA 614 3.140 6.539 8.761 903 HB3 ALA 614 HB3 ALA 614 3.685 4.866 8.919 904 H GLU 615 HN GLU 615 5.857 4.052 7.408 905 HA GLU 615 HA GLU 615 8.287 3.590 8.913 906 HB2 GLU 615 HB2 GLU 615 5.791 2.012 9.424 907 HB3 GLU 615 HB3 GLU 615 7.352 1.210 9.519 908 HG2 GLU 615 HG2 GLU 615 6.653 3.683 11.078 909 HG3 GLU 615 HG3 GLU 615 6.454 2.041 11.690 910 HA PRO 616 HA PRO 616 8.577 1.674 4.818 911 HB2 PRO 616 HB2 PRO 616 10.891 2.780 4.092 912 HB3 PRO 616 HB3 PRO 616 9.393 3.716 4.089 913 HG2 PRO 616 HG2 PRO 616 11.656 3.773 6.019 914 HG3 PRO 616 HG3 PRO 616 10.594 5.089 5.486 915 HD2 PRO 616 HD2 PRO 616 10.359 3.590 7.874 916 HD3 PRO 616 HD3 PRO 616 9.168 4.722 7.205 917 H ASP 617 HN ASP 617 9.910 -0.001 3.988 918 HA ASP 617 HA ASP 617 11.763 -1.296 3.683 919 HB2 ASP 617 HB2 ASP 617 12.868 0.448 5.868 920 HB3 ASP 617 HB3 ASP 617 13.740 -0.982 5.326 921 H ILE 618 HN ILE 618 9.501 -1.879 5.179 922 HA ILE 618 HA ILE 618 10.295 -3.506 7.405 923 HB ILE 618 HB ILE 618 7.722 -2.788 6.047 924 HG12 ILE 618 HG12 ILE 618 8.709 -2.585 8.904 925 HG13 ILE 618 HG13 ILE 618 8.663 -1.282 7.723 926 HG21 ILE 618 HG21 ILE 618 8.017 -4.945 8.165 927 HG22 ILE 618 HG22 ILE 618 6.490 -4.289 7.576 928 HG23 ILE 618 HG23 ILE 618 7.534 -5.203 6.488 929 HD11 ILE 618 HD11 ILE 618 6.228 -1.424 7.665 930 HD12 ILE 618 HD12 ILE 618 6.279 -2.722 8.859 931 HD13 ILE 618 HD13 ILE 618 6.830 -1.103 9.293 932 H MET 619 HN MET 619 11.562 -5.112 6.736 933 HA MET 619 HA MET 619 11.391 -6.504 4.330 934 HB2 MET 619 HB2 MET 619 12.647 -7.360 6.942 935 HB3 MET 619 HB3 MET 619 12.908 -8.155 5.401 936 HG2 MET 619 HG2 MET 619 13.513 -5.248 5.666 937 HG3 MET 619 HG3 MET 619 14.634 -6.430 6.332 938 HE1 MET 619 HE1 MET 619 13.688 -5.659 1.911 939 HE2 MET 619 HE2 MET 619 12.529 -6.669 2.781 940 HE3 MET 619 HE3 MET 619 12.839 -5.024 3.327 941 H ALA 620 HN ALA 620 9.688 -7.638 3.714 942 HA ALA 620 HA ALA 620 8.636 -9.655 5.576 943 HB1 ALA 620 HB1 ALA 620 6.934 -8.106 4.720 944 HB2 ALA 620 HB2 ALA 620 7.359 -8.560 3.067 945 HB3 ALA 620 HB3 ALA 620 6.655 -9.755 4.156 946 H THR 621 HN THR 621 7.737 -11.601 4.007 947 HA THR 621 HA THR 621 10.103 -12.835 3.117 948 HB THR 621 HB THR 621 7.195 -13.599 2.955 949 HG1 THR 621 HG1 THR 621 7.815 -13.803 5.019 950 HG21 THR 621 HG21 THR 621 7.966 -15.850 2.379 951 HG22 THR 621 HG22 THR 621 9.608 -15.228 2.218 952 HG23 THR 621 HG23 THR 621 8.341 -14.666 1.129 953 H ASN 622 HN ASN 622 7.267 -11.515 1.419 954 HA ASN 622 HA ASN 622 8.706 -11.968 -1.100 955 HB2 ASN 622 HB2 ASN 622 6.500 -12.196 -2.191 956 HB3 ASN 622 HB3 ASN 622 6.774 -13.417 -0.959 957 HD21 ASN 622 HD21 ASN 622 4.294 -12.548 -2.083 958 HD22 ASN 622 HD22 ASN 622 3.331 -11.959 -0.769 959 H GLY 623 HN GLY 623 8.883 -9.580 0.570 960 HA2 GLY 623 HA2 GLY 623 9.181 -7.616 -1.182 961 HA3 GLY 623 HA3 GLY 623 7.437 -7.576 -0.967 962 H VAL 624 HN VAL 624 7.808 -5.410 -0.222 963 HA VAL 624 HA VAL 624 8.485 -5.394 2.643 964 HB VAL 624 HB VAL 624 8.949 -2.950 2.430 965 HG11 VAL 624 HG11 VAL 624 10.808 -4.808 0.987 966 HG12 VAL 624 HG12 VAL 624 11.229 -3.221 1.637 967 HG13 VAL 624 HG13 VAL 624 10.730 -4.514 2.727 968 HG21 VAL 624 HG21 VAL 624 9.009 -3.593 -0.503 969 HG22 VAL 624 HG22 VAL 624 7.885 -2.524 0.337 970 HG23 VAL 624 HG23 VAL 624 9.590 -2.093 0.226 971 H VAL 625 HN VAL 625 7.514 -3.639 3.787 972 HA VAL 625 HA VAL 625 4.846 -2.916 2.809 973 HB VAL 625 HB VAL 625 5.478 -3.867 5.612 974 HG11 VAL 625 HG11 VAL 625 3.101 -3.545 6.077 975 HG12 VAL 625 HG12 VAL 625 3.873 -2.025 5.624 976 HG13 VAL 625 HG13 VAL 625 2.871 -2.887 4.458 977 HG21 VAL 625 HG21 VAL 625 3.737 -5.075 3.464 978 HG22 VAL 625 HG22 VAL 625 5.287 -5.704 4.022 979 HG23 VAL 625 HG23 VAL 625 3.900 -5.683 5.111 980 H HIS 626 HN HIS 626 5.036 -0.815 2.484 981 HA HIS 626 HA HIS 626 6.503 0.800 4.425 982 HB2 HIS 626 HB2 HIS 626 5.312 1.512 1.735 983 HB3 HIS 626 HB3 HIS 626 6.127 2.652 2.791 984 HD2 HIS 626 HD2 HIS 626 7.099 1.476 -0.292 985 HE1 HIS 626 HE1 HIS 626 10.454 0.348 2.025 986 HE2 HIS 626 HE2 HIS 626 9.639 0.927 -0.303 987 H VAL 627 HN VAL 627 5.292 1.130 6.141 988 HA VAL 627 HA VAL 627 2.483 1.304 6.207 989 HB VAL 627 HB VAL 627 4.426 2.520 8.173 990 HG11 VAL 627 HG11 VAL 627 2.623 2.190 9.799 991 HG12 VAL 627 HG12 VAL 627 2.146 3.281 8.498 992 HG13 VAL 627 HG13 VAL 627 1.573 1.612 8.506 993 HG21 VAL 627 HG21 VAL 627 3.284 -0.268 8.073 994 HG22 VAL 627 HG22 VAL 627 4.964 0.183 7.788 995 HG23 VAL 627 HG23 VAL 627 4.253 0.398 9.388 996 H ILE 628 HN ILE 628 1.093 2.938 5.813 997 HA ILE 628 HA ILE 628 2.207 5.655 5.582 998 HB ILE 628 HB ILE 628 0.277 6.010 3.879 999 HG12 ILE 628 HG12 ILE 628 0.726 3.030 3.614 1000 HG13 ILE 628 HG13 ILE 628 -0.752 3.786 4.199 1001 HG21 ILE 628 HG21 ILE 628 1.777 5.401 2.027 1002 HG22 ILE 628 HG22 ILE 628 2.611 6.246 3.336 1003 HG23 ILE 628 HG23 ILE 628 2.781 4.499 3.166 1004 HD11 ILE 628 HD11 ILE 628 -1.079 4.822 2.012 1005 HD12 ILE 628 HD12 ILE 628 0.407 4.069 1.432 1006 HD13 ILE 628 HD13 ILE 628 -0.972 3.066 1.891 1007 H THR 629 HN THR 629 0.992 7.334 6.341 1008 HA THR 629 HA THR 629 -1.039 6.573 8.269 1009 HB THR 629 HB THR 629 -0.902 9.016 8.910 1010 HG1 THR 629 HG1 THR 629 0.577 10.275 7.910 1011 HG21 THR 629 HG21 THR 629 1.315 8.767 9.966 1012 HG22 THR 629 HG22 THR 629 1.639 7.382 8.920 1013 HG23 THR 629 HG23 THR 629 0.343 7.300 10.115 1014 H ASN 630 HN ASN 630 -1.289 7.080 5.118 1015 HA ASN 630 HA ASN 630 -4.060 7.888 5.375 1016 HB2 ASN 630 HB2 ASN 630 -2.733 10.001 4.955 1017 HB3 ASN 630 HB3 ASN 630 -2.290 9.326 3.396 1018 HD21 ASN 630 HD21 ASN 630 -3.290 11.036 2.333 1019 HD22 ASN 630 HD22 ASN 630 -5.022 11.130 2.207 1020 H VAL 631 HN VAL 631 -5.049 7.813 3.051 1021 HA VAL 631 HA VAL 631 -4.191 5.228 1.934 1022 HB VAL 631 HB VAL 631 -6.850 6.649 1.615 1023 HG11 VAL 631 HG11 VAL 631 -6.356 5.175 -0.251 1024 HG12 VAL 631 HG12 VAL 631 -6.005 3.855 0.867 1025 HG13 VAL 631 HG13 VAL 631 -7.641 4.498 0.750 1026 HG21 VAL 631 HG21 VAL 631 -6.112 4.315 3.382 1027 HG22 VAL 631 HG22 VAL 631 -6.487 5.949 3.927 1028 HG23 VAL 631 HG23 VAL 631 -7.735 4.967 3.160 1029 H LEU 632 HN LEU 632 -3.587 5.044 -0.196 1030 HA LEU 632 HA LEU 632 -2.899 7.509 -1.506 1031 HB2 LEU 632 HB2 LEU 632 -2.451 4.630 -2.282 1032 HB3 LEU 632 HB3 LEU 632 -1.850 6.004 -3.192 1033 HG LEU 632 HG LEU 632 -1.103 5.375 -0.336 1034 HD11 LEU 632 HD11 LEU 632 1.066 4.731 -1.236 1035 HD12 LEU 632 HD12 LEU 632 -0.216 3.714 -1.895 1036 HD13 LEU 632 HD13 LEU 632 0.476 5.004 -2.878 1037 HD21 LEU 632 HD21 LEU 632 -0.004 7.413 -2.268 1038 HD22 LEU 632 HD22 LEU 632 -1.025 7.761 -0.872 1039 HD23 LEU 632 HD23 LEU 632 0.591 7.097 -0.638 1040 H GLN 633 HN GLN 633 -4.193 8.547 -2.774 1041 HA GLN 633 HA GLN 633 -6.103 7.050 -4.437 1042 HB2 GLN 633 HB2 GLN 633 -7.257 8.272 -2.636 1043 HB3 GLN 633 HB3 GLN 633 -6.478 9.765 -3.139 1044 HG2 GLN 633 HG2 GLN 633 -7.665 9.672 -5.265 1045 HG3 GLN 633 HG3 GLN 633 -8.428 8.159 -4.777 1046 HE21 GLN 633 HE21 GLN 633 -8.720 9.050 -2.004 1047 HE22 GLN 633 HE22 GLN 633 -10.021 10.188 -1.999 1048 HA PRO 634 HA PRO 634 -3.578 9.116 -7.527 1049 HB2 PRO 634 HB2 PRO 634 -4.714 7.938 -9.690 1050 HB3 PRO 634 HB3 PRO 634 -3.540 7.121 -8.656 1051 HG2 PRO 634 HG2 PRO 634 -6.519 6.881 -8.695 1052 HG3 PRO 634 HG3 PRO 634 -5.295 5.617 -8.490 1053 HD2 PRO 634 HD2 PRO 634 -6.704 6.713 -6.422 1054 HD3 PRO 634 HD3 PRO 634 -5.073 6.031 -6.246 Start of MODEL 7 1 H1 ALA 500 H1 ALA 500 15.613 -12.615 7.239 2 H2 ALA 500 H2 ALA 500 16.277 -11.229 7.958 3 H3 ALA 500 H3 ALA 500 15.453 -11.107 6.482 4 HA ALA 500 HA ALA 500 14.244 -11.902 9.063 5 HB1 ALA 500 HB1 ALA 500 14.855 -9.534 9.034 6 HB2 ALA 500 HB2 ALA 500 13.979 -9.322 7.518 7 HB3 ALA 500 HB3 ALA 500 13.104 -9.741 8.991 8 H GLY 501 HN GLY 501 11.774 -11.518 8.849 9 HA2 GLY 501 HA2 GLY 501 9.883 -11.531 7.304 10 HA3 GLY 501 HA3 GLY 501 10.869 -12.489 6.205 11 H MET 502 HN MET 502 8.444 -12.618 8.461 12 HA MET 502 HA MET 502 8.969 -15.474 9.010 13 HB2 MET 502 HB2 MET 502 7.446 -13.479 10.698 14 HB3 MET 502 HB3 MET 502 7.569 -15.199 11.044 15 HG2 MET 502 HG2 MET 502 9.957 -15.009 11.332 16 HG3 MET 502 HG3 MET 502 9.903 -13.302 10.889 17 HE1 MET 502 HE1 MET 502 8.705 -11.424 12.415 18 HE2 MET 502 HE2 MET 502 7.227 -12.384 12.340 19 HE3 MET 502 HE3 MET 502 7.833 -11.812 13.896 20 H GLY 503 HN GLY 503 7.356 -13.659 6.995 21 HA2 GLY 503 HA2 GLY 503 5.405 -15.623 6.376 22 HA3 GLY 503 HA3 GLY 503 4.656 -14.223 7.134 23 H THR 504 HN THR 504 3.683 -14.439 4.793 24 HA THR 504 HA THR 504 5.337 -13.236 2.757 25 HB THR 504 HB THR 504 3.249 -13.231 1.388 26 HG1 THR 504 HG1 THR 504 1.417 -14.286 2.264 27 HG21 THR 504 HG21 THR 504 3.069 -15.669 1.170 28 HG22 THR 504 HG22 THR 504 3.913 -15.866 2.705 29 HG23 THR 504 HG23 THR 504 4.749 -15.155 1.324 30 H VAL 505 HN VAL 505 4.300 -11.312 1.532 31 HA VAL 505 HA VAL 505 4.457 -9.066 3.133 32 HB VAL 505 HB VAL 505 4.835 -8.893 0.777 33 HG11 VAL 505 HG11 VAL 505 3.286 -10.573 -0.023 34 HG12 VAL 505 HG12 VAL 505 1.920 -9.540 0.399 35 HG13 VAL 505 HG13 VAL 505 3.037 -9.049 -0.875 36 HG21 VAL 505 HG21 VAL 505 4.053 -6.885 1.935 37 HG22 VAL 505 HG22 VAL 505 3.556 -6.898 0.241 38 HG23 VAL 505 HG23 VAL 505 2.392 -7.293 1.506 39 H MET 506 HN MET 506 1.493 -10.657 1.931 40 HA MET 506 HA MET 506 -0.123 -8.762 3.387 41 HB2 MET 506 HB2 MET 506 -2.029 -9.846 2.522 42 HB3 MET 506 HB3 MET 506 -0.881 -9.668 1.209 43 HG2 MET 506 HG2 MET 506 -1.667 -11.779 0.841 44 HG3 MET 506 HG3 MET 506 -0.271 -12.139 1.854 45 HE1 MET 506 HE1 MET 506 -4.149 -11.325 2.042 46 HE2 MET 506 HE2 MET 506 -4.448 -11.714 3.739 47 HE3 MET 506 HE3 MET 506 -3.372 -10.382 3.315 48 H ASP 507 HN ASP 507 1.321 -11.783 4.041 49 HA ASP 507 HA ASP 507 -0.359 -12.557 6.194 50 HB2 ASP 507 HB2 ASP 507 1.297 -14.105 5.176 51 HB3 ASP 507 HB3 ASP 507 2.596 -13.128 5.856 52 H VAL 508 HN VAL 508 2.310 -10.332 5.850 53 HA VAL 508 HA VAL 508 2.657 -9.644 8.551 54 HB VAL 508 HB VAL 508 2.918 -7.883 6.102 55 HG11 VAL 508 HG11 VAL 508 2.714 -6.534 8.116 56 HG12 VAL 508 HG12 VAL 508 3.975 -7.486 8.901 57 HG13 VAL 508 HG13 VAL 508 4.368 -6.481 7.506 58 HG21 VAL 508 HG21 VAL 508 5.316 -8.379 6.295 59 HG22 VAL 508 HG22 VAL 508 4.971 -9.484 7.626 60 HG23 VAL 508 HG23 VAL 508 4.362 -9.835 6.009 61 H LEU 509 HN LEU 509 0.577 -8.163 6.055 62 HA LEU 509 HA LEU 509 -0.958 -6.479 7.584 63 HB2 LEU 509 HB2 LEU 509 -1.577 -8.204 5.199 64 HB3 LEU 509 HB3 LEU 509 -2.781 -7.149 5.896 65 HG LEU 509 HG LEU 509 -1.307 -5.227 5.453 66 HD11 LEU 509 HD11 LEU 509 0.535 -5.485 3.879 67 HD12 LEU 509 HD12 LEU 509 0.839 -6.290 5.420 68 HD13 LEU 509 HD13 LEU 509 0.369 -7.237 4.008 69 HD21 LEU 509 HD21 LEU 509 -2.046 -6.960 3.121 70 HD22 LEU 509 HD22 LEU 509 -3.071 -5.763 3.912 71 HD23 LEU 509 HD23 LEU 509 -1.647 -5.248 3.007 72 H LYS 510 HN LYS 510 -1.293 -9.908 7.069 73 HA LYS 510 HA LYS 510 -3.748 -10.285 8.411 74 HB2 LYS 510 HB2 LYS 510 -1.891 -11.833 6.912 75 HB3 LYS 510 HB3 LYS 510 -2.167 -12.668 8.433 76 HG2 LYS 510 HG2 LYS 510 -4.435 -12.959 8.000 77 HG3 LYS 510 HG3 LYS 510 -4.446 -11.707 6.753 78 HD2 LYS 510 HD2 LYS 510 -4.553 -14.053 5.878 79 HD3 LYS 510 HD3 LYS 510 -3.213 -13.098 5.247 80 HE2 LYS 510 HE2 LYS 510 -2.380 -15.278 5.771 81 HE3 LYS 510 HE3 LYS 510 -1.745 -14.156 6.973 82 HZ1 LYS 510 HZ1 LYS 510 -2.456 -16.086 8.106 83 HZ2 LYS 510 HZ2 LYS 510 -3.950 -16.110 7.301 84 HZ3 LYS 510 HZ3 LYS 510 -3.620 -14.901 8.433 85 H GLY 511 HN GLY 511 -0.532 -9.958 9.489 86 HA2 GLY 511 HA2 GLY 511 -1.180 -11.069 12.117 87 HA3 GLY 511 HA3 GLY 511 0.415 -10.574 11.561 88 H ASP 512 HN ASP 512 -1.646 -8.219 10.556 89 HA ASP 512 HA ASP 512 -1.097 -6.679 13.029 90 HB2 ASP 512 HB2 ASP 512 0.372 -5.931 11.266 91 HB3 ASP 512 HB3 ASP 512 -0.995 -5.704 10.175 92 H ASN 513 HN ASN 513 -2.509 -5.098 13.683 93 HA ASN 513 HA ASN 513 -5.274 -5.684 13.214 94 HB2 ASN 513 HB2 ASN 513 -4.030 -3.430 14.810 95 HB3 ASN 513 HB3 ASN 513 -5.713 -3.929 14.875 96 HD21 ASN 513 HD21 ASN 513 -5.701 -4.390 17.038 97 HD22 ASN 513 HD22 ASN 513 -4.824 -5.724 17.719 98 H ARG 514 HN ARG 514 -2.991 -3.232 12.212 99 HA ARG 514 HA ARG 514 -5.004 -1.370 11.308 100 HB2 ARG 514 HB2 ARG 514 -2.084 -1.285 10.574 101 HB3 ARG 514 HB3 ARG 514 -3.204 0.059 10.761 102 HG2 ARG 514 HG2 ARG 514 -3.188 -0.155 13.129 103 HG3 ARG 514 HG3 ARG 514 -2.320 -1.688 13.045 104 HD2 ARG 514 HD2 ARG 514 -0.456 -0.353 11.898 105 HD3 ARG 514 HD3 ARG 514 -1.301 1.082 12.477 106 HE ARG 514 HE ARG 514 -0.742 -0.905 14.504 107 HH11 ARG 514 HH12 ARG 514 0.431 1.959 12.850 108 HH12 ARG 514 HH11 ARG 514 1.533 2.394 14.125 109 HH21 ARG 514 HH22 ARG 514 0.674 -0.304 16.188 110 HH22 ARG 514 HH21 ARG 514 1.633 1.134 16.040 111 H PHE 515 HN PHE 515 -2.486 -3.343 9.747 112 HA PHE 515 HA PHE 515 -3.254 -2.836 7.085 113 HB2 PHE 515 HB2 PHE 515 -1.895 -5.288 8.201 114 HB3 PHE 515 HB3 PHE 515 -1.872 -4.743 6.539 115 HD1 PHE 515 HD2 PHE 515 -1.503 -1.742 7.385 116 HD2 PHE 515 HD1 PHE 515 0.479 -5.383 8.343 117 HE1 PHE 515 HE2 PHE 515 0.561 -0.491 7.859 118 HE2 PHE 515 HE1 PHE 515 2.547 -4.139 8.809 119 HZ PHE 515 HZ PHE 515 2.587 -1.691 8.567 120 H SER 516 HN SER 516 -4.691 -4.780 9.514 121 HA SER 516 HA SER 516 -5.736 -6.921 8.070 122 HB2 SER 516 HB2 SER 516 -5.789 -6.806 10.525 123 HB3 SER 516 HB3 SER 516 -6.963 -5.491 10.444 124 HG SER 516 HG SER 516 -7.523 -7.922 9.152 125 H MET 517 HN MET 517 -6.818 -3.600 8.284 126 HA MET 517 HA MET 517 -9.373 -4.062 7.101 127 HB2 MET 517 HB2 MET 517 -7.746 -1.527 7.337 128 HB3 MET 517 HB3 MET 517 -9.419 -1.606 6.804 129 HG2 MET 517 HG2 MET 517 -10.136 -2.399 8.943 130 HG3 MET 517 HG3 MET 517 -8.468 -2.549 9.496 131 HE1 MET 517 HE1 MET 517 -7.381 1.248 9.302 132 HE2 MET 517 HE2 MET 517 -6.849 -0.332 9.880 133 HE3 MET 517 HE3 MET 517 -7.205 -0.089 8.169 134 H LEU 518 HN LEU 518 -6.164 -3.366 5.883 135 HA LEU 518 HA LEU 518 -6.970 -3.012 3.173 136 HB2 LEU 518 HB2 LEU 518 -4.784 -2.236 3.952 137 HB3 LEU 518 HB3 LEU 518 -4.311 -3.882 4.323 138 HG LEU 518 HG LEU 518 -4.345 -4.459 1.954 139 HD11 LEU 518 HD11 LEU 518 -6.125 -3.008 1.202 140 HD12 LEU 518 HD12 LEU 518 -5.135 -1.583 1.528 141 HD13 LEU 518 HD13 LEU 518 -4.665 -2.714 0.256 142 HD21 LEU 518 HD21 LEU 518 -2.784 -1.938 2.507 143 HD22 LEU 518 HD22 LEU 518 -2.279 -3.578 2.918 144 HD23 LEU 518 HD23 LEU 518 -2.450 -3.103 1.226 145 H VAL 519 HN VAL 519 -6.129 -5.768 5.183 146 HA VAL 519 HA VAL 519 -6.161 -7.773 3.208 147 HB VAL 519 HB VAL 519 -7.109 -8.019 6.076 148 HG11 VAL 519 HG11 VAL 519 -6.136 -10.112 4.138 149 HG12 VAL 519 HG12 VAL 519 -6.524 -10.385 5.837 150 HG13 VAL 519 HG13 VAL 519 -7.792 -9.906 4.711 151 HG21 VAL 519 HG21 VAL 519 -4.858 -7.119 5.987 152 HG22 VAL 519 HG22 VAL 519 -4.837 -8.783 6.571 153 HG23 VAL 519 HG23 VAL 519 -4.362 -8.426 4.912 154 H ALA 520 HN ALA 520 -8.702 -6.083 4.922 155 HA ALA 520 HA ALA 520 -10.869 -7.720 4.107 156 HB1 ALA 520 HB1 ALA 520 -10.887 -4.795 4.861 157 HB2 ALA 520 HB2 ALA 520 -12.297 -5.851 4.767 158 HB3 ALA 520 HB3 ALA 520 -11.052 -6.148 5.980 159 H ALA 521 HN ALA 521 -9.367 -4.825 2.742 160 HA ALA 521 HA ALA 521 -11.103 -4.564 0.524 161 HB1 ALA 521 HB1 ALA 521 -9.648 -2.743 1.263 162 HB2 ALA 521 HB2 ALA 521 -8.230 -3.688 0.807 163 HB3 ALA 521 HB3 ALA 521 -9.361 -3.142 -0.431 164 H ILE 522 HN ILE 522 -7.911 -6.080 0.906 165 HA ILE 522 HA ILE 522 -7.616 -7.128 -1.655 166 HB ILE 522 HB ILE 522 -6.700 -8.324 0.970 167 HG12 ILE 522 HG12 ILE 522 -5.195 -6.628 -1.034 168 HG13 ILE 522 HG13 ILE 522 -5.859 -6.031 0.485 169 HG21 ILE 522 HG21 ILE 522 -6.704 -10.003 -0.786 170 HG22 ILE 522 HG22 ILE 522 -5.785 -8.929 -1.840 171 HG23 ILE 522 HG23 ILE 522 -5.054 -9.554 -0.360 172 HD11 ILE 522 HD11 ILE 522 -3.744 -8.161 0.219 173 HD12 ILE 522 HD12 ILE 522 -3.461 -6.469 0.634 174 HD13 ILE 522 HD13 ILE 522 -4.380 -7.502 1.726 175 H GLN 523 HN GLN 523 -9.246 -8.508 1.175 176 HA GLN 523 HA GLN 523 -9.968 -10.974 0.044 177 HB2 GLN 523 HB2 GLN 523 -10.099 -10.563 2.443 178 HB3 GLN 523 HB3 GLN 523 -11.343 -9.349 2.190 179 HG2 GLN 523 HG2 GLN 523 -12.783 -11.154 1.227 180 HG3 GLN 523 HG3 GLN 523 -11.564 -12.312 1.754 181 HE21 GLN 523 HE21 GLN 523 -10.958 -10.724 4.160 182 HE22 GLN 523 HE22 GLN 523 -12.271 -11.008 5.247 183 H SER 524 HN SER 524 -11.739 -7.900 0.208 184 HA SER 524 HA SER 524 -14.094 -8.894 -1.003 185 HB2 SER 524 HB2 SER 524 -13.083 -6.046 -0.831 186 HB3 SER 524 HB3 SER 524 -14.739 -6.533 -1.195 187 HG SER 524 HG SER 524 -13.304 -6.796 1.232 188 H ALA 525 HN ALA 525 -11.192 -7.337 -2.297 189 HA ALA 525 HA ALA 525 -12.221 -7.260 -4.986 190 HB1 ALA 525 HB1 ALA 525 -9.947 -6.592 -5.631 191 HB2 ALA 525 HB2 ALA 525 -10.569 -5.621 -4.296 192 HB3 ALA 525 HB3 ALA 525 -9.399 -6.904 -3.983 193 H GLY 526 HN GLY 526 -10.398 -9.513 -3.051 194 HA2 GLY 526 HA2 GLY 526 -10.174 -11.793 -3.419 195 HA3 GLY 526 HA3 GLY 526 -10.855 -11.578 -5.024 196 H LEU 527 HN LEU 527 -8.048 -9.923 -3.651 197 HA LEU 527 HA LEU 527 -6.452 -11.075 -5.848 198 HB2 LEU 527 HB2 LEU 527 -6.102 -8.458 -4.379 199 HB3 LEU 527 HB3 LEU 527 -5.029 -9.061 -5.626 200 HG LEU 527 HG LEU 527 -7.931 -8.333 -6.029 201 HD11 LEU 527 HD11 LEU 527 -6.525 -6.383 -5.622 202 HD12 LEU 527 HD12 LEU 527 -5.411 -6.918 -6.881 203 HD13 LEU 527 HD13 LEU 527 -7.057 -6.449 -7.302 204 HD21 LEU 527 HD21 LEU 527 -7.187 -10.132 -7.509 205 HD22 LEU 527 HD22 LEU 527 -7.450 -8.634 -8.405 206 HD23 LEU 527 HD23 LEU 527 -5.810 -9.151 -8.011 207 H THR 528 HN THR 528 -6.934 -12.057 -3.014 208 HA THR 528 HA THR 528 -4.640 -11.653 -1.462 209 HB THR 528 HB THR 528 -6.322 -14.155 -1.431 210 HG1 THR 528 HG1 THR 528 -7.691 -12.976 -0.009 211 HG21 THR 528 HG21 THR 528 -4.747 -12.688 0.691 212 HG22 THR 528 HG22 THR 528 -4.362 -14.257 -0.012 213 HG23 THR 528 HG23 THR 528 -5.799 -14.076 0.994 214 H GLU 529 HN GLU 529 -5.331 -14.012 -3.994 215 HA GLU 529 HA GLU 529 -3.174 -15.758 -3.504 216 HB2 GLU 529 HB2 GLU 529 -5.185 -16.215 -4.961 217 HB3 GLU 529 HB3 GLU 529 -4.445 -15.196 -6.189 218 HG2 GLU 529 HG2 GLU 529 -3.973 -17.472 -6.722 219 HG3 GLU 529 HG3 GLU 529 -2.478 -16.710 -6.180 220 H THR 530 HN THR 530 -3.433 -12.741 -5.235 221 HA THR 530 HA THR 530 -1.093 -12.828 -6.753 222 HB THR 530 HB THR 530 -2.334 -10.368 -5.497 223 HG1 THR 530 HG1 THR 530 -3.123 -10.597 -7.971 224 HG21 THR 530 HG21 THR 530 -1.402 -9.216 -7.453 225 HG22 THR 530 HG22 THR 530 -0.682 -10.728 -8.005 226 HG23 THR 530 HG23 THR 530 -0.134 -9.987 -6.502 227 H LEU 531 HN LEU 531 -1.645 -11.629 -3.447 228 HA LEU 531 HA LEU 531 1.207 -11.103 -3.129 229 HB2 LEU 531 HB2 LEU 531 -1.066 -10.681 -1.195 230 HB3 LEU 531 HB3 LEU 531 0.566 -10.057 -1.034 231 HG LEU 531 HG LEU 531 -1.416 -9.285 -3.173 232 HD11 LEU 531 HD11 LEU 531 -0.369 -7.771 -0.791 233 HD12 LEU 531 HD12 LEU 531 -1.399 -7.110 -2.061 234 HD13 LEU 531 HD13 LEU 531 -2.007 -8.390 -1.014 235 HD21 LEU 531 HD21 LEU 531 0.875 -9.291 -3.989 236 HD22 LEU 531 HD22 LEU 531 0.254 -7.645 -3.844 237 HD23 LEU 531 HD23 LEU 531 1.372 -8.278 -2.634 238 H ASN 532 HN ASN 532 -0.361 -13.794 -3.126 239 HA ASN 532 HA ASN 532 0.415 -14.851 -0.524 240 HB2 ASN 532 HB2 ASN 532 -1.792 -15.440 -1.491 241 HB3 ASN 532 HB3 ASN 532 -0.977 -16.231 -2.834 242 HD21 ASN 532 HD21 ASN 532 -1.796 -18.231 -2.434 243 HD22 ASN 532 HD22 ASN 532 -1.356 -19.165 -1.037 244 H ARG 533 HN ARG 533 1.009 -15.555 -3.956 245 HA ARG 533 HA ARG 533 3.027 -17.501 -3.477 246 HB2 ARG 533 HB2 ARG 533 1.637 -17.154 -5.608 247 HB3 ARG 533 HB3 ARG 533 2.745 -15.843 -5.990 248 HG2 ARG 533 HG2 ARG 533 3.477 -17.770 -7.165 249 HG3 ARG 533 HG3 ARG 533 4.616 -17.493 -5.846 250 HD2 ARG 533 HD2 ARG 533 2.675 -19.146 -4.744 251 HD3 ARG 533 HD3 ARG 533 2.905 -19.774 -6.374 252 HE ARG 533 HE ARG 533 5.329 -19.266 -4.872 253 HH11 ARG 533 HH12 ARG 533 2.893 -21.625 -5.784 254 HH12 ARG 533 HH11 ARG 533 3.914 -22.986 -5.402 255 HH21 ARG 533 HH22 ARG 533 6.662 -21.028 -4.410 256 HH22 ARG 533 HH21 ARG 533 6.053 -22.646 -4.627 257 H GLU 534 HN GLU 534 5.297 -17.296 -3.598 258 HA GLU 534 HA GLU 534 6.250 -14.748 -2.703 259 HB2 GLU 534 HB2 GLU 534 8.361 -15.777 -2.328 260 HB3 GLU 534 HB3 GLU 534 7.142 -16.944 -1.847 261 HG2 GLU 534 HG2 GLU 534 8.416 -17.031 -4.558 262 HG3 GLU 534 HG3 GLU 534 9.176 -17.770 -3.154 263 H GLY 535 HN GLY 535 7.663 -13.382 -3.688 264 HA2 GLY 535 HA2 GLY 535 8.838 -13.617 -6.204 265 HA3 GLY 535 HA3 GLY 535 7.233 -12.922 -6.430 266 H VAL 536 HN VAL 536 7.797 -10.829 -6.936 267 HA VAL 536 HA VAL 536 9.097 -9.387 -4.723 268 HB VAL 536 HB VAL 536 10.065 -7.805 -6.319 269 HG11 VAL 536 HG11 VAL 536 11.732 -9.356 -7.340 270 HG12 VAL 536 HG12 VAL 536 11.443 -9.634 -5.621 271 HG13 VAL 536 HG13 VAL 536 10.717 -10.707 -6.818 272 HG21 VAL 536 HG21 VAL 536 8.990 -9.642 -8.465 273 HG22 VAL 536 HG22 VAL 536 8.436 -8.000 -8.132 274 HG23 VAL 536 HG23 VAL 536 10.075 -8.273 -8.722 275 H TYR 537 HN TYR 537 8.008 -7.738 -3.893 276 HA TYR 537 HA TYR 537 5.948 -6.339 -5.376 277 HB2 TYR 537 HB2 TYR 537 5.308 -7.976 -2.911 278 HB3 TYR 537 HB3 TYR 537 4.252 -6.722 -3.546 279 HD1 TYR 537 HD1 TYR 537 3.493 -7.026 -6.025 280 HD2 TYR 537 HD2 TYR 537 5.031 -10.165 -3.597 281 HE1 TYR 537 HE1 TYR 537 2.390 -8.680 -7.472 282 HE2 TYR 537 HE2 TYR 537 3.940 -11.824 -5.043 283 HH TYR 537 HH TYR 537 2.002 -11.906 -6.577 284 H THR 538 HN THR 538 5.351 -4.388 -4.439 285 HA THR 538 HA THR 538 6.600 -3.671 -1.877 286 HB THR 538 HB THR 538 6.474 -1.872 -4.308 287 HG1 THR 538 HG1 THR 538 8.283 -2.822 -4.855 288 HG21 THR 538 HG21 THR 538 7.974 -0.428 -2.991 289 HG22 THR 538 HG22 THR 538 7.808 -1.529 -1.623 290 HG23 THR 538 HG23 THR 538 6.407 -0.633 -2.214 291 H VAL 539 HN VAL 539 4.816 -3.522 -0.597 292 HA VAL 539 HA VAL 539 2.392 -2.330 -1.778 293 HB VAL 539 HB VAL 539 2.548 -4.190 0.599 294 HG11 VAL 539 HG11 VAL 539 0.124 -4.398 0.305 295 HG12 VAL 539 HG12 VAL 539 0.598 -2.733 0.638 296 HG13 VAL 539 HG13 VAL 539 0.182 -3.219 -1.007 297 HG21 VAL 539 HG21 VAL 539 3.233 -5.337 -1.452 298 HG22 VAL 539 HG22 VAL 539 1.676 -5.929 -0.874 299 HG23 VAL 539 HG23 VAL 539 1.746 -4.818 -2.242 300 H PHE 540 HN PHE 540 1.737 -0.438 -1.033 301 HA PHE 540 HA PHE 540 2.672 0.523 1.564 302 HB2 PHE 540 HB2 PHE 540 1.103 1.894 -0.640 303 HB3 PHE 540 HB3 PHE 540 1.597 2.658 0.864 304 HD1 PHE 540 HD2 PHE 540 2.838 1.193 -2.293 305 HD2 PHE 540 HD1 PHE 540 3.777 3.519 1.150 306 HE1 PHE 540 HE2 PHE 540 4.971 1.858 -3.324 307 HE2 PHE 540 HE1 PHE 540 5.905 4.191 0.117 308 HZ PHE 540 HZ PHE 540 6.505 3.358 -2.119 309 H ALA 541 HN ALA 541 1.458 -0.149 3.228 310 HA ALA 541 HA ALA 541 -1.365 -0.766 2.757 311 HB1 ALA 541 HB1 ALA 541 -0.063 -2.525 3.802 312 HB2 ALA 541 HB2 ALA 541 0.416 -1.430 5.101 313 HB3 ALA 541 HB3 ALA 541 -1.275 -1.917 4.940 314 HA PRO 542 HA PRO 542 -2.298 3.137 4.798 315 HB2 PRO 542 HB2 PRO 542 -5.004 2.900 4.351 316 HB3 PRO 542 HB3 PRO 542 -3.870 3.649 3.229 317 HG2 PRO 542 HG2 PRO 542 -5.115 0.961 3.156 318 HG3 PRO 542 HG3 PRO 542 -4.630 2.013 1.816 319 HD2 PRO 542 HD2 PRO 542 -3.220 -0.197 2.637 320 HD3 PRO 542 HD3 PRO 542 -2.504 1.182 1.782 321 H THR 543 HN THR 543 -2.703 3.389 6.873 322 HA THR 543 HA THR 543 -3.456 0.991 8.357 323 HB THR 543 HB THR 543 -2.525 2.325 10.319 324 HG1 THR 543 HG1 THR 543 -1.335 3.894 8.254 325 HG21 THR 543 HG21 THR 543 -0.211 1.826 9.690 326 HG22 THR 543 HG22 THR 543 -0.702 1.664 8.003 327 HG23 THR 543 HG23 THR 543 -1.298 0.522 9.210 328 H ASN 544 HN ASN 544 -4.251 1.770 10.689 329 HA ASN 544 HA ASN 544 -6.932 2.320 10.604 330 HB2 ASN 544 HB2 ASN 544 -5.863 1.382 12.553 331 HB3 ASN 544 HB3 ASN 544 -4.922 2.848 12.797 332 HD21 ASN 544 HD21 ASN 544 -5.834 4.588 13.812 333 HD22 ASN 544 HD22 ASN 544 -7.411 4.528 14.540 334 H GLU 545 HN GLU 545 -4.271 4.592 10.774 335 HA GLU 545 HA GLU 545 -5.754 6.858 11.556 336 HB2 GLU 545 HB2 GLU 545 -3.226 6.899 9.907 337 HB3 GLU 545 HB3 GLU 545 -3.795 8.124 11.035 338 HG2 GLU 545 HG2 GLU 545 -2.757 5.379 11.701 339 HG3 GLU 545 HG3 GLU 545 -1.975 6.923 12.026 340 H ALA 546 HN ALA 546 -5.257 5.316 8.480 341 HA ALA 546 HA ALA 546 -5.947 7.615 6.901 342 HB1 ALA 546 HB1 ALA 546 -5.821 6.086 4.995 343 HB2 ALA 546 HB2 ALA 546 -4.404 5.944 6.035 344 HB3 ALA 546 HB3 ALA 546 -5.673 4.721 6.105 345 H PHE 547 HN PHE 547 -7.484 4.473 7.420 346 HA PHE 547 HA PHE 547 -9.811 5.112 5.994 347 HB2 PHE 547 HB2 PHE 547 -9.259 2.982 8.055 348 HB3 PHE 547 HB3 PHE 547 -10.744 3.089 7.131 349 HD1 PHE 547 HD1 PHE 547 -10.625 2.925 4.618 350 HD2 PHE 547 HD2 PHE 547 -7.366 1.938 7.167 351 HE1 PHE 547 HE1 PHE 547 -9.609 1.609 2.803 352 HE2 PHE 547 HE2 PHE 547 -6.343 0.625 5.358 353 HZ PHE 547 HZ PHE 547 -7.465 0.460 3.175 354 H ARG 548 HN ARG 548 -8.893 5.590 9.328 355 HA ARG 548 HA ARG 548 -11.480 6.017 10.410 356 HB2 ARG 548 HB2 ARG 548 -9.559 5.552 11.840 357 HB3 ARG 548 HB3 ARG 548 -8.763 7.020 11.293 358 HG2 ARG 548 HG2 ARG 548 -10.645 8.314 12.301 359 HG3 ARG 548 HG3 ARG 548 -11.225 6.802 13.001 360 HD2 ARG 548 HD2 ARG 548 -9.863 8.092 14.588 361 HD3 ARG 548 HD3 ARG 548 -9.137 6.529 14.208 362 HE ARG 548 HE ARG 548 -8.224 8.849 12.688 363 HH11 ARG 548 HH12 ARG 548 -7.626 6.602 15.301 364 HH12 ARG 548 HH11 ARG 548 -5.909 6.856 15.293 365 HH21 ARG 548 HH22 ARG 548 -5.959 9.213 12.704 366 HH22 ARG 548 HH21 ARG 548 -4.963 8.327 13.824 367 H ALA 549 HN ALA 549 -9.258 8.003 8.619 368 HA ALA 549 HA ALA 549 -10.590 10.478 9.355 369 HB1 ALA 549 HB1 ALA 549 -8.320 10.009 7.428 370 HB2 ALA 549 HB2 ALA 549 -8.889 11.574 8.012 371 HB3 ALA 549 HB3 ALA 549 -8.151 10.429 9.133 372 H LEU 550 HN LEU 550 -11.060 8.061 7.087 373 HA LEU 550 HA LEU 550 -11.783 9.633 4.827 374 HB2 LEU 550 HB2 LEU 550 -12.489 6.782 5.526 375 HB3 LEU 550 HB3 LEU 550 -12.788 7.537 3.972 376 HG LEU 550 HG LEU 550 -10.078 7.020 5.202 377 HD11 LEU 550 HD11 LEU 550 -9.807 5.436 3.372 378 HD12 LEU 550 HD12 LEU 550 -11.181 5.004 4.390 379 HD13 LEU 550 HD13 LEU 550 -11.451 5.773 2.827 380 HD21 LEU 550 HD21 LEU 550 -10.809 8.231 2.536 381 HD22 LEU 550 HD22 LEU 550 -10.067 9.075 3.897 382 HD23 LEU 550 HD23 LEU 550 -9.179 7.798 3.066 383 HA PRO 551 HA PRO 551 -15.674 11.042 6.421 384 HB2 PRO 551 HB2 PRO 551 -16.125 11.978 3.667 385 HB3 PRO 551 HB3 PRO 551 -15.972 12.915 5.156 386 HG2 PRO 551 HG2 PRO 551 -14.064 12.940 3.275 387 HG3 PRO 551 HG3 PRO 551 -13.670 13.027 5.003 388 HD2 PRO 551 HD2 PRO 551 -13.580 10.654 3.158 389 HD3 PRO 551 HD3 PRO 551 -12.387 11.183 4.369 390 HA PRO 552 HA PRO 552 -18.813 8.115 5.573 391 HB2 PRO 552 HB2 PRO 552 -20.847 9.945 4.771 392 HB3 PRO 552 HB3 PRO 552 -20.619 9.208 6.358 393 HG2 PRO 552 HG2 PRO 552 -19.815 11.882 5.382 394 HG3 PRO 552 HG3 PRO 552 -20.200 11.351 7.027 395 HD2 PRO 552 HD2 PRO 552 -17.676 11.875 6.268 396 HD3 PRO 552 HD3 PRO 552 -18.048 10.561 7.406 397 H ARG 553 HN ARG 553 -18.965 10.759 3.152 398 HA ARG 553 HA ARG 553 -20.198 9.167 1.181 399 HB2 ARG 553 HB2 ARG 553 -18.491 11.613 0.714 400 HB3 ARG 553 HB3 ARG 553 -19.694 10.948 -0.379 401 HG2 ARG 553 HG2 ARG 553 -21.382 11.385 1.475 402 HG3 ARG 553 HG3 ARG 553 -20.123 12.367 2.224 403 HD2 ARG 553 HD2 ARG 553 -21.375 12.753 -0.488 404 HD3 ARG 553 HD3 ARG 553 -21.538 13.800 0.919 405 HE ARG 553 HE ARG 553 -18.867 13.412 -0.206 406 HH11 ARG 553 HH12 ARG 553 -21.641 15.489 0.323 407 HH12 ARG 553 HH11 ARG 553 -20.843 16.923 -0.268 408 HH21 ARG 553 HH22 ARG 553 -17.816 15.284 -1.015 409 HH22 ARG 553 HH21 ARG 553 -18.670 16.801 -1.026 410 H GLU 554 HN GLU 554 -16.795 10.061 1.655 411 HA GLU 554 HA GLU 554 -15.836 8.930 -0.738 412 HB2 GLU 554 HB2 GLU 554 -14.193 9.195 1.775 413 HB3 GLU 554 HB3 GLU 554 -13.651 9.302 0.109 414 HG2 GLU 554 HG2 GLU 554 -15.244 11.313 1.665 415 HG3 GLU 554 HG3 GLU 554 -13.619 11.488 1.009 416 H ARG 555 HN ARG 555 -15.750 7.716 2.601 417 HA ARG 555 HA ARG 555 -14.542 5.247 1.921 418 HB2 ARG 555 HB2 ARG 555 -15.012 4.562 4.181 419 HB3 ARG 555 HB3 ARG 555 -14.486 6.239 4.185 420 HG2 ARG 555 HG2 ARG 555 -16.867 6.921 4.343 421 HG3 ARG 555 HG3 ARG 555 -17.297 5.215 4.493 422 HD2 ARG 555 HD2 ARG 555 -15.821 5.075 6.485 423 HD3 ARG 555 HD3 ARG 555 -15.547 6.812 6.360 424 HE ARG 555 HE ARG 555 -18.289 5.816 6.645 425 HH11 ARG 555 HH12 ARG 555 -15.554 7.566 7.966 426 HH12 ARG 555 HH11 ARG 555 -16.460 8.242 9.282 427 HH21 ARG 555 HH22 ARG 555 -19.485 6.686 8.366 428 HH22 ARG 555 HH21 ARG 555 -18.721 7.776 9.497 429 H SER 556 HN SER 556 -17.866 6.301 1.930 430 HA SER 556 HA SER 556 -18.982 3.660 1.944 431 HB2 SER 556 HB2 SER 556 -20.235 5.638 2.751 432 HB3 SER 556 HB3 SER 556 -20.268 6.267 1.106 433 HG SER 556 HG SER 556 -21.196 3.889 0.841 434 H ARG 557 HN ARG 557 -17.745 5.809 -0.469 435 HA ARG 557 HA ARG 557 -19.000 4.400 -2.653 436 HB2 ARG 557 HB2 ARG 557 -18.535 6.789 -2.858 437 HB3 ARG 557 HB3 ARG 557 -16.818 6.489 -2.645 438 HG2 ARG 557 HG2 ARG 557 -17.560 6.895 -4.999 439 HG3 ARG 557 HG3 ARG 557 -16.650 5.408 -4.742 440 HD2 ARG 557 HD2 ARG 557 -18.644 5.165 -6.231 441 HD3 ARG 557 HD3 ARG 557 -18.643 4.089 -4.835 442 HE ARG 557 HE ARG 557 -20.102 6.583 -4.535 443 HH11 ARG 557 HH12 ARG 557 -20.243 3.173 -5.364 444 HH12 ARG 557 HH11 ARG 557 -21.929 3.020 -4.931 445 HH21 ARG 557 HH22 ARG 557 -22.302 6.396 -4.023 446 HH22 ARG 557 HH21 ARG 557 -23.108 4.864 -4.197 447 H LEU 558 HN LEU 558 -15.730 4.689 -1.296 448 HA LEU 558 HA LEU 558 -14.455 2.929 -3.065 449 HB2 LEU 558 HB2 LEU 558 -13.264 4.451 -1.551 450 HB3 LEU 558 HB3 LEU 558 -13.821 3.524 -0.171 451 HG LEU 558 HG LEU 558 -12.503 1.594 -0.913 452 HD11 LEU 558 HD11 LEU 558 -11.607 3.414 -3.142 453 HD12 LEU 558 HD12 LEU 558 -10.930 1.828 -2.773 454 HD13 LEU 558 HD13 LEU 558 -12.603 1.968 -3.314 455 HD21 LEU 558 HD21 LEU 558 -10.299 2.520 -0.478 456 HD22 LEU 558 HD22 LEU 558 -10.898 4.144 -0.823 457 HD23 LEU 558 HD23 LEU 558 -11.501 3.262 0.579 458 H LEU 559 HN LEU 559 -16.117 2.345 -0.003 459 HA LEU 559 HA LEU 559 -15.631 -0.524 -0.202 460 HB2 LEU 559 HB2 LEU 559 -17.068 1.119 1.887 461 HB3 LEU 559 HB3 LEU 559 -16.780 -0.606 1.990 462 HG LEU 559 HG LEU 559 -14.577 1.451 1.837 463 HD11 LEU 559 HD11 LEU 559 -14.290 1.085 4.226 464 HD12 LEU 559 HD12 LEU 559 -15.887 1.744 3.874 465 HD13 LEU 559 HD13 LEU 559 -15.702 0.028 4.244 466 HD21 LEU 559 HD21 LEU 559 -14.537 -1.473 2.582 467 HD22 LEU 559 HD22 LEU 559 -13.970 -0.795 1.055 468 HD23 LEU 559 HD23 LEU 559 -13.153 -0.380 2.563 469 H GLY 560 HN GLY 560 -17.624 1.447 -1.699 470 HA2 GLY 560 HA2 GLY 560 -20.073 -0.120 -1.347 471 HA3 GLY 560 HA3 GLY 560 -19.931 1.399 -2.221 472 H ASP 561 HN ASP 561 -17.726 0.789 -3.812 473 HA ASP 561 HA ASP 561 -18.867 -1.201 -5.625 474 HB2 ASP 561 HB2 ASP 561 -16.994 1.128 -6.028 475 HB3 ASP 561 HB3 ASP 561 -17.248 -0.094 -7.254 476 H ALA 562 HN ALA 562 -17.913 -3.117 -5.734 477 HA ALA 562 HA ALA 562 -15.627 -3.748 -4.184 478 HB1 ALA 562 HB1 ALA 562 -16.951 -5.366 -6.356 479 HB2 ALA 562 HB2 ALA 562 -15.817 -5.978 -5.151 480 HB3 ALA 562 HB3 ALA 562 -17.395 -5.370 -4.649 481 H LYS 563 HN LYS 563 -16.074 -2.850 -7.515 482 HA LYS 563 HA LYS 563 -13.554 -3.725 -8.479 483 HB2 LYS 563 HB2 LYS 563 -15.836 -2.227 -9.484 484 HB3 LYS 563 HB3 LYS 563 -14.310 -1.580 -10.073 485 HG2 LYS 563 HG2 LYS 563 -15.344 -3.271 -11.547 486 HG3 LYS 563 HG3 LYS 563 -13.705 -3.670 -11.029 487 HD2 LYS 563 HD2 LYS 563 -14.562 -5.227 -9.397 488 HD3 LYS 563 HD3 LYS 563 -16.221 -4.744 -9.753 489 HE2 LYS 563 HE2 LYS 563 -15.595 -6.887 -10.822 490 HE3 LYS 563 HE3 LYS 563 -16.052 -5.645 -11.987 491 HZ1 LYS 563 HZ1 LYS 563 -13.765 -5.252 -12.497 492 HZ2 LYS 563 HZ2 LYS 563 -14.049 -6.920 -12.624 493 HZ3 LYS 563 HZ3 LYS 563 -13.245 -6.295 -11.268 494 H GLU 564 HN GLU 564 -14.711 -0.727 -7.037 495 HA GLU 564 HA GLU 564 -12.438 0.838 -7.581 496 HB2 GLU 564 HB2 GLU 564 -14.304 1.057 -5.210 497 HB3 GLU 564 HB3 GLU 564 -13.215 2.310 -5.793 498 HG2 GLU 564 HG2 GLU 564 -15.585 1.176 -7.257 499 HG3 GLU 564 HG3 GLU 564 -15.490 2.754 -6.479 500 H LEU 565 HN LEU 565 -13.279 -1.291 -4.894 501 HA LEU 565 HA LEU 565 -11.071 -0.885 -3.262 502 HB2 LEU 565 HB2 LEU 565 -12.759 -3.314 -3.792 503 HB3 LEU 565 HB3 LEU 565 -11.468 -3.314 -2.614 504 HG LEU 565 HG LEU 565 -13.912 -1.551 -2.552 505 HD11 LEU 565 HD11 LEU 565 -14.425 -3.861 -2.022 506 HD12 LEU 565 HD12 LEU 565 -13.090 -3.914 -0.869 507 HD13 LEU 565 HD13 LEU 565 -14.484 -2.875 -0.560 508 HD21 LEU 565 HD21 LEU 565 -13.078 -0.903 -0.322 509 HD22 LEU 565 HD22 LEU 565 -11.597 -1.808 -0.637 510 HD23 LEU 565 HD23 LEU 565 -11.998 -0.399 -1.622 511 H ALA 566 HN ALA 566 -11.520 -3.237 -5.876 512 HA ALA 566 HA ALA 566 -8.968 -4.391 -5.763 513 HB1 ALA 566 HB1 ALA 566 -9.408 -5.174 -8.044 514 HB2 ALA 566 HB2 ALA 566 -10.812 -5.408 -7.002 515 HB3 ALA 566 HB3 ALA 566 -10.782 -4.074 -8.154 516 H ASN 567 HN ASN 567 -10.220 -1.835 -7.890 517 HA ASN 567 HA ASN 567 -7.837 -1.370 -9.274 518 HB2 ASN 567 HB2 ASN 567 -10.207 0.424 -8.768 519 HB3 ASN 567 HB3 ASN 567 -8.850 0.909 -9.777 520 HD21 ASN 567 HD21 ASN 567 -8.439 -1.829 -10.744 521 HD22 ASN 567 HD22 ASN 567 -9.695 -2.114 -11.897 522 H ILE 568 HN ILE 568 -9.117 0.385 -6.428 523 HA ILE 568 HA ILE 568 -6.973 2.213 -6.273 524 HB ILE 568 HB ILE 568 -8.872 1.257 -4.127 525 HG12 ILE 568 HG12 ILE 568 -9.918 2.436 -6.008 526 HG13 ILE 568 HG13 ILE 568 -10.003 3.390 -4.533 527 HG21 ILE 568 HG21 ILE 568 -6.882 2.096 -3.042 528 HG22 ILE 568 HG22 ILE 568 -6.914 3.553 -4.034 529 HG23 ILE 568 HG23 ILE 568 -8.190 3.260 -2.852 530 HD11 ILE 568 HD11 ILE 568 -8.062 3.791 -6.802 531 HD12 ILE 568 HD12 ILE 568 -9.475 4.782 -6.444 532 HD13 ILE 568 HD13 ILE 568 -8.117 4.744 -5.319 533 H LEU 569 HN LEU 569 -7.415 -0.997 -4.798 534 HA LEU 569 HA LEU 569 -5.110 -0.725 -3.135 535 HB2 LEU 569 HB2 LEU 569 -5.992 -2.487 -2.123 536 HB3 LEU 569 HB3 LEU 569 -7.290 -2.440 -3.292 537 HG LEU 569 HG LEU 569 -5.682 -3.935 -4.712 538 HD11 LEU 569 HD11 LEU 569 -4.728 -4.500 -1.907 539 HD12 LEU 569 HD12 LEU 569 -4.275 -5.382 -3.364 540 HD13 LEU 569 HD13 LEU 569 -3.779 -3.699 -3.159 541 HD21 LEU 569 HD21 LEU 569 -7.865 -4.626 -3.904 542 HD22 LEU 569 HD22 LEU 569 -6.694 -5.924 -3.668 543 HD23 LEU 569 HD23 LEU 569 -7.196 -4.930 -2.300 544 H LYS 570 HN LYS 570 -5.715 -1.914 -6.369 545 HA LYS 570 HA LYS 570 -3.241 -3.162 -6.859 546 HB2 LYS 570 HB2 LYS 570 -5.217 -1.755 -8.638 547 HB3 LYS 570 HB3 LYS 570 -3.715 -2.410 -9.279 548 HG2 LYS 570 HG2 LYS 570 -4.342 -4.624 -8.742 549 HG3 LYS 570 HG3 LYS 570 -5.684 -4.078 -7.732 550 HD2 LYS 570 HD2 LYS 570 -6.427 -4.946 -9.922 551 HD3 LYS 570 HD3 LYS 570 -6.866 -3.258 -9.672 552 HE2 LYS 570 HE2 LYS 570 -6.075 -3.556 -11.929 553 HE3 LYS 570 HE3 LYS 570 -4.918 -2.584 -11.027 554 HZ1 LYS 570 HZ1 LYS 570 -3.518 -4.520 -10.776 555 HZ2 LYS 570 HZ2 LYS 570 -3.842 -4.257 -12.415 556 HZ3 LYS 570 HZ3 LYS 570 -4.640 -5.496 -11.583 557 H TYR 571 HN TYR 571 -4.183 0.187 -6.716 558 HA TYR 571 HA TYR 571 -1.814 1.238 -7.913 559 HB2 TYR 571 HB2 TYR 571 -3.960 2.448 -7.863 560 HB3 TYR 571 HB3 TYR 571 -3.858 2.549 -6.111 561 HD1 TYR 571 HD2 TYR 571 -1.702 3.373 -9.060 562 HD2 TYR 571 HD1 TYR 571 -3.199 4.563 -5.262 563 HE1 TYR 571 HE2 TYR 571 -0.509 5.511 -9.270 564 HE2 TYR 571 HE1 TYR 571 -2.010 6.704 -5.454 565 HH TYR 571 HH TYR 571 -0.771 7.859 -8.320 566 H HIS 572 HN HIS 572 -2.553 -0.009 -4.807 567 HA HIS 572 HA HIS 572 -0.530 1.561 -3.437 568 HB2 HIS 572 HB2 HIS 572 -2.468 -0.560 -2.540 569 HB3 HIS 572 HB3 HIS 572 -1.169 0.002 -1.495 570 HD1 HIS 572 HD1 HIS 572 -4.340 1.243 -3.150 571 HD2 HIS 572 HD2 HIS 572 -1.573 2.410 -0.276 572 HE1 HIS 572 HE1 HIS 572 -5.333 3.248 -1.977 573 H ILE 573 HN ILE 573 -0.626 -1.278 -5.254 574 HA ILE 573 HA ILE 573 1.769 -2.339 -3.913 575 HB ILE 573 HB ILE 573 0.035 -3.816 -5.892 576 HG12 ILE 573 HG12 ILE 573 -0.034 -4.064 -2.875 577 HG13 ILE 573 HG13 ILE 573 -1.217 -3.148 -3.805 578 HG21 ILE 573 HG21 ILE 573 1.150 -5.791 -4.925 579 HG22 ILE 573 HG22 ILE 573 2.289 -4.673 -5.677 580 HG23 ILE 573 HG23 ILE 573 2.130 -4.723 -3.922 581 HD11 ILE 573 HD11 ILE 573 -2.033 -5.368 -3.213 582 HD12 ILE 573 HD12 ILE 573 -1.896 -5.169 -4.961 583 HD13 ILE 573 HD13 ILE 573 -0.679 -6.093 -4.080 584 H GLY 574 HN GLY 574 3.595 -1.774 -4.887 585 HA2 GLY 574 HA2 GLY 574 3.681 -1.544 -7.813 586 HA3 GLY 574 HA3 GLY 574 4.972 -1.104 -6.697 587 H ASP 575 HN ASP 575 5.012 -2.897 -9.091 588 HA ASP 575 HA ASP 575 5.308 -5.532 -7.865 589 HB2 ASP 575 HB2 ASP 575 5.357 -6.424 -10.104 590 HB3 ASP 575 HB3 ASP 575 4.017 -5.290 -9.982 591 H GLU 576 HN GLU 576 7.223 -3.162 -7.679 592 HA GLU 576 HA GLU 576 9.644 -4.704 -8.156 593 HB2 GLU 576 HB2 GLU 576 9.258 -1.819 -8.975 594 HB3 GLU 576 HB3 GLU 576 10.810 -2.638 -8.933 595 HG2 GLU 576 HG2 GLU 576 9.984 -4.229 -10.624 596 HG3 GLU 576 HG3 GLU 576 8.473 -3.324 -10.693 597 H ILE 577 HN ILE 577 10.873 -4.756 -6.422 598 HA ILE 577 HA ILE 577 9.893 -3.589 -4.033 599 HB ILE 577 HB ILE 577 12.495 -5.048 -4.537 600 HG12 ILE 577 HG12 ILE 577 9.863 -5.971 -3.357 601 HG13 ILE 577 HG13 ILE 577 10.455 -6.366 -4.968 602 HG21 ILE 577 HG21 ILE 577 12.570 -5.356 -2.088 603 HG22 ILE 577 HG22 ILE 577 12.688 -3.658 -2.549 604 HG23 ILE 577 HG23 ILE 577 11.167 -4.299 -1.927 605 HD11 ILE 577 HD11 ILE 577 12.322 -7.581 -3.987 606 HD12 ILE 577 HD12 ILE 577 11.748 -7.168 -2.371 607 HD13 ILE 577 HD13 ILE 577 10.777 -8.208 -3.413 608 H LEU 578 HN LEU 578 10.143 -1.641 -3.376 609 HA LEU 578 HA LEU 578 12.606 -0.174 -4.048 610 HB2 LEU 578 HB2 LEU 578 10.464 0.656 -5.071 611 HB3 LEU 578 HB3 LEU 578 9.872 0.970 -3.457 612 HG LEU 578 HG LEU 578 10.759 2.953 -4.793 613 HD11 LEU 578 HD11 LEU 578 10.326 3.093 -2.410 614 HD12 LEU 578 HD12 LEU 578 11.920 2.421 -2.065 615 HD13 LEU 578 HD13 LEU 578 11.777 3.999 -2.839 616 HD21 LEU 578 HD21 LEU 578 13.384 1.666 -4.069 617 HD22 LEU 578 HD22 LEU 578 12.749 1.920 -5.694 618 HD23 LEU 578 HD23 LEU 578 13.184 3.304 -4.689 619 H VAL 579 HN VAL 579 13.891 -0.057 -2.320 620 HA VAL 579 HA VAL 579 12.675 0.163 0.352 621 HB VAL 579 HB VAL 579 14.877 -0.571 1.240 622 HG11 VAL 579 HG11 VAL 579 13.129 -2.222 0.912 623 HG12 VAL 579 HG12 VAL 579 13.613 -2.435 -0.770 624 HG13 VAL 579 HG13 VAL 579 14.700 -2.926 0.529 625 HG21 VAL 579 HG21 VAL 579 15.550 -0.967 -1.672 626 HG22 VAL 579 HG22 VAL 579 16.310 0.177 -0.565 627 HG23 VAL 579 HG23 VAL 579 16.513 -1.559 -0.317 628 H SER 580 HN SER 580 13.951 1.523 1.917 629 HA SER 580 HA SER 580 14.055 4.153 0.952 630 HB2 SER 580 HB2 SER 580 13.627 3.523 3.319 631 HB3 SER 580 HB3 SER 580 15.321 3.078 3.485 632 HG SER 580 HG SER 580 14.675 5.259 4.186 633 H GLY 581 HN GLY 581 16.652 1.836 1.613 634 HA2 GLY 581 HA2 GLY 581 18.730 3.707 0.968 635 HA3 GLY 581 HA3 GLY 581 18.927 1.985 1.241 636 H GLY 582 HN GLY 582 16.583 2.909 -1.110 637 HA2 GLY 582 HA2 GLY 582 18.535 2.659 -3.287 638 HA3 GLY 582 HA3 GLY 582 17.184 1.535 -3.240 639 H ILE 583 HN ILE 583 16.481 4.672 -2.065 640 HA ILE 583 HA ILE 583 14.746 5.156 -4.333 641 HB ILE 583 HB ILE 583 15.178 6.943 -1.937 642 HG12 ILE 583 HG12 ILE 583 13.152 4.724 -2.296 643 HG13 ILE 583 HG13 ILE 583 14.540 4.676 -1.216 644 HG21 ILE 583 HG21 ILE 583 14.062 8.048 -3.771 645 HG22 ILE 583 HG22 ILE 583 12.918 6.713 -3.924 646 HG23 ILE 583 HG23 ILE 583 12.897 7.730 -2.485 647 HD11 ILE 583 HD11 ILE 583 12.234 6.598 -1.020 648 HD12 ILE 583 HD12 ILE 583 12.481 5.168 -0.018 649 HD13 ILE 583 HD13 ILE 583 13.616 6.516 0.071 650 H GLY 584 HN GLY 584 17.574 6.664 -2.828 651 HA2 GLY 584 HA2 GLY 584 19.199 7.983 -3.842 652 HA3 GLY 584 HA3 GLY 584 18.271 7.912 -5.335 653 H ALA 585 HN ALA 585 16.594 9.379 -5.681 654 HA ALA 585 HA ALA 585 16.369 11.574 -3.740 655 HB1 ALA 585 HB1 ALA 585 17.832 12.273 -5.609 656 HB2 ALA 585 HB2 ALA 585 16.510 11.955 -6.733 657 HB3 ALA 585 HB3 ALA 585 16.346 13.218 -5.512 658 H LEU 586 HN LEU 586 14.936 10.696 -6.884 659 HA LEU 586 HA LEU 586 12.392 10.185 -5.548 660 HB2 LEU 586 HB2 LEU 586 12.622 12.609 -6.545 661 HB3 LEU 586 HB3 LEU 586 12.379 11.794 -8.077 662 HG LEU 586 HG LEU 586 10.434 11.416 -5.823 663 HD11 LEU 586 HD11 LEU 586 10.666 13.824 -6.132 664 HD12 LEU 586 HD12 LEU 586 10.401 13.638 -7.864 665 HD13 LEU 586 HD13 LEU 586 9.106 13.257 -6.727 666 HD21 LEU 586 HD21 LEU 586 10.255 9.924 -7.741 667 HD22 LEU 586 HD22 LEU 586 8.865 11.001 -7.625 668 HD23 LEU 586 HD23 LEU 586 10.124 11.315 -8.819 669 H VAL 587 HN VAL 587 11.301 8.510 -6.472 670 HA VAL 587 HA VAL 587 12.542 7.345 -8.874 671 HB VAL 587 HB VAL 587 13.328 6.142 -6.894 672 HG11 VAL 587 HG11 VAL 587 11.787 4.848 -5.511 673 HG12 VAL 587 HG12 VAL 587 11.459 6.576 -5.405 674 HG13 VAL 587 HG13 VAL 587 10.421 5.542 -6.384 675 HG21 VAL 587 HG21 VAL 587 13.092 4.889 -8.946 676 HG22 VAL 587 HG22 VAL 587 12.666 3.870 -7.574 677 HG23 VAL 587 HG23 VAL 587 11.397 4.559 -8.587 678 H ARG 588 HN ARG 588 11.188 6.495 -10.376 679 HA ARG 588 HA ARG 588 8.325 6.856 -9.883 680 HB2 ARG 588 HB2 ARG 588 9.809 6.428 -12.485 681 HB3 ARG 588 HB3 ARG 588 8.092 6.786 -12.319 682 HG2 ARG 588 HG2 ARG 588 8.562 8.972 -11.464 683 HG3 ARG 588 HG3 ARG 588 10.286 8.621 -11.366 684 HD2 ARG 588 HD2 ARG 588 10.333 8.382 -13.831 685 HD3 ARG 588 HD3 ARG 588 8.634 8.851 -13.880 686 HE ARG 588 HE ARG 588 9.792 10.882 -12.520 687 HH11 ARG 588 HH12 ARG 588 10.557 9.374 -15.582 688 HH12 ARG 588 HH11 ARG 588 11.172 10.840 -16.292 689 HH21 ARG 588 HH22 ARG 588 10.622 12.801 -13.434 690 HH22 ARG 588 HH21 ARG 588 11.182 12.784 -15.078 691 H LEU 589 HN LEU 589 7.543 5.088 -8.968 692 HA LEU 589 HA LEU 589 8.373 2.463 -10.006 693 HB2 LEU 589 HB2 LEU 589 8.624 3.264 -7.487 694 HB3 LEU 589 HB3 LEU 589 6.934 2.819 -7.404 695 HG LEU 589 HG LEU 589 8.485 1.052 -6.597 696 HD11 LEU 589 HD11 LEU 589 7.463 -0.812 -7.831 697 HD12 LEU 589 HD12 LEU 589 6.286 0.410 -7.345 698 HD13 LEU 589 HD13 LEU 589 6.845 0.341 -9.015 699 HD21 LEU 589 HD21 LEU 589 9.341 0.959 -9.481 700 HD22 LEU 589 HD22 LEU 589 10.335 1.432 -8.103 701 HD23 LEU 589 HD23 LEU 589 9.765 -0.230 -8.249 702 H LYS 590 HN LYS 590 6.860 1.260 -11.033 703 HA LYS 590 HA LYS 590 4.239 2.448 -11.368 704 HB2 LYS 590 HB2 LYS 590 3.936 0.729 -13.118 705 HB3 LYS 590 HB3 LYS 590 5.370 1.715 -13.367 706 HG2 LYS 590 HG2 LYS 590 6.720 -0.125 -12.355 707 HG3 LYS 590 HG3 LYS 590 5.253 -1.106 -12.325 708 HD2 LYS 590 HD2 LYS 590 5.067 -0.965 -14.733 709 HD3 LYS 590 HD3 LYS 590 6.449 0.130 -14.804 710 HE2 LYS 590 HE2 LYS 590 7.216 -2.048 -15.417 711 HE3 LYS 590 HE3 LYS 590 7.841 -1.682 -13.811 712 HZ1 LYS 590 HZ1 LYS 590 6.048 -3.019 -12.859 713 HZ2 LYS 590 HZ2 LYS 590 7.020 -3.930 -13.905 714 HZ3 LYS 590 HZ3 LYS 590 5.498 -3.401 -14.419 715 H SER 591 HN SER 591 2.308 1.463 -10.926 716 HA SER 591 HA SER 591 2.428 -0.518 -8.778 717 HB2 SER 591 HB2 SER 591 0.087 0.165 -8.341 718 HB3 SER 591 HB3 SER 591 1.182 1.547 -8.334 719 HG SER 591 HG SER 591 0.477 2.089 -10.396 720 H LEU 592 HN LEU 592 0.298 -1.972 -8.802 721 HA LEU 592 HA LEU 592 0.522 -3.669 -11.076 722 HB2 LEU 592 HB2 LEU 592 -1.617 -3.664 -8.957 723 HB3 LEU 592 HB3 LEU 592 -1.228 -4.979 -10.037 724 HG LEU 592 HG LEU 592 0.459 -3.929 -7.776 725 HD11 LEU 592 HD11 LEU 592 -0.889 -6.588 -8.239 726 HD12 LEU 592 HD12 LEU 592 0.145 -6.180 -6.869 727 HD13 LEU 592 HD13 LEU 592 -1.394 -5.347 -7.089 728 HD21 LEU 592 HD21 LEU 592 1.858 -4.535 -9.694 729 HD22 LEU 592 HD22 LEU 592 2.067 -5.645 -8.338 730 HD23 LEU 592 HD23 LEU 592 1.098 -6.127 -9.732 731 H GLN 593 HN GLN 593 -1.226 -0.857 -10.484 732 HA GLN 593 HA GLN 593 -3.522 -1.526 -12.121 733 HB2 GLN 593 HB2 GLN 593 -3.795 -0.112 -10.148 734 HB3 GLN 593 HB3 GLN 593 -2.664 1.054 -10.807 735 HG2 GLN 593 HG2 GLN 593 -4.210 1.517 -12.643 736 HG3 GLN 593 HG3 GLN 593 -5.352 0.356 -11.963 737 HE21 GLN 593 HE21 GLN 593 -3.368 2.419 -10.005 738 HE22 GLN 593 HE22 GLN 593 -4.643 3.409 -9.404 739 H GLY 594 HN GLY 594 -0.464 0.105 -12.448 740 HA2 GLY 594 HA2 GLY 594 0.371 0.256 -14.780 741 HA3 GLY 594 HA3 GLY 594 -1.211 0.906 -15.195 742 H ASP 595 HN ASP 595 -1.323 2.465 -12.688 743 HA ASP 595 HA ASP 595 0.019 4.815 -13.592 744 HB2 ASP 595 HB2 ASP 595 -1.600 4.142 -11.163 745 HB3 ASP 595 HB3 ASP 595 -0.727 5.660 -11.255 746 H LYS 596 HN LYS 596 1.384 6.107 -12.090 747 HA LYS 596 HA LYS 596 3.419 4.336 -10.938 748 HB2 LYS 596 HB2 LYS 596 4.963 6.306 -11.199 749 HB3 LYS 596 HB3 LYS 596 4.405 5.579 -12.693 750 HG2 LYS 596 HG2 LYS 596 4.274 7.835 -13.142 751 HG3 LYS 596 HG3 LYS 596 2.624 7.446 -12.671 752 HD2 LYS 596 HD2 LYS 596 3.050 8.320 -10.427 753 HD3 LYS 596 HD3 LYS 596 4.717 8.684 -10.881 754 HE2 LYS 596 HE2 LYS 596 4.005 10.310 -12.475 755 HE3 LYS 596 HE3 LYS 596 2.320 9.829 -12.297 756 HZ1 LYS 596 HZ1 LYS 596 2.462 10.594 -9.959 757 HZ2 LYS 596 HZ2 LYS 596 2.655 11.832 -11.096 758 HZ3 LYS 596 HZ3 LYS 596 4.009 11.222 -10.280 759 H LEU 597 HN LEU 597 4.134 4.568 -8.920 760 HA LEU 597 HA LEU 597 2.715 6.423 -7.179 761 HB2 LEU 597 HB2 LEU 597 4.658 4.179 -6.598 762 HB3 LEU 597 HB3 LEU 597 3.929 5.192 -5.366 763 HG LEU 597 HG LEU 597 2.286 3.542 -7.277 764 HD11 LEU 597 HD11 LEU 597 3.776 2.076 -5.978 765 HD12 LEU 597 HD12 LEU 597 3.165 2.802 -4.491 766 HD13 LEU 597 HD13 LEU 597 2.080 1.881 -5.535 767 HD21 LEU 597 HD21 LEU 597 1.682 4.833 -4.620 768 HD22 LEU 597 HD22 LEU 597 1.147 5.407 -6.199 769 HD23 LEU 597 HD23 LEU 597 0.558 3.866 -5.575 770 H GLU 598 HN GLU 598 3.557 8.348 -6.699 771 HA GLU 598 HA GLU 598 6.202 8.974 -7.675 772 HB2 GLU 598 HB2 GLU 598 4.071 10.435 -7.794 773 HB3 GLU 598 HB3 GLU 598 4.416 10.825 -6.116 774 HG2 GLU 598 HG2 GLU 598 6.256 12.067 -6.634 775 HG3 GLU 598 HG3 GLU 598 6.585 11.165 -8.115 776 H VAL 599 HN VAL 599 7.499 7.718 -6.330 777 HA VAL 599 HA VAL 599 7.398 8.230 -3.446 778 HB VAL 599 HB VAL 599 9.004 6.150 -4.946 779 HG11 VAL 599 HG11 VAL 599 8.377 6.441 -2.010 780 HG12 VAL 599 HG12 VAL 599 9.216 5.074 -2.746 781 HG13 VAL 599 HG13 VAL 599 9.946 6.679 -2.777 782 HG21 VAL 599 HG21 VAL 599 6.607 5.780 -5.252 783 HG22 VAL 599 HG22 VAL 599 7.325 4.537 -4.228 784 HG23 VAL 599 HG23 VAL 599 6.371 5.831 -3.504 785 H SER 600 HN SER 600 8.998 9.270 -2.389 786 HA SER 600 HA SER 600 11.496 9.820 -3.781 787 HB2 SER 600 HB2 SER 600 9.973 11.667 -4.402 788 HB3 SER 600 HB3 SER 600 9.739 12.031 -2.693 789 HG SER 600 HG SER 600 12.298 12.017 -3.907 790 H LEU 601 HN LEU 601 12.975 11.057 -2.335 791 HA LEU 601 HA LEU 601 12.621 10.295 0.478 792 HB2 LEU 601 HB2 LEU 601 14.045 8.632 -0.770 793 HB3 LEU 601 HB3 LEU 601 15.181 9.929 -1.086 794 HG LEU 601 HG LEU 601 15.514 10.192 1.360 795 HD11 LEU 601 HD11 LEU 601 14.713 8.439 2.856 796 HD12 LEU 601 HD12 LEU 601 13.371 9.310 2.115 797 HD13 LEU 601 HD13 LEU 601 13.811 7.707 1.527 798 HD21 LEU 601 HD21 LEU 601 16.020 7.419 0.284 799 HD22 LEU 601 HD22 LEU 601 17.047 8.831 0.037 800 HD23 LEU 601 HD23 LEU 601 16.845 8.162 1.655 801 H LYS 602 HN LYS 602 12.553 12.197 1.480 802 HA LYS 602 HA LYS 602 14.454 14.295 0.641 803 HB2 LYS 602 HB2 LYS 602 12.109 14.860 0.107 804 HB3 LYS 602 HB3 LYS 602 11.677 14.636 1.794 805 HG2 LYS 602 HG2 LYS 602 13.133 16.509 2.408 806 HG3 LYS 602 HG3 LYS 602 13.536 16.738 0.704 807 HD2 LYS 602 HD2 LYS 602 10.746 16.869 1.841 808 HD3 LYS 602 HD3 LYS 602 11.761 18.277 1.519 809 HE2 LYS 602 HE2 LYS 602 11.034 16.259 -0.598 810 HE3 LYS 602 HE3 LYS 602 10.054 17.688 -0.261 811 HZ1 LYS 602 HZ1 LYS 602 12.917 17.718 -1.072 812 HZ2 LYS 602 HZ2 LYS 602 11.942 19.080 -0.789 813 HZ3 LYS 602 HZ3 LYS 602 11.604 18.054 -2.096 814 H ASN 603 HN ASN 603 15.996 14.528 2.107 815 HA ASN 603 HA ASN 603 17.132 14.588 4.072 816 HB2 ASN 603 HB2 ASN 603 14.403 15.341 5.149 817 HB3 ASN 603 HB3 ASN 603 15.887 15.409 6.091 818 HD21 ASN 603 HD21 ASN 603 17.504 16.313 3.833 819 HD22 ASN 603 HD22 ASN 603 17.081 17.966 3.575 820 H ASN 604 HN ASN 604 16.099 12.111 3.129 821 HA ASN 604 HA ASN 604 16.109 9.929 3.721 822 HB2 ASN 604 HB2 ASN 604 16.844 11.079 6.394 823 HB3 ASN 604 HB3 ASN 604 16.520 9.360 6.207 824 HD21 ASN 604 HD21 ASN 604 17.963 8.080 5.101 825 HD22 ASN 604 HD22 ASN 604 19.535 8.627 4.640 826 H VAL 605 HN VAL 605 13.762 11.984 4.299 827 HA VAL 605 HA VAL 605 12.027 10.073 5.681 828 HB VAL 605 HB VAL 605 11.387 12.866 4.707 829 HG11 VAL 605 HG11 VAL 605 9.390 12.680 6.105 830 HG12 VAL 605 HG12 VAL 605 9.410 11.445 4.845 831 HG13 VAL 605 HG13 VAL 605 9.821 11.016 6.506 832 HG21 VAL 605 HG21 VAL 605 12.026 11.883 7.491 833 HG22 VAL 605 HG22 VAL 605 13.054 12.903 6.487 834 HG23 VAL 605 HG23 VAL 605 11.506 13.514 7.072 835 H VAL 606 HN VAL 606 10.905 8.655 4.532 836 HA VAL 606 HA VAL 606 10.819 8.841 1.655 837 HB VAL 606 HB VAL 606 9.479 6.761 3.387 838 HG11 VAL 606 HG11 VAL 606 8.725 6.781 1.085 839 HG12 VAL 606 HG12 VAL 606 10.391 6.728 0.512 840 HG13 VAL 606 HG13 VAL 606 9.714 5.351 1.382 841 HG21 VAL 606 HG21 VAL 606 12.288 6.749 2.282 842 HG22 VAL 606 HG22 VAL 606 11.836 6.876 3.983 843 HG23 VAL 606 HG23 VAL 606 11.490 5.397 3.087 844 H SER 607 HN SER 607 9.110 9.332 0.402 845 HA SER 607 HA SER 607 6.464 9.574 1.615 846 HB2 SER 607 HB2 SER 607 6.223 11.803 0.352 847 HB3 SER 607 HB3 SER 607 7.182 11.817 1.833 848 HG SER 607 HG SER 607 9.046 11.515 0.405 849 H VAL 608 HN VAL 608 4.765 9.321 0.176 850 HA VAL 608 HA VAL 608 5.462 8.792 -2.627 851 HB VAL 608 HB VAL 608 5.234 6.619 -1.593 852 HG11 VAL 608 HG11 VAL 608 3.910 7.206 0.359 853 HG12 VAL 608 HG12 VAL 608 2.505 7.513 -0.664 854 HG13 VAL 608 HG13 VAL 608 3.155 5.879 -0.525 855 HG21 VAL 608 HG21 VAL 608 2.816 7.325 -3.246 856 HG22 VAL 608 HG22 VAL 608 4.397 6.836 -3.850 857 HG23 VAL 608 HG23 VAL 608 3.403 5.688 -2.952 858 H ASN 609 HN ASN 609 4.399 10.124 -3.882 859 HA ASN 609 HA ASN 609 2.842 11.544 -4.731 860 HB2 ASN 609 HB2 ASN 609 0.951 9.854 -3.077 861 HB3 ASN 609 HB3 ASN 609 0.440 11.063 -4.248 862 HD21 ASN 609 HD21 ASN 609 -0.139 8.261 -4.218 863 HD22 ASN 609 HD22 ASN 609 0.475 7.610 -5.698 864 H LYS 610 HN LYS 610 4.255 12.211 -2.347 865 HA LYS 610 HA LYS 610 4.442 14.007 -0.972 866 HB2 LYS 610 HB2 LYS 610 1.619 14.615 -1.845 867 HB3 LYS 610 HB3 LYS 610 2.502 15.604 -0.691 868 HG2 LYS 610 HG2 LYS 610 3.506 15.017 -3.466 869 HG3 LYS 610 HG3 LYS 610 2.517 16.424 -3.062 870 HD2 LYS 610 HD2 LYS 610 5.106 15.781 -1.664 871 HD3 LYS 610 HD3 LYS 610 5.022 16.797 -3.103 872 HE2 LYS 610 HE2 LYS 610 3.512 17.324 -0.547 873 HE3 LYS 610 HE3 LYS 610 5.055 18.070 -0.966 874 HZ1 LYS 610 HZ1 LYS 610 3.149 19.485 -1.505 875 HZ2 LYS 610 HZ2 LYS 610 2.559 18.307 -2.565 876 HZ3 LYS 610 HZ3 LYS 610 4.038 19.073 -2.885 877 H GLU 611 HN GLU 611 2.496 11.384 -0.539 878 HA GLU 611 HA GLU 611 1.717 12.073 2.185 879 HB2 GLU 611 HB2 GLU 611 1.326 9.443 0.756 880 HB3 GLU 611 HB3 GLU 611 0.503 9.999 2.206 881 HG2 GLU 611 HG2 GLU 611 0.205 11.171 -0.555 882 HG3 GLU 611 HG3 GLU 611 -0.946 10.112 0.257 883 HA PRO 612 HA PRO 612 5.583 10.463 3.622 884 HB2 PRO 612 HB2 PRO 612 4.469 10.602 6.315 885 HB3 PRO 612 HB3 PRO 612 5.758 11.569 5.591 886 HG2 PRO 612 HG2 PRO 612 3.325 12.591 6.198 887 HG3 PRO 612 HG3 PRO 612 4.301 13.179 4.839 888 HD2 PRO 612 HD2 PRO 612 1.962 11.306 4.823 889 HD3 PRO 612 HD3 PRO 612 2.353 12.631 3.704 890 H VAL 613 HN VAL 613 6.429 8.538 4.205 891 HA VAL 613 HA VAL 613 4.614 6.334 4.723 892 HB VAL 613 HB VAL 613 7.624 6.373 4.386 893 HG11 VAL 613 HG11 VAL 613 7.490 3.946 4.233 894 HG12 VAL 613 HG12 VAL 613 6.891 4.496 5.799 895 HG13 VAL 613 HG13 VAL 613 5.754 4.007 4.542 896 HG21 VAL 613 HG21 VAL 613 5.425 5.485 2.526 897 HG22 VAL 613 HG22 VAL 613 6.408 6.939 2.349 898 HG23 VAL 613 HG23 VAL 613 7.155 5.348 2.213 899 H ALA 614 HN ALA 614 4.209 5.509 6.649 900 HA ALA 614 HA ALA 614 5.186 6.910 8.973 901 HB1 ALA 614 HB1 ALA 614 3.231 4.624 8.769 902 HB2 ALA 614 HB2 ALA 614 3.497 5.653 10.176 903 HB3 ALA 614 HB3 ALA 614 2.811 6.337 8.700 904 H GLU 615 HN GLU 615 5.731 3.833 7.436 905 HA GLU 615 HA GLU 615 7.950 3.279 9.173 906 HB2 GLU 615 HB2 GLU 615 6.002 2.463 10.522 907 HB3 GLU 615 HB3 GLU 615 5.621 1.349 9.219 908 HG2 GLU 615 HG2 GLU 615 6.771 0.130 10.897 909 HG3 GLU 615 HG3 GLU 615 7.869 0.320 9.534 910 HA PRO 616 HA PRO 616 8.419 1.537 5.002 911 HB2 PRO 616 HB2 PRO 616 10.801 2.592 4.469 912 HB3 PRO 616 HB3 PRO 616 9.350 3.603 4.497 913 HG2 PRO 616 HG2 PRO 616 11.500 3.311 6.547 914 HG3 PRO 616 HG3 PRO 616 10.623 4.765 6.038 915 HD2 PRO 616 HD2 PRO 616 10.057 3.213 8.295 916 HD3 PRO 616 HD3 PRO 616 8.976 4.412 7.560 917 H ASP 617 HN ASP 617 9.655 -0.174 4.171 918 HA ASP 617 HA ASP 617 11.483 -1.507 3.814 919 HB2 ASP 617 HB2 ASP 617 12.646 -0.216 6.297 920 HB3 ASP 617 HB3 ASP 617 13.489 -1.377 5.279 921 H ILE 618 HN ILE 618 9.126 -2.070 5.283 922 HA ILE 618 HA ILE 618 9.769 -3.925 7.357 923 HB ILE 618 HB ILE 618 7.321 -3.127 5.841 924 HG12 ILE 618 HG12 ILE 618 8.015 -3.275 8.784 925 HG13 ILE 618 HG13 ILE 618 8.016 -1.829 7.781 926 HG21 ILE 618 HG21 ILE 618 5.997 -4.837 7.079 927 HG22 ILE 618 HG22 ILE 618 7.128 -5.565 5.935 928 HG23 ILE 618 HG23 ILE 618 7.501 -5.553 7.659 929 HD11 ILE 618 HD11 ILE 618 6.036 -1.943 9.184 930 HD12 ILE 618 HD12 ILE 618 5.609 -2.033 7.475 931 HD13 ILE 618 HD13 ILE 618 5.602 -3.494 8.464 932 H MET 619 HN MET 619 10.799 -5.752 6.936 933 HA MET 619 HA MET 619 11.015 -6.799 4.301 934 HB2 MET 619 HB2 MET 619 11.979 -7.900 6.940 935 HB3 MET 619 HB3 MET 619 12.404 -8.564 5.372 936 HG2 MET 619 HG2 MET 619 13.004 -5.722 6.100 937 HG3 MET 619 HG3 MET 619 14.079 -7.042 6.546 938 HE1 MET 619 HE1 MET 619 12.112 -6.212 2.959 939 HE2 MET 619 HE2 MET 619 12.590 -4.814 3.927 940 HE3 MET 619 HE3 MET 619 13.438 -5.184 2.425 941 H ALA 620 HN ALA 620 9.681 -8.124 3.329 942 HA ALA 620 HA ALA 620 8.322 -10.199 4.923 943 HB1 ALA 620 HB1 ALA 620 7.314 -8.895 2.388 944 HB2 ALA 620 HB2 ALA 620 6.489 -10.147 3.317 945 HB3 ALA 620 HB3 ALA 620 6.727 -8.541 4.015 946 H THR 621 HN THR 621 7.949 -12.234 3.601 947 HA THR 621 HA THR 621 10.478 -12.972 2.544 948 HB THR 621 HB THR 621 8.969 -14.544 3.792 949 HG1 THR 621 HG1 THR 621 10.431 -15.023 1.519 950 HG21 THR 621 HG21 THR 621 7.536 -14.754 1.133 951 HG22 THR 621 HG22 THR 621 6.869 -14.010 2.588 952 HG23 THR 621 HG23 THR 621 7.234 -15.735 2.567 953 H ASN 622 HN ASN 622 7.482 -11.969 1.025 954 HA ASN 622 HA ASN 622 8.729 -12.516 -1.580 955 HB2 ASN 622 HB2 ASN 622 6.481 -12.755 -2.540 956 HB3 ASN 622 HB3 ASN 622 6.769 -13.931 -1.267 957 HD21 ASN 622 HD21 ASN 622 4.254 -13.093 -2.304 958 HD22 ASN 622 HD22 ASN 622 3.374 -12.387 -0.989 959 H GLY 623 HN GLY 623 8.936 -10.066 0.097 960 HA2 GLY 623 HA2 GLY 623 9.168 -8.162 -1.777 961 HA3 GLY 623 HA3 GLY 623 7.448 -8.097 -1.422 962 H VAL 624 HN VAL 624 7.903 -5.910 -0.779 963 HA VAL 624 HA VAL 624 8.813 -5.812 2.018 964 HB VAL 624 HB VAL 624 10.454 -4.771 0.379 965 HG11 VAL 624 HG11 VAL 624 9.896 -2.506 -0.422 966 HG12 VAL 624 HG12 VAL 624 8.899 -3.766 -1.153 967 HG13 VAL 624 HG13 VAL 624 8.239 -2.758 0.133 968 HG21 VAL 624 HG21 VAL 624 10.865 -2.789 1.765 969 HG22 VAL 624 HG22 VAL 624 9.275 -2.978 2.501 970 HG23 VAL 624 HG23 VAL 624 10.515 -4.212 2.745 971 H VAL 625 HN VAL 625 7.830 -4.072 3.264 972 HA VAL 625 HA VAL 625 5.215 -3.222 2.206 973 HB VAL 625 HB VAL 625 5.757 -4.045 5.069 974 HG11 VAL 625 HG11 VAL 625 3.152 -3.408 3.695 975 HG12 VAL 625 HG12 VAL 625 3.365 -3.852 5.388 976 HG13 VAL 625 HG13 VAL 625 4.018 -2.327 4.785 977 HG21 VAL 625 HG21 VAL 625 4.311 -5.545 2.891 978 HG22 VAL 625 HG22 VAL 625 5.824 -6.010 3.669 979 HG23 VAL 625 HG23 VAL 625 4.325 -5.992 4.597 980 H HIS 626 HN HIS 626 4.731 -1.113 2.484 981 HA HIS 626 HA HIS 626 6.404 0.430 4.337 982 HB2 HIS 626 HB2 HIS 626 5.319 1.235 1.633 983 HB3 HIS 626 HB3 HIS 626 6.002 2.369 2.783 984 HD2 HIS 626 HD2 HIS 626 7.100 -0.195 0.152 985 HE1 HIS 626 HE1 HIS 626 10.571 1.366 1.997 986 HE2 HIS 626 HE2 HIS 626 9.674 0.123 -0.019 987 H VAL 627 HN VAL 627 5.233 0.946 6.023 988 HA VAL 627 HA VAL 627 2.392 0.990 6.091 989 HB VAL 627 HB VAL 627 4.358 2.205 8.047 990 HG11 VAL 627 HG11 VAL 627 2.100 3.098 8.321 991 HG12 VAL 627 HG12 VAL 627 1.459 1.459 8.427 992 HG13 VAL 627 HG13 VAL 627 2.547 2.066 9.679 993 HG21 VAL 627 HG21 VAL 627 4.027 0.126 9.324 994 HG22 VAL 627 HG22 VAL 627 3.051 -0.511 8.000 995 HG23 VAL 627 HG23 VAL 627 4.761 -0.164 7.746 996 H ILE 628 HN ILE 628 0.993 2.568 5.564 997 HA ILE 628 HA ILE 628 2.004 5.330 5.572 998 HB ILE 628 HB ILE 628 0.248 5.789 3.768 999 HG12 ILE 628 HG12 ILE 628 0.578 2.813 3.361 1000 HG13 ILE 628 HG13 ILE 628 -0.884 3.605 3.934 1001 HG21 ILE 628 HG21 ILE 628 2.716 4.202 3.106 1002 HG22 ILE 628 HG22 ILE 628 1.831 5.237 1.983 1003 HG23 ILE 628 HG23 ILE 628 2.626 5.940 3.394 1004 HD11 ILE 628 HD11 ILE 628 0.372 3.785 1.214 1005 HD12 ILE 628 HD12 ILE 628 -1.205 3.125 1.647 1006 HD13 ILE 628 HD13 ILE 628 -0.915 4.864 1.756 1007 H THR 629 HN THR 629 0.640 6.914 6.286 1008 HA THR 629 HA THR 629 -1.568 5.965 7.956 1009 HB THR 629 HB THR 629 -1.500 8.311 8.873 1010 HG1 THR 629 HG1 THR 629 -0.546 9.380 7.126 1011 HG21 THR 629 HG21 THR 629 -0.313 6.486 9.990 1012 HG22 THR 629 HG22 THR 629 0.599 7.990 10.114 1013 HG23 THR 629 HG23 THR 629 1.092 6.753 8.955 1014 H ASN 630 HN ASN 630 -1.256 6.954 4.877 1015 HA ASN 630 HA ASN 630 -3.846 8.349 4.855 1016 HB2 ASN 630 HB2 ASN 630 -1.428 8.949 3.134 1017 HB3 ASN 630 HB3 ASN 630 -3.018 9.650 2.885 1018 HD21 ASN 630 HD21 ASN 630 -2.233 11.731 3.132 1019 HD22 ASN 630 HD22 ASN 630 -1.806 12.366 4.691 1020 H VAL 631 HN VAL 631 -4.972 8.152 2.736 1021 HA VAL 631 HA VAL 631 -4.540 5.487 1.592 1022 HB VAL 631 HB VAL 631 -6.922 7.339 1.300 1023 HG11 VAL 631 HG11 VAL 631 -6.627 5.844 -0.607 1024 HG12 VAL 631 HG12 VAL 631 -6.583 4.460 0.484 1025 HG13 VAL 631 HG13 VAL 631 -8.056 5.417 0.333 1026 HG21 VAL 631 HG21 VAL 631 -6.559 4.881 3.017 1027 HG22 VAL 631 HG22 VAL 631 -6.740 6.541 3.585 1028 HG23 VAL 631 HG23 VAL 631 -8.084 5.734 2.776 1029 H LEU 632 HN LEU 632 -3.627 5.308 -0.380 1030 HA LEU 632 HA LEU 632 -2.955 7.721 -1.811 1031 HB2 LEU 632 HB2 LEU 632 -2.345 4.823 -2.377 1032 HB3 LEU 632 HB3 LEU 632 -1.778 6.157 -3.368 1033 HG LEU 632 HG LEU 632 -1.067 5.666 -0.471 1034 HD11 LEU 632 HD11 LEU 632 0.600 5.479 -2.976 1035 HD12 LEU 632 HD12 LEU 632 1.169 5.237 -1.323 1036 HD13 LEU 632 HD13 LEU 632 0.003 4.115 -2.028 1037 HD21 LEU 632 HD21 LEU 632 -0.173 7.842 -2.364 1038 HD22 LEU 632 HD22 LEU 632 -1.200 8.050 -0.946 1039 HD23 LEU 632 HD23 LEU 632 0.480 7.551 -0.752 1040 H GLN 633 HN GLN 633 -4.266 8.630 -3.184 1041 HA GLN 633 HA GLN 633 -5.921 6.931 -4.926 1042 HB2 GLN 633 HB2 GLN 633 -7.299 8.247 -3.351 1043 HB3 GLN 633 HB3 GLN 633 -6.543 9.724 -3.932 1044 HG2 GLN 633 HG2 GLN 633 -7.473 9.332 -6.154 1045 HG3 GLN 633 HG3 GLN 633 -8.236 7.850 -5.575 1046 HE21 GLN 633 HE21 GLN 633 -10.007 7.994 -4.196 1047 HE22 GLN 633 HE22 GLN 633 -10.889 9.464 -3.981 1048 HA PRO 634 HA PRO 634 -3.335 8.505 -8.179 1049 HB2 PRO 634 HB2 PRO 634 -5.178 8.109 -10.221 1050 HB3 PRO 634 HB3 PRO 634 -4.054 6.894 -9.605 1051 HG2 PRO 634 HG2 PRO 634 -6.938 7.314 -8.950 1052 HG3 PRO 634 HG3 PRO 634 -6.046 5.797 -9.169 1053 HD2 PRO 634 HD2 PRO 634 -6.673 6.697 -6.725 1054 HD3 PRO 634 HD3 PRO 634 -5.122 5.889 -7.040 Start of MODEL 8 1 H1 ALA 500 H1 ALA 500 5.213 -24.209 11.970 2 H2 ALA 500 H2 ALA 500 6.891 -24.035 12.151 3 H3 ALA 500 H3 ALA 500 6.260 -24.781 10.765 4 HA ALA 500 HA ALA 500 5.225 -22.722 10.085 5 HB1 ALA 500 HB1 ALA 500 5.733 -20.655 11.297 6 HB2 ALA 500 HB2 ALA 500 4.851 -21.797 12.311 7 HB3 ALA 500 HB3 ALA 500 6.589 -21.587 12.525 8 H GLY 501 HN GLY 501 6.608 -20.729 9.294 9 HA2 GLY 501 HA2 GLY 501 9.353 -20.688 9.242 10 HA3 GLY 501 HA3 GLY 501 8.910 -21.877 8.024 11 H MET 502 HN MET 502 9.577 -18.703 8.568 12 HA MET 502 HA MET 502 9.614 -16.855 7.263 13 HB2 MET 502 HB2 MET 502 8.445 -18.622 5.105 14 HB3 MET 502 HB3 MET 502 9.126 -17.018 4.864 15 HG2 MET 502 HG2 MET 502 11.307 -17.850 5.615 16 HG3 MET 502 HG3 MET 502 10.617 -19.457 5.812 17 HE1 MET 502 HE1 MET 502 8.605 -19.377 3.185 18 HE2 MET 502 HE2 MET 502 9.624 -20.282 2.063 19 HE3 MET 502 HE3 MET 502 9.488 -20.796 3.745 20 H GLY 503 HN GLY 503 8.254 -15.159 6.495 21 HA2 GLY 503 HA2 GLY 503 5.372 -15.658 6.849 22 HA3 GLY 503 HA3 GLY 503 6.151 -14.272 7.592 23 H THR 504 HN THR 504 4.132 -14.945 5.274 24 HA THR 504 HA THR 504 5.282 -13.538 3.037 25 HB THR 504 HB THR 504 2.961 -13.650 2.106 26 HG1 THR 504 HG1 THR 504 2.332 -15.279 4.351 27 HG21 THR 504 HG21 THR 504 4.507 -15.435 1.595 28 HG22 THR 504 HG22 THR 504 2.905 -16.119 1.867 29 HG23 THR 504 HG23 THR 504 4.141 -16.240 3.121 30 H VAL 505 HN VAL 505 4.032 -11.631 2.098 31 HA VAL 505 HA VAL 505 3.940 -9.506 3.930 32 HB VAL 505 HB VAL 505 2.676 -8.263 2.123 33 HG11 VAL 505 HG11 VAL 505 4.603 -8.185 0.594 34 HG12 VAL 505 HG12 VAL 505 5.094 -8.143 2.288 35 HG13 VAL 505 HG13 VAL 505 5.249 -9.635 1.361 36 HG21 VAL 505 HG21 VAL 505 3.122 -10.822 0.593 37 HG22 VAL 505 HG22 VAL 505 1.559 -10.186 1.108 38 HG23 VAL 505 HG23 VAL 505 2.522 -9.305 -0.077 39 H MET 506 HN MET 506 1.465 -11.727 2.778 40 HA MET 506 HA MET 506 -0.761 -10.392 3.895 41 HB2 MET 506 HB2 MET 506 -0.358 -13.345 3.381 42 HB3 MET 506 HB3 MET 506 -1.896 -12.592 3.776 43 HG2 MET 506 HG2 MET 506 -0.245 -12.126 1.301 44 HG3 MET 506 HG3 MET 506 -1.773 -12.996 1.406 45 HE1 MET 506 HE1 MET 506 -3.413 -11.124 3.442 46 HE2 MET 506 HE2 MET 506 -4.275 -10.097 2.295 47 HE3 MET 506 HE3 MET 506 -4.107 -11.823 1.978 48 H ASP 507 HN ASP 507 1.591 -12.637 5.199 49 HA ASP 507 HA ASP 507 0.271 -13.091 7.684 50 HB2 ASP 507 HB2 ASP 507 1.946 -14.668 6.896 51 HB3 ASP 507 HB3 ASP 507 3.176 -13.408 6.889 52 H VAL 508 HN VAL 508 2.844 -10.912 6.618 53 HA VAL 508 HA VAL 508 3.352 -9.642 9.050 54 HB VAL 508 HB VAL 508 3.496 -8.463 6.269 55 HG11 VAL 508 HG11 VAL 508 4.796 -7.567 8.838 56 HG12 VAL 508 HG12 VAL 508 5.159 -6.923 7.236 57 HG13 VAL 508 HG13 VAL 508 3.552 -6.709 7.931 58 HG21 VAL 508 HG21 VAL 508 5.606 -9.852 7.917 59 HG22 VAL 508 HG22 VAL 508 4.819 -10.497 6.478 60 HG23 VAL 508 HG23 VAL 508 5.867 -9.083 6.352 61 H LEU 509 HN LEU 509 0.949 -8.917 6.540 62 HA LEU 509 HA LEU 509 0.011 -6.521 7.735 63 HB2 LEU 509 HB2 LEU 509 -1.470 -8.361 5.858 64 HB3 LEU 509 HB3 LEU 509 -1.866 -6.689 6.196 65 HG LEU 509 HG LEU 509 0.644 -7.644 4.827 66 HD11 LEU 509 HD11 LEU 509 -1.364 -7.957 3.461 67 HD12 LEU 509 HD12 LEU 509 -1.788 -6.261 3.700 68 HD13 LEU 509 HD13 LEU 509 -0.328 -6.688 2.810 69 HD21 LEU 509 HD21 LEU 509 1.004 -5.581 6.073 70 HD22 LEU 509 HD22 LEU 509 1.015 -5.270 4.337 71 HD23 LEU 509 HD23 LEU 509 -0.403 -4.853 5.301 72 H LYS 510 HN LYS 510 -0.830 -9.886 8.189 73 HA LYS 510 HA LYS 510 -3.207 -9.176 9.711 74 HB2 LYS 510 HB2 LYS 510 -3.672 -11.539 9.891 75 HB3 LYS 510 HB3 LYS 510 -3.309 -11.144 8.222 76 HG2 LYS 510 HG2 LYS 510 -1.089 -12.104 8.445 77 HG3 LYS 510 HG3 LYS 510 -1.388 -12.431 10.158 78 HD2 LYS 510 HD2 LYS 510 -3.199 -13.937 9.581 79 HD3 LYS 510 HD3 LYS 510 -2.998 -13.564 7.869 80 HE2 LYS 510 HE2 LYS 510 -1.990 -15.703 8.406 81 HE3 LYS 510 HE3 LYS 510 -0.755 -14.542 7.927 82 HZ1 LYS 510 HZ1 LYS 510 -1.359 -14.855 10.784 83 HZ2 LYS 510 HZ2 LYS 510 0.110 -14.454 10.022 84 HZ3 LYS 510 HZ3 LYS 510 -0.444 -16.053 10.010 85 H GLY 511 HN GLY 511 0.082 -9.700 10.215 86 HA2 GLY 511 HA2 GLY 511 -0.165 -10.379 13.018 87 HA3 GLY 511 HA3 GLY 511 1.321 -10.000 12.154 88 H ASP 512 HN ASP 512 -0.504 -7.595 11.182 89 HA ASP 512 HA ASP 512 0.094 -5.913 13.542 90 HB2 ASP 512 HB2 ASP 512 1.516 -5.311 11.656 91 HB3 ASP 512 HB3 ASP 512 0.103 -5.144 10.619 92 H ASN 513 HN ASN 513 -1.475 -4.615 14.332 93 HA ASN 513 HA ASN 513 -4.159 -5.334 13.836 94 HB2 ASN 513 HB2 ASN 513 -3.406 -4.576 16.030 95 HB3 ASN 513 HB3 ASN 513 -3.031 -2.986 15.377 96 HD21 ASN 513 HD21 ASN 513 -5.887 -4.833 14.511 97 HD22 ASN 513 HD22 ASN 513 -7.027 -3.787 15.282 98 H ARG 514 HN ARG 514 -2.206 -2.623 12.713 99 HA ARG 514 HA ARG 514 -4.443 -1.089 11.770 100 HB2 ARG 514 HB2 ARG 514 -1.486 -0.906 11.153 101 HB3 ARG 514 HB3 ARG 514 -2.685 0.284 10.663 102 HG2 ARG 514 HG2 ARG 514 -3.111 0.892 12.933 103 HG3 ARG 514 HG3 ARG 514 -2.123 -0.447 13.530 104 HD2 ARG 514 HD2 ARG 514 -0.137 0.553 12.838 105 HD3 ARG 514 HD3 ARG 514 -0.962 1.638 11.725 106 HE ARG 514 HE ARG 514 -1.909 2.532 14.034 107 HH11 ARG 514 HH12 ARG 514 1.365 1.531 13.261 108 HH12 ARG 514 HH11 ARG 514 2.108 2.775 14.232 109 HH21 ARG 514 HH22 ARG 514 -0.912 4.157 15.345 110 HH22 ARG 514 HH21 ARG 514 0.823 4.234 15.423 111 H PHE 515 HN PHE 515 -1.967 -3.127 10.286 112 HA PHE 515 HA PHE 515 -2.825 -2.810 7.611 113 HB2 PHE 515 HB2 PHE 515 -1.267 -5.063 8.891 114 HB3 PHE 515 HB3 PHE 515 -1.367 -4.720 7.176 115 HD1 PHE 515 HD2 PHE 515 -1.265 -1.563 8.075 116 HD2 PHE 515 HD1 PHE 515 1.202 -5.007 8.480 117 HE1 PHE 515 HE2 PHE 515 0.719 -0.121 8.260 118 HE2 PHE 515 HE1 PHE 515 3.181 -3.568 8.664 119 HZ PHE 515 HZ PHE 515 2.943 -1.127 8.555 120 H SER 516 HN SER 516 -4.077 -4.638 10.237 121 HA SER 516 HA SER 516 -5.064 -6.931 9.010 122 HB2 SER 516 HB2 SER 516 -6.145 -5.368 11.356 123 HB3 SER 516 HB3 SER 516 -6.769 -6.942 10.863 124 HG SER 516 HG SER 516 -4.007 -6.578 11.337 125 H MET 517 HN MET 517 -6.458 -3.681 9.129 126 HA MET 517 HA MET 517 -8.984 -4.499 8.067 127 HB2 MET 517 HB2 MET 517 -7.709 -1.761 8.140 128 HB3 MET 517 HB3 MET 517 -9.378 -2.085 7.702 129 HG2 MET 517 HG2 MET 517 -9.775 -2.992 9.942 130 HG3 MET 517 HG3 MET 517 -8.111 -2.603 10.378 131 HE1 MET 517 HE1 MET 517 -8.249 1.322 9.630 132 HE2 MET 517 HE2 MET 517 -7.175 0.043 10.195 133 HE3 MET 517 HE3 MET 517 -7.840 -0.026 8.563 134 H LEU 518 HN LEU 518 -5.960 -3.328 6.721 135 HA LEU 518 HA LEU 518 -6.826 -3.114 4.048 136 HB2 LEU 518 HB2 LEU 518 -4.678 -2.200 4.779 137 HB3 LEU 518 HB3 LEU 518 -4.090 -3.819 5.118 138 HG LEU 518 HG LEU 518 -4.288 -4.370 2.712 139 HD11 LEU 518 HD11 LEU 518 -4.989 -1.454 2.434 140 HD12 LEU 518 HD12 LEU 518 -4.575 -2.535 1.103 141 HD13 LEU 518 HD13 LEU 518 -6.026 -2.835 2.063 142 HD21 LEU 518 HD21 LEU 518 -2.374 -3.024 1.977 143 HD22 LEU 518 HD22 LEU 518 -2.597 -1.968 3.372 144 HD23 LEU 518 HD23 LEU 518 -2.160 -3.659 3.608 145 H VAL 519 HN VAL 519 -5.590 -5.833 5.939 146 HA VAL 519 HA VAL 519 -5.569 -7.786 3.947 147 HB VAL 519 HB VAL 519 -6.411 -8.182 6.829 148 HG11 VAL 519 HG11 VAL 519 -6.963 -10.076 5.401 149 HG12 VAL 519 HG12 VAL 519 -5.294 -10.144 4.837 150 HG13 VAL 519 HG13 VAL 519 -5.668 -10.482 6.527 151 HG21 VAL 519 HG21 VAL 519 -3.668 -8.319 5.588 152 HG22 VAL 519 HG22 VAL 519 -4.247 -7.085 6.707 153 HG23 VAL 519 HG23 VAL 519 -4.066 -8.754 7.251 154 H ALA 520 HN ALA 520 -8.208 -6.410 5.802 155 HA ALA 520 HA ALA 520 -10.202 -8.264 4.950 156 HB1 ALA 520 HB1 ALA 520 -10.529 -5.462 6.017 157 HB2 ALA 520 HB2 ALA 520 -11.801 -6.676 5.875 158 HB3 ALA 520 HB3 ALA 520 -10.456 -6.933 6.987 159 H ALA 521 HN ALA 521 -9.098 -5.113 3.823 160 HA ALA 521 HA ALA 521 -11.004 -4.787 1.766 161 HB1 ALA 521 HB1 ALA 521 -9.616 -2.951 2.627 162 HB2 ALA 521 HB2 ALA 521 -8.192 -3.706 1.912 163 HB3 ALA 521 HB3 ALA 521 -9.487 -3.106 0.875 164 H ILE 522 HN ILE 522 -7.668 -6.021 1.723 165 HA ILE 522 HA ILE 522 -7.518 -6.794 -0.950 166 HB ILE 522 HB ILE 522 -6.245 -8.099 1.465 167 HG12 ILE 522 HG12 ILE 522 -5.108 -6.088 -0.490 168 HG13 ILE 522 HG13 ILE 522 -5.736 -5.679 1.105 169 HG21 ILE 522 HG21 ILE 522 -6.190 -9.640 -0.392 170 HG22 ILE 522 HG22 ILE 522 -5.582 -8.378 -1.464 171 HG23 ILE 522 HG23 ILE 522 -4.577 -8.972 -0.142 172 HD11 ILE 522 HD11 ILE 522 -4.024 -7.048 2.143 173 HD12 ILE 522 HD12 ILE 522 -3.410 -7.507 0.553 174 HD13 ILE 522 HD13 ILE 522 -3.306 -5.829 1.090 175 H GLN 523 HN GLN 523 -8.764 -8.559 1.848 176 HA GLN 523 HA GLN 523 -9.359 -10.980 0.535 177 HB2 GLN 523 HB2 GLN 523 -9.243 -10.886 2.931 178 HB3 GLN 523 HB3 GLN 523 -10.518 -9.680 2.997 179 HG2 GLN 523 HG2 GLN 523 -12.104 -11.349 2.129 180 HG3 GLN 523 HG3 GLN 523 -10.813 -12.552 2.159 181 HE21 GLN 523 HE21 GLN 523 -10.088 -13.353 4.109 182 HE22 GLN 523 HE22 GLN 523 -10.951 -13.108 5.592 183 H SER 524 HN SER 524 -11.281 -8.068 1.110 184 HA SER 524 HA SER 524 -13.708 -9.142 0.095 185 HB2 SER 524 HB2 SER 524 -13.543 -7.227 1.696 186 HB3 SER 524 HB3 SER 524 -12.933 -6.229 0.379 187 HG SER 524 HG SER 524 -14.981 -6.938 -0.718 188 H ALA 525 HN ALA 525 -11.025 -7.429 -1.369 189 HA ALA 525 HA ALA 525 -12.467 -7.030 -3.862 190 HB1 ALA 525 HB1 ALA 525 -10.418 -5.934 -4.620 191 HB2 ALA 525 HB2 ALA 525 -10.958 -5.291 -3.068 192 HB3 ALA 525 HB3 ALA 525 -9.606 -6.423 -3.131 193 H GLY 526 HN GLY 526 -10.158 -9.252 -2.493 194 HA2 GLY 526 HA2 GLY 526 -9.721 -11.405 -3.294 195 HA3 GLY 526 HA3 GLY 526 -10.467 -10.962 -4.823 196 H LEU 527 HN LEU 527 -7.760 -9.538 -2.995 197 HA LEU 527 HA LEU 527 -6.102 -9.911 -5.407 198 HB2 LEU 527 HB2 LEU 527 -6.164 -7.753 -3.341 199 HB3 LEU 527 HB3 LEU 527 -4.652 -8.110 -4.148 200 HG LEU 527 HG LEU 527 -5.735 -6.256 -5.250 201 HD11 LEU 527 HD11 LEU 527 -5.886 -8.783 -6.886 202 HD12 LEU 527 HD12 LEU 527 -5.878 -7.146 -7.541 203 HD13 LEU 527 HD13 LEU 527 -4.471 -7.754 -6.667 204 HD21 LEU 527 HD21 LEU 527 -8.069 -8.109 -5.709 205 HD22 LEU 527 HD22 LEU 527 -8.045 -6.740 -4.598 206 HD23 LEU 527 HD23 LEU 527 -7.903 -6.468 -6.335 207 H THR 528 HN THR 528 -6.686 -11.476 -2.762 208 HA THR 528 HA THR 528 -4.332 -11.669 -1.275 209 HB THR 528 HB THR 528 -6.246 -13.948 -1.743 210 HG1 THR 528 HG1 THR 528 -6.750 -12.209 0.367 211 HG21 THR 528 HG21 THR 528 -4.296 -14.477 -0.389 212 HG22 THR 528 HG22 THR 528 -5.736 -14.431 0.627 213 HG23 THR 528 HG23 THR 528 -4.605 -13.079 0.640 214 H GLU 529 HN GLU 529 -5.315 -13.231 -4.254 215 HA GLU 529 HA GLU 529 -3.448 -15.322 -4.325 216 HB2 GLU 529 HB2 GLU 529 -4.608 -13.798 -6.661 217 HB3 GLU 529 HB3 GLU 529 -3.901 -15.407 -6.714 218 HG2 GLU 529 HG2 GLU 529 -5.689 -16.348 -5.510 219 HG3 GLU 529 HG3 GLU 529 -6.298 -14.764 -5.029 220 H THR 530 HN THR 530 -3.189 -11.936 -5.150 221 HA THR 530 HA THR 530 -0.826 -12.142 -6.715 222 HB THR 530 HB THR 530 -1.907 -9.717 -5.268 223 HG1 THR 530 HG1 THR 530 -3.264 -10.988 -6.923 224 HG21 THR 530 HG21 THR 530 -0.127 -9.942 -7.699 225 HG22 THR 530 HG22 THR 530 0.397 -9.458 -6.087 226 HG23 THR 530 HG23 THR 530 -0.730 -8.444 -6.988 227 H LEU 531 HN LEU 531 -1.432 -11.196 -3.327 228 HA LEU 531 HA LEU 531 1.404 -10.823 -2.878 229 HB2 LEU 531 HB2 LEU 531 -0.800 -10.721 -0.833 230 HB3 LEU 531 HB3 LEU 531 0.796 -10.015 -0.724 231 HG LEU 531 HG LEU 531 -1.389 -9.132 -2.598 232 HD11 LEU 531 HD11 LEU 531 -1.840 -8.491 -0.319 233 HD12 LEU 531 HD12 LEU 531 -0.208 -7.843 -0.149 234 HD13 LEU 531 HD13 LEU 531 -1.350 -7.080 -1.255 235 HD21 LEU 531 HD21 LEU 531 0.128 -7.325 -3.198 236 HD22 LEU 531 HD22 LEU 531 1.382 -8.033 -2.181 237 HD23 LEU 531 HD23 LEU 531 0.809 -8.902 -3.605 238 H ASN 532 HN ASN 532 -0.313 -13.472 -3.171 239 HA ASN 532 HA ASN 532 0.544 -14.902 -0.804 240 HB2 ASN 532 HB2 ASN 532 -1.620 -15.413 -1.871 241 HB3 ASN 532 HB3 ASN 532 -0.781 -15.930 -3.329 242 HD21 ASN 532 HD21 ASN 532 0.482 -16.610 -0.147 243 HD22 ASN 532 HD22 ASN 532 0.174 -18.311 -0.176 244 H ARG 533 HN ARG 533 1.462 -14.612 -4.187 245 HA ARG 533 HA ARG 533 3.403 -16.732 -4.017 246 HB2 ARG 533 HB2 ARG 533 2.905 -14.675 -6.174 247 HB3 ARG 533 HB3 ARG 533 4.051 -16.002 -6.304 248 HG2 ARG 533 HG2 ARG 533 2.133 -17.574 -5.934 249 HG3 ARG 533 HG3 ARG 533 1.060 -16.182 -6.084 250 HD2 ARG 533 HD2 ARG 533 3.020 -17.121 -8.171 251 HD3 ARG 533 HD3 ARG 533 1.281 -17.405 -8.196 252 HE ARG 533 HE ARG 533 1.508 -14.697 -8.017 253 HH11 ARG 533 HH12 ARG 533 2.792 -17.107 -10.198 254 HH12 ARG 533 HH11 ARG 533 2.804 -16.040 -11.575 255 HH21 ARG 533 HH22 ARG 533 1.498 -13.290 -9.819 256 HH22 ARG 533 HH21 ARG 533 2.037 -13.873 -11.372 257 H GLU 534 HN GLU 534 5.479 -16.592 -3.513 258 HA GLU 534 HA GLU 534 6.515 -14.144 -2.470 259 HB2 GLU 534 HB2 GLU 534 8.027 -16.706 -3.008 260 HB3 GLU 534 HB3 GLU 534 8.502 -15.407 -1.924 261 HG2 GLU 534 HG2 GLU 534 7.668 -16.832 -0.389 262 HG3 GLU 534 HG3 GLU 534 6.168 -16.009 -0.811 263 H GLY 535 HN GLY 535 7.665 -12.651 -3.444 264 HA2 GLY 535 HA2 GLY 535 9.505 -13.077 -5.552 265 HA3 GLY 535 HA3 GLY 535 7.983 -12.459 -6.191 266 H VAL 536 HN VAL 536 8.356 -10.368 -6.634 267 HA VAL 536 HA VAL 536 9.378 -8.745 -4.406 268 HB VAL 536 HB VAL 536 10.397 -7.202 -6.023 269 HG11 VAL 536 HG11 VAL 536 12.224 -8.725 -6.789 270 HG12 VAL 536 HG12 VAL 536 11.810 -8.892 -5.081 271 HG13 VAL 536 HG13 VAL 536 11.239 -10.089 -6.246 272 HG21 VAL 536 HG21 VAL 536 8.974 -7.590 -7.955 273 HG22 VAL 536 HG22 VAL 536 10.659 -7.887 -8.380 274 HG23 VAL 536 HG23 VAL 536 9.570 -9.244 -8.091 275 H TYR 537 HN TYR 537 8.110 -7.190 -3.744 276 HA TYR 537 HA TYR 537 6.252 -5.819 -5.481 277 HB2 TYR 537 HB2 TYR 537 5.288 -7.462 -3.120 278 HB3 TYR 537 HB3 TYR 537 4.329 -6.213 -3.900 279 HD1 TYR 537 HD2 TYR 537 3.820 -6.525 -6.413 280 HD2 TYR 537 HD1 TYR 537 5.216 -9.661 -3.898 281 HE1 TYR 537 HE2 TYR 537 2.978 -8.185 -8.021 282 HE2 TYR 537 HE1 TYR 537 4.380 -11.326 -5.501 283 HH TYR 537 HH TYR 537 3.552 -10.610 -8.635 284 H THR 538 HN THR 538 5.618 -3.822 -4.606 285 HA THR 538 HA THR 538 6.765 -3.189 -1.963 286 HB THR 538 HB THR 538 6.360 -1.244 -4.250 287 HG1 THR 538 HG1 THR 538 8.146 -2.248 -4.905 288 HG21 THR 538 HG21 THR 538 7.595 0.309 -2.918 289 HG22 THR 538 HG22 THR 538 7.934 -0.925 -1.707 290 HG23 THR 538 HG23 THR 538 6.287 -0.320 -1.912 291 H VAL 539 HN VAL 539 5.090 -3.292 -0.590 292 HA VAL 539 HA VAL 539 2.466 -2.358 -1.542 293 HB VAL 539 HB VAL 539 3.065 -4.166 0.803 294 HG11 VAL 539 HG11 VAL 539 0.982 -2.930 1.059 295 HG12 VAL 539 HG12 VAL 539 0.460 -3.448 -0.543 296 HG13 VAL 539 HG13 VAL 539 0.655 -4.635 0.747 297 HG21 VAL 539 HG21 VAL 539 2.053 -4.871 -1.956 298 HG22 VAL 539 HG22 VAL 539 3.657 -5.239 -1.319 299 HG23 VAL 539 HG23 VAL 539 2.229 -5.988 -0.603 300 H PHE 540 HN PHE 540 1.727 -0.496 -0.792 301 HA PHE 540 HA PHE 540 2.788 0.584 1.706 302 HB2 PHE 540 HB2 PHE 540 0.974 1.813 -0.387 303 HB3 PHE 540 HB3 PHE 540 1.584 2.647 1.033 304 HD1 PHE 540 HD1 PHE 540 3.915 3.338 1.172 305 HD2 PHE 540 HD2 PHE 540 2.403 1.362 -2.281 306 HE1 PHE 540 HE1 PHE 540 5.907 4.034 -0.101 307 HE2 PHE 540 HE2 PHE 540 4.393 2.055 -3.553 308 HZ PHE 540 HZ PHE 540 6.144 3.389 -2.458 309 H ALA 541 HN ALA 541 1.733 0.048 3.521 310 HA ALA 541 HA ALA 541 -1.096 -0.735 3.322 311 HB1 ALA 541 HB1 ALA 541 0.357 -2.455 4.245 312 HB2 ALA 541 HB2 ALA 541 0.904 -1.343 5.500 313 HB3 ALA 541 HB3 ALA 541 -0.781 -1.885 5.476 314 HA PRO 542 HA PRO 542 -1.883 3.214 5.305 315 HB2 PRO 542 HB2 PRO 542 -4.676 2.406 4.894 316 HB3 PRO 542 HB3 PRO 542 -3.826 3.829 4.285 317 HG2 PRO 542 HG2 PRO 542 -4.539 1.825 2.650 318 HG3 PRO 542 HG3 PRO 542 -3.019 2.710 2.422 319 HD2 PRO 542 HD2 PRO 542 -3.475 0.036 3.708 320 HD3 PRO 542 HD3 PRO 542 -2.220 0.524 2.545 321 H THR 543 HN THR 543 -2.306 3.692 7.370 322 HA THR 543 HA THR 543 -2.847 1.548 9.217 323 HB THR 543 HB THR 543 -2.484 3.349 10.939 324 HG1 THR 543 HG1 THR 543 -1.533 5.011 8.875 325 HG21 THR 543 HG21 THR 543 -0.631 1.962 10.173 326 HG22 THR 543 HG22 THR 543 -0.080 3.614 10.450 327 HG23 THR 543 HG23 THR 543 -0.361 3.042 8.805 328 H ASN 544 HN ASN 544 -4.277 2.353 11.218 329 HA ASN 544 HA ASN 544 -6.947 2.291 10.435 330 HB2 ASN 544 HB2 ASN 544 -5.714 3.240 13.031 331 HB3 ASN 544 HB3 ASN 544 -7.444 3.015 12.796 332 HD21 ASN 544 HD21 ASN 544 -8.300 0.978 12.817 333 HD22 ASN 544 HD22 ASN 544 -7.367 -0.428 13.204 334 H GLU 545 HN GLU 545 -4.831 5.005 11.001 335 HA GLU 545 HA GLU 545 -6.902 6.947 11.243 336 HB2 GLU 545 HB2 GLU 545 -4.425 6.994 12.077 337 HB3 GLU 545 HB3 GLU 545 -4.089 7.621 10.470 338 HG2 GLU 545 HG2 GLU 545 -4.351 9.404 12.109 339 HG3 GLU 545 HG3 GLU 545 -5.587 9.482 10.850 340 H ALA 546 HN ALA 546 -5.240 5.468 8.598 341 HA ALA 546 HA ALA 546 -5.645 7.515 6.666 342 HB1 ALA 546 HB1 ALA 546 -5.223 4.555 6.301 343 HB2 ALA 546 HB2 ALA 546 -5.205 5.745 4.996 344 HB3 ALA 546 HB3 ALA 546 -3.982 5.808 6.269 345 H PHE 547 HN PHE 547 -7.354 4.512 7.349 346 HA PHE 547 HA PHE 547 -9.412 4.998 5.465 347 HB2 PHE 547 HB2 PHE 547 -9.315 3.095 7.812 348 HB3 PHE 547 HB3 PHE 547 -10.497 3.069 6.518 349 HD1 PHE 547 HD2 PHE 547 -9.713 2.598 4.162 350 HD2 PHE 547 HD1 PHE 547 -7.257 1.993 7.584 351 HE1 PHE 547 HE2 PHE 547 -8.262 1.107 2.853 352 HE2 PHE 547 HE1 PHE 547 -5.802 0.498 6.276 353 HZ PHE 547 HZ PHE 547 -6.305 0.052 3.909 354 H ARG 548 HN ARG 548 -8.832 5.981 8.704 355 HA ARG 548 HA ARG 548 -11.528 6.627 9.406 356 HB2 ARG 548 HB2 ARG 548 -9.096 6.522 10.745 357 HB3 ARG 548 HB3 ARG 548 -9.446 8.241 10.688 358 HG2 ARG 548 HG2 ARG 548 -11.243 6.103 11.813 359 HG3 ARG 548 HG3 ARG 548 -10.272 7.240 12.743 360 HD2 ARG 548 HD2 ARG 548 -12.548 7.934 10.893 361 HD3 ARG 548 HD3 ARG 548 -12.607 7.931 12.653 362 HE ARG 548 HE ARG 548 -10.555 9.645 11.676 363 HH11 ARG 548 HH12 ARG 548 -13.984 9.415 12.345 364 HH12 ARG 548 HH11 ARG 548 -14.236 11.138 12.322 365 HH21 ARG 548 HH22 ARG 548 -10.865 11.916 11.684 366 HH22 ARG 548 HH21 ARG 548 -12.463 12.562 11.933 367 H ALA 549 HN ALA 549 -8.970 8.133 7.635 368 HA ALA 549 HA ALA 549 -10.153 10.782 7.764 369 HB1 ALA 549 HB1 ALA 549 -7.689 9.817 6.321 370 HB2 ALA 549 HB2 ALA 549 -8.174 11.499 6.540 371 HB3 ALA 549 HB3 ALA 549 -7.723 10.520 7.938 372 H LEU 550 HN LEU 550 -10.875 8.124 6.057 373 HA LEU 550 HA LEU 550 -11.034 9.172 3.407 374 HB2 LEU 550 HB2 LEU 550 -12.306 6.791 4.743 375 HB3 LEU 550 HB3 LEU 550 -12.591 7.200 3.061 376 HG LEU 550 HG LEU 550 -9.893 6.559 4.255 377 HD11 LEU 550 HD11 LEU 550 -11.330 4.592 4.170 378 HD12 LEU 550 HD12 LEU 550 -11.684 4.915 2.472 379 HD13 LEU 550 HD13 LEU 550 -10.045 4.489 2.965 380 HD21 LEU 550 HD21 LEU 550 -9.123 6.533 1.939 381 HD22 LEU 550 HD22 LEU 550 -10.732 7.019 1.394 382 HD23 LEU 550 HD23 LEU 550 -9.764 8.117 2.379 383 HA PRO 551 HA PRO 551 -14.563 11.725 3.900 384 HB2 PRO 551 HB2 PRO 551 -15.101 11.288 1.039 385 HB3 PRO 551 HB3 PRO 551 -14.669 12.776 1.887 386 HG2 PRO 551 HG2 PRO 551 -12.943 11.538 0.246 387 HG3 PRO 551 HG3 PRO 551 -12.401 12.377 1.713 388 HD2 PRO 551 HD2 PRO 551 -12.819 9.444 1.250 389 HD3 PRO 551 HD3 PRO 551 -11.493 10.273 2.096 390 HA PRO 552 HA PRO 552 -18.121 9.198 4.536 391 HB2 PRO 552 HB2 PRO 552 -19.641 11.511 3.433 392 HB3 PRO 552 HB3 PRO 552 -19.866 10.635 4.953 393 HG2 PRO 552 HG2 PRO 552 -18.729 13.033 4.947 394 HG3 PRO 552 HG3 PRO 552 -18.116 11.747 6.003 395 HD2 PRO 552 HD2 PRO 552 -16.991 12.800 3.443 396 HD3 PRO 552 HD3 PRO 552 -16.149 12.250 4.906 397 H ARG 553 HN ARG 553 -17.696 10.823 1.459 398 HA ARG 553 HA ARG 553 -19.704 9.235 0.122 399 HB2 ARG 553 HB2 ARG 553 -17.557 10.942 -1.147 400 HB3 ARG 553 HB3 ARG 553 -19.075 10.424 -1.866 401 HG2 ARG 553 HG2 ARG 553 -18.800 12.321 0.454 402 HG3 ARG 553 HG3 ARG 553 -19.120 12.775 -1.220 403 HD2 ARG 553 HD2 ARG 553 -21.237 11.685 -1.191 404 HD3 ARG 553 HD3 ARG 553 -20.895 10.933 0.367 405 HE ARG 553 HE ARG 553 -20.729 13.633 0.838 406 HH11 ARG 553 HH12 ARG 553 -23.181 11.511 -0.490 407 HH12 ARG 553 HH11 ARG 553 -24.509 12.443 0.144 408 HH21 ARG 553 HH22 ARG 553 -22.488 14.865 1.651 409 HH22 ARG 553 HH21 ARG 553 -24.113 14.339 1.341 410 H GLU 554 HN GLU 554 -16.178 9.559 -0.063 411 HA GLU 554 HA GLU 554 -15.753 7.454 -1.847 412 HB2 GLU 554 HB2 GLU 554 -13.982 8.895 0.093 413 HB3 GLU 554 HB3 GLU 554 -13.370 7.547 -0.854 414 HG2 GLU 554 HG2 GLU 554 -12.951 9.839 -1.800 415 HG3 GLU 554 HG3 GLU 554 -13.713 8.680 -2.889 416 H ARG 555 HN ARG 555 -15.821 7.453 1.708 417 HA ARG 555 HA ARG 555 -14.852 4.820 2.018 418 HB2 ARG 555 HB2 ARG 555 -15.691 4.886 4.268 419 HB3 ARG 555 HB3 ARG 555 -15.044 6.473 3.875 420 HG2 ARG 555 HG2 ARG 555 -17.278 7.333 3.528 421 HG3 ARG 555 HG3 ARG 555 -17.960 5.732 3.824 422 HD2 ARG 555 HD2 ARG 555 -17.001 5.789 6.101 423 HD3 ARG 555 HD3 ARG 555 -16.426 7.426 5.788 424 HE ARG 555 HE ARG 555 -19.234 7.157 5.336 425 HH11 ARG 555 HH12 ARG 555 -16.859 7.491 7.887 426 HH12 ARG 555 HH11 ARG 555 -17.946 8.286 8.975 427 HH21 ARG 555 HH22 ARG 555 -20.669 8.214 6.766 428 HH22 ARG 555 HH21 ARG 555 -20.108 8.749 8.317 429 H SER 556 HN SER 556 -18.063 6.081 1.360 430 HA SER 556 HA SER 556 -19.408 3.584 1.742 431 HB2 SER 556 HB2 SER 556 -20.313 6.046 0.222 432 HB3 SER 556 HB3 SER 556 -21.344 4.716 0.750 433 HG SER 556 HG SER 556 -20.342 6.847 2.180 434 H ARG 557 HN ARG 557 -17.905 5.257 -0.924 435 HA ARG 557 HA ARG 557 -18.773 3.555 -3.015 436 HB2 ARG 557 HB2 ARG 557 -16.330 5.308 -2.725 437 HB3 ARG 557 HB3 ARG 557 -16.716 4.427 -4.193 438 HG2 ARG 557 HG2 ARG 557 -18.707 5.701 -4.517 439 HG3 ARG 557 HG3 ARG 557 -18.524 6.476 -2.939 440 HD2 ARG 557 HD2 ARG 557 -17.779 7.835 -4.936 441 HD3 ARG 557 HD3 ARG 557 -16.606 7.662 -3.630 442 HE ARG 557 HE ARG 557 -16.316 5.662 -5.675 443 HH11 ARG 557 HH12 ARG 557 -15.449 8.935 -4.724 444 HH12 ARG 557 HH11 ARG 557 -14.056 8.990 -5.768 445 HH21 ARG 557 HH22 ARG 557 -14.450 5.722 -6.990 446 HH22 ARG 557 HH21 ARG 557 -13.470 7.164 -7.022 447 H LEU 558 HN LEU 558 -15.700 3.728 -1.250 448 HA LEU 558 HA LEU 558 -14.494 1.574 -2.583 449 HB2 LEU 558 HB2 LEU 558 -13.343 3.407 -1.307 450 HB3 LEU 558 HB3 LEU 558 -13.819 2.597 0.173 451 HG LEU 558 HG LEU 558 -12.508 0.616 -0.521 452 HD11 LEU 558 HD11 LEU 558 -12.610 0.962 -2.940 453 HD12 LEU 558 HD12 LEU 558 -11.595 2.394 -2.778 454 HD13 LEU 558 HD13 LEU 558 -10.945 0.804 -2.381 455 HD21 LEU 558 HD21 LEU 558 -11.535 2.311 0.943 456 HD22 LEU 558 HD22 LEU 558 -10.316 1.598 -0.114 457 HD23 LEU 558 HD23 LEU 558 -10.960 3.202 -0.467 458 H LEU 559 HN LEU 559 -16.239 1.728 0.497 459 HA LEU 559 HA LEU 559 -15.783 -1.103 0.954 460 HB2 LEU 559 HB2 LEU 559 -17.364 0.904 2.556 461 HB3 LEU 559 HB3 LEU 559 -16.979 -0.731 3.062 462 HG LEU 559 HG LEU 559 -14.944 1.440 2.540 463 HD11 LEU 559 HD11 LEU 559 -16.266 1.953 4.492 464 HD12 LEU 559 HD12 LEU 559 -16.013 0.325 5.124 465 HD13 LEU 559 HD13 LEU 559 -14.651 1.435 4.972 466 HD21 LEU 559 HD21 LEU 559 -13.373 -0.126 3.595 467 HD22 LEU 559 HD22 LEU 559 -14.653 -1.338 3.682 468 HD23 LEU 559 HD23 LEU 559 -14.065 -0.789 2.114 469 H GLY 560 HN GLY 560 -17.620 0.257 -1.171 470 HA2 GLY 560 HA2 GLY 560 -19.919 -1.525 -0.655 471 HA3 GLY 560 HA3 GLY 560 -20.087 0.037 -1.446 472 H ASP 561 HN ASP 561 -17.828 -0.089 -3.132 473 HA ASP 561 HA ASP 561 -18.825 -2.054 -5.064 474 HB2 ASP 561 HB2 ASP 561 -18.745 0.344 -5.734 475 HB3 ASP 561 HB3 ASP 561 -16.997 0.306 -5.539 476 H ALA 562 HN ALA 562 -17.743 -3.870 -5.305 477 HA ALA 562 HA ALA 562 -15.288 -4.354 -3.973 478 HB1 ALA 562 HB1 ALA 562 -16.704 -6.031 -6.035 479 HB2 ALA 562 HB2 ALA 562 -15.412 -6.580 -4.967 480 HB3 ALA 562 HB3 ALA 562 -16.969 -6.094 -4.292 481 H LYS 563 HN LYS 563 -16.019 -3.176 -7.122 482 HA LYS 563 HA LYS 563 -13.566 -4.089 -8.328 483 HB2 LYS 563 HB2 LYS 563 -15.533 -3.789 -9.736 484 HB3 LYS 563 HB3 LYS 563 -15.615 -2.087 -9.294 485 HG2 LYS 563 HG2 LYS 563 -13.445 -1.709 -10.367 486 HG3 LYS 563 HG3 LYS 563 -13.391 -3.412 -10.833 487 HD2 LYS 563 HD2 LYS 563 -15.365 -3.141 -12.190 488 HD3 LYS 563 HD3 LYS 563 -15.550 -1.474 -11.644 489 HE2 LYS 563 HE2 LYS 563 -13.206 -2.546 -13.202 490 HE3 LYS 563 HE3 LYS 563 -14.551 -1.639 -13.890 491 HZ1 LYS 563 HZ1 LYS 563 -12.716 -0.170 -13.503 492 HZ2 LYS 563 HZ2 LYS 563 -12.601 -0.648 -11.880 493 HZ3 LYS 563 HZ3 LYS 563 -13.953 0.220 -12.410 494 H GLU 564 HN GLU 564 -14.879 -0.952 -7.242 495 HA GLU 564 HA GLU 564 -12.583 0.574 -7.720 496 HB2 GLU 564 HB2 GLU 564 -14.684 0.900 -5.568 497 HB3 GLU 564 HB3 GLU 564 -13.456 2.103 -5.937 498 HG2 GLU 564 HG2 GLU 564 -14.355 2.123 -8.290 499 HG3 GLU 564 HG3 GLU 564 -15.704 1.160 -7.691 500 H LEU 565 HN LEU 565 -13.477 -1.421 -4.953 501 HA LEU 565 HA LEU 565 -11.342 -0.890 -3.258 502 HB2 LEU 565 HB2 LEU 565 -13.269 -3.037 -3.619 503 HB3 LEU 565 HB3 LEU 565 -11.720 -3.639 -3.066 504 HG LEU 565 HG LEU 565 -13.361 -1.514 -1.692 505 HD11 LEU 565 HD11 LEU 565 -14.371 -3.729 -1.518 506 HD12 LEU 565 HD12 LEU 565 -12.838 -4.391 -0.950 507 HD13 LEU 565 HD13 LEU 565 -13.707 -3.210 0.031 508 HD21 LEU 565 HD21 LEU 565 -10.972 -1.184 -1.379 509 HD22 LEU 565 HD22 LEU 565 -11.729 -1.743 0.112 510 HD23 LEU 565 HD23 LEU 565 -10.796 -2.866 -0.876 511 H ALA 566 HN ALA 566 -11.565 -3.380 -5.773 512 HA ALA 566 HA ALA 566 -8.945 -4.343 -5.492 513 HB1 ALA 566 HB1 ALA 566 -9.318 -5.436 -7.639 514 HB2 ALA 566 HB2 ALA 566 -10.729 -5.595 -6.592 515 HB3 ALA 566 HB3 ALA 566 -10.740 -4.429 -7.916 516 H ASN 567 HN ASN 567 -10.302 -1.777 -7.495 517 HA ASN 567 HA ASN 567 -8.001 -1.384 -9.101 518 HB2 ASN 567 HB2 ASN 567 -10.294 0.472 -8.457 519 HB3 ASN 567 HB3 ASN 567 -9.040 0.838 -9.637 520 HD21 ASN 567 HD21 ASN 567 -8.911 -2.042 -10.415 521 HD22 ASN 567 HD22 ASN 567 -10.305 -2.310 -11.409 522 H ILE 568 HN ILE 568 -9.122 0.149 -6.101 523 HA ILE 568 HA ILE 568 -6.977 2.012 -5.965 524 HB ILE 568 HB ILE 568 -8.734 0.931 -3.750 525 HG12 ILE 568 HG12 ILE 568 -10.005 2.066 -5.495 526 HG13 ILE 568 HG13 ILE 568 -9.974 3.043 -4.035 527 HG21 ILE 568 HG21 ILE 568 -6.944 3.363 -3.766 528 HG22 ILE 568 HG22 ILE 568 -8.052 2.904 -2.472 529 HG23 ILE 568 HG23 ILE 568 -6.670 1.877 -2.857 530 HD11 ILE 568 HD11 ILE 568 -8.314 3.468 -6.505 531 HD12 ILE 568 HD12 ILE 568 -9.687 4.440 -5.975 532 HD13 ILE 568 HD13 ILE 568 -8.198 4.424 -5.028 533 H LEU 569 HN LEU 569 -7.403 -1.296 -4.789 534 HA LEU 569 HA LEU 569 -5.063 -1.415 -3.217 535 HB2 LEU 569 HB2 LEU 569 -6.517 -3.592 -4.707 536 HB3 LEU 569 HB3 LEU 569 -5.224 -3.879 -3.559 537 HG LEU 569 HG LEU 569 -7.917 -2.659 -2.950 538 HD11 LEU 569 HD11 LEU 569 -6.686 -5.295 -2.163 539 HD12 LEU 569 HD12 LEU 569 -8.243 -4.680 -1.609 540 HD13 LEU 569 HD13 LEU 569 -8.001 -5.061 -3.314 541 HD21 LEU 569 HD21 LEU 569 -7.200 -2.690 -0.611 542 HD22 LEU 569 HD22 LEU 569 -5.595 -3.225 -1.106 543 HD23 LEU 569 HD23 LEU 569 -6.176 -1.629 -1.581 544 H LYS 570 HN LYS 570 -5.640 -1.940 -6.644 545 HA LYS 570 HA LYS 570 -3.088 -2.913 -7.340 546 HB2 LYS 570 HB2 LYS 570 -5.188 -1.414 -8.899 547 HB3 LYS 570 HB3 LYS 570 -3.693 -1.973 -9.632 548 HG2 LYS 570 HG2 LYS 570 -4.272 -4.236 -9.338 549 HG3 LYS 570 HG3 LYS 570 -5.570 -3.838 -8.210 550 HD2 LYS 570 HD2 LYS 570 -6.476 -4.445 -10.394 551 HD3 LYS 570 HD3 LYS 570 -6.815 -2.756 -10.020 552 HE2 LYS 570 HE2 LYS 570 -6.154 -2.774 -12.276 553 HE3 LYS 570 HE3 LYS 570 -4.748 -2.198 -11.387 554 HZ1 LYS 570 HZ1 LYS 570 -3.828 -4.454 -11.506 555 HZ2 LYS 570 HZ2 LYS 570 -4.090 -3.799 -13.042 556 HZ3 LYS 570 HZ3 LYS 570 -5.166 -4.956 -12.419 557 H TYR 571 HN TYR 571 -4.038 0.124 -6.224 558 HA TYR 571 HA TYR 571 -1.892 1.548 -7.610 559 HB2 TYR 571 HB2 TYR 571 -4.266 2.450 -7.414 560 HB3 TYR 571 HB3 TYR 571 -3.927 2.705 -5.706 561 HD1 TYR 571 HD2 TYR 571 -1.755 3.264 -8.678 562 HD2 TYR 571 HD1 TYR 571 -3.865 4.999 -5.422 563 HE1 TYR 571 HE2 TYR 571 -0.787 5.448 -9.233 564 HE2 TYR 571 HE1 TYR 571 -2.909 7.201 -5.951 565 HH TYR 571 HH TYR 571 -1.040 7.703 -8.900 566 H HIS 572 HN HIS 572 -2.525 -0.001 -4.651 567 HA HIS 572 HA HIS 572 -0.597 1.623 -3.170 568 HB2 HIS 572 HB2 HIS 572 -2.578 -0.490 -2.368 569 HB3 HIS 572 HB3 HIS 572 -1.283 -0.004 -1.280 570 HD1 HIS 572 HD1 HIS 572 -4.386 1.376 -2.952 571 HD2 HIS 572 HD2 HIS 572 -1.616 2.393 -0.024 572 HE1 HIS 572 HE1 HIS 572 -5.306 3.417 -1.782 573 H ILE 573 HN ILE 573 -0.688 -1.171 -5.030 574 HA ILE 573 HA ILE 573 1.731 -2.213 -3.734 575 HB ILE 573 HB ILE 573 0.056 -3.638 -5.800 576 HG12 ILE 573 HG12 ILE 573 -0.091 -4.011 -2.803 577 HG13 ILE 573 HG13 ILE 573 -1.245 -3.045 -3.715 578 HG21 ILE 573 HG21 ILE 573 1.169 -5.632 -4.924 579 HG22 ILE 573 HG22 ILE 573 2.341 -4.456 -5.521 580 HG23 ILE 573 HG23 ILE 573 2.069 -4.633 -3.786 581 HD11 ILE 573 HD11 ILE 573 -0.725 -5.979 -4.113 582 HD12 ILE 573 HD12 ILE 573 -2.089 -5.278 -3.241 583 HD13 ILE 573 HD13 ILE 573 -1.914 -5.002 -4.975 584 H GLY 574 HN GLY 574 3.584 -1.753 -4.689 585 HA2 GLY 574 HA2 GLY 574 3.628 -0.938 -7.497 586 HA3 GLY 574 HA3 GLY 574 4.964 -0.818 -6.362 587 H ASP 575 HN ASP 575 5.059 -1.878 -9.016 588 HA ASP 575 HA ASP 575 4.724 -4.702 -9.047 589 HB2 ASP 575 HB2 ASP 575 4.507 -3.309 -11.043 590 HB3 ASP 575 HB3 ASP 575 6.210 -2.885 -10.948 591 H GLU 576 HN GLU 576 7.336 -2.752 -7.966 592 HA GLU 576 HA GLU 576 8.993 -5.059 -7.618 593 HB2 GLU 576 HB2 GLU 576 10.949 -3.988 -8.693 594 HB3 GLU 576 HB3 GLU 576 9.686 -4.391 -9.842 595 HG2 GLU 576 HG2 GLU 576 8.939 -1.999 -9.701 596 HG3 GLU 576 HG3 GLU 576 10.391 -1.682 -8.748 597 H ILE 577 HN ILE 577 10.768 -4.615 -6.217 598 HA ILE 577 HA ILE 577 9.795 -3.062 -4.035 599 HB ILE 577 HB ILE 577 12.387 -4.604 -4.317 600 HG12 ILE 577 HG12 ILE 577 9.795 -5.382 -2.964 601 HG13 ILE 577 HG13 ILE 577 10.322 -5.969 -4.540 602 HG21 ILE 577 HG21 ILE 577 12.584 -2.947 -2.571 603 HG22 ILE 577 HG22 ILE 577 11.052 -3.461 -1.866 604 HG23 ILE 577 HG23 ILE 577 12.439 -4.550 -1.853 605 HD11 ILE 577 HD11 ILE 577 11.663 -6.454 -1.892 606 HD12 ILE 577 HD12 ILE 577 10.786 -7.626 -2.875 607 HD13 ILE 577 HD13 ILE 577 12.309 -6.955 -3.455 608 H LEU 578 HN LEU 578 10.224 -1.086 -3.533 609 HA LEU 578 HA LEU 578 12.802 0.089 -4.306 610 HB2 LEU 578 HB2 LEU 578 10.925 1.027 -5.640 611 HB3 LEU 578 HB3 LEU 578 10.151 1.534 -4.151 612 HG LEU 578 HG LEU 578 12.046 3.035 -3.678 613 HD11 LEU 578 HD11 LEU 578 13.712 3.450 -5.428 614 HD12 LEU 578 HD12 LEU 578 13.804 1.803 -4.803 615 HD13 LEU 578 HD13 LEU 578 13.048 2.114 -6.367 616 HD21 LEU 578 HD21 LEU 578 10.832 3.410 -6.414 617 HD22 LEU 578 HD22 LEU 578 10.107 3.895 -4.881 618 HD23 LEU 578 HD23 LEU 578 11.589 4.670 -5.439 619 H VAL 579 HN VAL 579 13.909 0.076 -2.442 620 HA VAL 579 HA VAL 579 12.508 0.687 0.033 621 HB VAL 579 HB VAL 579 14.535 -1.132 -0.764 622 HG11 VAL 579 HG11 VAL 579 16.064 -1.028 1.096 623 HG12 VAL 579 HG12 VAL 579 16.195 0.316 -0.039 624 HG13 VAL 579 HG13 VAL 579 15.384 0.546 1.515 625 HG21 VAL 579 HG21 VAL 579 13.066 -0.805 1.816 626 HG22 VAL 579 HG22 VAL 579 12.576 -1.791 0.436 627 HG23 VAL 579 HG23 VAL 579 14.013 -2.224 1.364 628 H SER 580 HN SER 580 13.929 1.831 1.640 629 HA SER 580 HA SER 580 14.219 4.478 0.757 630 HB2 SER 580 HB2 SER 580 15.423 3.239 3.235 631 HB3 SER 580 HB3 SER 580 15.102 4.952 2.969 632 HG SER 580 HG SER 580 13.256 2.827 3.293 633 H GLY 581 HN GLY 581 16.488 1.863 0.776 634 HA2 GLY 581 HA2 GLY 581 18.800 3.624 0.635 635 HA3 GLY 581 HA3 GLY 581 18.829 1.865 0.639 636 H GLY 582 HN GLY 582 16.539 2.626 -1.554 637 HA2 GLY 582 HA2 GLY 582 18.509 2.509 -3.749 638 HA3 GLY 582 HA3 GLY 582 16.900 1.802 -3.815 639 H ILE 583 HN ILE 583 15.998 4.395 -2.382 640 HA ILE 583 HA ILE 583 15.079 5.661 -4.759 641 HB ILE 583 HB ILE 583 14.924 6.735 -1.941 642 HG12 ILE 583 HG12 ILE 583 12.924 5.014 -3.426 643 HG13 ILE 583 HG13 ILE 583 14.006 4.422 -2.171 644 HG21 ILE 583 HG21 ILE 583 13.263 7.283 -4.400 645 HG22 ILE 583 HG22 ILE 583 12.971 7.951 -2.796 646 HG23 ILE 583 HG23 ILE 583 14.438 8.380 -3.675 647 HD11 ILE 583 HD11 ILE 583 11.888 6.525 -1.805 648 HD12 ILE 583 HD12 ILE 583 11.763 4.833 -1.323 649 HD13 ILE 583 HD13 ILE 583 12.948 5.885 -0.550 650 H GLY 584 HN GLY 584 17.014 7.005 -2.071 651 HA2 GLY 584 HA2 GLY 584 18.852 8.425 -2.172 652 HA3 GLY 584 HA3 GLY 584 18.767 8.360 -3.930 653 H ALA 585 HN ALA 585 16.651 9.428 -4.779 654 HA ALA 585 HA ALA 585 16.042 11.858 -3.247 655 HB1 ALA 585 HB1 ALA 585 16.224 13.236 -5.256 656 HB2 ALA 585 HB2 ALA 585 17.763 12.450 -4.900 657 HB3 ALA 585 HB3 ALA 585 16.731 11.828 -6.189 658 H LEU 586 HN LEU 586 15.194 10.565 -6.465 659 HA LEU 586 HA LEU 586 12.451 10.147 -5.590 660 HB2 LEU 586 HB2 LEU 586 12.350 12.432 -6.308 661 HB3 LEU 586 HB3 LEU 586 13.258 12.073 -7.764 662 HG LEU 586 HG LEU 586 11.333 10.667 -8.535 663 HD11 LEU 586 HD11 LEU 586 10.288 10.209 -6.407 664 HD12 LEU 586 HD12 LEU 586 9.948 11.924 -6.178 665 HD13 LEU 586 HD13 LEU 586 9.156 11.034 -7.479 666 HD21 LEU 586 HD21 LEU 586 11.679 12.959 -9.330 667 HD22 LEU 586 HD22 LEU 586 9.966 12.554 -9.220 668 HD23 LEU 586 HD23 LEU 586 10.712 13.566 -7.984 669 H VAL 587 HN VAL 587 11.593 8.404 -6.525 670 HA VAL 587 HA VAL 587 12.595 7.513 -9.139 671 HB VAL 587 HB VAL 587 12.218 5.649 -6.777 672 HG11 VAL 587 HG11 VAL 587 13.076 5.084 -9.614 673 HG12 VAL 587 HG12 VAL 587 13.085 3.914 -8.294 674 HG13 VAL 587 HG13 VAL 587 11.558 4.599 -8.856 675 HG21 VAL 587 HG21 VAL 587 14.625 5.232 -6.937 676 HG22 VAL 587 HG22 VAL 587 14.756 6.452 -8.203 677 HG23 VAL 587 HG23 VAL 587 14.289 6.922 -6.567 678 H ARG 588 HN ARG 588 10.975 6.990 -10.478 679 HA ARG 588 HA ARG 588 8.268 7.145 -9.459 680 HB2 ARG 588 HB2 ARG 588 9.267 6.800 -12.293 681 HB3 ARG 588 HB3 ARG 588 7.605 7.135 -11.820 682 HG2 ARG 588 HG2 ARG 588 8.386 9.267 -10.810 683 HG3 ARG 588 HG3 ARG 588 9.989 8.930 -11.462 684 HD2 ARG 588 HD2 ARG 588 7.466 9.227 -13.081 685 HD3 ARG 588 HD3 ARG 588 8.711 10.459 -12.891 686 HE ARG 588 HE ARG 588 9.664 7.937 -13.925 687 HH11 ARG 588 HH12 ARG 588 8.377 11.101 -14.722 688 HH12 ARG 588 HH11 ARG 588 8.985 11.067 -16.352 689 HH21 ARG 588 HH22 ARG 588 10.447 7.891 -16.041 690 HH22 ARG 588 HH21 ARG 588 10.141 9.227 -17.109 691 H LEU 589 HN LEU 589 7.364 5.386 -8.669 692 HA LEU 589 HA LEU 589 8.325 2.751 -9.513 693 HB2 LEU 589 HB2 LEU 589 7.904 3.776 -7.042 694 HB3 LEU 589 HB3 LEU 589 6.342 3.043 -7.332 695 HG LEU 589 HG LEU 589 9.002 1.621 -7.339 696 HD11 LEU 589 HD11 LEU 589 8.123 0.512 -5.345 697 HD12 LEU 589 HD12 LEU 589 8.251 2.257 -5.121 698 HD13 LEU 589 HD13 LEU 589 6.678 1.521 -5.425 699 HD21 LEU 589 HD21 LEU 589 7.508 0.600 -8.953 700 HD22 LEU 589 HD22 LEU 589 7.676 -0.437 -7.537 701 HD23 LEU 589 HD23 LEU 589 6.220 0.536 -7.751 702 H LYS 590 HN LYS 590 7.138 1.558 -10.879 703 HA LYS 590 HA LYS 590 4.503 2.410 -11.649 704 HB2 LYS 590 HB2 LYS 590 4.548 0.427 -13.144 705 HB3 LYS 590 HB3 LYS 590 5.959 1.461 -13.347 706 HG2 LYS 590 HG2 LYS 590 7.345 -0.047 -12.149 707 HG3 LYS 590 HG3 LYS 590 5.949 -0.979 -11.603 708 HD2 LYS 590 HD2 LYS 590 5.520 -1.749 -13.849 709 HD3 LYS 590 HD3 LYS 590 6.800 -0.717 -14.489 710 HE2 LYS 590 HE2 LYS 590 8.487 -2.007 -13.425 711 HE3 LYS 590 HE3 LYS 590 7.301 -2.867 -12.443 712 HZ1 LYS 590 HZ1 LYS 590 7.963 -4.323 -14.162 713 HZ2 LYS 590 HZ2 LYS 590 7.781 -3.138 -15.357 714 HZ3 LYS 590 HZ3 LYS 590 6.416 -3.777 -14.587 715 H SER 591 HN SER 591 2.580 1.473 -11.157 716 HA SER 591 HA SER 591 2.625 -0.390 -8.885 717 HB2 SER 591 HB2 SER 591 0.343 0.449 -8.430 718 HB3 SER 591 HB3 SER 591 1.517 1.765 -8.480 719 HG SER 591 HG SER 591 0.777 2.362 -10.469 720 H LEU 592 HN LEU 592 0.760 -1.956 -8.810 721 HA LEU 592 HA LEU 592 0.606 -3.468 -11.183 722 HB2 LEU 592 HB2 LEU 592 -0.753 -3.606 -8.521 723 HB3 LEU 592 HB3 LEU 592 -1.226 -4.681 -9.821 724 HG LEU 592 HG LEU 592 1.133 -5.462 -9.945 725 HD11 LEU 592 HD11 LEU 592 1.454 -3.884 -7.411 726 HD12 LEU 592 HD12 LEU 592 2.610 -5.056 -8.046 727 HD13 LEU 592 HD13 LEU 592 2.263 -3.583 -8.950 728 HD21 LEU 592 HD21 LEU 592 0.995 -6.870 -7.952 729 HD22 LEU 592 HD22 LEU 592 -0.254 -5.809 -7.301 730 HD23 LEU 592 HD23 LEU 592 -0.563 -6.737 -8.768 731 H GLN 593 HN GLN 593 -1.130 -0.716 -10.275 732 HA GLN 593 HA GLN 593 -3.513 -1.359 -11.777 733 HB2 GLN 593 HB2 GLN 593 -3.569 0.308 -9.946 734 HB3 GLN 593 HB3 GLN 593 -2.474 1.336 -10.864 735 HG2 GLN 593 HG2 GLN 593 -4.282 1.226 -12.706 736 HG3 GLN 593 HG3 GLN 593 -5.343 0.673 -11.411 737 HE21 GLN 593 HE21 GLN 593 -3.956 2.316 -9.418 738 HE22 GLN 593 HE22 GLN 593 -4.462 3.938 -9.707 739 H GLY 594 HN GLY 594 -0.373 -0.083 -12.387 740 HA2 GLY 594 HA2 GLY 594 0.482 0.120 -14.625 741 HA3 GLY 594 HA3 GLY 594 -1.147 0.525 -15.161 742 H ASP 595 HN ASP 595 -1.195 2.132 -12.496 743 HA ASP 595 HA ASP 595 -0.446 4.637 -13.710 744 HB2 ASP 595 HB2 ASP 595 -2.484 4.109 -12.143 745 HB3 ASP 595 HB3 ASP 595 -1.320 4.350 -10.848 746 H LYS 596 HN LYS 596 0.500 6.140 -11.623 747 HA LYS 596 HA LYS 596 3.159 4.899 -11.321 748 HB2 LYS 596 HB2 LYS 596 4.148 7.093 -11.650 749 HB3 LYS 596 HB3 LYS 596 3.092 6.713 -13.005 750 HG2 LYS 596 HG2 LYS 596 1.339 8.117 -12.025 751 HG3 LYS 596 HG3 LYS 596 2.418 8.513 -10.687 752 HD2 LYS 596 HD2 LYS 596 4.027 9.401 -12.417 753 HD3 LYS 596 HD3 LYS 596 2.721 9.233 -13.591 754 HE2 LYS 596 HE2 LYS 596 1.318 10.710 -12.219 755 HE3 LYS 596 HE3 LYS 596 2.650 10.904 -11.079 756 HZ1 LYS 596 HZ1 LYS 596 2.468 11.851 -13.870 757 HZ2 LYS 596 HZ2 LYS 596 3.956 11.734 -13.063 758 HZ3 LYS 596 HZ3 LYS 596 2.744 12.762 -12.467 759 H LEU 597 HN LEU 597 4.012 4.818 -9.325 760 HA LEU 597 HA LEU 597 2.856 6.573 -7.264 761 HB2 LEU 597 HB2 LEU 597 4.575 4.100 -7.042 762 HB3 LEU 597 HB3 LEU 597 4.097 5.090 -5.675 763 HG LEU 597 HG LEU 597 2.079 3.785 -7.490 764 HD11 LEU 597 HD11 LEU 597 3.210 2.697 -4.917 765 HD12 LEU 597 HD12 LEU 597 1.903 1.992 -5.869 766 HD13 LEU 597 HD13 LEU 597 3.537 2.062 -6.531 767 HD21 LEU 597 HD21 LEU 597 1.870 4.760 -4.637 768 HD22 LEU 597 HD22 LEU 597 1.367 5.685 -6.056 769 HD23 LEU 597 HD23 LEU 597 0.562 4.168 -5.663 770 H GLU 598 HN GLU 598 3.915 8.411 -7.002 771 HA GLU 598 HA GLU 598 6.667 8.688 -7.862 772 HB2 GLU 598 HB2 GLU 598 4.490 10.413 -7.655 773 HB3 GLU 598 HB3 GLU 598 5.550 10.924 -6.350 774 HG2 GLU 598 HG2 GLU 598 6.282 12.243 -8.062 775 HG3 GLU 598 HG3 GLU 598 7.384 10.876 -8.202 776 H VAL 599 HN VAL 599 7.896 7.461 -6.454 777 HA VAL 599 HA VAL 599 7.594 7.973 -3.586 778 HB VAL 599 HB VAL 599 9.255 5.855 -4.945 779 HG11 VAL 599 HG11 VAL 599 10.069 6.410 -2.730 780 HG12 VAL 599 HG12 VAL 599 8.447 6.206 -2.067 781 HG13 VAL 599 HG13 VAL 599 9.314 4.816 -2.722 782 HG21 VAL 599 HG21 VAL 599 6.523 5.645 -3.689 783 HG22 VAL 599 HG22 VAL 599 6.894 5.496 -5.407 784 HG23 VAL 599 HG23 VAL 599 7.486 4.287 -4.266 785 H SER 600 HN SER 600 8.876 9.362 -2.659 786 HA SER 600 HA SER 600 11.565 9.773 -3.751 787 HB2 SER 600 HB2 SER 600 11.176 12.249 -2.990 788 HB3 SER 600 HB3 SER 600 10.554 11.704 -4.543 789 HG SER 600 HG SER 600 9.024 11.732 -2.146 790 H LEU 601 HN LEU 601 13.140 10.478 -2.284 791 HA LEU 601 HA LEU 601 12.468 9.915 0.529 792 HB2 LEU 601 HB2 LEU 601 14.009 8.282 -0.494 793 HB3 LEU 601 HB3 LEU 601 15.110 9.584 -0.897 794 HG LEU 601 HG LEU 601 15.341 10.047 1.559 795 HD11 LEU 601 HD11 LEU 601 13.267 9.000 2.303 796 HD12 LEU 601 HD12 LEU 601 13.879 7.423 1.805 797 HD13 LEU 601 HD13 LEU 601 14.665 8.299 3.118 798 HD21 LEU 601 HD21 LEU 601 16.126 7.291 0.623 799 HD22 LEU 601 HD22 LEU 601 17.009 8.782 0.294 800 HD23 LEU 601 HD23 LEU 601 16.865 8.188 1.949 801 H LYS 602 HN LYS 602 12.268 11.794 1.576 802 HA LYS 602 HA LYS 602 14.305 13.860 1.081 803 HB2 LYS 602 HB2 LYS 602 11.326 14.326 1.359 804 HB3 LYS 602 HB3 LYS 602 12.544 15.595 1.326 805 HG2 LYS 602 HG2 LYS 602 13.191 14.931 -0.934 806 HG3 LYS 602 HG3 LYS 602 11.976 13.653 -0.910 807 HD2 LYS 602 HD2 LYS 602 10.203 15.283 -0.730 808 HD3 LYS 602 HD3 LYS 602 11.376 16.592 -0.595 809 HE2 LYS 602 HE2 LYS 602 10.985 14.802 -2.988 810 HE3 LYS 602 HE3 LYS 602 10.420 16.465 -2.841 811 HZ1 LYS 602 HZ1 LYS 602 13.214 15.499 -3.034 812 HZ2 LYS 602 HZ2 LYS 602 12.848 17.049 -2.471 813 HZ3 LYS 602 HZ3 LYS 602 12.405 16.594 -4.043 814 H ASN 603 HN ASN 603 15.254 14.570 2.866 815 HA ASN 603 HA ASN 603 15.794 14.864 5.050 816 HB2 ASN 603 HB2 ASN 603 13.615 16.168 4.967 817 HB3 ASN 603 HB3 ASN 603 12.826 14.743 5.633 818 HD21 ASN 603 HD21 ASN 603 12.210 15.824 7.495 819 HD22 ASN 603 HD22 ASN 603 13.340 16.256 8.728 820 H ASN 604 HN ASN 604 15.493 12.223 3.871 821 HA ASN 604 HA ASN 604 15.729 10.048 4.413 822 HB2 ASN 604 HB2 ASN 604 15.862 11.142 7.224 823 HB3 ASN 604 HB3 ASN 604 16.021 9.426 6.859 824 HD21 ASN 604 HD21 ASN 604 17.970 11.212 8.050 825 HD22 ASN 604 HD22 ASN 604 19.348 11.170 7.013 826 H VAL 605 HN VAL 605 13.053 11.641 4.593 827 HA VAL 605 HA VAL 605 11.485 9.419 5.720 828 HB VAL 605 HB VAL 605 10.556 12.247 5.168 829 HG11 VAL 605 HG11 VAL 605 9.179 9.947 6.558 830 HG12 VAL 605 HG12 VAL 605 8.555 11.592 6.435 831 HG13 VAL 605 HG13 VAL 605 8.757 10.615 4.981 832 HG21 VAL 605 HG21 VAL 605 11.215 10.914 7.790 833 HG22 VAL 605 HG22 VAL 605 12.146 12.193 7.012 834 HG23 VAL 605 HG23 VAL 605 10.516 12.521 7.599 835 H VAL 606 HN VAL 606 10.505 8.139 4.311 836 HA VAL 606 HA VAL 606 10.631 8.638 1.506 837 HB VAL 606 HB VAL 606 9.081 6.476 2.948 838 HG11 VAL 606 HG11 VAL 606 9.276 5.245 0.834 839 HG12 VAL 606 HG12 VAL 606 8.392 6.758 0.627 840 HG13 VAL 606 HG13 VAL 606 10.071 6.639 0.101 841 HG21 VAL 606 HG21 VAL 606 11.459 6.463 3.556 842 HG22 VAL 606 HG22 VAL 606 11.014 5.051 2.598 843 HG23 VAL 606 HG23 VAL 606 11.885 6.388 1.847 844 H SER 607 HN SER 607 8.923 8.975 0.069 845 HA SER 607 HA SER 607 6.313 9.635 1.195 846 HB2 SER 607 HB2 SER 607 6.386 11.724 -0.352 847 HB3 SER 607 HB3 SER 607 7.243 11.798 1.190 848 HG SER 607 HG SER 607 9.108 10.989 -0.161 849 H VAL 608 HN VAL 608 4.627 9.214 -0.177 850 HA VAL 608 HA VAL 608 5.320 8.309 -2.891 851 HB VAL 608 HB VAL 608 4.897 6.310 -1.636 852 HG11 VAL 608 HG11 VAL 608 2.749 5.917 -0.461 853 HG12 VAL 608 HG12 VAL 608 3.718 7.197 0.272 854 HG13 VAL 608 HG13 VAL 608 2.327 7.610 -0.732 855 HG21 VAL 608 HG21 VAL 608 4.014 6.298 -3.873 856 HG22 VAL 608 HG22 VAL 608 2.915 5.413 -2.817 857 HG23 VAL 608 HG23 VAL 608 2.516 7.053 -3.329 858 H ASN 609 HN ASN 609 4.495 9.747 -4.235 859 HA ASN 609 HA ASN 609 3.090 11.242 -5.227 860 HB2 ASN 609 HB2 ASN 609 1.064 9.387 -3.973 861 HB3 ASN 609 HB3 ASN 609 0.616 10.705 -5.049 862 HD21 ASN 609 HD21 ASN 609 0.332 7.794 -5.312 863 HD22 ASN 609 HD22 ASN 609 1.088 7.396 -6.814 864 H LYS 610 HN LYS 610 4.178 12.365 -3.151 865 HA LYS 610 HA LYS 610 4.007 14.272 -1.930 866 HB2 LYS 610 HB2 LYS 610 2.222 15.028 -3.412 867 HB3 LYS 610 HB3 LYS 610 1.044 14.092 -2.509 868 HG2 LYS 610 HG2 LYS 610 1.550 15.493 -0.520 869 HG3 LYS 610 HG3 LYS 610 2.576 16.491 -1.551 870 HD2 LYS 610 HD2 LYS 610 0.699 17.076 -2.942 871 HD3 LYS 610 HD3 LYS 610 -0.353 15.974 -2.053 872 HE2 LYS 610 HE2 LYS 610 -0.768 18.210 -1.289 873 HE3 LYS 610 HE3 LYS 610 0.061 17.319 -0.010 874 HZ1 LYS 610 HZ1 LYS 610 1.123 19.379 -0.117 875 HZ2 LYS 610 HZ2 LYS 610 1.148 19.394 -1.813 876 HZ3 LYS 610 HZ3 LYS 610 2.166 18.343 -0.963 877 H GLU 611 HN GLU 611 2.026 11.515 -1.209 878 HA GLU 611 HA GLU 611 1.501 12.267 1.521 879 HB2 GLU 611 HB2 GLU 611 1.120 9.661 0.035 880 HB3 GLU 611 HB3 GLU 611 0.580 9.955 1.683 881 HG2 GLU 611 HG2 GLU 611 -0.353 11.456 -0.753 882 HG3 GLU 611 HG3 GLU 611 -1.230 10.162 0.059 883 HA PRO 612 HA PRO 612 5.480 10.816 2.918 884 HB2 PRO 612 HB2 PRO 612 4.490 11.299 5.618 885 HB3 PRO 612 HB3 PRO 612 5.759 12.144 4.731 886 HG2 PRO 612 HG2 PRO 612 3.370 13.282 5.319 887 HG3 PRO 612 HG3 PRO 612 4.303 13.693 3.869 888 HD2 PRO 612 HD2 PRO 612 1.931 11.885 4.150 889 HD3 PRO 612 HD3 PRO 612 2.302 13.068 2.875 890 H VAL 613 HN VAL 613 6.322 8.970 3.721 891 HA VAL 613 HA VAL 613 4.480 6.869 4.549 892 HB VAL 613 HB VAL 613 7.417 6.821 3.820 893 HG11 VAL 613 HG11 VAL 613 7.317 4.389 3.998 894 HG12 VAL 613 HG12 VAL 613 6.974 5.143 5.555 895 HG13 VAL 613 HG13 VAL 613 5.657 4.488 4.581 896 HG21 VAL 613 HG21 VAL 613 6.632 5.500 1.910 897 HG22 VAL 613 HG22 VAL 613 4.969 5.704 2.464 898 HG23 VAL 613 HG23 VAL 613 5.905 7.106 1.944 899 H ALA 614 HN ALA 614 4.527 5.894 6.530 900 HA ALA 614 HA ALA 614 5.623 7.526 8.658 901 HB1 ALA 614 HB1 ALA 614 3.311 6.800 8.798 902 HB2 ALA 614 HB2 ALA 614 3.823 5.112 8.752 903 HB3 ALA 614 HB3 ALA 614 4.252 6.128 10.130 904 H GLU 615 HN GLU 615 6.087 4.304 7.320 905 HA GLU 615 HA GLU 615 8.574 4.008 8.750 906 HB2 GLU 615 HB2 GLU 615 6.884 3.296 10.439 907 HB3 GLU 615 HB3 GLU 615 6.341 2.047 9.328 908 HG2 GLU 615 HG2 GLU 615 7.791 1.108 11.009 909 HG3 GLU 615 HG3 GLU 615 8.552 1.010 9.424 910 HA PRO 616 HA PRO 616 8.706 1.827 4.800 911 HB2 PRO 616 HB2 PRO 616 11.064 2.759 4.004 912 HB3 PRO 616 HB3 PRO 616 9.639 3.803 4.024 913 HG2 PRO 616 HG2 PRO 616 11.931 3.697 5.926 914 HG3 PRO 616 HG3 PRO 616 11.007 5.099 5.362 915 HD2 PRO 616 HD2 PRO 616 10.641 3.721 7.789 916 HD3 PRO 616 HD3 PRO 616 9.528 4.900 7.070 917 H ASP 617 HN ASP 617 10.041 0.134 3.930 918 HA ASP 617 HA ASP 617 11.897 -1.162 3.636 919 HB2 ASP 617 HB2 ASP 617 12.913 0.520 5.892 920 HB3 ASP 617 HB3 ASP 617 13.766 -0.963 5.474 921 H ILE 618 HN ILE 618 9.547 -1.751 5.062 922 HA ILE 618 HA ILE 618 10.265 -3.694 7.061 923 HB ILE 618 HB ILE 618 7.732 -2.774 5.744 924 HG12 ILE 618 HG12 ILE 618 8.720 -2.847 8.603 925 HG13 ILE 618 HG13 ILE 618 8.570 -1.430 7.569 926 HG21 ILE 618 HG21 ILE 618 7.532 -5.232 5.940 927 HG22 ILE 618 HG22 ILE 618 7.959 -5.134 7.648 928 HG23 ILE 618 HG23 ILE 618 6.453 -4.418 7.075 929 HD11 ILE 618 HD11 ILE 618 6.314 -3.115 8.634 930 HD12 ILE 618 HD12 ILE 618 6.778 -1.505 9.184 931 HD13 ILE 618 HD13 ILE 618 6.131 -1.730 7.557 932 H MET 619 HN MET 619 11.461 -5.299 6.209 933 HA MET 619 HA MET 619 11.064 -6.279 3.552 934 HB2 MET 619 HB2 MET 619 13.291 -6.094 4.782 935 HB3 MET 619 HB3 MET 619 12.802 -7.517 5.688 936 HG2 MET 619 HG2 MET 619 13.950 -8.574 4.077 937 HG3 MET 619 HG3 MET 619 12.420 -8.445 3.213 938 HE1 MET 619 HE1 MET 619 12.564 -5.191 2.829 939 HE2 MET 619 HE2 MET 619 13.238 -5.040 1.203 940 HE3 MET 619 HE3 MET 619 11.959 -6.213 1.521 941 H ALA 620 HN ALA 620 9.871 -7.898 2.895 942 HA ALA 620 HA ALA 620 9.188 -10.057 4.774 943 HB1 ALA 620 HB1 ALA 620 7.219 -8.618 4.453 944 HB2 ALA 620 HB2 ALA 620 7.327 -8.868 2.710 945 HB3 ALA 620 HB3 ALA 620 6.970 -10.229 3.776 946 H THR 621 HN THR 621 8.253 -12.001 3.289 947 HA THR 621 HA THR 621 10.469 -12.588 1.543 948 HB THR 621 HB THR 621 9.488 -14.292 3.100 949 HG1 THR 621 HG1 THR 621 9.630 -14.874 0.306 950 HG21 THR 621 HG21 THR 621 7.488 -15.496 2.422 951 HG22 THR 621 HG22 THR 621 7.287 -14.426 1.034 952 HG23 THR 621 HG23 THR 621 7.109 -13.791 2.671 953 H ASN 622 HN ASN 622 7.367 -11.259 1.096 954 HA ASN 622 HA ASN 622 7.334 -12.048 -1.738 955 HB2 ASN 622 HB2 ASN 622 5.179 -10.565 -0.237 956 HB3 ASN 622 HB3 ASN 622 5.047 -11.310 -1.810 957 HD21 ASN 622 HD21 ASN 622 4.508 -13.364 -1.945 958 HD22 ASN 622 HD22 ASN 622 4.232 -14.421 -0.605 959 H GLY 623 HN GLY 623 8.613 -9.671 0.101 960 HA2 GLY 623 HA2 GLY 623 9.630 -8.017 -1.653 961 HA3 GLY 623 HA3 GLY 623 7.956 -7.492 -1.736 962 H VAL 624 HN VAL 624 8.112 -5.495 -0.872 963 HA VAL 624 HA VAL 624 9.029 -5.368 1.922 964 HB VAL 624 HB VAL 624 10.583 -4.242 0.213 965 HG11 VAL 624 HG11 VAL 624 8.857 -3.229 -1.172 966 HG12 VAL 624 HG12 VAL 624 8.337 -2.239 0.194 967 HG13 VAL 624 HG13 VAL 624 9.936 -2.000 -0.510 968 HG21 VAL 624 HG21 VAL 624 11.046 -2.371 1.693 969 HG22 VAL 624 HG22 VAL 624 9.458 -2.552 2.443 970 HG23 VAL 624 HG23 VAL 624 10.670 -3.820 2.626 971 H VAL 625 HN VAL 625 7.979 -3.748 3.199 972 HA VAL 625 HA VAL 625 5.350 -2.913 2.174 973 HB VAL 625 HB VAL 625 5.937 -3.886 4.985 974 HG11 VAL 625 HG11 VAL 625 3.327 -3.062 3.713 975 HG12 VAL 625 HG12 VAL 625 3.522 -3.712 5.340 976 HG13 VAL 625 HG13 VAL 625 4.225 -2.146 4.922 977 HG21 VAL 625 HG21 VAL 625 4.488 -5.785 4.441 978 HG22 VAL 625 HG22 VAL 625 4.362 -5.213 2.778 979 HG23 VAL 625 HG23 VAL 625 5.920 -5.745 3.414 980 H HIS 626 HN HIS 626 4.808 -0.828 2.581 981 HA HIS 626 HA HIS 626 6.582 0.706 4.351 982 HB2 HIS 626 HB2 HIS 626 5.224 1.526 1.779 983 HB3 HIS 626 HB3 HIS 626 5.950 2.674 2.888 984 HD2 HIS 626 HD2 HIS 626 6.917 0.300 0.050 985 HE1 HIS 626 HE1 HIS 626 10.490 1.889 1.673 986 HE2 HIS 626 HE2 HIS 626 9.439 0.779 -0.347 987 H VAL 627 HN VAL 627 5.579 1.255 6.144 988 HA VAL 627 HA VAL 627 2.742 1.234 6.465 989 HB VAL 627 HB VAL 627 4.785 2.544 8.272 990 HG11 VAL 627 HG11 VAL 627 3.118 2.135 10.028 991 HG12 VAL 627 HG12 VAL 627 2.502 3.199 8.762 992 HG13 VAL 627 HG13 VAL 627 2.007 1.506 8.812 993 HG21 VAL 627 HG21 VAL 627 3.777 -0.297 8.292 994 HG22 VAL 627 HG22 VAL 627 5.410 0.233 7.886 995 HG23 VAL 627 HG23 VAL 627 4.798 0.438 9.528 996 H ILE 628 HN ILE 628 1.328 2.793 5.961 997 HA ILE 628 HA ILE 628 2.332 5.556 5.806 998 HB ILE 628 HB ILE 628 0.404 5.870 4.092 999 HG12 ILE 628 HG12 ILE 628 0.978 2.919 3.775 1000 HG13 ILE 628 HG13 ILE 628 -0.532 3.608 4.356 1001 HG21 ILE 628 HG21 ILE 628 2.969 4.470 3.362 1002 HG22 ILE 628 HG22 ILE 628 1.945 5.385 2.251 1003 HG23 ILE 628 HG23 ILE 628 2.746 6.205 3.595 1004 HD11 ILE 628 HD11 ILE 628 0.636 3.996 1.610 1005 HD12 ILE 628 HD12 ILE 628 -0.696 2.916 2.032 1006 HD13 ILE 628 HD13 ILE 628 -0.890 4.664 2.192 1007 H THR 629 HN THR 629 1.029 7.184 6.519 1008 HA THR 629 HA THR 629 -1.076 6.344 8.368 1009 HB THR 629 HB THR 629 -0.912 8.764 9.128 1010 HG1 THR 629 HG1 THR 629 1.067 9.810 8.411 1011 HG21 THR 629 HG21 THR 629 0.214 6.962 10.327 1012 HG22 THR 629 HG22 THR 629 1.224 8.410 10.310 1013 HG23 THR 629 HG23 THR 629 1.585 7.067 9.222 1014 H ASN 630 HN ASN 630 -0.973 6.882 5.299 1015 HA ASN 630 HA ASN 630 -3.583 8.165 5.123 1016 HB2 ASN 630 HB2 ASN 630 -2.620 9.378 3.039 1017 HB3 ASN 630 HB3 ASN 630 -2.259 10.035 4.632 1018 HD21 ASN 630 HD21 ASN 630 -0.401 11.033 4.052 1019 HD22 ASN 630 HD22 ASN 630 1.040 10.188 3.609 1020 H VAL 631 HN VAL 631 -4.511 7.803 2.875 1021 HA VAL 631 HA VAL 631 -3.487 5.316 1.731 1022 HB VAL 631 HB VAL 631 -5.398 4.769 3.023 1023 HG11 VAL 631 HG11 VAL 631 -6.325 6.980 3.329 1024 HG12 VAL 631 HG12 VAL 631 -6.886 6.996 1.657 1025 HG13 VAL 631 HG13 VAL 631 -7.572 5.847 2.809 1026 HG21 VAL 631 HG21 VAL 631 -7.004 3.979 1.357 1027 HG22 VAL 631 HG22 VAL 631 -6.232 5.008 0.150 1028 HG23 VAL 631 HG23 VAL 631 -5.334 3.678 0.877 1029 H LEU 632 HN LEU 632 -3.027 5.463 -0.409 1030 HA LEU 632 HA LEU 632 -3.268 7.894 -1.781 1031 HB2 LEU 632 HB2 LEU 632 -2.639 5.117 -2.754 1032 HB3 LEU 632 HB3 LEU 632 -2.584 6.530 -3.780 1033 HG LEU 632 HG LEU 632 -0.376 6.222 -3.224 1034 HD11 LEU 632 HD11 LEU 632 -1.374 8.094 -1.100 1035 HD12 LEU 632 HD12 LEU 632 0.281 7.999 -1.697 1036 HD13 LEU 632 HD13 LEU 632 -1.018 8.515 -2.775 1037 HD21 LEU 632 HD21 LEU 632 -1.047 5.713 -0.340 1038 HD22 LEU 632 HD22 LEU 632 -0.790 4.447 -1.547 1039 HD23 LEU 632 HD23 LEU 632 0.521 5.546 -1.129 1040 H GLN 633 HN GLN 633 -4.961 8.741 -2.716 1041 HA GLN 633 HA GLN 633 -6.954 6.971 -3.933 1042 HB2 GLN 633 HB2 GLN 633 -7.764 8.014 -1.794 1043 HB3 GLN 633 HB3 GLN 633 -7.546 9.591 -2.538 1044 HG2 GLN 633 HG2 GLN 633 -9.857 8.943 -2.647 1045 HG3 GLN 633 HG3 GLN 633 -9.168 8.981 -4.268 1046 HE21 GLN 633 HE21 GLN 633 -8.541 6.400 -2.002 1047 HE22 GLN 633 HE22 GLN 633 -9.422 5.184 -2.851 1048 HA PRO 634 HA PRO 634 -5.408 9.329 -7.431 1049 HB2 PRO 634 HB2 PRO 634 -7.544 7.813 -8.813 1050 HB3 PRO 634 HB3 PRO 634 -5.819 7.905 -9.177 1051 HG2 PRO 634 HG2 PRO 634 -6.889 5.706 -8.098 1052 HG3 PRO 634 HG3 PRO 634 -5.271 6.266 -7.634 1053 HD2 PRO 634 HD2 PRO 634 -7.865 6.541 -6.169 1054 HD3 PRO 634 HD3 PRO 634 -6.246 6.181 -5.536 Start of MODEL 9 1 H1 ALA 500 H1 ALA 500 4.070 -13.066 10.487 2 H2 ALA 500 H2 ALA 500 2.880 -12.644 11.617 3 H3 ALA 500 H3 ALA 500 4.489 -12.866 12.116 4 HA ALA 500 HA ALA 500 3.586 -10.763 10.246 5 HB1 ALA 500 HB1 ALA 500 2.687 -10.421 12.506 6 HB2 ALA 500 HB2 ALA 500 4.324 -10.511 13.157 7 HB3 ALA 500 HB3 ALA 500 3.876 -9.194 12.073 8 H GLY 501 HN GLY 501 5.333 -11.277 8.876 9 HA2 GLY 501 HA2 GLY 501 7.446 -10.405 8.210 10 HA3 GLY 501 HA3 GLY 501 7.911 -10.319 9.905 11 H MET 502 HN MET 502 6.286 -13.169 9.114 12 HA MET 502 HA MET 502 8.835 -14.641 9.062 13 HB2 MET 502 HB2 MET 502 6.066 -15.568 9.867 14 HB3 MET 502 HB3 MET 502 7.476 -16.610 9.785 15 HG2 MET 502 HG2 MET 502 7.316 -16.119 12.033 16 HG3 MET 502 HG3 MET 502 8.521 -14.967 11.465 17 HE1 MET 502 HE1 MET 502 6.653 -12.937 14.251 18 HE2 MET 502 HE2 MET 502 7.073 -14.651 14.248 19 HE3 MET 502 HE3 MET 502 8.224 -13.459 13.643 20 H GLY 503 HN GLY 503 5.960 -13.919 7.298 21 HA2 GLY 503 HA2 GLY 503 6.819 -15.836 5.222 22 HA3 GLY 503 HA3 GLY 503 5.123 -15.648 5.643 23 H THR 504 HN THR 504 4.085 -14.592 4.121 24 HA THR 504 HA THR 504 5.511 -12.816 2.323 25 HB THR 504 HB THR 504 3.374 -12.801 1.052 26 HG1 THR 504 HG1 THR 504 1.722 -14.252 1.790 27 HG21 THR 504 HG21 THR 504 5.013 -14.503 0.521 28 HG22 THR 504 HG22 THR 504 3.396 -15.204 0.432 29 HG23 THR 504 HG23 THR 504 4.421 -15.526 1.830 30 H VAL 505 HN VAL 505 3.905 -10.926 1.535 31 HA VAL 505 HA VAL 505 3.824 -8.930 3.447 32 HB VAL 505 HB VAL 505 1.887 -9.138 1.140 33 HG11 VAL 505 HG11 VAL 505 3.102 -6.733 2.494 34 HG12 VAL 505 HG12 VAL 505 1.960 -6.707 1.150 35 HG13 VAL 505 HG13 VAL 505 1.455 -7.318 2.725 36 HG21 VAL 505 HG21 VAL 505 3.591 -7.991 -0.206 37 HG22 VAL 505 HG22 VAL 505 4.737 -8.172 1.123 38 HG23 VAL 505 HG23 VAL 505 4.100 -9.601 0.307 39 H MET 506 HN MET 506 1.311 -11.209 2.479 40 HA MET 506 HA MET 506 -0.834 -10.222 3.941 41 HB2 MET 506 HB2 MET 506 -0.102 -12.850 2.813 42 HB3 MET 506 HB3 MET 506 -1.287 -12.884 4.114 43 HG2 MET 506 HG2 MET 506 -1.488 -11.269 1.583 44 HG3 MET 506 HG3 MET 506 -2.364 -12.758 1.942 45 HE1 MET 506 HE1 MET 506 -3.435 -9.694 1.147 46 HE2 MET 506 HE2 MET 506 -4.483 -11.113 1.162 47 HE3 MET 506 HE3 MET 506 -4.935 -9.673 2.076 48 H ASP 507 HN ASP 507 1.737 -12.430 4.975 49 HA ASP 507 HA ASP 507 0.721 -12.977 7.531 50 HB2 ASP 507 HB2 ASP 507 2.461 -14.373 6.725 51 HB3 ASP 507 HB3 ASP 507 3.526 -13.005 6.422 52 H VAL 508 HN VAL 508 2.794 -10.396 6.339 53 HA VAL 508 HA VAL 508 3.399 -9.239 8.847 54 HB VAL 508 HB VAL 508 3.232 -7.825 6.175 55 HG11 VAL 508 HG11 VAL 508 4.754 -7.157 8.687 56 HG12 VAL 508 HG12 VAL 508 4.849 -6.282 7.160 57 HG13 VAL 508 HG13 VAL 508 3.337 -6.310 8.067 58 HG21 VAL 508 HG21 VAL 508 5.627 -8.288 5.951 59 HG22 VAL 508 HG22 VAL 508 5.585 -9.232 7.441 60 HG23 VAL 508 HG23 VAL 508 4.691 -9.781 6.023 61 H LEU 509 HN LEU 509 0.862 -8.605 6.454 62 HA LEU 509 HA LEU 509 -0.216 -6.335 7.779 63 HB2 LEU 509 HB2 LEU 509 -1.658 -8.148 5.850 64 HB3 LEU 509 HB3 LEU 509 -2.010 -6.469 6.192 65 HG LEU 509 HG LEU 509 0.471 -7.477 4.812 66 HD11 LEU 509 HD11 LEU 509 -1.534 -7.748 3.450 67 HD12 LEU 509 HD12 LEU 509 -1.944 -6.052 3.709 68 HD13 LEU 509 HD13 LEU 509 -0.488 -6.481 2.808 69 HD21 LEU 509 HD21 LEU 509 0.877 -5.428 6.065 70 HD22 LEU 509 HD22 LEU 509 0.891 -5.118 4.328 71 HD23 LEU 509 HD23 LEU 509 -0.515 -4.670 5.292 72 H LYS 510 HN LYS 510 -0.565 -9.689 8.297 73 HA LYS 510 HA LYS 510 -3.150 -9.464 9.607 74 HB2 LYS 510 HB2 LYS 510 -1.336 -11.816 9.093 75 HB3 LYS 510 HB3 LYS 510 -2.805 -11.936 10.048 76 HG2 LYS 510 HG2 LYS 510 -4.125 -11.251 8.120 77 HG3 LYS 510 HG3 LYS 510 -2.651 -11.098 7.159 78 HD2 LYS 510 HD2 LYS 510 -2.189 -13.475 7.491 79 HD3 LYS 510 HD3 LYS 510 -3.657 -13.629 8.457 80 HE2 LYS 510 HE2 LYS 510 -4.999 -12.999 6.516 81 HE3 LYS 510 HE3 LYS 510 -3.531 -12.826 5.551 82 HZ1 LYS 510 HZ1 LYS 510 -4.490 -15.337 6.823 83 HZ2 LYS 510 HZ2 LYS 510 -3.070 -15.172 5.912 84 HZ3 LYS 510 HZ3 LYS 510 -4.580 -14.965 5.168 85 H GLY 511 HN GLY 511 0.153 -9.298 10.353 86 HA2 GLY 511 HA2 GLY 511 -0.114 -10.081 13.127 87 HA3 GLY 511 HA3 GLY 511 1.315 -9.388 12.368 88 H ASP 512 HN ASP 512 -0.877 -7.383 11.314 89 HA ASP 512 HA ASP 512 -0.826 -5.676 13.725 90 HB2 ASP 512 HB2 ASP 512 0.715 -4.788 12.091 91 HB3 ASP 512 HB3 ASP 512 -0.509 -4.871 10.828 92 H ASN 513 HN ASN 513 -2.633 -4.358 14.119 93 HA ASN 513 HA ASN 513 -5.108 -5.510 13.236 94 HB2 ASN 513 HB2 ASN 513 -4.483 -3.190 15.055 95 HB3 ASN 513 HB3 ASN 513 -6.127 -3.672 14.662 96 HD21 ASN 513 HD21 ASN 513 -5.420 -6.532 14.590 97 HD22 ASN 513 HD22 ASN 513 -5.239 -7.002 16.242 98 H ARG 514 HN ARG 514 -3.260 -2.659 12.453 99 HA ARG 514 HA ARG 514 -5.428 -1.263 11.187 100 HB2 ARG 514 HB2 ARG 514 -2.464 -0.787 10.836 101 HB3 ARG 514 HB3 ARG 514 -3.765 0.359 10.543 102 HG2 ARG 514 HG2 ARG 514 -4.238 0.513 12.890 103 HG3 ARG 514 HG3 ARG 514 -3.093 -0.783 13.245 104 HD2 ARG 514 HD2 ARG 514 -1.271 0.626 12.372 105 HD3 ARG 514 HD3 ARG 514 -2.428 1.931 12.105 106 HE ARG 514 HE ARG 514 -2.388 0.953 14.814 107 HH11 ARG 514 HH12 ARG 514 -0.950 3.202 12.551 108 HH12 ARG 514 HH11 ARG 514 -0.334 4.259 13.778 109 HH21 ARG 514 HH22 ARG 514 -1.594 2.336 16.445 110 HH22 ARG 514 HH21 ARG 514 -0.692 3.755 16.001 111 H PHE 515 HN PHE 515 -2.534 -2.984 10.075 112 HA PHE 515 HA PHE 515 -3.093 -2.836 7.316 113 HB2 PHE 515 HB2 PHE 515 -1.500 -4.908 8.835 114 HB3 PHE 515 HB3 PHE 515 -1.418 -4.595 7.114 115 HD1 PHE 515 HD1 PHE 515 -1.713 -1.449 7.807 116 HD2 PHE 515 HD2 PHE 515 0.948 -4.594 8.867 117 HE1 PHE 515 HE1 PHE 515 0.072 0.197 8.194 118 HE2 PHE 515 HE2 PHE 515 2.737 -2.954 9.261 119 HZ PHE 515 HZ PHE 515 2.300 -0.554 8.924 120 H SER 516 HN SER 516 -4.251 -4.920 9.850 121 HA SER 516 HA SER 516 -5.081 -7.113 8.290 122 HB2 SER 516 HB2 SER 516 -4.846 -7.102 10.789 123 HB3 SER 516 HB3 SER 516 -6.331 -6.154 10.874 124 HG SER 516 HG SER 516 -6.204 -8.637 9.527 125 H MET 517 HN MET 517 -6.514 -3.990 8.880 126 HA MET 517 HA MET 517 -9.120 -4.654 7.898 127 HB2 MET 517 HB2 MET 517 -7.763 -1.948 7.931 128 HB3 MET 517 HB3 MET 517 -9.487 -2.253 7.791 129 HG2 MET 517 HG2 MET 517 -9.526 -3.158 10.048 130 HG3 MET 517 HG3 MET 517 -7.787 -2.893 10.187 131 HE1 MET 517 HE1 MET 517 -7.717 -0.169 8.433 132 HE2 MET 517 HE2 MET 517 -7.768 1.078 9.678 133 HE3 MET 517 HE3 MET 517 -6.723 -0.330 9.882 134 H LEU 518 HN LEU 518 -6.125 -3.454 6.496 135 HA LEU 518 HA LEU 518 -7.071 -3.113 3.867 136 HB2 LEU 518 HB2 LEU 518 -4.905 -2.228 4.624 137 HB3 LEU 518 HB3 LEU 518 -4.302 -3.863 4.813 138 HG LEU 518 HG LEU 518 -4.563 -4.213 2.377 139 HD11 LEU 518 HD11 LEU 518 -5.287 -1.290 2.380 140 HD12 LEU 518 HD12 LEU 518 -4.923 -2.247 0.943 141 HD13 LEU 518 HD13 LEU 518 -6.334 -2.638 1.929 142 HD21 LEU 518 HD21 LEU 518 -2.399 -3.571 3.233 143 HD22 LEU 518 HD22 LEU 518 -2.689 -2.759 1.694 144 HD23 LEU 518 HD23 LEU 518 -2.858 -1.868 3.208 145 H VAL 519 HN VAL 519 -5.747 -5.898 5.598 146 HA VAL 519 HA VAL 519 -5.730 -7.779 3.551 147 HB VAL 519 HB VAL 519 -6.526 -8.219 6.444 148 HG11 VAL 519 HG11 VAL 519 -5.818 -10.555 6.046 149 HG12 VAL 519 HG12 VAL 519 -7.242 -10.091 5.114 150 HG13 VAL 519 HG13 VAL 519 -5.667 -10.183 4.328 151 HG21 VAL 519 HG21 VAL 519 -4.216 -8.880 6.794 152 HG22 VAL 519 HG22 VAL 519 -3.849 -8.548 5.099 153 HG23 VAL 519 HG23 VAL 519 -4.299 -7.228 6.178 154 H ALA 520 HN ALA 520 -8.398 -6.508 5.449 155 HA ALA 520 HA ALA 520 -10.348 -8.379 4.532 156 HB1 ALA 520 HB1 ALA 520 -10.681 -7.223 6.617 157 HB2 ALA 520 HB2 ALA 520 -10.635 -5.657 5.808 158 HB3 ALA 520 HB3 ALA 520 -11.972 -6.768 5.505 159 H ALA 521 HN ALA 521 -9.448 -5.086 3.587 160 HA ALA 521 HA ALA 521 -11.386 -4.762 1.561 161 HB1 ALA 521 HB1 ALA 521 -8.652 -3.496 1.783 162 HB2 ALA 521 HB2 ALA 521 -9.976 -2.936 0.761 163 HB3 ALA 521 HB3 ALA 521 -10.136 -2.884 2.516 164 H ILE 522 HN ILE 522 -7.983 -5.804 1.421 165 HA ILE 522 HA ILE 522 -7.838 -6.281 -1.332 166 HB ILE 522 HB ILE 522 -6.371 -7.643 0.935 167 HG12 ILE 522 HG12 ILE 522 -5.528 -5.402 -0.918 168 HG13 ILE 522 HG13 ILE 522 -6.071 -5.183 0.744 169 HG21 ILE 522 HG21 ILE 522 -5.727 -7.641 -2.014 170 HG22 ILE 522 HG22 ILE 522 -4.728 -8.331 -0.736 171 HG23 ILE 522 HG23 ILE 522 -6.313 -9.021 -1.083 172 HD11 ILE 522 HD11 ILE 522 -3.636 -5.102 0.551 173 HD12 ILE 522 HD12 ILE 522 -4.171 -6.451 1.554 174 HD13 ILE 522 HD13 ILE 522 -3.636 -6.742 -0.100 175 H GLN 523 HN GLN 523 -8.902 -8.370 1.317 176 HA GLN 523 HA GLN 523 -9.278 -10.711 -0.214 177 HB2 GLN 523 HB2 GLN 523 -9.184 -10.734 2.236 178 HB3 GLN 523 HB3 GLN 523 -10.681 -9.822 2.320 179 HG2 GLN 523 HG2 GLN 523 -10.641 -12.445 0.903 180 HG3 GLN 523 HG3 GLN 523 -10.659 -12.405 2.662 181 HE21 GLN 523 HE21 GLN 523 -12.248 -9.951 2.746 182 HE22 GLN 523 HE22 GLN 523 -13.858 -10.413 2.322 183 H SER 524 HN SER 524 -11.444 -8.031 0.606 184 HA SER 524 HA SER 524 -13.741 -9.160 -0.624 185 HB2 SER 524 HB2 SER 524 -13.744 -7.344 1.129 186 HB3 SER 524 HB3 SER 524 -13.189 -6.224 -0.113 187 HG SER 524 HG SER 524 -15.239 -7.361 -1.186 188 H ALA 525 HN ALA 525 -11.163 -7.030 -1.753 189 HA ALA 525 HA ALA 525 -12.373 -6.445 -4.274 190 HB1 ALA 525 HB1 ALA 525 -10.691 -4.986 -3.232 191 HB2 ALA 525 HB2 ALA 525 -9.474 -6.241 -3.470 192 HB3 ALA 525 HB3 ALA 525 -10.232 -5.474 -4.865 193 H GLY 526 HN GLY 526 -10.349 -9.003 -3.060 194 HA2 GLY 526 HA2 GLY 526 -10.144 -11.121 -4.055 195 HA3 GLY 526 HA3 GLY 526 -10.716 -10.443 -5.571 196 H LEU 527 HN LEU 527 -8.034 -9.524 -3.436 197 HA LEU 527 HA LEU 527 -6.182 -10.058 -5.668 198 HB2 LEU 527 HB2 LEU 527 -6.144 -7.783 -3.680 199 HB3 LEU 527 HB3 LEU 527 -4.806 -8.160 -4.746 200 HG LEU 527 HG LEU 527 -7.567 -7.335 -5.640 201 HD11 LEU 527 HD11 LEU 527 -4.972 -5.801 -5.609 202 HD12 LEU 527 HD12 LEU 527 -6.494 -5.243 -6.302 203 HD13 LEU 527 HD13 LEU 527 -6.362 -5.512 -4.564 204 HD21 LEU 527 HD21 LEU 527 -6.490 -8.810 -7.247 205 HD22 LEU 527 HD22 LEU 527 -6.542 -7.159 -7.860 206 HD23 LEU 527 HD23 LEU 527 -5.036 -7.813 -7.215 207 H THR 528 HN THR 528 -7.003 -11.748 -3.408 208 HA THR 528 HA THR 528 -4.951 -11.622 -1.411 209 HB THR 528 HB THR 528 -6.879 -13.886 -1.953 210 HG1 THR 528 HG1 THR 528 -7.351 -11.369 -1.135 211 HG21 THR 528 HG21 THR 528 -6.541 -14.408 0.414 212 HG22 THR 528 HG22 THR 528 -5.408 -13.065 0.557 213 HG23 THR 528 HG23 THR 528 -5.008 -14.451 -0.458 214 H GLU 529 HN GLU 529 -5.551 -13.527 -4.305 215 HA GLU 529 HA GLU 529 -3.651 -15.541 -3.985 216 HB2 GLU 529 HB2 GLU 529 -4.372 -14.228 -6.610 217 HB3 GLU 529 HB3 GLU 529 -3.739 -15.849 -6.385 218 HG2 GLU 529 HG2 GLU 529 -5.990 -16.195 -6.792 219 HG3 GLU 529 HG3 GLU 529 -5.882 -16.274 -5.032 220 H THR 530 HN THR 530 -3.325 -12.244 -5.089 221 HA THR 530 HA THR 530 -0.836 -12.359 -6.328 222 HB THR 530 HB THR 530 -1.800 -9.982 -4.750 223 HG1 THR 530 HG1 THR 530 -2.664 -9.936 -7.295 224 HG21 THR 530 HG21 THR 530 0.380 -9.758 -5.821 225 HG22 THR 530 HG22 THR 530 -0.809 -8.735 -6.625 226 HG23 THR 530 HG23 THR 530 -0.312 -10.256 -7.364 227 H LEU 531 HN LEU 531 -1.668 -11.808 -2.922 228 HA LEU 531 HA LEU 531 1.152 -11.474 -2.238 229 HB2 LEU 531 HB2 LEU 531 -1.286 -11.255 -0.473 230 HB3 LEU 531 HB3 LEU 531 0.342 -10.721 -0.086 231 HG LEU 531 HG LEU 531 -1.417 -9.577 -2.249 232 HD11 LEU 531 HD11 LEU 531 -0.605 -8.460 0.424 233 HD12 LEU 531 HD12 LEU 531 -1.516 -7.606 -0.822 234 HD13 LEU 531 HD13 LEU 531 -2.213 -9.023 -0.037 235 HD21 LEU 531 HD21 LEU 531 0.969 -9.517 -2.800 236 HD22 LEU 531 HD22 LEU 531 0.314 -7.902 -2.513 237 HD23 LEU 531 HD23 LEU 531 1.296 -8.690 -1.276 238 H ASN 532 HN ASN 532 -0.408 -14.057 -2.896 239 HA ASN 532 HA ASN 532 -0.062 -15.543 -0.412 240 HB2 ASN 532 HB2 ASN 532 -2.093 -15.918 -1.778 241 HB3 ASN 532 HB3 ASN 532 -1.082 -16.493 -3.100 242 HD21 ASN 532 HD21 ASN 532 -2.334 -17.199 0.070 243 HD22 ASN 532 HD22 ASN 532 -1.945 -18.882 0.063 244 H ARG 533 HN ARG 533 1.129 -15.654 -3.765 245 HA ARG 533 HA ARG 533 3.134 -17.633 -3.012 246 HB2 ARG 533 HB2 ARG 533 1.744 -17.529 -5.247 247 HB3 ARG 533 HB3 ARG 533 2.973 -16.367 -5.730 248 HG2 ARG 533 HG2 ARG 533 4.613 -18.261 -4.943 249 HG3 ARG 533 HG3 ARG 533 3.207 -19.288 -5.234 250 HD2 ARG 533 HD2 ARG 533 4.575 -19.196 -7.231 251 HD3 ARG 533 HD3 ARG 533 3.044 -18.367 -7.518 252 HE ARG 533 HE ARG 533 5.035 -16.542 -6.634 253 HH11 ARG 533 HH12 ARG 533 4.071 -18.379 -9.465 254 HH12 ARG 533 HH11 ARG 533 4.698 -17.210 -10.592 255 HH21 ARG 533 HH22 ARG 533 5.870 -15.020 -8.101 256 HH22 ARG 533 HH21 ARG 533 5.736 -15.298 -9.814 257 H GLU 534 HN GLU 534 5.449 -17.165 -4.011 258 HA GLU 534 HA GLU 534 6.212 -14.576 -2.938 259 HB2 GLU 534 HB2 GLU 534 8.437 -15.366 -2.836 260 HB3 GLU 534 HB3 GLU 534 7.415 -16.698 -2.318 261 HG2 GLU 534 HG2 GLU 534 8.259 -16.535 -5.168 262 HG3 GLU 534 HG3 GLU 534 9.405 -17.096 -3.951 263 H GLY 535 HN GLY 535 8.376 -13.812 -4.177 264 HA2 GLY 535 HA2 GLY 535 8.899 -13.467 -6.702 265 HA3 GLY 535 HA3 GLY 535 7.256 -12.825 -6.698 266 H VAL 536 HN VAL 536 7.899 -10.669 -7.160 267 HA VAL 536 HA VAL 536 9.063 -9.388 -4.782 268 HB VAL 536 HB VAL 536 10.141 -7.693 -6.166 269 HG11 VAL 536 HG11 VAL 536 11.464 -9.594 -5.545 270 HG12 VAL 536 HG12 VAL 536 10.832 -10.531 -6.902 271 HG13 VAL 536 HG13 VAL 536 11.878 -9.138 -7.200 272 HG21 VAL 536 HG21 VAL 536 9.234 -9.324 -8.537 273 HG22 VAL 536 HG22 VAL 536 8.626 -7.729 -8.092 274 HG23 VAL 536 HG23 VAL 536 10.307 -7.925 -8.589 275 H TYR 537 HN TYR 537 7.892 -7.809 -3.920 276 HA TYR 537 HA TYR 537 5.922 -6.355 -5.494 277 HB2 TYR 537 HB2 TYR 537 5.178 -7.903 -2.994 278 HB3 TYR 537 HB3 TYR 537 4.135 -6.757 -3.819 279 HD1 TYR 537 HD1 TYR 537 3.424 -7.311 -6.214 280 HD2 TYR 537 HD2 TYR 537 5.191 -10.162 -3.596 281 HE1 TYR 537 HE1 TYR 537 2.504 -9.131 -7.585 282 HE2 TYR 537 HE2 TYR 537 4.280 -11.988 -4.964 283 HH TYR 537 HH TYR 537 2.380 -12.322 -6.547 284 H THR 538 HN THR 538 5.411 -4.368 -4.616 285 HA THR 538 HA THR 538 6.643 -3.719 -2.022 286 HB THR 538 HB THR 538 6.484 -1.849 -4.405 287 HG1 THR 538 HG1 THR 538 8.264 -2.853 -4.975 288 HG21 THR 538 HG21 THR 538 7.869 -1.551 -1.736 289 HG22 THR 538 HG22 THR 538 6.402 -0.701 -2.227 290 HG23 THR 538 HG23 THR 538 7.925 -0.399 -3.066 291 H VAL 539 HN VAL 539 4.920 -3.635 -0.715 292 HA VAL 539 HA VAL 539 2.441 -2.433 -1.761 293 HB VAL 539 HB VAL 539 2.722 -4.352 0.558 294 HG11 VAL 539 HG11 VAL 539 0.288 -4.568 0.367 295 HG12 VAL 539 HG12 VAL 539 0.772 -2.911 0.731 296 HG13 VAL 539 HG13 VAL 539 0.285 -3.346 -0.907 297 HG21 VAL 539 HG21 VAL 539 1.801 -6.053 -0.921 298 HG22 VAL 539 HG22 VAL 539 1.796 -4.904 -2.260 299 HG23 VAL 539 HG23 VAL 539 3.324 -5.428 -1.554 300 H PHE 540 HN PHE 540 1.681 -0.646 -0.865 301 HA PHE 540 HA PHE 540 2.849 0.303 1.649 302 HB2 PHE 540 HB2 PHE 540 1.209 1.750 -0.453 303 HB3 PHE 540 HB3 PHE 540 1.813 2.482 1.026 304 HD1 PHE 540 HD1 PHE 540 2.766 1.073 -2.232 305 HD2 PHE 540 HD2 PHE 540 4.082 3.184 1.222 306 HE1 PHE 540 HE1 PHE 540 4.848 1.676 -3.398 307 HE2 PHE 540 HE2 PHE 540 6.163 3.788 0.058 308 HZ PHE 540 HZ PHE 540 6.549 3.035 -2.256 309 H ALA 541 HN ALA 541 1.731 -0.325 3.385 310 HA ALA 541 HA ALA 541 -1.155 -0.770 3.152 311 HB1 ALA 541 HB1 ALA 541 0.729 -1.498 5.396 312 HB2 ALA 541 HB2 ALA 541 -0.986 -1.919 5.311 313 HB3 ALA 541 HB3 ALA 541 0.154 -2.587 4.133 314 HA PRO 542 HA PRO 542 -1.645 3.195 5.172 315 HB2 PRO 542 HB2 PRO 542 -4.497 2.758 4.785 316 HB3 PRO 542 HB3 PRO 542 -3.453 3.976 4.051 317 HG2 PRO 542 HG2 PRO 542 -4.537 1.927 2.646 318 HG3 PRO 542 HG3 PRO 542 -2.980 2.667 2.234 319 HD2 PRO 542 HD2 PRO 542 -3.535 0.119 3.712 320 HD3 PRO 542 HD3 PRO 542 -2.309 0.454 2.469 321 H THR 543 HN THR 543 -1.934 3.625 7.272 322 HA THR 543 HA THR 543 -2.693 1.520 9.056 323 HB THR 543 HB THR 543 -2.306 3.272 10.822 324 HG1 THR 543 HG1 THR 543 -1.772 5.296 10.232 325 HG21 THR 543 HG21 THR 543 0.112 3.373 10.469 326 HG22 THR 543 HG22 THR 543 -0.105 2.922 8.778 327 HG23 THR 543 HG23 THR 543 -0.516 1.777 10.054 328 H ASN 544 HN ASN 544 -4.118 2.502 11.076 329 HA ASN 544 HA ASN 544 -6.756 2.504 10.025 330 HB2 ASN 544 HB2 ASN 544 -6.191 1.517 12.227 331 HB3 ASN 544 HB3 ASN 544 -5.857 3.125 12.847 332 HD21 ASN 544 HD21 ASN 544 -8.319 0.892 11.836 333 HD22 ASN 544 HD22 ASN 544 -9.668 1.770 12.459 334 H GLU 545 HN GLU 545 -4.583 4.959 11.196 335 HA GLU 545 HA GLU 545 -6.357 7.103 11.421 336 HB2 GLU 545 HB2 GLU 545 -3.525 7.366 10.403 337 HB3 GLU 545 HB3 GLU 545 -4.453 8.534 11.331 338 HG2 GLU 545 HG2 GLU 545 -2.978 7.688 12.890 339 HG3 GLU 545 HG3 GLU 545 -4.433 6.737 13.185 340 H ALA 546 HN ALA 546 -4.769 5.692 8.622 341 HA ALA 546 HA ALA 546 -5.328 7.703 6.749 342 HB1 ALA 546 HB1 ALA 546 -5.009 4.735 6.358 343 HB2 ALA 546 HB2 ALA 546 -5.028 5.925 5.056 344 HB3 ALA 546 HB3 ALA 546 -3.739 5.955 6.259 345 H PHE 547 HN PHE 547 -7.106 4.795 7.629 346 HA PHE 547 HA PHE 547 -9.293 5.388 5.885 347 HB2 PHE 547 HB2 PHE 547 -8.978 3.348 8.093 348 HB3 PHE 547 HB3 PHE 547 -10.339 3.437 6.992 349 HD1 PHE 547 HD1 PHE 547 -9.914 3.144 4.515 350 HD2 PHE 547 HD2 PHE 547 -7.036 2.173 7.499 351 HE1 PHE 547 HE1 PHE 547 -8.724 1.720 2.902 352 HE2 PHE 547 HE2 PHE 547 -5.839 0.754 5.889 353 HZ PHE 547 HZ PHE 547 -6.685 0.522 3.588 354 H ARG 548 HN ARG 548 -8.409 6.143 9.116 355 HA ARG 548 HA ARG 548 -11.009 6.743 10.127 356 HB2 ARG 548 HB2 ARG 548 -8.967 6.286 11.528 357 HB3 ARG 548 HB3 ARG 548 -8.345 7.851 11.042 358 HG2 ARG 548 HG2 ARG 548 -9.298 8.060 13.222 359 HG3 ARG 548 HG3 ARG 548 -10.346 8.908 12.080 360 HD2 ARG 548 HD2 ARG 548 -11.591 7.545 13.732 361 HD3 ARG 548 HD3 ARG 548 -11.892 7.064 12.062 362 HE ARG 548 HE ARG 548 -9.797 5.494 13.041 363 HH11 ARG 548 HH12 ARG 548 -13.190 5.989 13.735 364 HH12 ARG 548 HH11 ARG 548 -13.474 4.331 14.169 365 HH21 ARG 548 HH22 ARG 548 -10.153 3.325 13.658 366 HH22 ARG 548 HH21 ARG 548 -11.748 2.810 14.118 367 H ALA 549 HN ALA 549 -8.506 8.499 8.440 368 HA ALA 549 HA ALA 549 -9.658 11.090 8.748 369 HB1 ALA 549 HB1 ALA 549 -7.977 11.797 7.143 370 HB2 ALA 549 HB2 ALA 549 -7.263 10.731 8.353 371 HB3 ALA 549 HB3 ALA 549 -7.630 10.114 6.742 372 H LEU 550 HN LEU 550 -10.372 8.431 6.762 373 HA LEU 550 HA LEU 550 -11.640 10.088 4.713 374 HB2 LEU 550 HB2 LEU 550 -11.104 8.472 3.278 375 HB3 LEU 550 HB3 LEU 550 -10.074 7.847 4.547 376 HG LEU 550 HG LEU 550 -12.186 6.521 5.259 377 HD11 LEU 550 HD11 LEU 550 -13.566 7.856 3.609 378 HD12 LEU 550 HD12 LEU 550 -12.791 6.911 2.336 379 HD13 LEU 550 HD13 LEU 550 -13.776 6.100 3.558 380 HD21 LEU 550 HD21 LEU 550 -11.538 4.710 3.736 381 HD22 LEU 550 HD22 LEU 550 -10.635 5.862 2.754 382 HD23 LEU 550 HD23 LEU 550 -10.125 5.527 4.407 383 HA PRO 551 HA PRO 551 -15.358 9.762 6.921 384 HB2 PRO 551 HB2 PRO 551 -16.839 10.735 4.655 385 HB3 PRO 551 HB3 PRO 551 -16.282 11.630 6.067 386 HG2 PRO 551 HG2 PRO 551 -15.322 11.997 3.514 387 HG3 PRO 551 HG3 PRO 551 -14.439 12.414 4.991 388 HD2 PRO 551 HD2 PRO 551 -14.147 10.020 3.222 389 HD3 PRO 551 HD3 PRO 551 -12.904 10.960 4.073 390 HA PRO 552 HA PRO 552 -17.806 6.192 5.935 391 HB2 PRO 552 HB2 PRO 552 -20.319 7.185 6.558 392 HB3 PRO 552 HB3 PRO 552 -19.184 6.496 7.719 393 HG2 PRO 552 HG2 PRO 552 -19.738 9.359 7.081 394 HG3 PRO 552 HG3 PRO 552 -19.393 8.600 8.647 395 HD2 PRO 552 HD2 PRO 552 -17.529 10.007 7.324 396 HD3 PRO 552 HD3 PRO 552 -17.113 8.564 8.273 397 H ARG 553 HN ARG 553 -18.932 9.328 4.751 398 HA ARG 553 HA ARG 553 -20.705 8.412 2.784 399 HB2 ARG 553 HB2 ARG 553 -20.509 10.771 3.606 400 HB3 ARG 553 HB3 ARG 553 -19.015 10.920 2.691 401 HG2 ARG 553 HG2 ARG 553 -20.768 11.915 1.425 402 HG3 ARG 553 HG3 ARG 553 -20.301 10.414 0.624 403 HD2 ARG 553 HD2 ARG 553 -22.695 10.554 0.630 404 HD3 ARG 553 HD3 ARG 553 -22.208 9.289 1.756 405 HE ARG 553 HE ARG 553 -22.521 11.781 3.092 406 HH11 ARG 553 HH12 ARG 553 -24.344 9.108 1.733 407 HH12 ARG 553 HH11 ARG 553 -25.722 9.364 2.758 408 HH21 ARG 553 HH22 ARG 553 -24.342 12.110 4.435 409 HH22 ARG 553 HH21 ARG 553 -25.719 11.058 4.289 410 H GLU 554 HN GLU 554 -17.260 9.228 2.609 411 HA GLU 554 HA GLU 554 -17.035 8.595 -0.166 412 HB2 GLU 554 HB2 GLU 554 -14.989 9.117 1.990 413 HB3 GLU 554 HB3 GLU 554 -14.543 8.729 0.333 414 HG2 GLU 554 HG2 GLU 554 -16.280 11.050 1.123 415 HG3 GLU 554 HG3 GLU 554 -14.541 11.151 0.857 416 H ARG 555 HN ARG 555 -16.112 6.911 2.846 417 HA ARG 555 HA ARG 555 -14.868 4.732 1.605 418 HB2 ARG 555 HB2 ARG 555 -15.101 3.502 3.652 419 HB3 ARG 555 HB3 ARG 555 -14.731 5.172 4.041 420 HG2 ARG 555 HG2 ARG 555 -17.049 5.575 4.623 421 HG3 ARG 555 HG3 ARG 555 -17.468 3.921 4.166 422 HD2 ARG 555 HD2 ARG 555 -17.218 4.146 6.591 423 HD3 ARG 555 HD3 ARG 555 -15.997 3.065 5.920 424 HE ARG 555 HE ARG 555 -14.875 5.604 5.995 425 HH11 ARG 555 HH12 ARG 555 -16.105 3.263 8.288 426 HH12 ARG 555 HH11 ARG 555 -15.010 3.738 9.552 427 HH21 ARG 555 HH22 ARG 555 -13.440 6.248 7.666 428 HH22 ARG 555 HH21 ARG 555 -13.506 5.429 9.195 429 H SER 556 HN SER 556 -18.289 5.252 2.373 430 HA SER 556 HA SER 556 -19.153 2.646 1.724 431 HB2 SER 556 HB2 SER 556 -20.458 4.348 3.048 432 HB3 SER 556 HB3 SER 556 -20.786 5.188 1.534 433 HG SER 556 HG SER 556 -21.845 2.843 2.534 434 H ARG 557 HN ARG 557 -18.740 5.578 -0.183 435 HA ARG 557 HA ARG 557 -19.875 4.696 -2.595 436 HB2 ARG 557 HB2 ARG 557 -17.715 6.682 -1.931 437 HB3 ARG 557 HB3 ARG 557 -18.143 6.339 -3.602 438 HG2 ARG 557 HG2 ARG 557 -20.025 7.359 -1.482 439 HG3 ARG 557 HG3 ARG 557 -19.269 8.330 -2.748 440 HD2 ARG 557 HD2 ARG 557 -21.279 6.110 -3.071 441 HD3 ARG 557 HD3 ARG 557 -21.481 7.815 -3.473 442 HE ARG 557 HE ARG 557 -19.314 6.737 -4.935 443 HH11 ARG 557 HH12 ARG 557 -22.814 6.741 -4.828 444 HH12 ARG 557 HH11 ARG 557 -22.994 6.279 -6.492 445 HH21 ARG 557 HH22 ARG 557 -19.534 6.101 -7.101 446 HH22 ARG 557 HH21 ARG 557 -21.118 5.929 -7.794 447 H LEU 558 HN LEU 558 -16.590 4.474 -1.341 448 HA LEU 558 HA LEU 558 -15.482 3.232 -3.640 449 HB2 LEU 558 HB2 LEU 558 -14.162 4.535 -2.017 450 HB3 LEU 558 HB3 LEU 558 -14.447 3.302 -0.806 451 HG LEU 558 HG LEU 558 -13.207 1.675 -2.214 452 HD11 LEU 558 HD11 LEU 558 -11.880 2.479 -4.085 453 HD12 LEU 558 HD12 LEU 558 -13.595 2.754 -4.387 454 HD13 LEU 558 HD13 LEU 558 -12.559 4.096 -3.898 455 HD21 LEU 558 HD21 LEU 558 -11.698 4.194 -1.528 456 HD22 LEU 558 HD22 LEU 558 -12.092 2.889 -0.410 457 HD23 LEU 558 HD23 LEU 558 -10.993 2.595 -1.759 458 H LEU 559 HN LEU 559 -16.277 1.905 -0.393 459 HA LEU 559 HA LEU 559 -15.556 -0.730 -1.248 460 HB2 LEU 559 HB2 LEU 559 -16.309 -1.482 0.960 461 HB3 LEU 559 HB3 LEU 559 -15.177 -0.153 1.045 462 HG LEU 559 HG LEU 559 -17.208 1.360 1.362 463 HD11 LEU 559 HD11 LEU 559 -18.861 -0.289 0.600 464 HD12 LEU 559 HD12 LEU 559 -18.521 -1.262 2.030 465 HD13 LEU 559 HD13 LEU 559 -19.217 0.350 2.208 466 HD21 LEU 559 HD21 LEU 559 -17.349 0.804 3.770 467 HD22 LEU 559 HD22 LEU 559 -16.470 -0.690 3.445 468 HD23 LEU 559 HD23 LEU 559 -15.693 0.868 3.168 469 H GLY 560 HN GLY 560 -18.295 1.103 -1.724 470 HA2 GLY 560 HA2 GLY 560 -20.302 -0.896 -1.692 471 HA3 GLY 560 HA3 GLY 560 -20.350 0.601 -2.617 472 H ASP 561 HN ASP 561 -17.899 0.068 -4.048 473 HA ASP 561 HA ASP 561 -18.904 -2.001 -5.882 474 HB2 ASP 561 HB2 ASP 561 -18.995 0.121 -6.988 475 HB3 ASP 561 HB3 ASP 561 -17.370 0.539 -6.452 476 H ALA 562 HN ALA 562 -17.714 -3.757 -6.058 477 HA ALA 562 HA ALA 562 -15.286 -4.106 -4.658 478 HB1 ALA 562 HB1 ALA 562 -16.499 -5.838 -6.808 479 HB2 ALA 562 HB2 ALA 562 -15.226 -6.317 -5.687 480 HB3 ALA 562 HB3 ALA 562 -16.840 -5.944 -5.080 481 H LYS 563 HN LYS 563 -16.028 -3.162 -7.919 482 HA LYS 563 HA LYS 563 -13.549 -3.795 -9.109 483 HB2 LYS 563 HB2 LYS 563 -15.383 -3.437 -10.554 484 HB3 LYS 563 HB3 LYS 563 -15.768 -1.891 -9.814 485 HG2 LYS 563 HG2 LYS 563 -13.628 -1.001 -10.719 486 HG3 LYS 563 HG3 LYS 563 -13.416 -2.523 -11.581 487 HD2 LYS 563 HD2 LYS 563 -14.378 -0.743 -13.000 488 HD3 LYS 563 HD3 LYS 563 -15.446 -2.137 -12.840 489 HE2 LYS 563 HE2 LYS 563 -16.564 0.115 -12.667 490 HE3 LYS 563 HE3 LYS 563 -16.870 -0.994 -11.332 491 HZ1 LYS 563 HZ1 LYS 563 -15.568 0.226 -9.898 492 HZ2 LYS 563 HZ2 LYS 563 -16.279 1.454 -10.825 493 HZ3 LYS 563 HZ3 LYS 563 -14.684 0.974 -11.139 494 H GLU 564 HN GLU 564 -14.831 -0.700 -7.869 495 HA GLU 564 HA GLU 564 -12.362 0.652 -8.299 496 HB2 GLU 564 HB2 GLU 564 -14.972 1.346 -7.066 497 HB3 GLU 564 HB3 GLU 564 -13.580 2.339 -6.641 498 HG2 GLU 564 HG2 GLU 564 -13.273 3.075 -8.813 499 HG3 GLU 564 HG3 GLU 564 -14.157 1.719 -9.504 500 H LEU 565 HN LEU 565 -13.663 -1.178 -5.611 501 HA LEU 565 HA LEU 565 -11.789 -0.458 -3.662 502 HB2 LEU 565 HB2 LEU 565 -13.389 -2.887 -4.249 503 HB3 LEU 565 HB3 LEU 565 -12.022 -3.082 -3.179 504 HG LEU 565 HG LEU 565 -14.418 -1.306 -2.765 505 HD11 LEU 565 HD11 LEU 565 -13.362 -3.695 -1.250 506 HD12 LEU 565 HD12 LEU 565 -14.772 -2.732 -0.807 507 HD13 LEU 565 HD13 LEU 565 -14.780 -3.672 -2.299 508 HD21 LEU 565 HD21 LEU 565 -11.943 -1.583 -1.060 509 HD22 LEU 565 HD22 LEU 565 -12.383 -0.169 -2.019 510 HD23 LEU 565 HD23 LEU 565 -13.387 -0.654 -0.652 511 H ALA 566 HN ALA 566 -11.662 -3.054 -6.066 512 HA ALA 566 HA ALA 566 -8.982 -3.800 -5.578 513 HB1 ALA 566 HB1 ALA 566 -9.134 -5.051 -7.645 514 HB2 ALA 566 HB2 ALA 566 -10.628 -5.238 -6.726 515 HB3 ALA 566 HB3 ALA 566 -10.577 -4.153 -8.116 516 H ASN 567 HN ASN 567 -10.485 -1.451 -7.669 517 HA ASN 567 HA ASN 567 -8.390 -0.826 -9.378 518 HB2 ASN 567 HB2 ASN 567 -10.667 0.015 -9.686 519 HB3 ASN 567 HB3 ASN 567 -10.523 0.986 -8.228 520 HD21 ASN 567 HD21 ASN 567 -8.020 0.585 -10.671 521 HD22 ASN 567 HD22 ASN 567 -8.025 2.231 -11.190 522 H ILE 568 HN ILE 568 -9.241 0.767 -6.287 523 HA ILE 568 HA ILE 568 -6.958 2.467 -6.357 524 HB ILE 568 HB ILE 568 -8.784 1.788 -4.046 525 HG12 ILE 568 HG12 ILE 568 -9.928 2.834 -5.952 526 HG13 ILE 568 HG13 ILE 568 -9.862 3.927 -4.576 527 HG21 ILE 568 HG21 ILE 568 -7.931 3.852 -3.014 528 HG22 ILE 568 HG22 ILE 568 -6.661 2.645 -3.227 529 HG23 ILE 568 HG23 ILE 568 -6.770 4.016 -4.331 530 HD11 ILE 568 HD11 ILE 568 -8.064 4.017 -6.991 531 HD12 ILE 568 HD12 ILE 568 -9.426 5.090 -6.668 532 HD13 ILE 568 HD13 ILE 568 -8.007 5.125 -5.620 533 H LEU 569 HN LEU 569 -7.662 -0.620 -4.794 534 HA LEU 569 HA LEU 569 -5.320 -0.770 -3.222 535 HB2 LEU 569 HB2 LEU 569 -7.040 -2.960 -4.379 536 HB3 LEU 569 HB3 LEU 569 -5.762 -3.227 -3.209 537 HG LEU 569 HG LEU 569 -8.239 -1.566 -2.739 538 HD11 LEU 569 HD11 LEU 569 -8.896 -3.393 -1.249 539 HD12 LEU 569 HD12 LEU 569 -8.746 -3.934 -2.921 540 HD13 LEU 569 HD13 LEU 569 -7.477 -4.311 -1.755 541 HD21 LEU 569 HD21 LEU 569 -6.321 -0.774 -1.449 542 HD22 LEU 569 HD22 LEU 569 -7.515 -1.547 -0.406 543 HD23 LEU 569 HD23 LEU 569 -6.043 -2.411 -0.850 544 H LYS 570 HN LYS 570 -6.001 -1.551 -6.549 545 HA LYS 570 HA LYS 570 -3.686 -3.076 -7.106 546 HB2 LYS 570 HB2 LYS 570 -5.861 -2.899 -8.412 547 HB3 LYS 570 HB3 LYS 570 -5.253 -1.380 -9.044 548 HG2 LYS 570 HG2 LYS 570 -3.470 -2.487 -10.173 549 HG3 LYS 570 HG3 LYS 570 -3.852 -4.022 -9.382 550 HD2 LYS 570 HD2 LYS 570 -6.006 -4.086 -10.497 551 HD3 LYS 570 HD3 LYS 570 -5.704 -2.511 -11.227 552 HE2 LYS 570 HE2 LYS 570 -3.888 -3.424 -12.529 553 HE3 LYS 570 HE3 LYS 570 -4.052 -4.983 -11.719 554 HZ1 LYS 570 HZ1 LYS 570 -6.114 -5.366 -12.743 555 HZ2 LYS 570 HZ2 LYS 570 -5.113 -4.771 -13.983 556 HZ3 LYS 570 HZ3 LYS 570 -6.262 -3.757 -13.262 557 H TYR 571 HN TYR 571 -4.195 0.253 -6.616 558 HA TYR 571 HA TYR 571 -1.796 1.102 -8.010 559 HB2 TYR 571 HB2 TYR 571 -3.804 2.509 -8.046 560 HB3 TYR 571 HB3 TYR 571 -3.769 2.621 -6.293 561 HD1 TYR 571 HD2 TYR 571 -1.331 3.154 -9.084 562 HD2 TYR 571 HD1 TYR 571 -3.068 4.649 -5.499 563 HE1 TYR 571 HE2 TYR 571 0.060 5.168 -9.259 564 HE2 TYR 571 HE1 TYR 571 -1.677 6.668 -5.653 565 HH TYR 571 HH TYR 571 0.148 7.429 -8.477 566 H HIS 572 HN HIS 572 -2.669 -0.048 -4.914 567 HA HIS 572 HA HIS 572 -0.586 1.394 -3.489 568 HB2 HIS 572 HB2 HIS 572 -2.690 -0.594 -2.670 569 HB3 HIS 572 HB3 HIS 572 -1.361 -0.195 -1.586 570 HD1 HIS 572 HD1 HIS 572 -4.283 1.516 -3.348 571 HD2 HIS 572 HD2 HIS 572 -1.674 2.083 -0.159 572 HE1 HIS 572 HE1 HIS 572 -5.155 3.509 -2.058 573 H ILE 573 HN ILE 573 -0.769 -1.365 -5.375 574 HA ILE 573 HA ILE 573 1.496 -2.616 -3.982 575 HB ILE 573 HB ILE 573 -0.254 -3.903 -6.081 576 HG12 ILE 573 HG12 ILE 573 -0.419 -4.292 -3.085 577 HG13 ILE 573 HG13 ILE 573 -1.497 -3.227 -3.982 578 HG21 ILE 573 HG21 ILE 573 0.714 -5.984 -5.227 579 HG22 ILE 573 HG22 ILE 573 1.971 -4.889 -5.805 580 HG23 ILE 573 HG23 ILE 573 1.680 -5.065 -4.074 581 HD11 ILE 573 HD11 ILE 573 -1.211 -6.195 -4.386 582 HD12 ILE 573 HD12 ILE 573 -2.529 -5.381 -3.544 583 HD13 ILE 573 HD13 ILE 573 -2.300 -5.129 -5.274 584 H GLY 574 HN GLY 574 3.421 -2.261 -4.854 585 HA2 GLY 574 HA2 GLY 574 3.610 -1.643 -7.719 586 HA3 GLY 574 HA3 GLY 574 4.874 -1.390 -6.524 587 H ASP 575 HN ASP 575 5.025 -2.772 -9.109 588 HA ASP 575 HA ASP 575 5.158 -5.602 -8.373 589 HB2 ASP 575 HB2 ASP 575 5.358 -6.068 -10.742 590 HB3 ASP 575 HB3 ASP 575 4.017 -4.957 -10.479 591 H GLU 576 HN GLU 576 7.224 -3.244 -7.884 592 HA GLU 576 HA GLU 576 9.504 -4.992 -8.171 593 HB2 GLU 576 HB2 GLU 576 10.917 -3.176 -9.079 594 HB3 GLU 576 HB3 GLU 576 9.662 -3.677 -10.201 595 HG2 GLU 576 HG2 GLU 576 8.331 -1.731 -9.584 596 HG3 GLU 576 HG3 GLU 576 9.569 -1.238 -8.432 597 H ILE 577 HN ILE 577 10.858 -4.866 -6.525 598 HA ILE 577 HA ILE 577 9.923 -3.454 -4.218 599 HB ILE 577 HB ILE 577 12.376 -5.186 -4.587 600 HG12 ILE 577 HG12 ILE 577 9.706 -5.754 -3.293 601 HG13 ILE 577 HG13 ILE 577 10.221 -6.351 -4.864 602 HG21 ILE 577 HG21 ILE 577 12.450 -5.272 -2.116 603 HG22 ILE 577 HG22 ILE 577 12.742 -3.649 -2.745 604 HG23 ILE 577 HG23 ILE 577 11.169 -4.063 -2.062 605 HD11 ILE 577 HD11 ILE 577 10.433 -8.077 -3.191 606 HD12 ILE 577 HD12 ILE 577 12.028 -7.604 -3.778 607 HD13 ILE 577 HD13 ILE 577 11.462 -7.031 -2.210 608 H LEU 578 HN LEU 578 10.363 -1.463 -3.776 609 HA LEU 578 HA LEU 578 13.008 -0.391 -4.470 610 HB2 LEU 578 HB2 LEU 578 11.155 0.677 -5.713 611 HB3 LEU 578 HB3 LEU 578 10.421 1.134 -4.188 612 HG LEU 578 HG LEU 578 12.383 2.534 -3.673 613 HD11 LEU 578 HD11 LEU 578 14.060 1.325 -4.957 614 HD12 LEU 578 HD12 LEU 578 13.274 1.812 -6.459 615 HD13 LEU 578 HD13 LEU 578 14.013 3.027 -5.417 616 HD21 LEU 578 HD21 LEU 578 10.418 3.499 -4.760 617 HD22 LEU 578 HD22 LEU 578 11.906 4.298 -5.271 618 HD23 LEU 578 HD23 LEU 578 11.118 3.134 -6.338 619 H VAL 579 HN VAL 579 14.178 -0.446 -2.681 620 HA VAL 579 HA VAL 579 12.947 0.091 -0.103 621 HB VAL 579 HB VAL 579 15.167 -0.469 0.838 622 HG11 VAL 579 HG11 VAL 579 15.121 -2.859 0.243 623 HG12 VAL 579 HG12 VAL 579 13.512 -2.215 0.573 624 HG13 VAL 579 HG13 VAL 579 14.028 -2.488 -1.091 625 HG21 VAL 579 HG21 VAL 579 16.902 -1.404 -0.620 626 HG22 VAL 579 HG22 VAL 579 15.928 -1.006 -2.035 627 HG23 VAL 579 HG23 VAL 579 16.568 0.282 -1.015 628 H SER 580 HN SER 580 14.045 1.627 1.384 629 HA SER 580 HA SER 580 14.018 4.197 0.302 630 HB2 SER 580 HB2 SER 580 15.084 4.785 2.581 631 HB3 SER 580 HB3 SER 580 13.504 3.997 2.592 632 HG SER 580 HG SER 580 15.380 3.168 3.975 633 H GLY 581 HN GLY 581 16.751 2.113 1.176 634 HA2 GLY 581 HA2 GLY 581 18.741 4.069 0.621 635 HA3 GLY 581 HA3 GLY 581 19.014 2.348 0.830 636 H GLY 582 HN GLY 582 16.813 2.222 -1.452 637 HA2 GLY 582 HA2 GLY 582 18.828 2.148 -3.582 638 HA3 GLY 582 HA3 GLY 582 17.263 1.350 -3.611 639 H ILE 583 HN ILE 583 16.411 4.192 -2.478 640 HA ILE 583 HA ILE 583 15.319 5.059 -4.953 641 HB ILE 583 HB ILE 583 15.445 6.587 -2.348 642 HG12 ILE 583 HG12 ILE 583 13.248 4.780 -3.376 643 HG13 ILE 583 HG13 ILE 583 14.410 4.322 -2.136 644 HG21 ILE 583 HG21 ILE 583 13.587 6.842 -4.713 645 HG22 ILE 583 HG22 ILE 583 13.485 7.767 -3.215 646 HG23 ILE 583 HG23 ILE 583 14.875 7.966 -4.282 647 HD11 ILE 583 HD11 ILE 583 12.277 4.989 -1.175 648 HD12 ILE 583 HD12 ILE 583 13.569 6.085 -0.687 649 HD13 ILE 583 HD13 ILE 583 12.423 6.574 -1.935 650 H GLY 584 HN GLY 584 17.589 6.672 -2.720 651 HA2 GLY 584 HA2 GLY 584 19.421 8.004 -3.230 652 HA3 GLY 584 HA3 GLY 584 19.094 7.746 -4.940 653 H ALA 585 HN ALA 585 17.610 9.089 -6.013 654 HA ALA 585 HA ALA 585 17.081 11.621 -4.617 655 HB1 ALA 585 HB1 ALA 585 18.398 11.823 -6.656 656 HB2 ALA 585 HB2 ALA 585 17.122 11.023 -7.576 657 HB3 ALA 585 HB3 ALA 585 16.827 12.602 -6.851 658 H LEU 586 HN LEU 586 15.465 10.031 -7.351 659 HA LEU 586 HA LEU 586 13.031 9.656 -5.844 660 HB2 LEU 586 HB2 LEU 586 13.131 12.098 -6.696 661 HB3 LEU 586 HB3 LEU 586 12.885 11.408 -8.288 662 HG LEU 586 HG LEU 586 10.966 10.847 -6.040 663 HD11 LEU 586 HD11 LEU 586 10.922 13.182 -7.952 664 HD12 LEU 586 HD12 LEU 586 9.596 12.709 -6.890 665 HD13 LEU 586 HD13 LEU 586 11.124 13.264 -6.202 666 HD21 LEU 586 HD21 LEU 586 9.389 10.496 -7.855 667 HD22 LEU 586 HD22 LEU 586 10.633 10.899 -9.037 668 HD23 LEU 586 HD23 LEU 586 10.795 9.451 -8.042 669 H VAL 587 HN VAL 587 11.883 7.982 -6.671 670 HA VAL 587 HA VAL 587 12.616 7.026 -9.359 671 HB VAL 587 HB VAL 587 12.360 5.253 -6.917 672 HG11 VAL 587 HG11 VAL 587 13.045 4.576 -9.773 673 HG12 VAL 587 HG12 VAL 587 13.112 3.456 -8.411 674 HG13 VAL 587 HG13 VAL 587 11.566 4.138 -8.917 675 HG21 VAL 587 HG21 VAL 587 14.746 4.816 -7.187 676 HG22 VAL 587 HG22 VAL 587 14.812 5.960 -8.528 677 HG23 VAL 587 HG23 VAL 587 14.446 6.531 -6.900 678 H ARG 588 HN ARG 588 10.927 6.287 -10.549 679 HA ARG 588 HA ARG 588 8.269 6.573 -9.418 680 HB2 ARG 588 HB2 ARG 588 9.257 5.959 -12.205 681 HB3 ARG 588 HB3 ARG 588 7.551 5.966 -11.777 682 HG2 ARG 588 HG2 ARG 588 7.731 8.310 -11.108 683 HG3 ARG 588 HG3 ARG 588 9.436 8.301 -11.557 684 HD2 ARG 588 HD2 ARG 588 8.864 7.839 -13.860 685 HD3 ARG 588 HD3 ARG 588 7.157 7.713 -13.441 686 HE ARG 588 HE ARG 588 8.138 10.243 -12.659 687 HH11 ARG 588 HH12 ARG 588 7.349 8.409 -15.529 688 HH12 ARG 588 HH11 ARG 588 6.993 9.810 -16.490 689 HH21 ARG 588 HH22 ARG 588 7.599 12.093 -13.892 690 HH22 ARG 588 HH21 ARG 588 7.100 11.911 -15.549 691 H LEU 589 HN LEU 589 7.418 4.982 -8.343 692 HA LEU 589 HA LEU 589 8.342 2.251 -8.767 693 HB2 LEU 589 HB2 LEU 589 8.005 3.437 -6.487 694 HB3 LEU 589 HB3 LEU 589 6.298 3.154 -6.747 695 HG LEU 589 HG LEU 589 7.465 1.491 -5.262 696 HD11 LEU 589 HD11 LEU 589 5.327 0.987 -6.348 697 HD12 LEU 589 HD12 LEU 589 6.194 0.363 -7.751 698 HD13 LEU 589 HD13 LEU 589 6.343 -0.447 -6.192 699 HD21 LEU 589 HD21 LEU 589 8.723 0.653 -7.870 700 HD22 LEU 589 HD22 LEU 589 9.558 1.329 -6.470 701 HD23 LEU 589 HD23 LEU 589 8.788 -0.255 -6.358 702 H LYS 590 HN LYS 590 7.242 0.858 -9.989 703 HA LYS 590 HA LYS 590 4.821 1.852 -11.224 704 HB2 LYS 590 HB2 LYS 590 6.526 -0.561 -11.851 705 HB3 LYS 590 HB3 LYS 590 5.178 0.024 -12.831 706 HG2 LYS 590 HG2 LYS 590 6.280 2.000 -13.375 707 HG3 LYS 590 HG3 LYS 590 7.509 1.768 -12.131 708 HD2 LYS 590 HD2 LYS 590 8.051 -0.404 -13.483 709 HD3 LYS 590 HD3 LYS 590 7.238 0.451 -14.799 710 HE2 LYS 590 HE2 LYS 590 9.622 0.869 -14.891 711 HE3 LYS 590 HE3 LYS 590 8.765 2.353 -14.476 712 HZ1 LYS 590 HZ1 LYS 590 10.776 1.976 -13.122 713 HZ2 LYS 590 HZ2 LYS 590 10.067 0.569 -12.485 714 HZ3 LYS 590 HZ3 LYS 590 9.369 2.081 -12.187 715 H SER 591 HN SER 591 2.882 1.102 -10.957 716 HA SER 591 HA SER 591 2.503 -0.936 -8.887 717 HB2 SER 591 HB2 SER 591 0.208 -0.050 -8.727 718 HB3 SER 591 HB3 SER 591 1.409 1.226 -8.540 719 HG SER 591 HG SER 591 1.040 1.838 -10.680 720 H LEU 592 HN LEU 592 0.806 -2.533 -9.144 721 HA LEU 592 HA LEU 592 0.904 -3.922 -11.576 722 HB2 LEU 592 HB2 LEU 592 -0.828 -4.123 -9.142 723 HB3 LEU 592 HB3 LEU 592 -1.119 -5.143 -10.537 724 HG LEU 592 HG LEU 592 1.241 -5.964 -10.333 725 HD11 LEU 592 HD11 LEU 592 2.418 -5.656 -8.241 726 HD12 LEU 592 HD12 LEU 592 2.167 -4.113 -9.058 727 HD13 LEU 592 HD13 LEU 592 1.157 -4.556 -7.682 728 HD21 LEU 592 HD21 LEU 592 -0.642 -7.257 -9.509 729 HD22 LEU 592 HD22 LEU 592 0.762 -7.454 -8.460 730 HD23 LEU 592 HD23 LEU 592 -0.565 -6.401 -7.969 731 H GLN 593 HN GLN 593 -1.141 -1.357 -10.510 732 HA GLN 593 HA GLN 593 -3.247 -1.773 -12.394 733 HB2 GLN 593 HB2 GLN 593 -3.636 -0.410 -10.414 734 HB3 GLN 593 HB3 GLN 593 -2.376 0.714 -10.908 735 HG2 GLN 593 HG2 GLN 593 -3.716 1.250 -12.921 736 HG3 GLN 593 HG3 GLN 593 -5.002 0.225 -12.291 737 HE21 GLN 593 HE21 GLN 593 -3.035 2.144 -10.168 738 HE22 GLN 593 HE22 GLN 593 -4.237 3.317 -9.784 739 H GLY 594 HN GLY 594 -0.113 -0.270 -12.474 740 HA2 GLY 594 HA2 GLY 594 0.948 -0.065 -14.656 741 HA3 GLY 594 HA3 GLY 594 -0.602 0.466 -15.290 742 H ASP 595 HN ASP 595 -0.764 2.011 -12.577 743 HA ASP 595 HA ASP 595 0.270 4.455 -13.677 744 HB2 ASP 595 HB2 ASP 595 -1.249 3.788 -11.175 745 HB3 ASP 595 HB3 ASP 595 -0.553 5.388 -11.420 746 H LYS 596 HN LYS 596 1.429 5.971 -12.114 747 HA LYS 596 HA LYS 596 3.814 4.507 -11.237 748 HB2 LYS 596 HB2 LYS 596 4.952 6.754 -11.618 749 HB3 LYS 596 HB3 LYS 596 4.372 5.919 -13.055 750 HG2 LYS 596 HG2 LYS 596 2.357 7.335 -13.036 751 HG3 LYS 596 HG3 LYS 596 3.003 8.202 -11.641 752 HD2 LYS 596 HD2 LYS 596 4.854 9.014 -12.931 753 HD3 LYS 596 HD3 LYS 596 4.405 7.998 -14.304 754 HE2 LYS 596 HE2 LYS 596 3.718 10.316 -14.667 755 HE3 LYS 596 HE3 LYS 596 2.320 9.248 -14.552 756 HZ1 LYS 596 HZ1 LYS 596 3.352 11.034 -12.412 757 HZ2 LYS 596 HZ2 LYS 596 2.069 9.941 -12.222 758 HZ3 LYS 596 HZ3 LYS 596 1.920 11.241 -13.299 759 H LEU 597 HN LEU 597 4.212 4.427 -9.158 760 HA LEU 597 HA LEU 597 3.024 6.340 -7.321 761 HB2 LEU 597 HB2 LEU 597 4.847 3.974 -6.860 762 HB3 LEU 597 HB3 LEU 597 4.169 4.969 -5.587 763 HG LEU 597 HG LEU 597 2.405 3.513 -7.537 764 HD11 LEU 597 HD11 LEU 597 2.217 1.709 -5.948 765 HD12 LEU 597 HD12 LEU 597 3.899 1.882 -6.449 766 HD13 LEU 597 HD13 LEU 597 3.379 2.491 -4.875 767 HD21 LEU 597 HD21 LEU 597 0.774 3.750 -5.746 768 HD22 LEU 597 HD22 LEU 597 1.986 4.530 -4.730 769 HD23 LEU 597 HD23 LEU 597 1.429 5.325 -6.200 770 H GLU 598 HN GLU 598 3.995 8.167 -6.786 771 HA GLU 598 HA GLU 598 6.707 8.733 -7.533 772 HB2 GLU 598 HB2 GLU 598 5.059 10.512 -7.580 773 HB3 GLU 598 HB3 GLU 598 4.705 10.280 -5.873 774 HG2 GLU 598 HG2 GLU 598 7.201 10.838 -5.519 775 HG3 GLU 598 HG3 GLU 598 7.117 11.497 -7.154 776 H VAL 599 HN VAL 599 8.075 7.335 -6.392 777 HA VAL 599 HA VAL 599 7.990 7.630 -3.468 778 HB VAL 599 HB VAL 599 9.430 5.495 -5.043 779 HG11 VAL 599 HG11 VAL 599 8.873 5.725 -2.089 780 HG12 VAL 599 HG12 VAL 599 9.694 4.386 -2.891 781 HG13 VAL 599 HG13 VAL 599 10.435 5.987 -2.865 782 HG21 VAL 599 HG21 VAL 599 6.818 5.342 -3.540 783 HG22 VAL 599 HG22 VAL 599 7.019 5.252 -5.290 784 HG23 VAL 599 HG23 VAL 599 7.668 3.974 -4.263 785 H SER 600 HN SER 600 9.475 8.840 -2.551 786 HA SER 600 HA SER 600 12.086 9.155 -3.824 787 HB2 SER 600 HB2 SER 600 10.685 10.996 -4.681 788 HB3 SER 600 HB3 SER 600 10.332 11.486 -3.025 789 HG SER 600 HG SER 600 12.919 11.429 -4.209 790 H LEU 601 HN LEU 601 13.523 10.501 -2.393 791 HA LEU 601 HA LEU 601 12.993 10.061 0.453 792 HB2 LEU 601 HB2 LEU 601 14.300 8.124 -0.420 793 HB3 LEU 601 HB3 LEU 601 15.543 9.240 -0.954 794 HG LEU 601 HG LEU 601 15.863 9.923 1.438 795 HD11 LEU 601 HD11 LEU 601 14.024 7.590 1.931 796 HD12 LEU 601 HD12 LEU 601 14.990 8.403 3.166 797 HD13 LEU 601 HD13 LEU 601 13.716 9.283 2.321 798 HD21 LEU 601 HD21 LEU 601 17.124 7.923 2.054 799 HD22 LEU 601 HD22 LEU 601 16.280 6.997 0.813 800 HD23 LEU 601 HD23 LEU 601 17.356 8.316 0.350 801 H LYS 602 HN LYS 602 13.092 12.061 1.252 802 HA LYS 602 HA LYS 602 15.200 13.849 0.244 803 HB2 LYS 602 HB2 LYS 602 12.274 14.502 0.608 804 HB3 LYS 602 HB3 LYS 602 13.523 15.712 0.349 805 HG2 LYS 602 HG2 LYS 602 13.986 14.890 -1.834 806 HG3 LYS 602 HG3 LYS 602 12.988 13.460 -1.574 807 HD2 LYS 602 HD2 LYS 602 11.882 15.150 -2.986 808 HD3 LYS 602 HD3 LYS 602 10.990 14.824 -1.499 809 HE2 LYS 602 HE2 LYS 602 11.930 16.846 -0.492 810 HE3 LYS 602 HE3 LYS 602 12.837 17.166 -1.968 811 HZ1 LYS 602 HZ1 LYS 602 10.727 18.436 -1.733 812 HZ2 LYS 602 HZ2 LYS 602 9.877 16.979 -1.884 813 HZ3 LYS 602 HZ3 LYS 602 10.847 17.537 -3.164 814 H ASN 603 HN ASN 603 16.459 14.317 1.894 815 HA ASN 603 HA ASN 603 17.202 14.932 3.942 816 HB2 ASN 603 HB2 ASN 603 14.442 16.167 4.134 817 HB3 ASN 603 HB3 ASN 603 15.766 16.490 5.248 818 HD21 ASN 603 HD21 ASN 603 14.332 18.330 3.526 819 HD22 ASN 603 HD22 ASN 603 15.525 19.052 2.499 820 H ASN 604 HN ASN 604 16.421 12.376 3.776 821 HA ASN 604 HA ASN 604 16.301 10.580 5.136 822 HB2 ASN 604 HB2 ASN 604 16.034 12.652 7.310 823 HB3 ASN 604 HB3 ASN 604 16.097 10.922 7.621 824 HD21 ASN 604 HD21 ASN 604 17.995 10.403 5.479 825 HD22 ASN 604 HD22 ASN 604 19.519 10.991 6.032 826 H VAL 605 HN VAL 605 13.733 12.343 4.280 827 HA VAL 605 HA VAL 605 11.947 10.433 5.631 828 HB VAL 605 HB VAL 605 11.451 12.806 6.227 829 HG11 VAL 605 HG11 VAL 605 10.597 13.044 3.352 830 HG12 VAL 605 HG12 VAL 605 10.315 14.235 4.623 831 HG13 VAL 605 HG13 VAL 605 11.961 13.870 4.108 832 HG21 VAL 605 HG21 VAL 605 9.305 11.271 4.768 833 HG22 VAL 605 HG22 VAL 605 9.741 11.131 6.470 834 HG23 VAL 605 HG23 VAL 605 9.006 12.618 5.867 835 H VAL 606 HN VAL 606 10.759 9.113 4.436 836 HA VAL 606 HA VAL 606 11.033 9.321 1.528 837 HB VAL 606 HB VAL 606 11.820 7.215 2.374 838 HG11 VAL 606 HG11 VAL 606 10.400 5.672 3.633 839 HG12 VAL 606 HG12 VAL 606 10.660 7.182 4.507 840 HG13 VAL 606 HG13 VAL 606 9.127 6.891 3.683 841 HG21 VAL 606 HG21 VAL 606 10.616 7.125 0.255 842 HG22 VAL 606 HG22 VAL 606 10.400 5.633 1.172 843 HG23 VAL 606 HG23 VAL 606 9.107 6.831 1.119 844 H SER 607 HN SER 607 9.284 9.485 0.207 845 HA SER 607 HA SER 607 6.626 9.481 1.440 846 HB2 SER 607 HB2 SER 607 7.703 11.722 -0.292 847 HB3 SER 607 HB3 SER 607 6.060 11.609 0.342 848 HG SER 607 HG SER 607 7.903 11.324 2.305 849 H VAL 608 HN VAL 608 4.910 9.095 0.021 850 HA VAL 608 HA VAL 608 5.657 8.371 -2.724 851 HB VAL 608 HB VAL 608 5.447 6.270 -1.575 852 HG11 VAL 608 HG11 VAL 608 4.163 7.004 0.357 853 HG12 VAL 608 HG12 VAL 608 2.728 7.188 -0.652 854 HG13 VAL 608 HG13 VAL 608 3.425 5.588 -0.394 855 HG21 VAL 608 HG21 VAL 608 3.005 6.865 -3.245 856 HG22 VAL 608 HG22 VAL 608 4.565 6.269 -3.813 857 HG23 VAL 608 HG23 VAL 608 3.544 5.245 -2.802 858 H ASN 609 HN ASN 609 4.736 9.798 -3.970 859 HA ASN 609 HA ASN 609 3.255 11.249 -4.895 860 HB2 ASN 609 HB2 ASN 609 1.269 9.388 -3.581 861 HB3 ASN 609 HB3 ASN 609 0.788 10.738 -4.603 862 HD21 ASN 609 HD21 ASN 609 1.999 7.547 -4.490 863 HD22 ASN 609 HD22 ASN 609 2.043 7.275 -6.196 864 H LYS 610 HN LYS 610 4.465 12.214 -2.755 865 HA LYS 610 HA LYS 610 4.422 13.955 -1.310 866 HB2 LYS 610 HB2 LYS 610 1.496 14.157 -2.031 867 HB3 LYS 610 HB3 LYS 610 2.363 15.319 -1.036 868 HG2 LYS 610 HG2 LYS 610 3.809 15.878 -2.902 869 HG3 LYS 610 HG3 LYS 610 3.013 14.662 -3.904 870 HD2 LYS 610 HD2 LYS 610 2.171 16.907 -4.392 871 HD3 LYS 610 HD3 LYS 610 0.903 15.881 -3.719 872 HE2 LYS 610 HE2 LYS 610 1.295 16.901 -1.506 873 HE3 LYS 610 HE3 LYS 610 2.505 17.961 -2.232 874 HZ1 LYS 610 HZ1 LYS 610 0.796 18.906 -3.644 875 HZ2 LYS 610 HZ2 LYS 610 0.361 19.065 -2.013 876 HZ3 LYS 610 HZ3 LYS 610 -0.368 17.872 -2.973 877 H GLU 611 HN GLU 611 2.356 11.249 -0.897 878 HA GLU 611 HA GLU 611 1.586 11.864 1.812 879 HB2 GLU 611 HB2 GLU 611 1.483 9.183 0.413 880 HB3 GLU 611 HB3 GLU 611 0.591 9.662 1.853 881 HG2 GLU 611 HG2 GLU 611 0.225 10.776 -0.922 882 HG3 GLU 611 HG3 GLU 611 -0.846 9.643 -0.102 883 HA PRO 612 HA PRO 612 5.532 10.614 3.430 884 HB2 PRO 612 HB2 PRO 612 4.351 10.859 6.081 885 HB3 PRO 612 HB3 PRO 612 5.574 11.871 5.309 886 HG2 PRO 612 HG2 PRO 612 3.052 12.733 5.810 887 HG3 PRO 612 HG3 PRO 612 4.020 13.319 4.446 888 HD2 PRO 612 HD2 PRO 612 1.829 11.275 4.479 889 HD3 PRO 612 HD3 PRO 612 2.152 12.561 3.297 890 H VAL 613 HN VAL 613 6.404 8.709 3.894 891 HA VAL 613 HA VAL 613 4.748 6.461 4.629 892 HB VAL 613 HB VAL 613 7.734 6.661 4.161 893 HG11 VAL 613 HG11 VAL 613 7.737 4.220 4.100 894 HG12 VAL 613 HG12 VAL 613 7.213 4.814 5.676 895 HG13 VAL 613 HG13 VAL 613 6.026 4.200 4.528 896 HG21 VAL 613 HG21 VAL 613 5.507 5.572 2.448 897 HG22 VAL 613 HG22 VAL 613 6.418 7.055 2.161 898 HG23 VAL 613 HG23 VAL 613 7.227 5.491 2.066 899 H ALA 614 HN ALA 614 4.546 5.595 6.597 900 HA ALA 614 HA ALA 614 5.467 7.132 8.847 901 HB1 ALA 614 HB1 ALA 614 3.187 6.230 8.745 902 HB2 ALA 614 HB2 ALA 614 3.840 4.592 8.779 903 HB3 ALA 614 HB3 ALA 614 4.056 5.657 10.170 904 H GLU 615 HN GLU 615 6.260 4.043 7.369 905 HA GLU 615 HA GLU 615 8.740 3.926 8.761 906 HB2 GLU 615 HB2 GLU 615 7.214 3.113 10.554 907 HB3 GLU 615 HB3 GLU 615 6.721 1.795 9.495 908 HG2 GLU 615 HG2 GLU 615 8.870 0.814 9.562 909 HG3 GLU 615 HG3 GLU 615 9.576 2.243 10.317 910 HA PRO 616 HA PRO 616 9.002 1.667 4.885 911 HB2 PRO 616 HB2 PRO 616 11.431 2.509 4.199 912 HB3 PRO 616 HB3 PRO 616 10.045 3.606 4.159 913 HG2 PRO 616 HG2 PRO 616 12.246 3.402 6.158 914 HG3 PRO 616 HG3 PRO 616 11.402 4.841 5.559 915 HD2 PRO 616 HD2 PRO 616 10.874 3.486 7.964 916 HD3 PRO 616 HD3 PRO 616 9.831 4.697 7.194 917 H ASP 617 HN ASP 617 9.969 -0.214 4.227 918 HA ASP 617 HA ASP 617 11.600 -1.757 3.868 919 HB2 ASP 617 HB2 ASP 617 13.338 -0.075 4.422 920 HB3 ASP 617 HB3 ASP 617 13.181 -0.503 6.122 921 H ILE 618 HN ILE 618 9.542 -2.572 4.868 922 HA ILE 618 HA ILE 618 10.159 -4.160 7.247 923 HB ILE 618 HB ILE 618 7.664 -3.197 5.923 924 HG12 ILE 618 HG12 ILE 618 8.587 -3.402 8.800 925 HG13 ILE 618 HG13 ILE 618 8.575 -1.954 7.799 926 HG21 ILE 618 HG21 ILE 618 6.322 -4.806 7.283 927 HG22 ILE 618 HG22 ILE 618 7.270 -5.591 6.019 928 HG23 ILE 618 HG23 ILE 618 7.814 -5.652 7.696 929 HD11 ILE 618 HD11 ILE 618 6.172 -3.488 8.754 930 HD12 ILE 618 HD12 ILE 618 6.727 -1.920 9.341 931 HD13 ILE 618 HD13 ILE 618 6.123 -2.080 7.692 932 H MET 619 HN MET 619 10.956 -6.107 6.830 933 HA MET 619 HA MET 619 11.068 -7.034 4.123 934 HB2 MET 619 HB2 MET 619 12.149 -8.269 6.651 935 HB3 MET 619 HB3 MET 619 12.520 -8.810 5.023 936 HG2 MET 619 HG2 MET 619 13.101 -6.010 5.907 937 HG3 MET 619 HG3 MET 619 14.214 -7.330 6.241 938 HE1 MET 619 HE1 MET 619 13.310 -5.348 2.223 939 HE2 MET 619 HE2 MET 619 12.143 -6.587 2.683 940 HE3 MET 619 HE3 MET 619 12.403 -5.193 3.730 941 H ALA 620 HN ALA 620 9.895 -8.475 3.141 942 HA ALA 620 HA ALA 620 8.610 -10.607 4.709 943 HB1 ALA 620 HB1 ALA 620 6.734 -10.609 3.119 944 HB2 ALA 620 HB2 ALA 620 6.860 -9.063 3.957 945 HB3 ALA 620 HB3 ALA 620 7.429 -9.214 2.295 946 H THR 621 HN THR 621 8.249 -12.591 3.300 947 HA THR 621 HA THR 621 10.751 -13.134 2.026 948 HB THR 621 HB THR 621 9.404 -14.800 3.394 949 HG1 THR 621 HG1 THR 621 11.008 -15.809 2.393 950 HG21 THR 621 HG21 THR 621 7.232 -14.472 2.339 951 HG22 THR 621 HG22 THR 621 7.755 -16.148 2.164 952 HG23 THR 621 HG23 THR 621 7.878 -15.040 0.798 953 H ASN 622 HN ASN 622 7.713 -12.000 0.853 954 HA ASN 622 HA ASN 622 8.543 -12.703 -1.885 955 HB2 ASN 622 HB2 ASN 622 6.257 -12.812 -2.574 956 HB3 ASN 622 HB3 ASN 622 6.435 -13.813 -1.139 957 HD21 ASN 622 HD21 ASN 622 4.070 -12.613 -2.290 958 HD22 ASN 622 HD22 ASN 622 3.384 -11.605 -1.065 959 H GLY 623 HN GLY 623 8.933 -10.226 -0.054 960 HA2 GLY 623 HA2 GLY 623 9.323 -8.314 -1.897 961 HA3 GLY 623 HA3 GLY 623 7.597 -8.177 -1.603 962 H VAL 624 HN VAL 624 7.929 -6.069 -0.846 963 HA VAL 624 HA VAL 624 8.963 -5.964 1.903 964 HB VAL 624 HB VAL 624 10.556 -4.937 0.194 965 HG11 VAL 624 HG11 VAL 624 10.024 -2.679 -0.579 966 HG12 VAL 624 HG12 VAL 624 8.902 -3.877 -1.229 967 HG13 VAL 624 HG13 VAL 624 8.403 -2.838 0.106 968 HG21 VAL 624 HG21 VAL 624 11.077 -3.012 1.612 969 HG22 VAL 624 HG22 VAL 624 9.503 -3.162 2.392 970 HG23 VAL 624 HG23 VAL 624 10.703 -4.442 2.575 971 H VAL 625 HN VAL 625 8.030 -4.287 3.188 972 HA VAL 625 HA VAL 625 5.430 -3.317 2.198 973 HB VAL 625 HB VAL 625 6.029 -4.184 5.041 974 HG11 VAL 625 HG11 VAL 625 4.344 -2.412 4.857 975 HG12 VAL 625 HG12 VAL 625 3.419 -3.415 3.740 976 HG13 VAL 625 HG13 VAL 625 3.642 -3.931 5.412 977 HG21 VAL 625 HG21 VAL 625 4.398 -5.605 2.939 978 HG22 VAL 625 HG22 VAL 625 5.978 -6.112 3.536 979 HG23 VAL 625 HG23 VAL 625 4.588 -6.104 4.619 980 H HIS 626 HN HIS 626 5.120 -1.178 2.412 981 HA HIS 626 HA HIS 626 6.866 0.285 4.273 982 HB2 HIS 626 HB2 HIS 626 5.743 1.163 1.605 983 HB3 HIS 626 HB3 HIS 626 6.502 2.256 2.746 984 HD2 HIS 626 HD2 HIS 626 7.414 0.024 -0.142 985 HE1 HIS 626 HE1 HIS 626 11.012 0.948 1.880 986 HE2 HIS 626 HE2 HIS 626 9.997 0.212 -0.322 987 H VAL 627 HN VAL 627 5.778 0.946 5.972 988 HA VAL 627 HA VAL 627 2.933 0.987 6.108 989 HB VAL 627 HB VAL 627 4.891 2.279 8.017 990 HG11 VAL 627 HG11 VAL 627 2.556 2.968 8.312 991 HG12 VAL 627 HG12 VAL 627 2.084 1.277 8.475 992 HG13 VAL 627 HG13 VAL 627 3.143 2.019 9.677 993 HG21 VAL 627 HG21 VAL 627 3.822 -0.538 8.007 994 HG22 VAL 627 HG22 VAL 627 5.487 -0.048 7.697 995 HG23 VAL 627 HG23 VAL 627 4.781 0.191 9.296 996 H ILE 628 HN ILE 628 1.585 2.577 5.439 997 HA ILE 628 HA ILE 628 2.670 5.315 5.345 998 HB ILE 628 HB ILE 628 0.787 5.747 3.658 999 HG12 ILE 628 HG12 ILE 628 1.048 2.755 3.316 1000 HG13 ILE 628 HG13 ILE 628 -0.347 3.564 4.019 1001 HG21 ILE 628 HG21 ILE 628 2.225 5.037 1.785 1002 HG22 ILE 628 HG22 ILE 628 3.110 5.852 3.078 1003 HG23 ILE 628 HG23 ILE 628 3.195 4.097 2.923 1004 HD11 ILE 628 HD11 ILE 628 0.643 3.816 1.192 1005 HD12 ILE 628 HD12 ILE 628 -0.811 2.982 1.742 1006 HD13 ILE 628 HD13 ILE 628 -0.696 4.738 1.880 1007 H THR 629 HN THR 629 1.467 6.972 6.109 1008 HA THR 629 HA THR 629 -0.642 6.179 7.977 1009 HB THR 629 HB THR 629 1.179 7.491 8.920 1010 HG1 THR 629 HG1 THR 629 -1.414 8.527 8.793 1011 HG21 THR 629 HG21 THR 629 0.379 9.658 6.978 1012 HG22 THR 629 HG22 THR 629 1.831 8.664 6.860 1013 HG23 THR 629 HG23 THR 629 1.631 9.771 8.220 1014 H ASN 630 HN ASN 630 -0.601 6.922 4.888 1015 HA ASN 630 HA ASN 630 -3.175 8.319 4.972 1016 HB2 ASN 630 HB2 ASN 630 -0.781 9.050 3.291 1017 HB3 ASN 630 HB3 ASN 630 -2.412 9.518 2.840 1018 HD21 ASN 630 HD21 ASN 630 -3.476 11.083 4.004 1019 HD22 ASN 630 HD22 ASN 630 -2.670 12.114 5.140 1020 H VAL 631 HN VAL 631 -4.345 8.084 2.896 1021 HA VAL 631 HA VAL 631 -3.892 5.473 1.716 1022 HB VAL 631 HB VAL 631 -6.252 7.109 0.953 1023 HG11 VAL 631 HG11 VAL 631 -7.328 4.931 1.107 1024 HG12 VAL 631 HG12 VAL 631 -5.877 4.871 0.106 1025 HG13 VAL 631 HG13 VAL 631 -5.835 4.255 1.757 1026 HG21 VAL 631 HG21 VAL 631 -6.034 5.824 3.674 1027 HG22 VAL 631 HG22 VAL 631 -6.097 7.559 3.367 1028 HG23 VAL 631 HG23 VAL 631 -7.485 6.542 2.979 1029 H LEU 632 HN LEU 632 -3.201 5.259 -0.357 1030 HA LEU 632 HA LEU 632 -2.290 7.624 -1.706 1031 HB2 LEU 632 HB2 LEU 632 -2.184 4.712 -2.479 1032 HB3 LEU 632 HB3 LEU 632 -1.438 6.007 -3.401 1033 HG LEU 632 HG LEU 632 -0.747 5.293 -0.546 1034 HD11 LEU 632 HD11 LEU 632 -0.044 3.563 -2.117 1035 HD12 LEU 632 HD12 LEU 632 0.786 4.781 -3.089 1036 HD13 LEU 632 HD13 LEU 632 1.334 4.437 -1.446 1037 HD21 LEU 632 HD21 LEU 632 0.521 7.241 -2.467 1038 HD22 LEU 632 HD22 LEU 632 -0.436 7.656 -1.045 1039 HD23 LEU 632 HD23 LEU 632 1.116 6.841 -0.857 1040 H GLN 633 HN GLN 633 -3.495 8.812 -2.972 1041 HA GLN 633 HA GLN 633 -5.705 7.534 -4.441 1042 HB2 GLN 633 HB2 GLN 633 -6.389 9.102 -2.594 1043 HB3 GLN 633 HB3 GLN 633 -5.600 10.399 -3.479 1044 HG2 GLN 633 HG2 GLN 633 -7.773 10.661 -4.131 1045 HG3 GLN 633 HG3 GLN 633 -7.140 9.652 -5.427 1046 HE21 GLN 633 HE21 GLN 633 -7.113 7.282 -3.630 1047 HE22 GLN 633 HE22 GLN 633 -8.763 6.776 -3.524 1048 HA PRO 634 HA PRO 634 -3.255 8.819 -7.999 1049 HB2 PRO 634 HB2 PRO 634 -5.792 8.105 -9.361 1050 HB3 PRO 634 HB3 PRO 634 -4.146 7.561 -9.697 1051 HG2 PRO 634 HG2 PRO 634 -5.912 5.944 -8.526 1052 HG3 PRO 634 HG3 PRO 634 -4.206 5.940 -8.033 1053 HD2 PRO 634 HD2 PRO 634 -6.576 7.170 -6.682 1054 HD3 PRO 634 HD3 PRO 634 -5.174 6.346 -5.968 Start of MODEL 10 1 H1 ALA 500 H1 ALA 500 5.868 -10.883 13.417 2 H2 ALA 500 H2 ALA 500 6.296 -12.520 13.261 3 H3 ALA 500 H3 ALA 500 6.640 -11.430 12.009 4 HA ALA 500 HA ALA 500 8.175 -10.240 13.437 5 HB1 ALA 500 HB1 ALA 500 8.759 -11.147 15.622 6 HB2 ALA 500 HB2 ALA 500 7.046 -10.729 15.553 7 HB3 ALA 500 HB3 ALA 500 7.548 -12.415 15.429 8 H GLY 501 HN GLY 501 7.867 -12.563 11.483 9 HA2 GLY 501 HA2 GLY 501 10.675 -13.326 11.589 10 HA3 GLY 501 HA3 GLY 501 9.510 -14.644 11.668 11 H MET 502 HN MET 502 10.922 -15.064 9.633 12 HA MET 502 HA MET 502 10.406 -13.624 7.277 13 HB2 MET 502 HB2 MET 502 11.177 -15.658 6.093 14 HB3 MET 502 HB3 MET 502 12.263 -15.164 7.382 15 HG2 MET 502 HG2 MET 502 11.372 -16.901 8.827 16 HG3 MET 502 HG3 MET 502 10.226 -17.373 7.575 17 HE1 MET 502 HE1 MET 502 14.008 -17.159 8.586 18 HE2 MET 502 HE2 MET 502 14.804 -17.855 7.175 19 HE3 MET 502 HE3 MET 502 13.989 -16.295 7.047 20 H GLY 503 HN GLY 503 8.617 -13.411 6.157 21 HA2 GLY 503 HA2 GLY 503 6.831 -15.607 5.680 22 HA3 GLY 503 HA3 GLY 503 6.149 -14.381 6.742 23 H THR 504 HN THR 504 4.680 -14.554 4.663 24 HA THR 504 HA THR 504 5.696 -12.986 2.443 25 HB THR 504 HB THR 504 3.483 -13.361 1.419 26 HG1 THR 504 HG1 THR 504 2.845 -14.965 3.687 27 HG21 THR 504 HG21 THR 504 4.729 -15.857 2.580 28 HG22 THR 504 HG22 THR 504 5.201 -15.052 1.084 29 HG23 THR 504 HG23 THR 504 3.616 -15.813 1.212 30 H VAL 505 HN VAL 505 4.163 -11.217 1.590 31 HA VAL 505 HA VAL 505 3.919 -9.084 3.335 32 HB VAL 505 HB VAL 505 2.080 -9.571 0.987 33 HG11 VAL 505 HG11 VAL 505 2.030 -7.138 0.821 34 HG12 VAL 505 HG12 VAL 505 1.458 -7.683 2.397 35 HG13 VAL 505 HG13 VAL 505 3.082 -7.014 2.232 36 HG21 VAL 505 HG21 VAL 505 4.848 -8.376 0.981 37 HG22 VAL 505 HG22 VAL 505 4.384 -9.941 0.309 38 HG23 VAL 505 HG23 VAL 505 3.751 -8.455 -0.400 39 H MET 506 HN MET 506 1.601 -11.575 2.481 40 HA MET 506 HA MET 506 -0.664 -10.600 3.754 41 HB2 MET 506 HB2 MET 506 0.262 -13.298 2.926 42 HB3 MET 506 HB3 MET 506 -1.086 -13.213 4.058 43 HG2 MET 506 HG2 MET 506 -0.955 -11.836 1.390 44 HG3 MET 506 HG3 MET 506 -1.842 -13.322 1.743 45 HE1 MET 506 HE1 MET 506 -2.773 -10.300 0.603 46 HE2 MET 506 HE2 MET 506 -3.833 -11.708 0.527 47 HE3 MET 506 HE3 MET 506 -4.399 -10.219 1.283 48 H ASP 507 HN ASP 507 1.999 -12.519 5.121 49 HA ASP 507 HA ASP 507 0.756 -12.923 7.644 50 HB2 ASP 507 HB2 ASP 507 2.631 -14.324 6.896 51 HB3 ASP 507 HB3 ASP 507 3.708 -12.930 6.972 52 H VAL 508 HN VAL 508 2.967 -10.495 6.395 53 HA VAL 508 HA VAL 508 3.425 -9.092 8.779 54 HB VAL 508 HB VAL 508 3.300 -7.962 5.975 55 HG11 VAL 508 HG11 VAL 508 4.678 -6.922 8.446 56 HG12 VAL 508 HG12 VAL 508 4.806 -6.231 6.827 57 HG13 VAL 508 HG13 VAL 508 3.256 -6.221 7.673 58 HG21 VAL 508 HG21 VAL 508 5.714 -8.318 5.908 59 HG22 VAL 508 HG22 VAL 508 5.650 -9.085 7.496 60 HG23 VAL 508 HG23 VAL 508 4.849 -9.842 6.116 61 H LEU 509 HN LEU 509 0.878 -8.808 6.342 62 HA LEU 509 HA LEU 509 -0.390 -6.566 7.593 63 HB2 LEU 509 HB2 LEU 509 -1.581 -8.505 5.607 64 HB3 LEU 509 HB3 LEU 509 -2.142 -6.883 5.964 65 HG LEU 509 HG LEU 509 0.472 -7.579 4.621 66 HD11 LEU 509 HD11 LEU 509 -2.095 -6.440 3.524 67 HD12 LEU 509 HD12 LEU 509 -0.579 -6.572 2.631 68 HD13 LEU 509 HD13 LEU 509 -1.412 -8.028 3.175 69 HD21 LEU 509 HD21 LEU 509 0.652 -5.532 5.924 70 HD22 LEU 509 HD22 LEU 509 0.640 -5.169 4.200 71 HD23 LEU 509 HD23 LEU 509 -0.811 -4.902 5.165 72 H LYS 510 HN LYS 510 -0.457 -9.948 8.025 73 HA LYS 510 HA LYS 510 -3.077 -10.015 9.240 74 HB2 LYS 510 HB2 LYS 510 -1.068 -11.998 8.375 75 HB3 LYS 510 HB3 LYS 510 -2.021 -12.455 9.780 76 HG2 LYS 510 HG2 LYS 510 -3.324 -11.472 7.273 77 HG3 LYS 510 HG3 LYS 510 -2.840 -13.157 7.465 78 HD2 LYS 510 HD2 LYS 510 -4.581 -11.723 9.457 79 HD3 LYS 510 HD3 LYS 510 -5.237 -12.600 8.078 80 HE2 LYS 510 HE2 LYS 510 -5.323 -14.101 9.906 81 HE3 LYS 510 HE3 LYS 510 -3.966 -14.622 8.910 82 HZ1 LYS 510 HZ1 LYS 510 -3.796 -13.036 11.422 83 HZ2 LYS 510 HZ2 LYS 510 -2.471 -13.470 10.455 84 HZ3 LYS 510 HZ3 LYS 510 -3.373 -14.667 11.234 85 H GLY 511 HN GLY 511 0.268 -10.057 10.189 86 HA2 GLY 511 HA2 GLY 511 -0.211 -10.670 12.937 87 HA3 GLY 511 HA3 GLY 511 1.279 -10.024 12.260 88 H ASP 512 HN ASP 512 -0.815 -7.922 11.102 89 HA ASP 512 HA ASP 512 -0.557 -6.197 13.480 90 HB2 ASP 512 HB2 ASP 512 0.797 -5.392 11.627 91 HB3 ASP 512 HB3 ASP 512 -0.611 -5.400 10.564 92 H ASN 513 HN ASN 513 -2.203 -4.789 14.014 93 HA ASN 513 HA ASN 513 -4.830 -5.854 13.655 94 HB2 ASN 513 HB2 ASN 513 -4.125 -4.963 15.807 95 HB3 ASN 513 HB3 ASN 513 -3.805 -3.392 15.085 96 HD21 ASN 513 HD21 ASN 513 -6.599 -5.443 14.452 97 HD22 ASN 513 HD22 ASN 513 -7.770 -4.355 15.131 98 H ARG 514 HN ARG 514 -3.032 -3.194 12.291 99 HA ARG 514 HA ARG 514 -5.448 -1.825 11.407 100 HB2 ARG 514 HB2 ARG 514 -2.563 -1.033 10.930 101 HB3 ARG 514 HB3 ARG 514 -3.985 -0.017 10.745 102 HG2 ARG 514 HG2 ARG 514 -3.124 0.699 12.762 103 HG3 ARG 514 HG3 ARG 514 -4.343 -0.470 13.273 104 HD2 ARG 514 HD2 ARG 514 -2.400 -2.170 13.239 105 HD3 ARG 514 HD3 ARG 514 -1.355 -0.752 13.231 106 HE ARG 514 HE ARG 514 -3.193 -0.433 15.305 107 HH11 ARG 514 HH12 ARG 514 -0.540 -2.589 14.448 108 HH12 ARG 514 HH11 ARG 514 -0.166 -2.952 16.110 109 HH21 ARG 514 HH22 ARG 514 -2.695 -0.956 17.469 110 HH22 ARG 514 HH21 ARG 514 -1.393 -2.055 17.814 111 H PHE 515 HN PHE 515 -2.548 -3.331 10.045 112 HA PHE 515 HA PHE 515 -3.231 -3.057 7.332 113 HB2 PHE 515 HB2 PHE 515 -1.581 -5.205 8.678 114 HB3 PHE 515 HB3 PHE 515 -1.575 -4.812 6.971 115 HD1 PHE 515 HD2 PHE 515 -1.840 -1.694 7.905 116 HD2 PHE 515 HD1 PHE 515 0.887 -4.904 8.531 117 HE1 PHE 515 HE2 PHE 515 -0.034 -0.076 8.287 118 HE2 PHE 515 HE1 PHE 515 2.700 -3.284 8.914 119 HZ PHE 515 HZ PHE 515 2.241 -0.869 8.791 120 H SER 516 HN SER 516 -4.313 -5.215 9.818 121 HA SER 516 HA SER 516 -5.240 -7.378 8.308 122 HB2 SER 516 HB2 SER 516 -5.043 -7.354 10.788 123 HB3 SER 516 HB3 SER 516 -6.424 -6.266 10.868 124 HG SER 516 HG SER 516 -6.997 -8.470 11.179 125 H MET 517 HN MET 517 -6.730 -4.261 9.048 126 HA MET 517 HA MET 517 -9.297 -4.857 8.005 127 HB2 MET 517 HB2 MET 517 -7.863 -2.204 8.256 128 HB3 MET 517 HB3 MET 517 -9.560 -2.383 7.836 129 HG2 MET 517 HG2 MET 517 -10.029 -3.368 9.983 130 HG3 MET 517 HG3 MET 517 -8.316 -3.331 10.404 131 HE1 MET 517 HE1 MET 517 -6.949 -0.990 10.833 132 HE2 MET 517 HE2 MET 517 -7.411 -0.639 9.166 133 HE3 MET 517 HE3 MET 517 -7.674 0.564 10.427 134 H LEU 518 HN LEU 518 -6.320 -3.674 6.575 135 HA LEU 518 HA LEU 518 -7.355 -3.233 3.982 136 HB2 LEU 518 HB2 LEU 518 -5.207 -2.317 4.635 137 HB3 LEU 518 HB3 LEU 518 -4.567 -3.925 4.913 138 HG LEU 518 HG LEU 518 -4.716 -4.407 2.507 139 HD11 LEU 518 HD11 LEU 518 -5.708 -1.570 2.311 140 HD12 LEU 518 HD12 LEU 518 -5.181 -2.548 0.940 141 HD13 LEU 518 HD13 LEU 518 -6.587 -3.042 1.888 142 HD21 LEU 518 HD21 LEU 518 -3.242 -1.850 3.134 143 HD22 LEU 518 HD22 LEU 518 -2.649 -3.484 3.425 144 HD23 LEU 518 HD23 LEU 518 -2.915 -2.924 1.773 145 H VAL 519 HN VAL 519 -5.929 -6.072 5.554 146 HA VAL 519 HA VAL 519 -5.939 -7.852 3.414 147 HB VAL 519 HB VAL 519 -6.667 -8.502 6.286 148 HG11 VAL 519 HG11 VAL 519 -5.628 -10.280 4.079 149 HG12 VAL 519 HG12 VAL 519 -5.907 -10.765 5.752 150 HG13 VAL 519 HG13 VAL 519 -7.266 -10.288 4.733 151 HG21 VAL 519 HG21 VAL 519 -4.326 -9.038 6.611 152 HG22 VAL 519 HG22 VAL 519 -3.971 -8.595 4.938 153 HG23 VAL 519 HG23 VAL 519 -4.496 -7.362 6.085 154 H ALA 520 HN ALA 520 -8.541 -6.739 5.477 155 HA ALA 520 HA ALA 520 -10.524 -8.577 4.643 156 HB1 ALA 520 HB1 ALA 520 -12.117 -6.907 5.598 157 HB2 ALA 520 HB2 ALA 520 -10.807 -7.356 6.691 158 HB3 ALA 520 HB3 ALA 520 -10.753 -5.814 5.842 159 H ALA 521 HN ALA 521 -9.585 -5.370 3.491 160 HA ALA 521 HA ALA 521 -11.589 -5.184 1.487 161 HB1 ALA 521 HB1 ALA 521 -10.286 -3.335 0.611 162 HB2 ALA 521 HB2 ALA 521 -10.361 -3.232 2.371 163 HB3 ALA 521 HB3 ALA 521 -8.895 -3.820 1.582 164 H ILE 522 HN ILE 522 -8.207 -6.238 1.475 165 HA ILE 522 HA ILE 522 -7.948 -6.858 -1.234 166 HB ILE 522 HB ILE 522 -6.672 -8.211 1.151 167 HG12 ILE 522 HG12 ILE 522 -5.621 -6.082 -0.722 168 HG13 ILE 522 HG13 ILE 522 -6.241 -5.778 0.897 169 HG21 ILE 522 HG21 ILE 522 -5.897 -8.327 -1.763 170 HG22 ILE 522 HG22 ILE 522 -4.964 -8.997 -0.425 171 HG23 ILE 522 HG23 ILE 522 -6.555 -9.658 -0.813 172 HD11 ILE 522 HD11 ILE 522 -3.809 -5.814 0.858 173 HD12 ILE 522 HD12 ILE 522 -4.446 -7.133 1.842 174 HD13 ILE 522 HD13 ILE 522 -3.835 -7.457 0.220 175 H GLN 523 HN GLN 523 -9.199 -8.844 1.432 176 HA GLN 523 HA GLN 523 -9.600 -11.207 -0.031 177 HB2 GLN 523 HB2 GLN 523 -10.755 -10.083 2.505 178 HB3 GLN 523 HB3 GLN 523 -11.303 -11.613 1.857 179 HG2 GLN 523 HG2 GLN 523 -8.412 -11.068 2.395 180 HG3 GLN 523 HG3 GLN 523 -9.496 -11.676 3.640 181 HE21 GLN 523 HE21 GLN 523 -9.825 -12.614 0.286 182 HE22 GLN 523 HE22 GLN 523 -9.295 -14.243 0.490 183 H SER 524 HN SER 524 -11.408 -8.269 0.170 184 HA SER 524 HA SER 524 -13.818 -9.382 -0.924 185 HB2 SER 524 HB2 SER 524 -13.846 -7.385 0.547 186 HB3 SER 524 HB3 SER 524 -12.970 -6.481 -0.686 187 HG SER 524 HG SER 524 -14.732 -6.626 -2.027 188 H ALA 525 HN ALA 525 -11.024 -7.592 -2.171 189 HA ALA 525 HA ALA 525 -12.177 -7.378 -4.811 190 HB1 ALA 525 HB1 ALA 525 -10.127 -6.246 -5.418 191 HB2 ALA 525 HB2 ALA 525 -10.746 -5.607 -3.893 192 HB3 ALA 525 HB3 ALA 525 -9.386 -6.729 -3.892 193 H GLY 526 HN GLY 526 -9.898 -9.497 -3.186 194 HA2 GLY 526 HA2 GLY 526 -9.556 -11.728 -3.910 195 HA3 GLY 526 HA3 GLY 526 -10.026 -11.249 -5.532 196 H LEU 527 HN LEU 527 -7.722 -9.330 -3.777 197 HA LEU 527 HA LEU 527 -5.658 -10.067 -5.711 198 HB2 LEU 527 HB2 LEU 527 -5.978 -7.826 -3.739 199 HB3 LEU 527 HB3 LEU 527 -4.396 -8.199 -4.391 200 HG LEU 527 HG LEU 527 -5.370 -6.372 -5.626 201 HD11 LEU 527 HD11 LEU 527 -3.983 -7.878 -6.893 202 HD12 LEU 527 HD12 LEU 527 -5.358 -8.932 -7.214 203 HD13 LEU 527 HD13 LEU 527 -5.309 -7.310 -7.906 204 HD21 LEU 527 HD21 LEU 527 -7.718 -6.771 -5.206 205 HD22 LEU 527 HD22 LEU 527 -7.427 -6.655 -6.943 206 HD23 LEU 527 HD23 LEU 527 -7.673 -8.234 -6.190 207 H THR 528 HN THR 528 -6.686 -11.452 -3.085 208 HA THR 528 HA THR 528 -4.627 -11.604 -1.226 209 HB THR 528 HB THR 528 -6.488 -13.864 -1.975 210 HG1 THR 528 HG1 THR 528 -7.537 -12.574 0.016 211 HG21 THR 528 HG21 THR 528 -4.744 -14.462 -0.366 212 HG22 THR 528 HG22 THR 528 -6.330 -14.437 0.404 213 HG23 THR 528 HG23 THR 528 -5.208 -13.101 0.656 214 H GLU 529 HN GLU 529 -5.223 -13.544 -4.134 215 HA GLU 529 HA GLU 529 -3.186 -15.441 -3.686 216 HB2 GLU 529 HB2 GLU 529 -4.404 -14.590 -6.320 217 HB3 GLU 529 HB3 GLU 529 -3.518 -16.079 -6.013 218 HG2 GLU 529 HG2 GLU 529 -5.247 -16.773 -4.423 219 HG3 GLU 529 HG3 GLU 529 -6.141 -15.291 -4.764 220 H THR 530 HN THR 530 -3.189 -12.286 -5.164 221 HA THR 530 HA THR 530 -0.783 -12.450 -6.592 222 HB THR 530 HB THR 530 -1.918 -9.965 -5.302 223 HG1 THR 530 HG1 THR 530 -3.091 -9.799 -7.332 224 HG21 THR 530 HG21 THR 530 0.289 -9.700 -6.332 225 HG22 THR 530 HG22 THR 530 -0.949 -8.838 -7.245 226 HG23 THR 530 HG23 THR 530 -0.329 -10.378 -7.840 227 H LEU 531 HN LEU 531 -1.468 -11.351 -3.263 228 HA LEU 531 HA LEU 531 1.369 -10.876 -2.784 229 HB2 LEU 531 HB2 LEU 531 -0.936 -10.618 -0.862 230 HB3 LEU 531 HB3 LEU 531 0.664 -9.918 -0.698 231 HG LEU 531 HG LEU 531 -1.398 -9.159 -2.759 232 HD11 LEU 531 HD11 LEU 531 -1.931 -8.388 -0.520 233 HD12 LEU 531 HD12 LEU 531 -0.325 -7.674 -0.371 234 HD13 LEU 531 HD13 LEU 531 -1.465 -7.043 -1.561 235 HD21 LEU 531 HD21 LEU 531 1.329 -7.984 -2.246 236 HD22 LEU 531 HD22 LEU 531 0.911 -9.037 -3.600 237 HD23 LEU 531 HD23 LEU 531 0.158 -7.448 -3.452 238 H ASN 532 HN ASN 532 -0.271 -13.559 -2.964 239 HA ASN 532 HA ASN 532 0.481 -14.747 -0.402 240 HB2 ASN 532 HB2 ASN 532 -1.794 -15.141 -1.352 241 HB3 ASN 532 HB3 ASN 532 -1.047 -15.982 -2.704 242 HD21 ASN 532 HD21 ASN 532 -0.003 -16.195 0.651 243 HD22 ASN 532 HD22 ASN 532 -0.432 -17.854 0.867 244 H ARG 533 HN ARG 533 1.478 -14.656 -3.699 245 HA ARG 533 HA ARG 533 3.098 -17.071 -3.457 246 HB2 ARG 533 HB2 ARG 533 2.807 -15.186 -5.798 247 HB3 ARG 533 HB3 ARG 533 3.576 -16.764 -5.823 248 HG2 ARG 533 HG2 ARG 533 1.473 -17.858 -5.441 249 HG3 ARG 533 HG3 ARG 533 0.662 -16.304 -5.227 250 HD2 ARG 533 HD2 ARG 533 1.939 -17.369 -7.740 251 HD3 ARG 533 HD3 ARG 533 0.219 -17.116 -7.448 252 HE ARG 533 HE ARG 533 1.275 -14.651 -7.076 253 HH11 ARG 533 HH12 ARG 533 1.496 -16.978 -9.687 254 HH12 ARG 533 HH11 ARG 533 1.744 -15.762 -10.906 255 HH21 ARG 533 HH22 ARG 533 1.620 -13.060 -8.695 256 HH22 ARG 533 HH21 ARG 533 1.806 -13.562 -10.348 257 H GLU 534 HN GLU 534 5.380 -17.018 -3.958 258 HA GLU 534 HA GLU 534 6.718 -14.797 -2.730 259 HB2 GLU 534 HB2 GLU 534 8.749 -16.122 -3.044 260 HB3 GLU 534 HB3 GLU 534 7.463 -17.095 -2.343 261 HG2 GLU 534 HG2 GLU 534 6.986 -18.006 -4.591 262 HG3 GLU 534 HG3 GLU 534 8.363 -17.101 -5.215 263 H GLY 535 HN GLY 535 8.641 -13.794 -3.771 264 HA2 GLY 535 HA2 GLY 535 9.541 -13.409 -6.166 265 HA3 GLY 535 HA3 GLY 535 7.873 -12.926 -6.470 266 H VAL 536 HN VAL 536 8.151 -10.755 -6.812 267 HA VAL 536 HA VAL 536 9.069 -9.269 -4.449 268 HB VAL 536 HB VAL 536 9.931 -7.493 -5.928 269 HG11 VAL 536 HG11 VAL 536 11.506 -9.088 -5.104 270 HG12 VAL 536 HG12 VAL 536 11.045 -10.264 -6.339 271 HG13 VAL 536 HG13 VAL 536 11.896 -8.783 -6.796 272 HG21 VAL 536 HG21 VAL 536 10.220 -7.879 -8.313 273 HG22 VAL 536 HG22 VAL 536 9.417 -9.443 -8.179 274 HG23 VAL 536 HG23 VAL 536 8.510 -7.956 -7.892 275 H TYR 537 HN TYR 537 7.660 -7.901 -3.630 276 HA TYR 537 HA TYR 537 5.697 -6.531 -5.256 277 HB2 TYR 537 HB2 TYR 537 4.901 -8.482 -3.083 278 HB3 TYR 537 HB3 TYR 537 3.834 -7.211 -3.662 279 HD1 TYR 537 HD2 TYR 537 3.297 -7.209 -6.194 280 HD2 TYR 537 HD1 TYR 537 4.926 -10.564 -4.136 281 HE1 TYR 537 HE2 TYR 537 2.512 -8.685 -7.996 282 HE2 TYR 537 HE1 TYR 537 4.144 -12.045 -5.934 283 HH TYR 537 HH TYR 537 3.113 -10.912 -8.930 284 H THR 538 HN THR 538 5.380 -4.555 -4.508 285 HA THR 538 HA THR 538 6.353 -3.920 -1.799 286 HB THR 538 HB THR 538 6.229 -2.066 -4.190 287 HG1 THR 538 HG1 THR 538 8.061 -2.969 -4.747 288 HG21 THR 538 HG21 THR 538 6.118 -0.948 -1.993 289 HG22 THR 538 HG22 THR 538 7.622 -0.597 -2.843 290 HG23 THR 538 HG23 THR 538 7.611 -1.763 -1.521 291 H VAL 539 HN VAL 539 4.630 -3.720 -0.503 292 HA VAL 539 HA VAL 539 2.189 -2.497 -1.619 293 HB VAL 539 HB VAL 539 2.374 -4.401 0.721 294 HG11 VAL 539 HG11 VAL 539 0.460 -2.888 0.832 295 HG12 VAL 539 HG12 VAL 539 -0.012 -3.354 -0.802 296 HG13 VAL 539 HG13 VAL 539 -0.061 -4.541 0.503 297 HG21 VAL 539 HG21 VAL 539 1.513 -4.920 -2.125 298 HG22 VAL 539 HG22 VAL 539 2.980 -5.525 -1.355 299 HG23 VAL 539 HG23 VAL 539 1.400 -6.069 -0.793 300 H PHE 540 HN PHE 540 1.479 -0.667 -0.782 301 HA PHE 540 HA PHE 540 2.632 0.327 1.716 302 HB2 PHE 540 HB2 PHE 540 0.903 1.692 -0.368 303 HB3 PHE 540 HB3 PHE 540 1.556 2.471 1.065 304 HD1 PHE 540 HD2 PHE 540 2.417 0.962 -2.186 305 HD2 PHE 540 HD1 PHE 540 3.803 3.247 1.128 306 HE1 PHE 540 HE2 PHE 540 4.434 1.570 -3.456 307 HE2 PHE 540 HE1 PHE 540 5.821 3.865 -0.147 308 HZ PHE 540 HZ PHE 540 6.138 3.020 -2.437 309 H ALA 541 HN ALA 541 1.527 -0.239 3.506 310 HA ALA 541 HA ALA 541 -1.357 -0.754 3.265 311 HB1 ALA 541 HB1 ALA 541 -1.166 -2.022 5.353 312 HB2 ALA 541 HB2 ALA 541 -0.032 -2.618 4.133 313 HB3 ALA 541 HB3 ALA 541 0.547 -1.596 5.449 314 HA PRO 542 HA PRO 542 -1.907 3.088 5.496 315 HB2 PRO 542 HB2 PRO 542 -4.755 2.543 5.209 316 HB3 PRO 542 HB3 PRO 542 -3.792 3.832 4.489 317 HG2 PRO 542 HG2 PRO 542 -4.840 1.809 3.031 318 HG3 PRO 542 HG3 PRO 542 -3.317 2.611 2.606 319 HD2 PRO 542 HD2 PRO 542 -3.756 -0.002 4.008 320 HD3 PRO 542 HD3 PRO 542 -2.593 0.409 2.726 321 H THR 543 HN THR 543 -2.300 3.552 7.591 322 HA THR 543 HA THR 543 -2.852 1.355 9.370 323 HB THR 543 HB THR 543 -2.430 3.023 11.167 324 HG1 THR 543 HG1 THR 543 -1.854 5.124 10.605 325 HG21 THR 543 HG21 THR 543 -0.579 1.750 10.230 326 HG22 THR 543 HG22 THR 543 -0.062 3.383 10.648 327 HG23 THR 543 HG23 THR 543 -0.370 2.958 8.963 328 H ASN 544 HN ASN 544 -4.191 2.225 11.454 329 HA ASN 544 HA ASN 544 -6.904 2.172 10.718 330 HB2 ASN 544 HB2 ASN 544 -6.110 1.396 12.901 331 HB3 ASN 544 HB3 ASN 544 -5.607 3.027 13.321 332 HD21 ASN 544 HD21 ASN 544 -8.608 2.110 11.699 333 HD22 ASN 544 HD22 ASN 544 -9.654 2.627 12.975 334 H GLU 545 HN GLU 545 -4.681 4.745 11.368 335 HA GLU 545 HA GLU 545 -6.412 6.899 11.750 336 HB2 GLU 545 HB2 GLU 545 -3.712 6.924 10.393 337 HB3 GLU 545 HB3 GLU 545 -4.501 8.280 11.193 338 HG2 GLU 545 HG2 GLU 545 -4.059 7.476 13.291 339 HG3 GLU 545 HG3 GLU 545 -3.964 5.799 12.747 340 H ALA 546 HN ALA 546 -5.110 5.453 8.818 341 HA ALA 546 HA ALA 546 -5.911 7.405 6.983 342 HB1 ALA 546 HB1 ALA 546 -5.659 5.640 5.294 343 HB2 ALA 546 HB2 ALA 546 -4.292 5.704 6.413 344 HB3 ALA 546 HB3 ALA 546 -5.523 4.452 6.591 345 H PHE 547 HN PHE 547 -7.492 4.407 7.955 346 HA PHE 547 HA PHE 547 -9.736 4.752 6.271 347 HB2 PHE 547 HB2 PHE 547 -9.292 2.988 8.687 348 HB3 PHE 547 HB3 PHE 547 -10.693 2.898 7.636 349 HD1 PHE 547 HD2 PHE 547 -10.356 2.319 5.205 350 HD2 PHE 547 HD1 PHE 547 -7.295 1.888 8.135 351 HE1 PHE 547 HE2 PHE 547 -9.140 0.790 3.708 352 HE2 PHE 547 HE1 PHE 547 -6.076 0.365 6.642 353 HZ PHE 547 HZ PHE 547 -6.998 -0.188 4.424 354 H ARG 548 HN ARG 548 -8.892 5.978 9.372 355 HA ARG 548 HA ARG 548 -11.603 6.643 10.153 356 HB2 ARG 548 HB2 ARG 548 -9.848 6.132 11.822 357 HB3 ARG 548 HB3 ARG 548 -8.953 7.547 11.302 358 HG2 ARG 548 HG2 ARG 548 -10.140 8.006 13.353 359 HG3 ARG 548 HG3 ARG 548 -10.796 8.980 12.039 360 HD2 ARG 548 HD2 ARG 548 -12.663 7.461 11.799 361 HD3 ARG 548 HD3 ARG 548 -11.986 6.392 13.024 362 HE ARG 548 HE ARG 548 -12.308 8.923 14.169 363 HH11 ARG 548 HH12 ARG 548 -14.282 6.318 12.927 364 HH12 ARG 548 HH11 ARG 548 -15.647 6.682 13.939 365 HH21 ARG 548 HH22 ARG 548 -14.084 9.387 15.552 366 HH22 ARG 548 HH21 ARG 548 -15.521 8.413 15.439 367 H ALA 549 HN ALA 549 -8.850 8.160 8.655 368 HA ALA 549 HA ALA 549 -9.877 10.830 8.733 369 HB1 ALA 549 HB1 ALA 549 -7.663 9.657 7.052 370 HB2 ALA 549 HB2 ALA 549 -7.999 11.375 7.270 371 HB3 ALA 549 HB3 ALA 549 -7.482 10.396 8.642 372 H LEU 550 HN LEU 550 -10.326 8.125 6.652 373 HA LEU 550 HA LEU 550 -11.098 9.546 4.316 374 HB2 LEU 550 HB2 LEU 550 -11.624 6.736 5.259 375 HB3 LEU 550 HB3 LEU 550 -12.233 7.346 3.734 376 HG LEU 550 HG LEU 550 -9.315 7.197 4.483 377 HD11 LEU 550 HD11 LEU 550 -10.279 4.980 4.214 378 HD12 LEU 550 HD12 LEU 550 -10.967 5.455 2.659 379 HD13 LEU 550 HD13 LEU 550 -9.216 5.368 2.861 380 HD21 LEU 550 HD21 LEU 550 -9.807 9.004 2.928 381 HD22 LEU 550 HD22 LEU 550 -8.946 7.698 2.112 382 HD23 LEU 550 HD23 LEU 550 -10.687 7.886 1.885 383 HA PRO 551 HA PRO 551 -15.079 10.859 5.760 384 HB2 PRO 551 HB2 PRO 551 -15.626 11.789 3.072 385 HB3 PRO 551 HB3 PRO 551 -15.233 12.748 4.501 386 HG2 PRO 551 HG2 PRO 551 -13.579 12.498 2.340 387 HG3 PRO 551 HG3 PRO 551 -13.002 12.825 3.984 388 HD2 PRO 551 HD2 PRO 551 -13.083 10.233 2.483 389 HD3 PRO 551 HD3 PRO 551 -11.804 10.887 3.533 390 HA PRO 552 HA PRO 552 -17.843 7.580 4.672 391 HB2 PRO 552 HB2 PRO 552 -19.953 9.679 4.708 392 HB3 PRO 552 HB3 PRO 552 -19.875 8.142 5.580 393 HG2 PRO 552 HG2 PRO 552 -19.419 10.443 6.841 394 HG3 PRO 552 HG3 PRO 552 -18.471 8.993 7.219 395 HD2 PRO 552 HD2 PRO 552 -17.701 11.397 5.630 396 HD3 PRO 552 HD3 PRO 552 -16.720 10.399 6.722 397 H ARG 553 HN ARG 553 -18.148 10.650 2.984 398 HA ARG 553 HA ARG 553 -19.691 9.777 0.816 399 HB2 ARG 553 HB2 ARG 553 -17.721 12.044 1.082 400 HB3 ARG 553 HB3 ARG 553 -18.723 11.802 -0.345 401 HG2 ARG 553 HG2 ARG 553 -20.680 12.310 0.779 402 HG3 ARG 553 HG3 ARG 553 -19.979 11.961 2.359 403 HD2 ARG 553 HD2 ARG 553 -20.312 14.356 2.032 404 HD3 ARG 553 HD3 ARG 553 -18.605 13.953 2.221 405 HE ARG 553 HE ARG 553 -19.832 14.444 -0.420 406 HH11 ARG 553 HH12 ARG 553 -17.322 14.989 1.967 407 HH12 ARG 553 HH11 ARG 553 -16.372 16.008 0.927 408 HH21 ARG 553 HH22 ARG 553 -18.580 15.753 -1.813 409 HH22 ARG 553 HH21 ARG 553 -17.078 16.425 -1.241 410 H GLU 554 HN GLU 554 -16.168 9.900 1.246 411 HA GLU 554 HA GLU 554 -15.729 8.807 -1.395 412 HB2 GLU 554 HB2 GLU 554 -13.786 9.372 0.856 413 HB3 GLU 554 HB3 GLU 554 -13.330 8.838 -0.757 414 HG2 GLU 554 HG2 GLU 554 -14.488 10.892 -1.642 415 HG3 GLU 554 HG3 GLU 554 -14.598 11.444 0.029 416 H ARG 555 HN ARG 555 -15.668 7.703 1.941 417 HA ARG 555 HA ARG 555 -14.632 5.134 1.578 418 HB2 ARG 555 HB2 ARG 555 -16.653 6.239 3.513 419 HB3 ARG 555 HB3 ARG 555 -16.164 4.552 3.559 420 HG2 ARG 555 HG2 ARG 555 -13.855 5.220 3.941 421 HG3 ARG 555 HG3 ARG 555 -14.330 6.919 3.868 422 HD2 ARG 555 HD2 ARG 555 -14.087 6.003 6.183 423 HD3 ARG 555 HD3 ARG 555 -15.661 6.716 5.831 424 HE ARG 555 HE ARG 555 -16.320 4.272 5.373 425 HH11 ARG 555 HH12 ARG 555 -13.997 5.303 7.788 426 HH12 ARG 555 HH11 ARG 555 -14.310 3.964 8.843 427 HH21 ARG 555 HH22 ARG 555 -16.718 2.489 6.740 428 HH22 ARG 555 HH21 ARG 555 -15.875 2.368 8.257 429 H SER 556 HN SER 556 -17.945 6.324 1.202 430 HA SER 556 HA SER 556 -19.226 3.868 0.819 431 HB2 SER 556 HB2 SER 556 -20.382 6.023 1.250 432 HB3 SER 556 HB3 SER 556 -19.962 6.555 -0.377 433 HG SER 556 HG SER 556 -21.456 4.205 0.160 434 H ARG 557 HN ARG 557 -17.339 5.837 -1.354 435 HA ARG 557 HA ARG 557 -18.078 4.594 -3.791 436 HB2 ARG 557 HB2 ARG 557 -15.520 5.987 -2.971 437 HB3 ARG 557 HB3 ARG 557 -15.880 5.479 -4.614 438 HG2 ARG 557 HG2 ARG 557 -17.722 7.023 -4.736 439 HG3 ARG 557 HG3 ARG 557 -17.510 7.463 -3.037 440 HD2 ARG 557 HD2 ARG 557 -15.408 8.462 -3.466 441 HD3 ARG 557 HD3 ARG 557 -15.334 7.780 -5.087 442 HE ARG 557 HE ARG 557 -17.584 9.381 -5.026 443 HH11 ARG 557 HH12 ARG 557 -14.139 9.831 -4.541 444 HH12 ARG 557 HH11 ARG 557 -14.125 11.426 -5.230 445 HH21 ARG 557 HH22 ARG 557 -17.564 11.510 -5.911 446 HH22 ARG 557 HH21 ARG 557 -16.060 12.379 -5.983 447 H LEU 558 HN LEU 558 -15.158 4.218 -1.800 448 HA LEU 558 HA LEU 558 -14.149 2.076 -3.353 449 HB2 LEU 558 HB2 LEU 558 -12.748 3.655 -2.096 450 HB3 LEU 558 HB3 LEU 558 -13.371 3.010 -0.591 451 HG LEU 558 HG LEU 558 -12.351 0.823 -1.136 452 HD11 LEU 558 HD11 LEU 558 -12.363 1.009 -3.558 453 HD12 LEU 558 HD12 LEU 558 -11.179 2.312 -3.474 454 HD13 LEU 558 HD13 LEU 558 -10.735 0.685 -2.962 455 HD21 LEU 558 HD21 LEU 558 -11.168 2.448 0.256 456 HD22 LEU 558 HD22 LEU 558 -10.046 1.498 -0.719 457 HD23 LEU 558 HD23 LEU 558 -10.439 3.152 -1.186 458 H LEU 559 HN LEU 559 -15.598 2.173 -0.096 459 HA LEU 559 HA LEU 559 -15.146 -0.650 0.261 460 HB2 LEU 559 HB2 LEU 559 -16.664 1.294 1.997 461 HB3 LEU 559 HB3 LEU 559 -16.134 -0.312 2.458 462 HG LEU 559 HG LEU 559 -14.292 1.985 1.781 463 HD11 LEU 559 HD11 LEU 559 -13.803 2.042 4.160 464 HD12 LEU 559 HD12 LEU 559 -15.519 2.334 3.873 465 HD13 LEU 559 HD13 LEU 559 -14.977 0.757 4.447 466 HD21 LEU 559 HD21 LEU 559 -13.715 -0.764 2.882 467 HD22 LEU 559 HD22 LEU 559 -13.354 -0.213 1.247 468 HD23 LEU 559 HD23 LEU 559 -12.534 0.520 2.624 469 H GLY 560 HN GLY 560 -17.348 0.848 -1.555 470 HA2 GLY 560 HA2 GLY 560 -19.441 -1.122 -0.877 471 HA3 GLY 560 HA3 GLY 560 -19.821 0.509 -1.406 472 H ASP 561 HN ASP 561 -17.133 -0.535 -3.086 473 HA ASP 561 HA ASP 561 -18.756 -1.730 -5.218 474 HB2 ASP 561 HB2 ASP 561 -18.494 0.724 -5.627 475 HB3 ASP 561 HB3 ASP 561 -16.751 0.477 -5.716 476 H ALA 562 HN ALA 562 -17.838 -3.436 -6.162 477 HA ALA 562 HA ALA 562 -15.438 -4.487 -5.058 478 HB1 ALA 562 HB1 ALA 562 -15.815 -6.373 -6.564 479 HB2 ALA 562 HB2 ALA 562 -17.295 -5.920 -5.719 480 HB3 ALA 562 HB3 ALA 562 -17.064 -5.454 -7.403 481 H LYS 563 HN LYS 563 -16.252 -2.959 -8.123 482 HA LYS 563 HA LYS 563 -13.837 -3.598 -9.444 483 HB2 LYS 563 HB2 LYS 563 -15.570 -3.035 -10.887 484 HB3 LYS 563 HB3 LYS 563 -16.060 -1.650 -9.924 485 HG2 LYS 563 HG2 LYS 563 -14.197 -0.367 -10.698 486 HG3 LYS 563 HG3 LYS 563 -13.503 -1.772 -11.508 487 HD2 LYS 563 HD2 LYS 563 -15.222 -1.801 -13.133 488 HD3 LYS 563 HD3 LYS 563 -16.229 -0.701 -12.192 489 HE2 LYS 563 HE2 LYS 563 -13.563 0.061 -13.368 490 HE3 LYS 563 HE3 LYS 563 -15.104 0.327 -14.184 491 HZ1 LYS 563 HZ1 LYS 563 -14.382 2.307 -12.999 492 HZ2 LYS 563 HZ2 LYS 563 -14.338 1.450 -11.530 493 HZ3 LYS 563 HZ3 LYS 563 -15.818 1.702 -12.327 494 H GLU 564 HN GLU 564 -14.919 -0.671 -7.730 495 HA GLU 564 HA GLU 564 -12.501 0.739 -8.161 496 HB2 GLU 564 HB2 GLU 564 -14.559 1.146 -5.987 497 HB3 GLU 564 HB3 GLU 564 -13.300 2.291 -6.434 498 HG2 GLU 564 HG2 GLU 564 -15.662 1.418 -8.063 499 HG3 GLU 564 HG3 GLU 564 -15.309 3.026 -7.431 500 H LEU 565 HN LEU 565 -13.612 -1.385 -5.569 501 HA LEU 565 HA LEU 565 -11.511 -1.060 -3.778 502 HB2 LEU 565 HB2 LEU 565 -13.472 -3.163 -4.374 503 HB3 LEU 565 HB3 LEU 565 -11.999 -3.734 -3.618 504 HG LEU 565 HG LEU 565 -13.809 -1.594 -2.501 505 HD11 LEU 565 HD11 LEU 565 -13.397 -4.449 -1.616 506 HD12 LEU 565 HD12 LEU 565 -14.434 -3.250 -0.845 507 HD13 LEU 565 HD13 LEU 565 -14.819 -3.835 -2.462 508 HD21 LEU 565 HD21 LEU 565 -11.451 -1.313 -1.897 509 HD22 LEU 565 HD22 LEU 565 -12.434 -1.775 -0.505 510 HD23 LEU 565 HD23 LEU 565 -11.412 -2.972 -1.301 511 H ALA 566 HN ALA 566 -11.807 -3.348 -6.467 512 HA ALA 566 HA ALA 566 -9.269 -4.509 -6.181 513 HB1 ALA 566 HB1 ALA 566 -11.074 -5.506 -7.511 514 HB2 ALA 566 HB2 ALA 566 -10.889 -4.225 -8.709 515 HB3 ALA 566 HB3 ALA 566 -9.575 -5.367 -8.428 516 H ASN 567 HN ASN 567 -10.357 -1.858 -8.280 517 HA ASN 567 HA ASN 567 -7.931 -1.441 -9.606 518 HB2 ASN 567 HB2 ASN 567 -10.028 -0.516 -10.423 519 HB3 ASN 567 HB3 ASN 567 -10.144 0.530 -9.012 520 HD21 ASN 567 HD21 ASN 567 -8.399 -0.093 -11.979 521 HD22 ASN 567 HD22 ASN 567 -7.700 1.484 -12.118 522 H ILE 568 HN ILE 568 -9.195 0.178 -6.681 523 HA ILE 568 HA ILE 568 -6.929 1.873 -6.404 524 HB ILE 568 HB ILE 568 -9.038 1.071 -4.395 525 HG12 ILE 568 HG12 ILE 568 -9.854 2.309 -6.364 526 HG13 ILE 568 HG13 ILE 568 -9.998 3.259 -4.893 527 HG21 ILE 568 HG21 ILE 568 -7.002 1.797 -3.244 528 HG22 ILE 568 HG22 ILE 568 -7.000 3.286 -4.190 529 HG23 ILE 568 HG23 ILE 568 -8.309 2.968 -3.051 530 HD11 ILE 568 HD11 ILE 568 -7.818 3.548 -6.947 531 HD12 ILE 568 HD12 ILE 568 -9.229 4.594 -6.788 532 HD13 ILE 568 HD13 ILE 568 -8.025 4.535 -5.501 533 H LEU 569 HN LEU 569 -7.727 -1.318 -5.100 534 HA LEU 569 HA LEU 569 -5.527 -1.454 -3.319 535 HB2 LEU 569 HB2 LEU 569 -7.114 -3.626 -4.676 536 HB3 LEU 569 HB3 LEU 569 -5.847 -3.947 -3.506 537 HG LEU 569 HG LEU 569 -8.413 -2.444 -2.989 538 HD11 LEU 569 HD11 LEU 569 -8.943 -4.318 -1.531 539 HD12 LEU 569 HD12 LEU 569 -8.705 -4.854 -3.195 540 HD13 LEU 569 HD13 LEU 569 -7.439 -5.115 -1.995 541 HD21 LEU 569 HD21 LEU 569 -6.152 -3.107 -1.104 542 HD22 LEU 569 HD22 LEU 569 -6.568 -1.500 -1.697 543 HD23 LEU 569 HD23 LEU 569 -7.692 -2.373 -0.653 544 H LYS 570 HN LYS 570 -5.897 -2.261 -6.738 545 HA LYS 570 HA LYS 570 -3.304 -3.387 -7.031 546 HB2 LYS 570 HB2 LYS 570 -5.126 -2.126 -9.088 547 HB3 LYS 570 HB3 LYS 570 -3.636 -2.978 -9.467 548 HG2 LYS 570 HG2 LYS 570 -4.588 -5.015 -8.425 549 HG3 LYS 570 HG3 LYS 570 -6.108 -4.145 -8.196 550 HD2 LYS 570 HD2 LYS 570 -6.329 -5.411 -10.204 551 HD3 LYS 570 HD3 LYS 570 -6.116 -3.723 -10.684 552 HE2 LYS 570 HE2 LYS 570 -3.717 -4.166 -11.064 553 HE3 LYS 570 HE3 LYS 570 -3.980 -5.861 -10.654 554 HZ1 LYS 570 HZ1 LYS 570 -5.564 -5.977 -12.537 555 HZ2 LYS 570 HZ2 LYS 570 -3.976 -5.629 -13.015 556 HZ3 LYS 570 HZ3 LYS 570 -5.132 -4.390 -12.969 557 H TYR 571 HN TYR 571 -4.273 -0.241 -6.437 558 HA TYR 571 HA TYR 571 -2.019 0.974 -7.822 559 HB2 TYR 571 HB2 TYR 571 -4.234 2.099 -7.839 560 HB3 TYR 571 HB3 TYR 571 -4.142 2.263 -6.088 561 HD1 TYR 571 HD2 TYR 571 -1.825 2.918 -8.939 562 HD2 TYR 571 HD1 TYR 571 -3.673 4.425 -5.420 563 HE1 TYR 571 HE2 TYR 571 -0.616 5.030 -9.224 564 HE2 TYR 571 HE1 TYR 571 -2.462 6.551 -5.686 565 HH TYR 571 HH TYR 571 -0.622 7.266 -8.563 566 H HIS 572 HN HIS 572 -2.844 -0.276 -4.747 567 HA HIS 572 HA HIS 572 -0.764 1.250 -3.378 568 HB2 HIS 572 HB2 HIS 572 -2.866 -0.694 -2.430 569 HB3 HIS 572 HB3 HIS 572 -1.550 -0.170 -1.384 570 HD1 HIS 572 HD1 HIS 572 -4.569 1.233 -3.209 571 HD2 HIS 572 HD2 HIS 572 -1.851 2.275 -0.238 572 HE1 HIS 572 HE1 HIS 572 -5.449 3.354 -2.152 573 H ILE 573 HN ILE 573 -1.016 -1.504 -5.190 574 HA ILE 573 HA ILE 573 1.298 -2.766 -3.882 575 HB ILE 573 HB ILE 573 -0.637 -4.020 -5.836 576 HG12 ILE 573 HG12 ILE 573 -0.460 -4.500 -2.855 577 HG13 ILE 573 HG13 ILE 573 -1.617 -3.390 -3.583 578 HG21 ILE 573 HG21 ILE 573 0.397 -6.129 -5.136 579 HG22 ILE 573 HG22 ILE 573 1.582 -5.036 -5.852 580 HG23 ILE 573 HG23 ILE 573 1.512 -5.238 -4.101 581 HD11 ILE 573 HD11 ILE 573 -2.615 -5.228 -4.821 582 HD12 ILE 573 HD12 ILE 573 -1.433 -6.341 -4.131 583 HD13 ILE 573 HD13 ILE 573 -2.615 -5.553 -3.088 584 H GLY 574 HN GLY 574 3.171 -2.490 -4.896 585 HA2 GLY 574 HA2 GLY 574 3.150 -2.293 -7.845 586 HA3 GLY 574 HA3 GLY 574 4.404 -1.608 -6.815 587 H ASP 575 HN ASP 575 4.682 -3.550 -9.013 588 HA ASP 575 HA ASP 575 5.414 -5.966 -7.507 589 HB2 ASP 575 HB2 ASP 575 5.506 -7.129 -9.648 590 HB3 ASP 575 HB3 ASP 575 3.957 -6.316 -9.459 591 H GLU 576 HN GLU 576 6.931 -3.401 -7.623 592 HA GLU 576 HA GLU 576 9.500 -4.648 -8.151 593 HB2 GLU 576 HB2 GLU 576 10.390 -2.534 -9.058 594 HB3 GLU 576 HB3 GLU 576 9.119 -3.197 -10.070 595 HG2 GLU 576 HG2 GLU 576 7.537 -1.602 -9.198 596 HG3 GLU 576 HG3 GLU 576 8.741 -0.977 -8.071 597 H ILE 577 HN ILE 577 10.814 -4.506 -6.482 598 HA ILE 577 HA ILE 577 9.802 -3.266 -4.100 599 HB ILE 577 HB ILE 577 12.388 -4.767 -4.541 600 HG12 ILE 577 HG12 ILE 577 9.745 -5.618 -3.338 601 HG13 ILE 577 HG13 ILE 577 10.385 -6.138 -4.894 602 HG21 ILE 577 HG21 ILE 577 12.508 -4.924 -2.108 603 HG22 ILE 577 HG22 ILE 577 12.538 -3.241 -2.635 604 HG23 ILE 577 HG23 ILE 577 11.058 -3.931 -1.966 605 HD11 ILE 577 HD11 ILE 577 11.610 -6.717 -2.208 606 HD12 ILE 577 HD12 ILE 577 10.677 -7.845 -3.191 607 HD13 ILE 577 HD13 ILE 577 12.234 -7.251 -3.769 608 H LEU 578 HN LEU 578 10.064 -1.239 -3.665 609 HA LEU 578 HA LEU 578 12.626 0.049 -4.321 610 HB2 LEU 578 HB2 LEU 578 10.724 0.897 -5.671 611 HB3 LEU 578 HB3 LEU 578 9.899 1.341 -4.190 612 HG LEU 578 HG LEU 578 11.720 2.940 -3.677 613 HD11 LEU 578 HD11 LEU 578 12.718 2.184 -6.422 614 HD12 LEU 578 HD12 LEU 578 13.312 3.525 -5.444 615 HD13 LEU 578 HD13 LEU 578 13.532 1.867 -4.888 616 HD21 LEU 578 HD21 LEU 578 11.116 4.589 -5.391 617 HD22 LEU 578 HD22 LEU 578 10.399 3.306 -6.364 618 HD23 LEU 578 HD23 LEU 578 9.704 3.715 -4.796 619 H VAL 579 HN VAL 579 13.685 -0.022 -2.434 620 HA VAL 579 HA VAL 579 12.278 0.671 0.038 621 HB VAL 579 HB VAL 579 14.350 0.002 1.194 622 HG11 VAL 579 HG11 VAL 579 13.309 -2.034 -0.773 623 HG12 VAL 579 HG12 VAL 579 14.237 -2.404 0.679 624 HG13 VAL 579 HG13 VAL 579 12.642 -1.669 0.817 625 HG21 VAL 579 HG21 VAL 579 15.985 0.594 -0.490 626 HG22 VAL 579 HG22 VAL 579 16.152 -1.111 -0.076 627 HG23 VAL 579 HG23 VAL 579 15.356 -0.640 -1.578 628 H SER 580 HN SER 580 13.428 2.163 1.543 629 HA SER 580 HA SER 580 13.570 4.685 0.385 630 HB2 SER 580 HB2 SER 580 14.760 3.857 3.039 631 HB3 SER 580 HB3 SER 580 14.239 5.476 2.569 632 HG SER 580 HG SER 580 12.126 4.754 2.506 633 H GLY 581 HN GLY 581 16.225 2.567 1.457 634 HA2 GLY 581 HA2 GLY 581 18.275 4.445 0.814 635 HA3 GLY 581 HA3 GLY 581 18.503 2.730 1.123 636 H GLY 582 HN GLY 582 16.418 2.288 -1.109 637 HA2 GLY 582 HA2 GLY 582 18.483 2.178 -3.186 638 HA3 GLY 582 HA3 GLY 582 17.057 1.161 -3.104 639 H ILE 583 HN ILE 583 16.048 4.246 -2.430 640 HA ILE 583 HA ILE 583 14.712 4.529 -4.909 641 HB ILE 583 HB ILE 583 15.140 6.620 -2.770 642 HG12 ILE 583 HG12 ILE 583 12.836 4.723 -3.249 643 HG13 ILE 583 HG13 ILE 583 14.003 4.612 -1.940 644 HG21 ILE 583 HG21 ILE 583 13.214 7.751 -3.748 645 HG22 ILE 583 HG22 ILE 583 14.510 7.593 -4.932 646 HG23 ILE 583 HG23 ILE 583 13.113 6.518 -5.003 647 HD11 ILE 583 HD11 ILE 583 12.029 6.838 -2.363 648 HD12 ILE 583 HD12 ILE 583 11.915 5.552 -1.163 649 HD13 ILE 583 HD13 ILE 583 13.209 6.749 -1.056 650 H GLY 584 HN GLY 584 17.159 6.688 -3.464 651 HA2 GLY 584 HA2 GLY 584 18.859 7.875 -4.509 652 HA3 GLY 584 HA3 GLY 584 18.469 7.034 -6.005 653 H ALA 585 HN ALA 585 17.424 9.615 -3.861 654 HA ALA 585 HA ALA 585 16.498 11.640 -4.210 655 HB1 ALA 585 HB1 ALA 585 16.548 12.690 -6.396 656 HB2 ALA 585 HB2 ALA 585 18.089 11.902 -6.048 657 HB3 ALA 585 HB3 ALA 585 16.939 11.142 -7.148 658 H LEU 586 HN LEU 586 15.251 10.083 -7.173 659 HA LEU 586 HA LEU 586 12.611 9.902 -5.992 660 HB2 LEU 586 HB2 LEU 586 12.999 12.296 -6.817 661 HB3 LEU 586 HB3 LEU 586 12.982 11.623 -8.434 662 HG LEU 586 HG LEU 586 10.670 11.196 -6.566 663 HD11 LEU 586 HD11 LEU 586 11.086 13.531 -8.434 664 HD12 LEU 586 HD12 LEU 586 9.596 13.154 -7.569 665 HD13 LEU 586 HD13 LEU 586 11.045 13.608 -6.672 666 HD21 LEU 586 HD21 LEU 586 10.863 11.301 -9.569 667 HD22 LEU 586 HD22 LEU 586 10.787 9.834 -8.593 668 HD23 LEU 586 HD23 LEU 586 9.420 10.946 -8.619 669 H VAL 587 HN VAL 587 11.555 8.231 -6.798 670 HA VAL 587 HA VAL 587 11.975 7.334 -9.533 671 HB VAL 587 HB VAL 587 12.546 5.527 -7.166 672 HG11 VAL 587 HG11 VAL 587 11.125 4.374 -8.794 673 HG12 VAL 587 HG12 VAL 587 12.272 4.768 -10.074 674 HG13 VAL 587 HG13 VAL 587 12.753 3.697 -8.755 675 HG21 VAL 587 HG21 VAL 587 14.689 5.140 -8.293 676 HG22 VAL 587 HG22 VAL 587 14.230 6.291 -9.549 677 HG23 VAL 587 HG23 VAL 587 14.460 6.841 -7.888 678 H ARG 588 HN ARG 588 10.017 7.013 -10.332 679 HA ARG 588 HA ARG 588 7.776 6.690 -8.521 680 HB2 ARG 588 HB2 ARG 588 7.964 7.131 -11.496 681 HB3 ARG 588 HB3 ARG 588 6.437 6.868 -10.660 682 HG2 ARG 588 HG2 ARG 588 6.750 8.826 -9.327 683 HG3 ARG 588 HG3 ARG 588 8.382 9.042 -9.952 684 HD2 ARG 588 HD2 ARG 588 7.500 9.486 -12.171 685 HD3 ARG 588 HD3 ARG 588 5.857 9.203 -11.588 686 HE ARG 588 HE ARG 588 6.614 11.145 -9.944 687 HH11 ARG 588 HH12 ARG 588 7.073 10.906 -13.418 688 HH12 ARG 588 HH11 ARG 588 7.024 12.624 -13.659 689 HH21 ARG 588 HH22 ARG 588 6.570 13.348 -10.242 690 HH22 ARG 588 HH21 ARG 588 6.736 14.033 -11.838 691 H LEU 589 HN LEU 589 6.829 4.898 -8.034 692 HA LEU 589 HA LEU 589 7.901 2.406 -9.090 693 HB2 LEU 589 HB2 LEU 589 7.712 3.046 -6.618 694 HB3 LEU 589 HB3 LEU 589 5.985 2.812 -6.790 695 HG LEU 589 HG LEU 589 7.983 0.622 -7.347 696 HD11 LEU 589 HD11 LEU 589 8.281 1.386 -5.061 697 HD12 LEU 589 HD12 LEU 589 6.545 1.258 -4.776 698 HD13 LEU 589 HD13 LEU 589 7.498 -0.193 -5.094 699 HD21 LEU 589 HD21 LEU 589 5.036 0.578 -6.688 700 HD22 LEU 589 HD22 LEU 589 5.750 0.273 -8.272 701 HD23 LEU 589 HD23 LEU 589 6.063 -0.835 -6.936 702 H LYS 590 HN LYS 590 6.803 1.174 -10.520 703 HA LYS 590 HA LYS 590 4.212 2.000 -11.412 704 HB2 LYS 590 HB2 LYS 590 6.056 -0.280 -12.118 705 HB3 LYS 590 HB3 LYS 590 4.468 -0.110 -12.845 706 HG2 LYS 590 HG2 LYS 590 6.386 0.751 -14.182 707 HG3 LYS 590 HG3 LYS 590 5.071 1.896 -13.931 708 HD2 LYS 590 HD2 LYS 590 6.359 3.073 -12.288 709 HD3 LYS 590 HD3 LYS 590 7.602 1.820 -12.289 710 HE2 LYS 590 HE2 LYS 590 6.906 3.525 -14.678 711 HE3 LYS 590 HE3 LYS 590 8.209 3.888 -13.550 712 HZ1 LYS 590 HZ1 LYS 590 7.991 1.455 -15.240 713 HZ2 LYS 590 HZ2 LYS 590 9.216 1.743 -14.114 714 HZ3 LYS 590 HZ3 LYS 590 9.061 2.747 -15.480 715 H SER 591 HN SER 591 2.270 1.158 -10.948 716 HA SER 591 HA SER 591 2.209 -0.853 -8.811 717 HB2 SER 591 HB2 SER 591 -0.092 -0.020 -8.401 718 HB3 SER 591 HB3 SER 591 1.109 1.271 -8.321 719 HG SER 591 HG SER 591 0.539 1.826 -10.474 720 H LEU 592 HN LEU 592 0.517 -2.488 -8.847 721 HA LEU 592 HA LEU 592 0.457 -3.991 -11.178 722 HB2 LEU 592 HB2 LEU 592 -1.105 -3.994 -8.638 723 HB3 LEU 592 HB3 LEU 592 -1.605 -5.047 -9.947 724 HG LEU 592 HG LEU 592 -0.129 -6.077 -8.194 725 HD11 LEU 592 HD11 LEU 592 -0.440 -7.127 -10.354 726 HD12 LEU 592 HD12 LEU 592 0.818 -6.106 -11.052 727 HD13 LEU 592 HD13 LEU 592 1.235 -7.309 -9.832 728 HD21 LEU 592 HD21 LEU 592 1.433 -4.254 -7.863 729 HD22 LEU 592 HD22 LEU 592 2.276 -5.715 -8.381 730 HD23 LEU 592 HD23 LEU 592 1.986 -4.412 -9.531 731 H GLN 593 HN GLN 593 -1.627 -1.401 -10.170 732 HA GLN 593 HA GLN 593 -3.835 -1.981 -11.861 733 HB2 GLN 593 HB2 GLN 593 -3.895 -0.386 -9.939 734 HB3 GLN 593 HB3 GLN 593 -2.902 0.723 -10.879 735 HG2 GLN 593 HG2 GLN 593 -4.812 0.442 -12.648 736 HG3 GLN 593 HG3 GLN 593 -5.755 -0.047 -11.242 737 HE21 GLN 593 HE21 GLN 593 -4.194 1.764 -9.497 738 HE22 GLN 593 HE22 GLN 593 -4.794 3.346 -9.834 739 H GLY 594 HN GLY 594 -0.726 -0.591 -12.388 740 HA2 GLY 594 HA2 GLY 594 0.137 -0.336 -14.624 741 HA3 GLY 594 HA3 GLY 594 -1.491 0.069 -15.156 742 H ASP 595 HN ASP 595 -1.279 1.605 -12.325 743 HA ASP 595 HA ASP 595 -0.610 4.128 -13.611 744 HB2 ASP 595 HB2 ASP 595 -2.587 3.583 -11.915 745 HB3 ASP 595 HB3 ASP 595 -1.355 3.969 -10.724 746 H LYS 596 HN LYS 596 0.451 5.635 -11.629 747 HA LYS 596 HA LYS 596 3.008 4.271 -11.100 748 HB2 LYS 596 HB2 LYS 596 4.217 6.317 -11.770 749 HB3 LYS 596 HB3 LYS 596 3.321 5.611 -13.104 750 HG2 LYS 596 HG2 LYS 596 2.282 7.917 -11.474 751 HG3 LYS 596 HG3 LYS 596 3.250 8.118 -12.936 752 HD2 LYS 596 HD2 LYS 596 1.596 7.113 -14.285 753 HD3 LYS 596 HD3 LYS 596 0.726 6.481 -12.886 754 HE2 LYS 596 HE2 LYS 596 0.519 9.021 -12.269 755 HE3 LYS 596 HE3 LYS 596 0.796 9.246 -13.998 756 HZ1 LYS 596 HZ1 LYS 596 -1.084 7.778 -14.444 757 HZ2 LYS 596 HZ2 LYS 596 -1.567 9.099 -13.499 758 HZ3 LYS 596 HZ3 LYS 596 -1.346 7.577 -12.782 759 H LEU 597 HN LEU 597 3.760 4.487 -9.127 760 HA LEU 597 HA LEU 597 2.436 6.346 -7.299 761 HB2 LEU 597 HB2 LEU 597 4.413 4.118 -6.793 762 HB3 LEU 597 HB3 LEU 597 3.682 5.103 -5.542 763 HG LEU 597 HG LEU 597 2.050 3.430 -7.439 764 HD11 LEU 597 HD11 LEU 597 3.088 2.691 -4.707 765 HD12 LEU 597 HD12 LEU 597 1.890 1.781 -5.630 766 HD13 LEU 597 HD13 LEU 597 3.537 1.942 -6.240 767 HD21 LEU 597 HD21 LEU 597 1.422 4.632 -4.743 768 HD22 LEU 597 HD22 LEU 597 0.897 5.272 -6.301 769 HD23 LEU 597 HD23 LEU 597 0.321 3.698 -5.757 770 H GLU 598 HN GLU 598 3.262 8.260 -6.892 771 HA GLU 598 HA GLU 598 5.886 9.005 -7.785 772 HB2 GLU 598 HB2 GLU 598 4.189 10.643 -8.003 773 HB3 GLU 598 HB3 GLU 598 3.650 10.430 -6.348 774 HG2 GLU 598 HG2 GLU 598 4.782 12.544 -6.617 775 HG3 GLU 598 HG3 GLU 598 5.695 11.486 -5.541 776 H VAL 599 HN VAL 599 7.291 7.672 -6.559 777 HA VAL 599 HA VAL 599 7.341 8.214 -3.667 778 HB VAL 599 HB VAL 599 8.720 5.981 -5.163 779 HG11 VAL 599 HG11 VAL 599 8.392 6.462 -2.204 780 HG12 VAL 599 HG12 VAL 599 9.142 5.045 -2.941 781 HG13 VAL 599 HG13 VAL 599 9.888 6.634 -3.124 782 HG21 VAL 599 HG21 VAL 599 6.278 5.725 -5.185 783 HG22 VAL 599 HG22 VAL 599 7.057 4.497 -4.183 784 HG23 VAL 599 HG23 VAL 599 6.256 5.873 -3.426 785 H SER 600 HN SER 600 8.888 9.444 -2.876 786 HA SER 600 HA SER 600 11.440 9.644 -4.267 787 HB2 SER 600 HB2 SER 600 11.237 12.219 -3.863 788 HB3 SER 600 HB3 SER 600 10.459 11.493 -5.276 789 HG SER 600 HG SER 600 8.504 11.604 -4.252 790 H LEU 601 HN LEU 601 13.122 10.648 -2.982 791 HA LEU 601 HA LEU 601 12.641 10.383 -0.081 792 HB2 LEU 601 HB2 LEU 601 13.899 8.463 -1.009 793 HB3 LEU 601 HB3 LEU 601 15.105 9.571 -1.635 794 HG LEU 601 HG LEU 601 15.521 10.283 0.761 795 HD11 LEU 601 HD11 LEU 601 13.449 9.438 1.726 796 HD12 LEU 601 HD12 LEU 601 13.934 7.788 1.334 797 HD13 LEU 601 HD13 LEU 601 14.858 8.723 2.508 798 HD21 LEU 601 HD21 LEU 601 16.949 8.369 1.227 799 HD22 LEU 601 HD22 LEU 601 16.082 7.417 0.022 800 HD23 LEU 601 HD23 LEU 601 17.029 8.819 -0.476 801 H LYS 602 HN LYS 602 13.108 12.189 1.030 802 HA LYS 602 HA LYS 602 15.168 13.980 -0.022 803 HB2 LYS 602 HB2 LYS 602 12.919 14.727 -0.849 804 HB3 LYS 602 HB3 LYS 602 12.438 14.960 0.826 805 HG2 LYS 602 HG2 LYS 602 13.984 16.721 1.126 806 HG3 LYS 602 HG3 LYS 602 14.810 16.350 -0.391 807 HD2 LYS 602 HD2 LYS 602 11.987 17.387 -0.102 808 HD3 LYS 602 HD3 LYS 602 13.391 18.317 -0.632 809 HE2 LYS 602 HE2 LYS 602 13.646 16.750 -2.542 810 HE3 LYS 602 HE3 LYS 602 12.163 15.946 -2.034 811 HZ1 LYS 602 HZ1 LYS 602 12.403 18.782 -2.892 812 HZ2 LYS 602 HZ2 LYS 602 10.973 18.037 -2.359 813 HZ3 LYS 602 HZ3 LYS 602 11.717 17.518 -3.791 814 H ASN 603 HN ASN 603 16.597 13.993 1.560 815 HA ASN 603 HA ASN 603 17.565 14.295 3.587 816 HB2 ASN 603 HB2 ASN 603 14.971 15.741 4.158 817 HB3 ASN 603 HB3 ASN 603 16.331 15.709 5.273 818 HD21 ASN 603 HD21 ASN 603 18.204 16.844 4.766 819 HD22 ASN 603 HD22 ASN 603 18.243 18.048 3.530 820 H ASN 604 HN ASN 604 16.539 11.852 3.145 821 HA ASN 604 HA ASN 604 16.352 9.884 4.269 822 HB2 ASN 604 HB2 ASN 604 17.535 11.064 6.153 823 HB3 ASN 604 HB3 ASN 604 15.958 11.456 6.817 824 HD21 ASN 604 HD21 ASN 604 18.273 8.954 6.198 825 HD22 ASN 604 HD22 ASN 604 17.539 7.745 7.203 826 H VAL 605 HN VAL 605 13.990 12.233 4.086 827 HA VAL 605 HA VAL 605 11.890 10.562 5.244 828 HB VAL 605 HB VAL 605 11.667 13.300 3.982 829 HG11 VAL 605 HG11 VAL 605 9.701 11.745 5.664 830 HG12 VAL 605 HG12 VAL 605 9.482 13.396 5.083 831 HG13 VAL 605 HG13 VAL 605 9.566 12.063 3.935 832 HG21 VAL 605 HG21 VAL 605 11.806 12.534 6.899 833 HG22 VAL 605 HG22 VAL 605 13.065 13.364 5.980 834 HG23 VAL 605 HG23 VAL 605 11.516 14.156 6.266 835 H VAL 606 HN VAL 606 10.665 9.275 4.041 836 HA VAL 606 HA VAL 606 10.814 9.540 1.115 837 HB VAL 606 HB VAL 606 11.722 7.430 1.869 838 HG11 VAL 606 HG11 VAL 606 10.437 5.794 3.108 839 HG12 VAL 606 HG12 VAL 606 10.563 7.295 4.026 840 HG13 VAL 606 HG13 VAL 606 9.063 6.901 3.184 841 HG21 VAL 606 HG21 VAL 606 10.260 5.866 0.646 842 HG22 VAL 606 HG22 VAL 606 8.996 7.096 0.630 843 HG23 VAL 606 HG23 VAL 606 10.514 7.380 -0.221 844 H SER 607 HN SER 607 9.019 9.916 -0.024 845 HA SER 607 HA SER 607 6.432 9.595 1.331 846 HB2 SER 607 HB2 SER 607 5.699 11.754 0.268 847 HB3 SER 607 HB3 SER 607 6.932 11.943 1.509 848 HG SER 607 HG SER 607 7.908 11.588 -1.049 849 H VAL 608 HN VAL 608 4.726 8.995 0.068 850 HA VAL 608 HA VAL 608 5.282 8.500 -2.781 851 HB VAL 608 HB VAL 608 5.116 6.363 -1.683 852 HG11 VAL 608 HG11 VAL 608 3.161 5.658 -0.410 853 HG12 VAL 608 HG12 VAL 608 3.932 7.056 0.340 854 HG13 VAL 608 HG13 VAL 608 2.450 7.262 -0.594 855 HG21 VAL 608 HG21 VAL 608 2.581 7.019 -3.172 856 HG22 VAL 608 HG22 VAL 608 4.103 6.463 -3.866 857 HG23 VAL 608 HG23 VAL 608 3.159 5.389 -2.832 858 H ASN 609 HN ASN 609 4.171 9.809 -4.026 859 HA ASN 609 HA ASN 609 2.595 11.231 -4.831 860 HB2 ASN 609 HB2 ASN 609 0.766 9.537 -3.115 861 HB3 ASN 609 HB3 ASN 609 0.196 10.806 -4.195 862 HD21 ASN 609 HD21 ASN 609 -0.379 7.976 -4.276 863 HD22 ASN 609 HD22 ASN 609 0.139 7.425 -5.831 864 H LYS 610 HN LYS 610 4.127 11.883 -2.550 865 HA LYS 610 HA LYS 610 4.436 13.733 -1.264 866 HB2 LYS 610 HB2 LYS 610 2.618 14.792 -2.745 867 HB3 LYS 610 HB3 LYS 610 1.518 14.432 -1.425 868 HG2 LYS 610 HG2 LYS 610 2.186 16.668 -1.140 869 HG3 LYS 610 HG3 LYS 610 3.063 15.736 0.075 870 HD2 LYS 610 HD2 LYS 610 4.690 17.157 -0.798 871 HD3 LYS 610 HD3 LYS 610 4.957 15.645 -1.665 872 HE2 LYS 610 HE2 LYS 610 3.400 18.013 -2.713 873 HE3 LYS 610 HE3 LYS 610 5.061 17.613 -3.142 874 HZ1 LYS 610 HZ1 LYS 610 2.652 15.971 -3.702 875 HZ2 LYS 610 HZ2 LYS 610 4.244 15.500 -4.055 876 HZ3 LYS 610 HZ3 LYS 610 3.562 16.844 -4.830 877 H GLU 611 HN GLU 611 2.420 11.162 -0.655 878 HA GLU 611 HA GLU 611 1.845 11.854 2.104 879 HB2 GLU 611 HB2 GLU 611 1.448 9.241 0.633 880 HB3 GLU 611 HB3 GLU 611 0.833 9.619 2.236 881 HG2 GLU 611 HG2 GLU 611 0.053 11.004 -0.320 882 HG3 GLU 611 HG3 GLU 611 -0.900 9.792 0.535 883 HA PRO 612 HA PRO 612 5.964 10.429 3.176 884 HB2 PRO 612 HB2 PRO 612 5.713 10.953 5.846 885 HB3 PRO 612 HB3 PRO 612 6.125 12.180 4.643 886 HG2 PRO 612 HG2 PRO 612 3.484 11.565 5.901 887 HG3 PRO 612 HG3 PRO 612 4.218 13.141 5.548 888 HD2 PRO 612 HD2 PRO 612 2.305 12.062 3.986 889 HD3 PRO 612 HD3 PRO 612 3.612 13.064 3.324 890 H VAL 613 HN VAL 613 6.634 8.444 3.689 891 HA VAL 613 HA VAL 613 4.771 6.471 4.589 892 HB VAL 613 HB VAL 613 7.765 6.286 4.198 893 HG11 VAL 613 HG11 VAL 613 5.718 4.092 4.563 894 HG12 VAL 613 HG12 VAL 613 7.426 3.856 4.191 895 HG13 VAL 613 HG13 VAL 613 6.949 4.556 5.739 896 HG21 VAL 613 HG21 VAL 613 6.510 6.785 2.148 897 HG22 VAL 613 HG22 VAL 613 7.198 5.159 2.114 898 HG23 VAL 613 HG23 VAL 613 5.485 5.382 2.453 899 H ALA 614 HN ALA 614 4.319 5.897 6.560 900 HA ALA 614 HA ALA 614 5.283 7.319 8.791 901 HB1 ALA 614 HB1 ALA 614 3.738 4.729 8.761 902 HB2 ALA 614 HB2 ALA 614 3.844 5.883 10.090 903 HB3 ALA 614 HB3 ALA 614 3.021 6.330 8.592 904 H GLU 615 HN GLU 615 5.903 4.059 7.572 905 HA GLU 615 HA GLU 615 8.438 3.931 8.943 906 HB2 GLU 615 HB2 GLU 615 6.176 2.100 9.759 907 HB3 GLU 615 HB3 GLU 615 7.865 1.678 10.012 908 HG2 GLU 615 HG2 GLU 615 8.120 3.757 11.344 909 HG3 GLU 615 HG3 GLU 615 6.384 4.021 11.182 910 HA PRO 616 HA PRO 616 8.531 1.736 5.017 911 HB2 PRO 616 HB2 PRO 616 10.846 2.701 4.151 912 HB3 PRO 616 HB3 PRO 616 9.411 3.730 4.227 913 HG2 PRO 616 HG2 PRO 616 11.750 3.600 6.082 914 HG3 PRO 616 HG3 PRO 616 10.850 5.015 5.508 915 HD2 PRO 616 HD2 PRO 616 10.470 3.730 7.958 916 HD3 PRO 616 HD3 PRO 616 9.320 4.840 7.185 917 H ASP 617 HN ASP 617 9.694 -0.009 4.179 918 HA ASP 617 HA ASP 617 11.465 -1.391 3.762 919 HB2 ASP 617 HB2 ASP 617 12.917 0.566 4.491 920 HB3 ASP 617 HB3 ASP 617 12.933 -0.155 6.097 921 H ILE 618 HN ILE 618 9.300 -2.093 5.081 922 HA ILE 618 HA ILE 618 10.062 -3.828 7.276 923 HB ILE 618 HB ILE 618 7.514 -2.977 5.973 924 HG12 ILE 618 HG12 ILE 618 8.458 -3.136 8.850 925 HG13 ILE 618 HG13 ILE 618 8.386 -1.689 7.848 926 HG21 ILE 618 HG21 ILE 618 7.796 -5.424 7.754 927 HG22 ILE 618 HG22 ILE 618 6.264 -4.663 7.324 928 HG23 ILE 618 HG23 ILE 618 7.265 -5.401 6.074 929 HD11 ILE 618 HD11 ILE 618 6.530 -1.725 9.370 930 HD12 ILE 618 HD12 ILE 618 5.944 -1.947 7.721 931 HD13 ILE 618 HD13 ILE 618 6.060 -3.330 8.807 932 H MET 619 HN MET 619 10.901 -5.752 6.862 933 HA MET 619 HA MET 619 11.121 -6.659 4.160 934 HB2 MET 619 HB2 MET 619 12.148 -7.875 6.725 935 HB3 MET 619 HB3 MET 619 12.577 -8.412 5.110 936 HG2 MET 619 HG2 MET 619 13.078 -5.598 5.995 937 HG3 MET 619 HG3 MET 619 14.205 -6.896 6.373 938 HE1 MET 619 HE1 MET 619 12.545 -4.676 3.845 939 HE2 MET 619 HE2 MET 619 13.455 -4.885 2.346 940 HE3 MET 619 HE3 MET 619 12.211 -6.049 2.791 941 H ALA 620 HN ALA 620 10.054 -8.176 3.140 942 HA ALA 620 HA ALA 620 8.777 -10.326 4.683 943 HB1 ALA 620 HB1 ALA 620 6.987 -10.413 3.000 944 HB2 ALA 620 HB2 ALA 620 7.027 -8.853 3.821 945 HB3 ALA 620 HB3 ALA 620 7.686 -9.009 2.193 946 H THR 621 HN THR 621 8.406 -12.288 3.106 947 HA THR 621 HA THR 621 10.992 -12.809 1.928 948 HB THR 621 HB THR 621 9.630 -14.519 3.262 949 HG1 THR 621 HG1 THR 621 10.898 -14.974 0.782 950 HG21 THR 621 HG21 THR 621 8.242 -14.878 0.597 951 HG22 THR 621 HG22 THR 621 7.494 -14.181 2.035 952 HG23 THR 621 HG23 THR 621 8.022 -15.863 2.047 953 H ASN 622 HN ASN 622 7.884 -11.835 0.796 954 HA ASN 622 HA ASN 622 8.738 -12.387 -1.962 955 HB2 ASN 622 HB2 ASN 622 6.400 -12.598 -2.603 956 HB3 ASN 622 HB3 ASN 622 6.779 -13.729 -1.313 957 HD21 ASN 622 HD21 ASN 622 4.215 -12.694 -2.163 958 HD22 ASN 622 HD22 ASN 622 3.518 -11.914 -0.782 959 H GLY 623 HN GLY 623 9.131 -9.995 -0.162 960 HA2 GLY 623 HA2 GLY 623 9.330 -8.015 -1.921 961 HA3 GLY 623 HA3 GLY 623 7.610 -7.956 -1.572 962 H VAL 624 HN VAL 624 7.607 -5.986 -0.616 963 HA VAL 624 HA VAL 624 8.764 -5.836 2.058 964 HB VAL 624 HB VAL 624 10.393 -4.810 0.393 965 HG11 VAL 624 HG11 VAL 624 8.792 -3.792 -1.108 966 HG12 VAL 624 HG12 VAL 624 8.225 -2.739 0.190 967 HG13 VAL 624 HG13 VAL 624 9.868 -2.566 -0.433 968 HG21 VAL 624 HG21 VAL 624 10.488 -4.254 2.754 969 HG22 VAL 624 HG22 VAL 624 10.846 -2.836 1.766 970 HG23 VAL 624 HG23 VAL 624 9.264 -3.004 2.524 971 H VAL 625 HN VAL 625 7.806 -4.081 3.309 972 HA VAL 625 HA VAL 625 5.199 -3.188 2.265 973 HB VAL 625 HB VAL 625 5.757 -4.082 5.104 974 HG11 VAL 625 HG11 VAL 625 4.110 -2.281 4.984 975 HG12 VAL 625 HG12 VAL 625 3.169 -3.211 3.819 976 HG13 VAL 625 HG13 VAL 625 3.359 -3.803 5.470 977 HG21 VAL 625 HG21 VAL 625 5.668 -5.989 3.610 978 HG22 VAL 625 HG22 VAL 625 4.231 -5.942 4.632 979 HG23 VAL 625 HG23 VAL 625 4.135 -5.424 2.948 980 H HIS 626 HN HIS 626 4.768 -1.075 2.539 981 HA HIS 626 HA HIS 626 6.506 0.454 4.348 982 HB2 HIS 626 HB2 HIS 626 5.276 1.282 1.714 983 HB3 HIS 626 HB3 HIS 626 6.041 2.399 2.826 984 HD2 HIS 626 HD2 HIS 626 6.928 0.381 -0.177 985 HE1 HIS 626 HE1 HIS 626 10.561 1.037 1.889 986 HE2 HIS 626 HE2 HIS 626 9.515 0.527 -0.364 987 H VAL 627 HN VAL 627 5.434 1.107 6.070 988 HA VAL 627 HA VAL 627 2.597 1.082 6.265 989 HB VAL 627 HB VAL 627 4.595 2.407 8.100 990 HG11 VAL 627 HG11 VAL 627 2.309 3.155 8.474 991 HG12 VAL 627 HG12 VAL 627 1.775 1.480 8.617 992 HG13 VAL 627 HG13 VAL 627 2.878 2.159 9.813 993 HG21 VAL 627 HG21 VAL 627 3.490 -0.395 8.128 994 HG22 VAL 627 HG22 VAL 627 5.162 0.082 7.823 995 HG23 VAL 627 HG23 VAL 627 4.449 0.331 9.419 996 H ILE 628 HN ILE 628 1.179 2.616 5.683 997 HA ILE 628 HA ILE 628 2.134 5.399 5.534 998 HB ILE 628 HB ILE 628 0.241 5.728 3.830 999 HG12 ILE 628 HG12 ILE 628 0.624 2.738 3.546 1000 HG13 ILE 628 HG13 ILE 628 -0.821 3.529 4.166 1001 HG21 ILE 628 HG21 ILE 628 1.711 5.108 1.969 1002 HG22 ILE 628 HG22 ILE 628 2.582 5.914 3.279 1003 HG23 ILE 628 HG23 ILE 628 2.700 4.166 3.087 1004 HD11 ILE 628 HD11 ILE 628 -1.168 2.858 1.884 1005 HD12 ILE 628 HD12 ILE 628 -1.121 4.620 1.978 1006 HD13 ILE 628 HD13 ILE 628 0.280 3.731 1.375 1007 H THR 629 HN THR 629 0.785 7.010 6.214 1008 HA THR 629 HA THR 629 -1.097 6.153 8.258 1009 HB THR 629 HB THR 629 -1.061 8.646 8.806 1010 HG1 THR 629 HG1 THR 629 0.715 9.782 7.855 1011 HG21 THR 629 HG21 THR 629 0.231 7.027 10.079 1012 HG22 THR 629 HG22 THR 629 1.188 8.489 9.833 1013 HG23 THR 629 HG23 THR 629 1.503 7.053 8.861 1014 H ASN 630 HN ASN 630 -1.363 6.910 5.061 1015 HA ASN 630 HA ASN 630 -4.178 7.610 5.383 1016 HB2 ASN 630 HB2 ASN 630 -2.874 9.742 5.049 1017 HB3 ASN 630 HB3 ASN 630 -2.372 9.127 3.482 1018 HD21 ASN 630 HD21 ASN 630 -3.329 10.864 2.435 1019 HD22 ASN 630 HD22 ASN 630 -5.052 10.972 2.247 1020 H VAL 631 HN VAL 631 -5.156 7.646 3.049 1021 HA VAL 631 HA VAL 631 -4.250 5.148 1.780 1022 HB VAL 631 HB VAL 631 -6.998 6.420 1.679 1023 HG11 VAL 631 HG11 VAL 631 -6.043 3.725 0.712 1024 HG12 VAL 631 HG12 VAL 631 -7.708 4.306 0.673 1025 HG13 VAL 631 HG13 VAL 631 -6.474 5.096 -0.311 1026 HG21 VAL 631 HG21 VAL 631 -6.655 5.630 3.896 1027 HG22 VAL 631 HG22 VAL 631 -7.645 4.426 3.076 1028 HG23 VAL 631 HG23 VAL 631 -5.923 4.133 3.318 1029 H LEU 632 HN LEU 632 -3.480 5.258 -0.251 1030 HA LEU 632 HA LEU 632 -2.959 7.814 -1.361 1031 HB2 LEU 632 HB2 LEU 632 -2.534 5.057 -2.511 1032 HB3 LEU 632 HB3 LEU 632 -1.874 6.541 -3.180 1033 HG LEU 632 HG LEU 632 -1.243 5.481 -0.424 1034 HD11 LEU 632 HD11 LEU 632 -0.351 4.014 -2.160 1035 HD12 LEU 632 HD12 LEU 632 0.413 5.399 -2.940 1036 HD13 LEU 632 HD13 LEU 632 0.933 4.895 -1.330 1037 HD21 LEU 632 HD21 LEU 632 -0.050 7.732 -2.035 1038 HD22 LEU 632 HD22 LEU 632 -1.072 7.902 -0.607 1039 HD23 LEU 632 HD23 LEU 632 0.527 7.169 -0.465 1040 H GLN 633 HN GLN 633 -4.057 8.963 -2.760 1041 HA GLN 633 HA GLN 633 -6.254 7.687 -4.252 1042 HB2 GLN 633 HB2 GLN 633 -6.118 10.532 -3.219 1043 HB3 GLN 633 HB3 GLN 633 -7.454 9.824 -4.114 1044 HG2 GLN 633 HG2 GLN 633 -6.516 8.931 -1.397 1045 HG3 GLN 633 HG3 GLN 633 -7.899 9.979 -1.710 1046 HE21 GLN 633 HE21 GLN 633 -7.709 7.344 -0.435 1047 HE22 GLN 633 HE22 GLN 633 -8.791 6.320 -1.309 1048 HA PRO 634 HA PRO 634 -3.821 9.156 -7.718 1049 HB2 PRO 634 HB2 PRO 634 -5.449 8.125 -9.641 1050 HB3 PRO 634 HB3 PRO 634 -4.265 7.159 -8.754 1051 HG2 PRO 634 HG2 PRO 634 -7.211 7.393 -8.349 1052 HG3 PRO 634 HG3 PRO 634 -6.174 5.959 -8.251 1053 HD2 PRO 634 HD2 PRO 634 -7.073 7.311 -6.066 1054 HD3 PRO 634 HD3 PRO 634 -5.545 6.412 -6.098
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