NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | position | program | type |
142673 | 2kls | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H HIS 501 H HIS 501 1.418 -0.344 1.333 2 HA HIS 501 HA HIS 501 2.134 0.546 -0.747 3 HB2 HIS 501 HB2 HIS 501 4.425 1.032 0.006 4 HB3 HIS 501 HB3 HIS 501 4.792 -0.685 0.044 5 HD1 HIS 501 HD1 HIS 501 4.226 2.146 -2.377 6 HD2 HIS 501 HD2 HIS 501 5.517 -1.791 -2.346 7 HE1 HIS 501 HE1 HIS 501 5.215 1.719 -4.668 8 H ALA 502 H ALA 502 2.565 -2.438 0.726 9 HA ALA 502 HA ALA 502 2.631 -3.986 -1.719 10 HB1 ALA 502 HB1 ALA 502 3.958 -4.659 0.208 11 HB2 ALA 502 HB2 ALA 502 2.839 -5.920 -0.326 12 HB3 ALA 502 HB3 ALA 502 2.463 -4.962 1.102 13 H GLY 503 H GLY 503 0.179 -3.203 0.698 14 HA2 GLY 503 HA2 GLY 503 -2.081 -3.347 -0.308 15 HA3 GLY 503 HA3 GLY 503 -1.614 -4.963 -0.827 16 H ILE 504 H ILE 504 -3.367 -5.901 0.345 17 HA ILE 504 HA ILE 504 -3.214 -5.547 3.236 18 HB ILE 504 HB ILE 504 -5.615 -6.118 1.475 19 HG12 ILE 504 HG12 ILE 504 -6.507 -3.993 2.629 20 HG13 ILE 504 HG13 ILE 504 -4.838 -3.688 3.080 21 HG21 ILE 504 HG21 ILE 504 -5.844 -7.402 3.442 22 HG22 ILE 504 HG22 ILE 504 -6.994 -6.062 3.452 23 HG23 ILE 504 HG23 ILE 504 -5.534 -5.990 4.452 24 HD11 ILE 504 HD11 ILE 504 -5.476 -2.436 1.098 25 HD12 ILE 504 HD12 ILE 504 -5.891 -3.941 0.267 26 HD13 ILE 504 HD13 ILE 504 -4.220 -3.618 0.714 27 H PHE 505 H PHE 505 -2.177 -7.329 4.029 28 HA PHE 505 HA PHE 505 -3.049 -9.977 3.144 29 HB2 PHE 505 HB2 PHE 505 -0.916 -9.070 5.084 30 HB3 PHE 505 HB3 PHE 505 -1.523 -10.712 5.148 31 HD1 PHE 505 HD1 PHE 505 -1.632 -11.764 2.622 32 HD2 PHE 505 HD2 PHE 505 1.101 -8.840 4.038 33 HE1 PHE 505 HE1 PHE 505 -0.006 -12.471 0.925 34 HE2 PHE 505 HE2 PHE 505 2.733 -9.535 2.329 35 HZ PHE 505 HZ PHE 505 2.163 -11.367 0.760 36 H THR 506 H THR 506 -4.774 -10.886 4.046 37 HA THR 506 HA THR 506 -5.291 -10.627 6.840 38 HB THR 506 HB THR 506 -6.234 -8.464 5.917 39 HG1 THR 506 HG1 THR 506 -8.557 -9.694 6.698 40 HG21 THR 506 HG21 THR 506 -8.186 -10.310 4.550 41 HG22 THR 506 HG22 THR 506 -6.968 -9.333 3.730 42 HG23 THR 506 HG23 THR 506 -8.296 -8.550 4.584 43 H PHE 507 H PHE 507 -7.479 -11.787 7.293 44 HA PHE 507 HA PHE 507 -7.364 -14.294 5.913 45 HB2 PHE 507 HB2 PHE 507 -9.026 -13.245 8.180 46 HB3 PHE 507 HB3 PHE 507 -9.310 -14.839 7.480 47 HD1 PHE 507 HD2 PHE 507 -7.537 -16.516 7.581 48 HD2 PHE 507 HD1 PHE 507 -7.248 -12.838 9.665 49 HE1 PHE 507 HE2 PHE 507 -5.844 -17.497 9.030 50 HE2 PHE 507 HE1 PHE 507 -5.531 -13.792 11.135 51 HZ PHE 507 HZ PHE 507 -4.820 -16.117 10.833 52 H GLU 508 H GLU 508 -8.975 -15.272 4.661 53 HA GLU 508 HA GLU 508 -10.425 -13.599 2.896 54 HB2 GLU 508 HB2 GLU 508 -9.534 -16.120 2.783 55 HB3 GLU 508 HB3 GLU 508 -11.164 -16.465 3.322 56 HG2 GLU 508 HG2 GLU 508 -10.393 -15.010 0.800 57 HG3 GLU 508 HG3 GLU 508 -10.924 -16.678 0.918 58 H GLU 509 H GLU 509 -11.209 -15.296 5.833 59 HA GLU 509 HA GLU 509 -13.773 -13.973 5.832 60 HB2 GLU 509 HB2 GLU 509 -14.772 -16.015 6.895 61 HB3 GLU 509 HB3 GLU 509 -14.318 -16.251 5.223 62 HG2 GLU 509 HG2 GLU 509 -12.159 -17.260 6.155 63 HG3 GLU 509 HG3 GLU 509 -13.008 -17.260 7.703 64 HA PRO 510 HA PRO 510 -12.192 -12.638 9.708 65 HB2 PRO 510 HB2 PRO 510 -14.479 -11.709 10.839 66 HB3 PRO 510 HB3 PRO 510 -13.660 -10.863 9.520 67 HG2 PRO 510 HG2 PRO 510 -16.069 -12.635 9.433 68 HG3 PRO 510 HG3 PRO 510 -15.752 -11.135 8.547 69 HD2 PRO 510 HD2 PRO 510 -15.450 -13.652 7.453 70 HD3 PRO 510 HD3 PRO 510 -14.550 -12.216 6.909 71 H VAL 511 H VAL 511 -14.839 -14.852 9.506 72 HA VAL 511 HA VAL 511 -14.069 -16.153 11.982 73 HB VAL 511 HB VAL 511 -16.960 -15.482 11.263 74 HG11 VAL 511 HG11 VAL 511 -15.843 -16.865 13.693 75 HG12 VAL 511 HG12 VAL 511 -16.736 -17.626 12.379 76 HG13 VAL 511 HG13 VAL 511 -17.539 -16.459 13.428 77 HG21 VAL 511 HG21 VAL 511 -15.271 -14.356 13.507 78 HG22 VAL 511 HG22 VAL 511 -16.996 -14.081 13.305 79 HG23 VAL 511 HG23 VAL 511 -15.859 -13.474 12.100 80 H THR 512 H THR 512 -14.121 -18.347 11.655 81 HA THR 512 HA THR 512 -15.471 -19.253 9.237 82 HB THR 512 HB THR 512 -12.987 -19.055 8.866 83 HG1 THR 512 HG1 THR 512 -13.968 -20.398 7.646 84 HG21 THR 512 HG21 THR 512 -12.830 -21.266 10.909 85 HG22 THR 512 HG22 THR 512 -12.187 -19.632 11.093 86 HG23 THR 512 HG23 THR 512 -11.496 -20.723 9.889 87 H HIS 513 H HIS 513 -16.563 -21.177 9.484 88 HA HIS 513 HA HIS 513 -16.320 -22.349 12.140 89 HB2 HIS 513 HB2 HIS 513 -18.565 -23.261 11.942 90 HB3 HIS 513 HB3 HIS 513 -18.641 -21.551 11.573 91 HD1 HIS 513 HD1 HIS 513 -19.520 -24.873 10.237 92 HD2 HIS 513 HD2 HIS 513 -19.018 -21.018 8.749 93 HE1 HIS 513 HE1 HIS 513 -20.685 -24.823 8.005 94 H VAL 514 H VAL 514 -15.787 -24.427 12.326 95 HA VAL 514 HA VAL 514 -15.310 -25.861 9.839 96 HB VAL 514 HB VAL 514 -13.226 -26.784 10.684 97 HG11 VAL 514 HG11 VAL 514 -13.281 -23.783 10.880 98 HG12 VAL 514 HG12 VAL 514 -13.018 -24.749 9.425 99 HG13 VAL 514 HG13 VAL 514 -11.815 -24.744 10.715 100 HG21 VAL 514 HG21 VAL 514 -13.632 -25.046 13.129 101 HG22 VAL 514 HG22 VAL 514 -12.176 -25.978 12.771 102 HG23 VAL 514 HG23 VAL 514 -13.700 -26.807 13.083 103 H SER 515 H SER 515 -15.531 -28.089 9.979 104 HA SER 515 HA SER 515 -17.540 -28.844 11.798 105 HB2 SER 515 HB2 SER 515 -16.177 -29.898 9.420 106 HB3 SER 515 HB3 SER 515 -17.226 -30.982 10.296 107 HG SER 515 HG SER 515 -18.590 -28.781 10.055 108 H GLU 516 H GLU 516 -17.430 -30.300 13.391 109 HA GLU 516 HA GLU 516 -15.155 -30.929 14.809 110 HB2 GLU 516 HB2 GLU 516 -17.433 -31.032 15.757 111 HB3 GLU 516 HB3 GLU 516 -17.843 -32.379 14.737 112 HG2 GLU 516 HG2 GLU 516 -15.723 -32.516 16.881 113 HG3 GLU 516 HG3 GLU 516 -17.419 -32.853 17.181 114 H SER 517 H SER 517 -16.683 -32.798 12.211 115 HA SER 517 HA SER 517 -14.384 -34.577 12.303 116 HB2 SER 517 HB2 SER 517 -16.540 -35.696 12.827 117 HB3 SER 517 HB3 SER 517 -17.161 -35.185 11.260 118 HG SER 517 HG SER 517 -15.608 -37.263 11.915 119 H ILE 518 H ILE 518 -13.445 -32.797 11.089 120 HA ILE 518 HA ILE 518 -14.091 -33.020 8.226 121 HB ILE 518 HB ILE 518 -14.500 -30.827 9.180 122 HG12 ILE 518 HG12 ILE 518 -12.149 -30.881 7.296 123 HG13 ILE 518 HG13 ILE 518 -13.855 -30.916 6.843 124 HG21 ILE 518 HG21 ILE 518 -12.965 -30.784 10.979 125 HG22 ILE 518 HG22 ILE 518 -12.673 -29.388 9.949 126 HG23 ILE 518 HG23 ILE 518 -11.571 -30.778 9.886 127 HD11 ILE 518 HD11 ILE 518 -12.357 -28.712 8.166 128 HD12 ILE 518 HD12 ILE 518 -14.102 -28.709 7.896 129 HD13 ILE 518 HD13 ILE 518 -12.976 -28.706 6.502 130 H GLY 519 H GLY 519 -11.674 -33.293 10.680 131 HA2 GLY 519 HA2 GLY 519 -9.640 -34.399 10.485 132 HA3 GLY 519 HA3 GLY 519 -9.737 -34.212 8.736 133 H ILE 520 H ILE 520 -9.472 -32.084 7.883 134 HA ILE 520 HA ILE 520 -7.686 -30.434 9.523 135 HB ILE 520 HB ILE 520 -7.224 -31.237 6.632 136 HG12 ILE 520 HG12 ILE 520 -6.608 -33.060 8.149 137 HG13 ILE 520 HG13 ILE 520 -5.180 -32.351 7.407 138 HG21 ILE 520 HG21 ILE 520 -5.118 -29.995 6.768 139 HG22 ILE 520 HG22 ILE 520 -5.553 -29.452 8.387 140 HG23 ILE 520 HG23 ILE 520 -6.524 -28.953 7.001 141 HD11 ILE 520 HD11 ILE 520 -4.752 -31.099 9.473 142 HD12 ILE 520 HD12 ILE 520 -4.785 -32.846 9.724 143 HD13 ILE 520 HD13 ILE 520 -6.169 -31.868 10.197 144 H MET 521 H MET 521 -8.122 -28.348 9.320 145 HA MET 521 HA MET 521 -9.979 -27.598 7.192 146 HB2 MET 521 HB2 MET 521 -10.841 -25.864 8.602 147 HB3 MET 521 HB3 MET 521 -10.847 -27.357 9.526 148 HG2 MET 521 HG2 MET 521 -10.032 -25.902 11.121 149 HG3 MET 521 HG3 MET 521 -8.528 -26.356 10.336 150 HE1 MET 521 HE1 MET 521 -8.294 -22.461 11.169 151 HE2 MET 521 HE2 MET 521 -7.508 -24.008 11.435 152 HE3 MET 521 HE3 MET 521 -9.147 -23.734 12.054 153 H GLU 522 H GLU 522 -9.499 -25.831 5.986 154 HA GLU 522 HA GLU 522 -6.847 -24.663 6.361 155 HB2 GLU 522 HB2 GLU 522 -8.099 -25.770 3.892 156 HB3 GLU 522 HB3 GLU 522 -6.924 -24.470 3.781 157 HG2 GLU 522 HG2 GLU 522 -5.266 -25.769 4.788 158 HG3 GLU 522 HG3 GLU 522 -6.391 -27.080 5.180 159 H VAL 523 H VAL 523 -6.812 -22.607 6.475 160 HA VAL 523 HA VAL 523 -9.176 -21.080 5.629 161 HB VAL 523 HB VAL 523 -6.932 -20.129 7.439 162 HG11 VAL 523 HG11 VAL 523 -9.695 -19.032 7.022 163 HG12 VAL 523 HG12 VAL 523 -8.209 -18.370 6.329 164 HG13 VAL 523 HG13 VAL 523 -8.434 -18.393 8.079 165 HG21 VAL 523 HG21 VAL 523 -8.380 -20.580 9.312 166 HG22 VAL 523 HG22 VAL 523 -8.101 -22.067 8.405 167 HG23 VAL 523 HG23 VAL 523 -9.626 -21.201 8.231 168 H LYS 524 H LYS 524 -8.998 -19.832 3.929 169 HA LYS 524 HA LYS 524 -6.521 -19.603 2.448 170 HB2 LYS 524 HB2 LYS 524 -9.252 -18.403 1.913 171 HB3 LYS 524 HB3 LYS 524 -7.917 -18.566 0.764 172 HG2 LYS 524 HG2 LYS 524 -9.087 -20.999 2.035 173 HG3 LYS 524 HG3 LYS 524 -9.939 -20.218 0.710 174 HD2 LYS 524 HD2 LYS 524 -7.045 -20.824 0.402 175 HD3 LYS 524 HD3 LYS 524 -8.207 -22.163 0.233 176 HE2 LYS 524 HE2 LYS 524 -9.361 -20.691 -1.469 177 HE3 LYS 524 HE3 LYS 524 -7.982 -19.600 -1.346 178 HZ1 LYS 524 HZ1 LYS 524 -6.558 -21.507 -2.022 179 HZ2 LYS 524 HZ2 LYS 524 -7.683 -21.107 -3.206 180 HZ3 LYS 524 HZ3 LYS 524 -7.930 -22.434 -2.216 181 H VAL 525 H VAL 525 -5.226 -17.853 2.563 182 HA VAL 525 HA VAL 525 -6.217 -15.514 4.027 183 HB VAL 525 HB VAL 525 -3.347 -16.340 3.479 184 HG11 VAL 525 HG11 VAL 525 -4.419 -14.150 5.256 185 HG12 VAL 525 HG12 VAL 525 -3.588 -13.897 3.720 186 HG13 VAL 525 HG13 VAL 525 -2.720 -14.596 5.092 187 HG21 VAL 525 HG21 VAL 525 -4.431 -17.848 5.025 188 HG22 VAL 525 HG22 VAL 525 -4.965 -16.486 6.007 189 HG23 VAL 525 HG23 VAL 525 -3.247 -16.853 5.872 190 H LEU 526 H LEU 526 -6.179 -13.520 3.141 191 HA LEU 526 HA LEU 526 -6.103 -13.386 0.282 192 HB2 LEU 526 HB2 LEU 526 -6.659 -11.276 2.358 193 HB3 LEU 526 HB3 LEU 526 -6.816 -11.047 0.628 194 HG LEU 526 HG LEU 526 -8.452 -12.947 2.306 195 HD11 LEU 526 HD11 LEU 526 -9.007 -10.607 2.707 196 HD12 LEU 526 HD12 LEU 526 -10.295 -11.436 1.845 197 HD13 LEU 526 HD13 LEU 526 -9.208 -10.351 0.973 198 HD21 LEU 526 HD21 LEU 526 -8.558 -12.278 -0.628 199 HD22 LEU 526 HD22 LEU 526 -9.807 -13.157 0.234 200 HD23 LEU 526 HD23 LEU 526 -8.189 -13.851 0.086 201 H ARG 527 H ARG 527 -4.482 -12.865 -0.830 202 HA ARG 527 HA ARG 527 -1.980 -12.030 0.284 203 HB2 ARG 527 HB2 ARG 527 -2.023 -13.657 -1.487 204 HB3 ARG 527 HB3 ARG 527 -2.957 -12.586 -2.508 205 HG2 ARG 527 HG2 ARG 527 -1.036 -11.084 -2.684 206 HG3 ARG 527 HG3 ARG 527 -0.096 -12.173 -1.662 207 HD2 ARG 527 HD2 ARG 527 0.289 -12.434 -4.113 208 HD3 ARG 527 HD3 ARG 527 -0.187 -13.899 -3.268 209 HE ARG 527 HE ARG 527 -2.312 -13.794 -4.204 210 HH11 ARG 527 HH11 ARG 527 -0.280 -11.235 -5.527 211 HH12 ARG 527 HH12 ARG 527 -1.256 -10.985 -6.910 212 HH21 ARG 527 HH21 ARG 527 -3.623 -13.459 -6.106 213 HH22 ARG 527 HH22 ARG 527 -3.180 -12.282 -7.254 214 H THR 528 H THR 528 -0.815 -10.136 -0.391 215 HA THR 528 HA THR 528 -2.133 -7.761 -0.240 216 HB THR 528 HB THR 528 0.204 -7.066 -1.265 217 HG1 THR 528 HG1 THR 528 1.691 -8.677 -1.159 218 HG21 THR 528 HG21 THR 528 -0.533 -6.661 1.040 219 HG22 THR 528 HG22 THR 528 1.135 -7.232 1.005 220 HG23 THR 528 HG23 THR 528 -0.167 -8.336 1.450 221 H SER 529 H SER 529 -2.796 -6.331 -1.670 222 HA SER 529 HA SER 529 -3.704 -6.889 -4.166 223 HB2 SER 529 HB2 SER 529 -4.377 -5.011 -2.648 224 HB3 SER 529 HB3 SER 529 -2.884 -4.186 -3.060 225 HG SER 529 HG SER 529 -4.765 -5.009 -4.995 226 H GLY 530 H GLY 530 -0.569 -5.603 -3.157 227 HA2 GLY 530 HA2 GLY 530 0.413 -5.803 -5.911 228 HA3 GLY 530 HA3 GLY 530 1.010 -4.673 -4.693 229 H ALA 531 H ALA 531 1.077 -7.923 -5.820 230 HA ALA 531 HA ALA 531 2.601 -8.838 -3.553 231 HB1 ALA 531 HB1 ALA 531 1.905 -10.228 -6.144 232 HB2 ALA 531 HB2 ALA 531 1.001 -10.329 -4.630 233 HB3 ALA 531 HB3 ALA 531 2.630 -10.984 -4.720 234 H ARG 532 H ARG 532 4.632 -8.382 -3.400 235 HA ARG 532 HA ARG 532 6.193 -7.869 -5.837 236 HB2 ARG 532 HB2 ARG 532 6.319 -6.450 -3.172 237 HB3 ARG 532 HB3 ARG 532 7.399 -6.163 -4.526 238 HG2 ARG 532 HG2 ARG 532 4.422 -5.774 -4.680 239 HG3 ARG 532 HG3 ARG 532 5.520 -4.476 -4.241 240 HD2 ARG 532 HD2 ARG 532 6.681 -4.779 -6.390 241 HD3 ARG 532 HD3 ARG 532 5.535 -6.049 -6.812 242 HE ARG 532 HE ARG 532 3.788 -4.318 -6.677 243 HH11 ARG 532 HH11 ARG 532 7.140 -3.284 -7.255 244 HH12 ARG 532 HH12 ARG 532 6.695 -1.849 -8.034 245 HH21 ARG 532 HH21 ARG 532 3.200 -2.374 -7.823 246 HH22 ARG 532 HH22 ARG 532 4.415 -1.318 -8.382 247 H GLY 533 H GLY 533 7.432 -9.636 -5.991 248 HA2 GLY 533 HA2 GLY 533 9.373 -10.798 -5.585 249 HA3 GLY 533 HA3 GLY 533 9.578 -9.865 -4.114 250 H ASN 534 H ASN 534 9.702 -11.121 -2.432 251 HA ASN 534 HA ASN 534 7.801 -13.299 -2.123 252 HB2 ASN 534 HB2 ASN 534 9.895 -14.305 -2.886 253 HB3 ASN 534 HB3 ASN 534 10.788 -13.454 -1.637 254 HD21 ASN 534 HD21 ASN 534 7.671 -15.012 -1.076 255 HD22 ASN 534 HD22 ASN 534 8.285 -16.229 -0.045 256 H VAL 535 H VAL 535 6.781 -13.222 -0.216 257 HA VAL 535 HA VAL 535 7.962 -11.709 1.992 258 HB VAL 535 HB VAL 535 5.068 -11.626 1.088 259 HG11 VAL 535 HG11 VAL 535 6.471 -10.147 3.300 260 HG12 VAL 535 HG12 VAL 535 5.267 -11.422 3.486 261 HG13 VAL 535 HG13 VAL 535 4.811 -9.870 2.782 262 HG21 VAL 535 HG21 VAL 535 6.468 -10.392 -0.437 263 HG22 VAL 535 HG22 VAL 535 7.198 -9.511 0.904 264 HG23 VAL 535 HG23 VAL 535 5.486 -9.267 0.514 265 H ILE 536 H ILE 536 7.660 -12.724 3.941 266 HA ILE 536 HA ILE 536 6.097 -15.197 3.877 267 HB ILE 536 HB ILE 536 8.399 -14.409 5.683 268 HG12 ILE 536 HG12 ILE 536 9.122 -15.147 3.479 269 HG13 ILE 536 HG13 ILE 536 9.550 -16.353 4.694 270 HG21 ILE 536 HG21 ILE 536 6.731 -16.883 5.731 271 HG22 ILE 536 HG22 ILE 536 6.733 -15.605 6.941 272 HG23 ILE 536 HG23 ILE 536 8.177 -16.612 6.714 273 HD11 ILE 536 HD11 ILE 536 7.379 -16.438 2.630 274 HD12 ILE 536 HD12 ILE 536 7.453 -17.553 3.978 275 HD13 ILE 536 HD13 ILE 536 8.766 -17.518 2.794 276 H VAL 537 H VAL 537 4.456 -15.451 5.275 277 HA VAL 537 HA VAL 537 4.022 -13.267 7.158 278 HB VAL 537 HB VAL 537 1.866 -14.877 5.754 279 HG11 VAL 537 HG11 VAL 537 1.633 -12.461 7.550 280 HG12 VAL 537 HG12 VAL 537 1.157 -14.111 7.953 281 HG13 VAL 537 HG13 VAL 537 0.301 -13.231 6.686 282 HG21 VAL 537 HG21 VAL 537 1.389 -12.821 4.496 283 HG22 VAL 537 HG22 VAL 537 3.038 -13.405 4.215 284 HG23 VAL 537 HG23 VAL 537 2.763 -12.041 5.288 285 HA PRO 538 HA PRO 538 4.261 -16.911 9.897 286 HB2 PRO 538 HB2 PRO 538 4.523 -15.503 12.194 287 HB3 PRO 538 HB3 PRO 538 5.877 -15.810 11.106 288 HG2 PRO 538 HG2 PRO 538 4.213 -13.344 11.419 289 HG3 PRO 538 HG3 PRO 538 5.958 -13.488 11.155 290 HD2 PRO 538 HD2 PRO 538 4.186 -12.871 9.176 291 HD3 PRO 538 HD3 PRO 538 5.725 -13.701 8.887 292 H TYR 539 H TYR 539 2.859 -17.779 11.482 293 HA TYR 539 HA TYR 539 0.528 -16.264 12.291 294 HB2 TYR 539 HB2 TYR 539 -1.115 -17.805 11.331 295 HB3 TYR 539 HB3 TYR 539 -0.107 -17.096 10.069 296 HD1 TYR 539 HD2 TYR 539 -0.921 -20.197 11.875 297 HD2 TYR 539 HD1 TYR 539 1.377 -18.442 8.765 298 HE1 TYR 539 HE2 TYR 539 -0.426 -22.427 11.000 299 HE2 TYR 539 HE1 TYR 539 1.878 -20.669 7.875 300 HH TYR 539 HH TYR 539 2.004 -22.966 8.677 301 H LYS 540 H LYS 540 -0.831 -17.489 13.756 302 HA LYS 540 HA LYS 540 0.150 -19.999 14.822 303 HB2 LYS 540 HB2 LYS 540 0.812 -19.296 16.954 304 HB3 LYS 540 HB3 LYS 540 1.504 -18.051 15.926 305 HG2 LYS 540 HG2 LYS 540 -0.389 -16.596 16.412 306 HG3 LYS 540 HG3 LYS 540 -1.087 -17.849 17.428 307 HD2 LYS 540 HD2 LYS 540 1.100 -17.735 18.738 308 HD3 LYS 540 HD3 LYS 540 1.365 -16.203 17.891 309 HE2 LYS 540 HE2 LYS 540 0.216 -15.531 19.837 310 HE3 LYS 540 HE3 LYS 540 -1.020 -15.683 18.571 311 HZ1 LYS 540 HZ1 LYS 540 -1.776 -16.694 20.606 312 HZ2 LYS 540 HZ2 LYS 540 -0.454 -17.689 20.652 313 HZ3 LYS 540 HZ3 LYS 540 -1.581 -17.910 19.446 314 H THR 541 H THR 541 -1.355 -20.940 16.297 315 HA THR 541 HA THR 541 -4.032 -19.967 16.098 316 HB THR 541 HB THR 541 -4.370 -22.018 17.636 317 HG1 THR 541 HG1 THR 541 -2.317 -22.421 18.338 318 HG21 THR 541 HG21 THR 541 -4.176 -23.591 15.729 319 HG22 THR 541 HG22 THR 541 -3.190 -22.396 14.881 320 HG23 THR 541 HG23 THR 541 -4.881 -22.052 15.232 321 H ILE 542 H ILE 542 -5.334 -19.557 17.985 322 HA ILE 542 HA ILE 542 -3.949 -18.760 20.470 323 HB ILE 542 HB ILE 542 -6.188 -17.385 18.996 324 HG12 ILE 542 HG12 ILE 542 -3.432 -16.295 19.589 325 HG13 ILE 542 HG13 ILE 542 -3.914 -16.990 18.046 326 HG21 ILE 542 HG21 ILE 542 -6.572 -17.210 21.377 327 HG22 ILE 542 HG22 ILE 542 -6.073 -15.634 20.764 328 HG23 ILE 542 HG23 ILE 542 -4.924 -16.642 21.641 329 HD11 ILE 542 HD11 ILE 542 -5.517 -15.250 17.713 330 HD12 ILE 542 HD12 ILE 542 -3.940 -14.532 18.080 331 HD13 ILE 542 HD13 ILE 542 -5.198 -14.586 19.316 332 H GLU 543 H GLU 543 -4.846 -20.010 22.081 333 HA GLU 543 HA GLU 543 -7.229 -21.513 21.696 334 HB2 GLU 543 HB2 GLU 543 -6.053 -20.923 24.413 335 HB3 GLU 543 HB3 GLU 543 -6.983 -22.317 23.917 336 HG2 GLU 543 HG2 GLU 543 -4.857 -23.184 24.091 337 HG3 GLU 543 HG3 GLU 543 -4.947 -22.784 22.374 338 H GLY 544 H GLY 544 -9.103 -20.452 21.495 339 HA2 GLY 544 HA2 GLY 544 -9.725 -18.157 23.155 340 HA3 GLY 544 HA3 GLY 544 -10.799 -18.913 21.974 341 H THR 545 H THR 545 -12.082 -20.628 22.570 342 HA THR 545 HA THR 545 -12.155 -21.225 25.434 343 HB THR 545 HB THR 545 -14.527 -22.009 24.839 344 HG1 THR 545 HG1 THR 545 -15.051 -20.431 22.881 345 HG21 THR 545 HG21 THR 545 -14.048 -19.922 26.068 346 HG22 THR 545 HG22 THR 545 -15.439 -19.745 25.007 347 HG23 THR 545 HG23 THR 545 -13.877 -19.069 24.533 348 H ALA 546 H ALA 546 -10.845 -22.298 22.823 349 HA ALA 546 HA ALA 546 -11.685 -25.087 22.983 350 HB1 ALA 546 HB1 ALA 546 -10.620 -25.392 20.854 351 HB2 ALA 546 HB2 ALA 546 -9.880 -23.803 20.961 352 HB3 ALA 546 HB3 ALA 546 -11.624 -23.936 20.754 353 H ARG 547 H ARG 547 -10.304 -26.681 23.489 354 HA ARG 547 HA ARG 547 -8.048 -25.999 25.099 355 HB2 ARG 547 HB2 ARG 547 -9.141 -28.641 24.227 356 HB3 ARG 547 HB3 ARG 547 -7.934 -28.383 25.484 357 HG2 ARG 547 HG2 ARG 547 -9.394 -27.206 26.769 358 HG3 ARG 547 HG3 ARG 547 -10.692 -27.223 25.561 359 HD2 ARG 547 HD2 ARG 547 -10.344 -29.835 25.677 360 HD3 ARG 547 HD3 ARG 547 -9.685 -29.484 27.272 361 HE ARG 547 HE ARG 547 -12.162 -28.221 26.912 362 HH11 ARG 547 HH11 ARG 547 -10.749 -31.351 27.758 363 HH12 ARG 547 HH12 ARG 547 -12.237 -32.044 28.209 364 HH21 ARG 547 HH21 ARG 547 -14.252 -29.274 27.508 365 HH22 ARG 547 HH22 ARG 547 -14.205 -30.893 28.008 366 H GLY 548 H GLY 548 -6.106 -26.026 24.595 367 HA2 GLY 548 HA2 GLY 548 -5.316 -26.526 21.796 368 HA3 GLY 548 HA3 GLY 548 -4.354 -25.650 22.977 369 H GLY 549 H GLY 549 -2.898 -27.360 21.564 370 HA2 GLY 549 HA2 GLY 549 -1.318 -28.909 22.034 371 HA3 GLY 549 HA3 GLY 549 -2.136 -29.281 23.540 372 H GLY 550 H GLY 550 -4.060 -29.364 20.661 373 HA2 GLY 550 HA2 GLY 550 -4.767 -31.141 19.356 374 HA3 GLY 550 HA3 GLY 550 -3.602 -32.176 20.177 375 H GLU 551 H GLU 551 -5.729 -30.177 21.962 376 HA GLU 551 HA GLU 551 -6.910 -32.559 23.102 377 HB2 GLU 551 HB2 GLU 551 -5.758 -30.703 24.415 378 HB3 GLU 551 HB3 GLU 551 -7.153 -29.713 24.050 379 HG2 GLU 551 HG2 GLU 551 -8.552 -31.007 25.406 380 HG3 GLU 551 HG3 GLU 551 -7.402 -32.346 25.457 381 H ASP 552 H ASP 552 -8.204 -29.283 22.212 382 HA ASP 552 HA ASP 552 -10.543 -30.655 21.026 383 HB2 ASP 552 HB2 ASP 552 -10.068 -27.719 21.625 384 HB3 ASP 552 HB3 ASP 552 -11.369 -28.257 20.585 385 H PHE 553 H PHE 553 -7.797 -28.655 20.363 386 HA PHE 553 HA PHE 553 -8.040 -29.344 17.565 387 HB2 PHE 553 HB2 PHE 553 -7.734 -27.100 16.746 388 HB3 PHE 553 HB3 PHE 553 -9.094 -27.066 17.853 389 HD1 PHE 553 HD1 PHE 553 -8.697 -26.153 20.195 390 HD2 PHE 553 HD2 PHE 553 -5.887 -25.709 17.045 391 HE1 PHE 553 HE1 PHE 553 -7.628 -24.294 21.409 392 HE2 PHE 553 HE2 PHE 553 -4.814 -23.867 18.250 393 HZ PHE 553 HZ PHE 553 -5.684 -23.149 20.432 394 H GLU 554 H GLU 554 -6.075 -29.405 16.535 395 HA GLU 554 HA GLU 554 -3.765 -29.589 18.255 396 HB2 GLU 554 HB2 GLU 554 -4.568 -31.098 16.257 397 HB3 GLU 554 HB3 GLU 554 -3.885 -29.831 15.265 398 HG2 GLU 554 HG2 GLU 554 -2.362 -31.410 17.307 399 HG3 GLU 554 HG3 GLU 554 -2.451 -31.807 15.597 400 H ASP 555 H ASP 555 -2.724 -27.724 18.679 401 HA ASP 555 HA ASP 555 -3.318 -25.346 17.199 402 HB2 ASP 555 HB2 ASP 555 -1.903 -24.219 18.862 403 HB3 ASP 555 HB3 ASP 555 -3.117 -25.236 19.628 404 H THR 556 H THR 556 -1.776 -24.030 16.143 405 HA THR 556 HA THR 556 0.630 -25.395 15.372 406 HB THR 556 HB THR 556 -1.151 -26.316 13.887 407 HG1 THR 556 HG1 THR 556 0.790 -26.362 13.003 408 HG21 THR 556 HG21 THR 556 -2.136 -24.882 12.122 409 HG22 THR 556 HG22 THR 556 -1.375 -23.474 12.857 410 HG23 THR 556 HG23 THR 556 -2.621 -24.355 13.729 411 H CYS 557 H CYS 557 2.025 -24.052 14.132 412 HA CYS 557 HA CYS 557 1.444 -21.303 13.747 413 HB2 CYS 557 HB2 CYS 557 3.469 -20.619 15.139 414 HB3 CYS 557 HB3 CYS 557 2.051 -21.100 16.060 415 HG CYS 557 HG CYS 557 3.018 -23.448 16.977 416 H GLY 558 H GLY 558 3.152 -20.332 12.399 417 HA2 GLY 558 HA2 GLY 558 5.425 -21.574 11.589 418 HA3 GLY 558 HA3 GLY 558 4.136 -22.242 10.592 419 H GLU 559 H GLU 559 5.217 -21.199 8.846 420 HA GLU 559 HA GLU 559 4.523 -18.368 8.644 421 HB2 GLU 559 HB2 GLU 559 7.007 -19.791 7.788 422 HB3 GLU 559 HB3 GLU 559 6.594 -18.156 7.267 423 HG2 GLU 559 HG2 GLU 559 6.743 -17.396 9.574 424 HG3 GLU 559 HG3 GLU 559 7.072 -19.042 10.112 425 H LEU 560 H LEU 560 3.653 -17.758 6.728 426 HA LEU 560 HA LEU 560 3.249 -19.819 4.677 427 HB2 LEU 560 HB2 LEU 560 1.727 -17.299 5.284 428 HB3 LEU 560 HB3 LEU 560 1.451 -18.292 3.869 429 HG LEU 560 HG LEU 560 1.030 -19.102 6.730 430 HD11 LEU 560 HD11 LEU 560 -0.912 -18.579 4.500 431 HD12 LEU 560 HD12 LEU 560 -0.649 -17.573 5.926 432 HD13 LEU 560 HD13 LEU 560 -1.310 -19.198 6.099 433 HD21 LEU 560 HD21 LEU 560 1.757 -21.046 5.566 434 HD22 LEU 560 HD22 LEU 560 0.821 -20.649 4.157 435 HD23 LEU 560 HD23 LEU 560 -0.007 -21.156 5.641 436 H GLU 561 H GLU 561 3.840 -19.443 2.640 437 HA GLU 561 HA GLU 561 5.628 -17.183 2.292 438 HB2 GLU 561 HB2 GLU 561 6.486 -19.495 2.034 439 HB3 GLU 561 HB3 GLU 561 5.377 -19.710 0.690 440 HG2 GLU 561 HG2 GLU 561 6.561 -17.688 -0.363 441 HG3 GLU 561 HG3 GLU 561 7.720 -17.898 0.905 442 H PHE 562 H PHE 562 4.834 -15.528 1.205 443 HA PHE 562 HA PHE 562 3.010 -16.062 -1.013 444 HB2 PHE 562 HB2 PHE 562 3.164 -13.708 0.864 445 HB3 PHE 562 HB3 PHE 562 2.330 -13.631 -0.681 446 HD1 PHE 562 HD2 PHE 562 2.285 -15.056 2.701 447 HD2 PHE 562 HD1 PHE 562 0.258 -14.766 -1.028 448 HE1 PHE 562 HE2 PHE 562 0.240 -15.938 3.739 449 HE2 PHE 562 HE1 PHE 562 -1.771 -15.632 -0.010 450 HZ PHE 562 HZ PHE 562 -1.795 -16.228 2.378 451 H GLN 563 H GLN 563 3.388 -14.796 -2.913 452 HA GLN 563 HA GLN 563 5.881 -13.351 -3.002 453 HB2 GLN 563 HB2 GLN 563 5.403 -15.681 -4.885 454 HB3 GLN 563 HB3 GLN 563 6.803 -14.639 -4.818 455 HG2 GLN 563 HG2 GLN 563 7.307 -15.572 -2.577 456 HG3 GLN 563 HG3 GLN 563 5.990 -16.721 -2.803 457 HE21 GLN 563 HE21 GLN 563 8.327 -15.583 -5.224 458 HE22 GLN 563 HE22 GLN 563 9.017 -17.147 -5.418 459 H ASN 564 H ASN 564 6.120 -12.826 -5.467 460 HA ASN 564 HA ASN 564 3.801 -11.522 -6.378 461 HB2 ASN 564 HB2 ASN 564 5.096 -11.076 -8.449 462 HB3 ASN 564 HB3 ASN 564 6.030 -10.720 -7.006 463 HD21 ASN 564 HD21 ASN 564 6.940 -11.252 -9.682 464 HD22 ASN 564 HD22 ASN 564 7.992 -12.614 -9.603 465 H ASP 565 H ASP 565 5.199 -14.622 -6.821 466 HA ASP 565 HA ASP 565 3.301 -15.429 -8.872 467 HB2 ASP 565 HB2 ASP 565 5.580 -16.219 -9.148 468 HB3 ASP 565 HB3 ASP 565 5.520 -17.010 -7.576 469 H GLU 566 H GLU 566 4.123 -16.575 -5.526 470 HA GLU 566 HA GLU 566 2.120 -18.426 -5.223 471 HB2 GLU 566 HB2 GLU 566 3.394 -16.568 -3.235 472 HB3 GLU 566 HB3 GLU 566 2.209 -17.800 -2.831 473 HG2 GLU 566 HG2 GLU 566 4.866 -18.346 -4.128 474 HG3 GLU 566 HG3 GLU 566 4.555 -18.444 -2.393 475 H ILE 567 H ILE 567 0.030 -18.262 -5.069 476 HA ILE 567 HA ILE 567 -1.115 -15.613 -4.947 477 HB ILE 567 HB ILE 567 -3.326 -16.828 -5.496 478 HG12 ILE 567 HG12 ILE 567 -1.497 -18.922 -6.633 479 HG13 ILE 567 HG13 ILE 567 -2.196 -19.174 -5.048 480 HG21 ILE 567 HG21 ILE 567 -2.788 -16.796 -7.898 481 HG22 ILE 567 HG22 ILE 567 -1.074 -16.703 -7.495 482 HG23 ILE 567 HG23 ILE 567 -2.157 -15.385 -7.047 483 HD11 ILE 567 HD11 ILE 567 -4.394 -18.988 -6.023 484 HD12 ILE 567 HD12 ILE 567 -3.459 -20.292 -6.761 485 HD13 ILE 567 HD13 ILE 567 -3.690 -18.761 -7.627 486 H VAL 568 H VAL 568 -2.464 -18.622 -3.564 487 HA VAL 568 HA VAL 568 -2.899 -17.032 -1.151 488 HB VAL 568 HB VAL 568 -5.038 -17.469 -2.363 489 HG11 VAL 568 HG11 VAL 568 -4.377 -20.336 -1.969 490 HG12 VAL 568 HG12 VAL 568 -4.545 -19.469 -3.506 491 HG13 VAL 568 HG13 VAL 568 -5.945 -19.699 -2.442 492 HG21 VAL 568 HG21 VAL 568 -5.125 -17.267 0.056 493 HG22 VAL 568 HG22 VAL 568 -4.826 -18.997 0.220 494 HG23 VAL 568 HG23 VAL 568 -6.319 -18.425 -0.531 495 H LYS 569 H LYS 569 -2.646 -18.091 0.800 496 HA LYS 569 HA LYS 569 -1.577 -20.804 0.689 497 HB2 LYS 569 HB2 LYS 569 -0.873 -18.498 2.470 498 HB3 LYS 569 HB3 LYS 569 -0.381 -20.163 2.773 499 HG2 LYS 569 HG2 LYS 569 0.171 -19.124 0.152 500 HG3 LYS 569 HG3 LYS 569 1.106 -18.322 1.432 501 HD2 LYS 569 HD2 LYS 569 2.478 -20.122 0.661 502 HD3 LYS 569 HD3 LYS 569 1.720 -20.744 2.105 503 HE2 LYS 569 HE2 LYS 569 1.695 -22.425 0.354 504 HE3 LYS 569 HE3 LYS 569 0.059 -21.931 0.748 505 HZ1 LYS 569 HZ1 LYS 569 1.615 -20.958 -1.623 506 HZ2 LYS 569 HZ2 LYS 569 -0.016 -20.610 -1.308 507 HZ3 LYS 569 HZ3 LYS 569 0.468 -22.170 -1.631 508 H THR 570 H THR 570 -1.996 -21.973 2.630 509 HA THR 570 HA THR 570 -4.453 -21.126 3.994 510 HB THR 570 HB THR 570 -4.962 -23.665 4.088 511 HG1 THR 570 HG1 THR 570 -4.171 -24.887 2.483 512 HG21 THR 570 HG21 THR 570 -6.221 -23.569 2.017 513 HG22 THR 570 HG22 THR 570 -5.322 -22.131 1.500 514 HG23 THR 570 HG23 THR 570 -6.385 -22.061 2.907 515 H ILE 571 H ILE 571 -4.655 -21.576 6.093 516 HA ILE 571 HA ILE 571 -2.375 -22.789 7.469 517 HB ILE 571 HB ILE 571 -4.842 -21.389 8.613 518 HG12 ILE 571 HG12 ILE 571 -3.086 -19.834 9.616 519 HG13 ILE 571 HG13 ILE 571 -1.943 -20.591 8.519 520 HG21 ILE 571 HG21 ILE 571 -2.543 -22.598 10.133 521 HG22 ILE 571 HG22 ILE 571 -4.190 -23.209 10.061 522 HG23 ILE 571 HG23 ILE 571 -3.861 -21.653 10.832 523 HD11 ILE 571 HD11 ILE 571 -3.279 -19.834 6.640 524 HD12 ILE 571 HD12 ILE 571 -2.691 -18.518 7.654 525 HD13 ILE 571 HD13 ILE 571 -4.385 -19.026 7.761 526 H SER 572 H SER 572 -2.460 -24.843 7.981 527 HA SER 572 HA SER 572 -4.989 -26.293 7.712 528 HB2 SER 572 HB2 SER 572 -2.159 -27.329 7.879 529 HB3 SER 572 HB3 SER 572 -3.607 -28.219 7.397 530 HG SER 572 HG SER 572 -3.333 -25.970 5.971 531 H VAL 573 H VAL 573 -5.985 -26.714 9.558 532 HA VAL 573 HA VAL 573 -4.336 -27.237 11.934 533 HB VAL 573 HB VAL 573 -7.051 -25.875 11.902 534 HG11 VAL 573 HG11 VAL 573 -5.306 -26.578 14.257 535 HG12 VAL 573 HG12 VAL 573 -6.894 -27.268 13.864 536 HG13 VAL 573 HG13 VAL 573 -6.749 -25.569 14.315 537 HG21 VAL 573 HG21 VAL 573 -5.842 -23.945 12.848 538 HG22 VAL 573 HG22 VAL 573 -5.306 -24.377 11.224 539 HG23 VAL 573 HG23 VAL 573 -4.327 -24.823 12.620 540 H LYS 574 H LYS 574 -4.620 -29.167 12.816 541 HA LYS 574 HA LYS 574 -6.666 -30.928 11.849 542 HB2 LYS 574 HB2 LYS 574 -4.526 -31.952 12.310 543 HB3 LYS 574 HB3 LYS 574 -4.479 -31.279 13.926 544 HG2 LYS 574 HG2 LYS 574 -4.956 -33.667 14.019 545 HG3 LYS 574 HG3 LYS 574 -6.337 -32.738 14.594 546 HD2 LYS 574 HD2 LYS 574 -7.358 -32.988 12.332 547 HD3 LYS 574 HD3 LYS 574 -6.025 -34.054 11.898 548 HE2 LYS 574 HE2 LYS 574 -7.926 -34.532 14.196 549 HE3 LYS 574 HE3 LYS 574 -8.115 -35.222 12.590 550 HZ1 LYS 574 HZ1 LYS 574 -5.837 -35.751 14.455 551 HZ2 LYS 574 HZ2 LYS 574 -5.983 -36.368 12.902 552 HZ3 LYS 574 HZ3 LYS 574 -7.091 -36.814 14.080 553 H VAL 575 H VAL 575 -8.607 -30.806 12.508 554 HA VAL 575 HA VAL 575 -9.251 -29.654 15.077 555 HB VAL 575 HB VAL 575 -11.085 -30.817 12.943 556 HG11 VAL 575 HG11 VAL 575 -11.759 -29.067 15.322 557 HG12 VAL 575 HG12 VAL 575 -12.120 -30.781 15.171 558 HG13 VAL 575 HG13 VAL 575 -12.885 -29.622 14.092 559 HG21 VAL 575 HG21 VAL 575 -11.561 -28.490 12.325 560 HG22 VAL 575 HG22 VAL 575 -9.856 -28.885 12.098 561 HG23 VAL 575 HG23 VAL 575 -10.365 -27.939 13.496 562 H ILE 576 H ILE 576 -9.469 -30.856 16.819 563 HA ILE 576 HA ILE 576 -9.182 -33.738 16.583 564 HB ILE 576 HB ILE 576 -9.233 -31.932 19.029 565 HG12 ILE 576 HG12 ILE 576 -7.371 -31.349 17.524 566 HG13 ILE 576 HG13 ILE 576 -6.816 -32.015 19.053 567 HG21 ILE 576 HG21 ILE 576 -8.240 -34.757 18.713 568 HG22 ILE 576 HG22 ILE 576 -9.707 -34.257 19.559 569 HG23 ILE 576 HG23 ILE 576 -8.117 -33.765 20.167 570 HD11 ILE 576 HD11 ILE 576 -5.505 -32.826 17.191 571 HD12 ILE 576 HD12 ILE 576 -6.961 -33.478 16.426 572 HD13 ILE 576 HD13 ILE 576 -6.388 -34.146 17.956 573 H ASP 577 H ASP 577 -10.527 -35.140 17.478 574 HA ASP 577 HA ASP 577 -13.255 -34.611 17.138 575 HB2 ASP 577 HB2 ASP 577 -13.568 -36.892 18.003 576 HB3 ASP 577 HB3 ASP 577 -12.392 -36.821 16.705 577 H ASP 578 H ASP 578 -14.870 -34.505 18.555 578 HA ASP 578 HA ASP 578 -14.532 -32.722 20.643 579 HB2 ASP 578 HB2 ASP 578 -16.860 -32.967 21.208 580 HB3 ASP 578 HB3 ASP 578 -16.684 -33.067 19.470 581 H GLU 579 H GLU 579 -14.692 -32.735 22.834 582 HA GLU 579 HA GLU 579 -13.370 -34.926 24.005 583 HB2 GLU 579 HB2 GLU 579 -14.097 -32.230 25.012 584 HB3 GLU 579 HB3 GLU 579 -13.570 -33.470 26.143 585 HG2 GLU 579 HG2 GLU 579 -12.010 -32.628 23.711 586 HG3 GLU 579 HG3 GLU 579 -11.740 -32.009 25.345 587 H GLU 580 H GLU 580 -15.912 -33.435 25.940 588 HA GLU 580 HA GLU 580 -16.978 -36.130 26.071 589 HB2 GLU 580 HB2 GLU 580 -17.445 -35.887 28.519 590 HB3 GLU 580 HB3 GLU 580 -15.757 -36.003 28.077 591 HG2 GLU 580 HG2 GLU 580 -17.160 -33.420 28.725 592 HG3 GLU 580 HG3 GLU 580 -16.304 -34.391 29.910 593 H TYR 581 H TYR 581 -18.015 -32.808 26.887 594 HA TYR 581 HA TYR 581 -20.571 -33.548 25.705 595 HB2 TYR 581 HB2 TYR 581 -21.821 -32.465 27.606 596 HB3 TYR 581 HB3 TYR 581 -21.047 -33.982 28.014 597 HD1 TYR 581 HD2 TYR 581 -20.871 -30.308 28.452 598 HD2 TYR 581 HD1 TYR 581 -19.396 -34.085 29.718 599 HE1 TYR 581 HE2 TYR 581 -19.821 -29.241 30.398 600 HE2 TYR 581 HE1 TYR 581 -18.353 -33.034 31.667 601 HH TYR 581 HH TYR 581 -17.529 -30.780 32.290 602 H GLU 582 H GLU 582 -18.400 -32.007 24.871 603 HA GLU 582 HA GLU 582 -18.886 -29.261 25.370 604 HB2 GLU 582 HB2 GLU 582 -17.194 -30.528 23.220 605 HB3 GLU 582 HB3 GLU 582 -17.125 -28.854 23.759 606 HG2 GLU 582 HG2 GLU 582 -16.419 -31.299 25.379 607 HG3 GLU 582 HG3 GLU 582 -15.300 -30.097 24.740 608 H LYS 583 H LYS 583 -19.839 -27.789 24.149 609 HA LYS 583 HA LYS 583 -21.833 -28.738 22.294 610 HB2 LYS 583 HB2 LYS 583 -22.429 -27.059 23.972 611 HB3 LYS 583 HB3 LYS 583 -21.201 -25.979 23.332 612 HG2 LYS 583 HG2 LYS 583 -22.420 -25.798 21.238 613 HG3 LYS 583 HG3 LYS 583 -23.634 -26.927 21.834 614 HD2 LYS 583 HD2 LYS 583 -24.439 -24.652 22.040 615 HD3 LYS 583 HD3 LYS 583 -24.187 -25.375 23.626 616 HE2 LYS 583 HE2 LYS 583 -22.067 -24.189 23.859 617 HE3 LYS 583 HE3 LYS 583 -22.251 -23.508 22.243 618 HZ1 LYS 583 HZ1 LYS 583 -22.885 -21.938 23.957 619 HZ2 LYS 583 HZ2 LYS 583 -24.058 -22.999 24.548 620 HZ3 LYS 583 HZ3 LYS 583 -24.212 -22.347 23.001 621 H ASN 584 H ASN 584 -19.275 -26.289 22.252 622 HA ASN 584 HA ASN 584 -18.350 -27.050 19.723 623 HB2 ASN 584 HB2 ASN 584 -18.905 -25.025 18.458 624 HB3 ASN 584 HB3 ASN 584 -20.393 -25.791 18.983 625 HD21 ASN 584 HD21 ASN 584 -19.921 -23.090 18.153 626 HD22 ASN 584 HD22 ASN 584 -20.387 -22.073 19.467 627 H LYS 585 H LYS 585 -16.606 -25.475 19.109 628 HA LYS 585 HA LYS 585 -15.511 -24.150 21.502 629 HB2 LYS 585 HB2 LYS 585 -14.064 -26.089 19.688 630 HB3 LYS 585 HB3 LYS 585 -13.281 -25.057 20.870 631 HG2 LYS 585 HG2 LYS 585 -15.300 -27.190 21.484 632 HG3 LYS 585 HG3 LYS 585 -13.548 -27.337 21.669 633 HD2 LYS 585 HD2 LYS 585 -13.604 -25.427 23.256 634 HD3 LYS 585 HD3 LYS 585 -15.356 -25.401 23.097 635 HE2 LYS 585 HE2 LYS 585 -15.513 -27.622 23.963 636 HE3 LYS 585 HE3 LYS 585 -13.756 -27.738 24.055 637 HZ1 LYS 585 HZ1 LYS 585 -13.713 -26.049 25.704 638 HZ2 LYS 585 HZ2 LYS 585 -14.861 -27.224 26.142 639 HZ3 LYS 585 HZ3 LYS 585 -15.373 -25.746 25.536 640 H THR 586 H THR 586 -13.919 -22.512 20.953 641 HA THR 586 HA THR 586 -13.494 -22.148 18.180 642 HB THR 586 HB THR 586 -15.543 -20.877 18.378 643 HG1 THR 586 HG1 THR 586 -13.698 -20.036 17.186 644 HG21 THR 586 HG21 THR 586 -15.530 -20.404 20.762 645 HG22 THR 586 HG22 THR 586 -15.761 -18.936 19.809 646 HG23 THR 586 HG23 THR 586 -14.184 -19.274 20.541 647 H PHE 587 H PHE 587 -11.693 -21.154 17.665 648 HA PHE 587 HA PHE 587 -10.080 -19.999 19.778 649 HB2 PHE 587 HB2 PHE 587 -8.093 -21.237 19.048 650 HB3 PHE 587 HB3 PHE 587 -9.339 -22.357 19.558 651 HD1 PHE 587 HD1 PHE 587 -10.552 -23.699 17.845 652 HD2 PHE 587 HD2 PHE 587 -7.229 -21.235 16.846 653 HE1 PHE 587 HE1 PHE 587 -10.263 -24.931 15.727 654 HE2 PHE 587 HE2 PHE 587 -6.950 -22.461 14.734 655 HZ PHE 587 HZ PHE 587 -8.468 -24.311 14.181 656 H PHE 588 H PHE 588 -8.102 -18.910 18.609 657 HA PHE 588 HA PHE 588 -9.287 -17.618 16.266 658 HB2 PHE 588 HB2 PHE 588 -7.576 -16.293 18.411 659 HB3 PHE 588 HB3 PHE 588 -8.153 -15.530 16.943 660 HD1 PHE 588 HD1 PHE 588 -9.176 -16.998 20.159 661 HD2 PHE 588 HD2 PHE 588 -10.340 -14.630 16.814 662 HE1 PHE 588 HE1 PHE 588 -11.221 -16.335 21.347 663 HE2 PHE 588 HE2 PHE 588 -12.386 -13.977 17.992 664 HZ PHE 588 HZ PHE 588 -12.830 -14.827 20.266 665 H LEU 589 H LEU 589 -7.783 -16.741 14.803 666 HA LEU 589 HA LEU 589 -5.165 -18.086 14.840 667 HB2 LEU 589 HB2 LEU 589 -7.177 -18.675 13.088 668 HB3 LEU 589 HB3 LEU 589 -6.399 -17.354 12.244 669 HG LEU 589 HG LEU 589 -5.594 -19.433 11.379 670 HD11 LEU 589 HD11 LEU 589 -3.181 -19.296 11.786 671 HD12 LEU 589 HD12 LEU 589 -3.490 -18.138 13.081 672 HD13 LEU 589 HD13 LEU 589 -3.913 -17.739 11.416 673 HD21 LEU 589 HD21 LEU 589 -6.102 -20.897 13.179 674 HD22 LEU 589 HD22 LEU 589 -4.945 -20.094 14.221 675 HD23 LEU 589 HD23 LEU 589 -4.370 -21.032 12.835 676 H GLU 590 H GLU 590 -3.551 -16.660 14.697 677 HA GLU 590 HA GLU 590 -4.210 -13.948 13.775 678 HB2 GLU 590 HB2 GLU 590 -3.843 -13.971 16.171 679 HB3 GLU 590 HB3 GLU 590 -2.277 -14.750 15.950 680 HG2 GLU 590 HG2 GLU 590 -1.610 -12.728 14.597 681 HG3 GLU 590 HG3 GLU 590 -3.099 -11.971 15.156 682 H ILE 591 H ILE 591 -3.136 -13.424 12.030 683 HA ILE 591 HA ILE 591 -0.613 -14.736 11.474 684 HB ILE 591 HB ILE 591 -0.757 -13.593 9.240 685 HG12 ILE 591 HG12 ILE 591 -3.557 -12.855 10.151 686 HG13 ILE 591 HG13 ILE 591 -2.239 -11.723 9.889 687 HG21 ILE 591 HG21 ILE 591 -1.422 -15.880 9.449 688 HG22 ILE 591 HG22 ILE 591 -2.541 -15.076 8.341 689 HG23 ILE 591 HG23 ILE 591 -3.016 -15.412 10.010 690 HD11 ILE 591 HD11 ILE 591 -3.550 -13.431 7.784 691 HD12 ILE 591 HD12 ILE 591 -2.240 -12.280 7.509 692 HD13 ILE 591 HD13 ILE 591 -3.824 -11.710 8.048 693 H GLY 592 H GLY 592 1.237 -13.654 11.462 694 HA2 GLY 592 HA2 GLY 592 1.224 -11.190 12.971 695 HA3 GLY 592 HA3 GLY 592 2.634 -12.169 12.575 696 H GLU 593 H GLU 593 3.236 -9.774 12.239 697 HA GLU 593 HA GLU 593 2.325 -8.573 9.867 698 HB2 GLU 593 HB2 GLU 593 4.790 -8.027 11.493 699 HB3 GLU 593 HB3 GLU 593 4.319 -7.074 10.092 700 HG2 GLU 593 HG2 GLU 593 2.164 -6.628 11.218 701 HG3 GLU 593 HG3 GLU 593 2.812 -7.397 12.668 702 HA PRO 594 HA PRO 594 4.426 -10.894 6.850 703 HB2 PRO 594 HB2 PRO 594 4.411 -8.972 4.877 704 HB3 PRO 594 HB3 PRO 594 3.040 -10.017 5.244 705 HG2 PRO 594 HG2 PRO 594 3.559 -7.206 6.064 706 HG3 PRO 594 HG3 PRO 594 2.027 -7.955 5.608 707 HD2 PRO 594 HD2 PRO 594 2.710 -7.443 8.144 708 HD3 PRO 594 HD3 PRO 594 1.704 -8.838 7.727 709 H ARG 595 H ARG 595 6.464 -11.236 6.533 710 HA ARG 595 HA ARG 595 8.356 -9.056 6.977 711 HB2 ARG 595 HB2 ARG 595 9.977 -10.895 7.590 712 HB3 ARG 595 HB3 ARG 595 8.634 -10.697 8.705 713 HG2 ARG 595 HG2 ARG 595 7.499 -12.617 7.603 714 HG3 ARG 595 HG3 ARG 595 8.924 -12.786 6.579 715 HD2 ARG 595 HD2 ARG 595 8.901 -14.399 8.447 716 HD3 ARG 595 HD3 ARG 595 10.290 -13.326 8.502 717 HE ARG 595 HE ARG 595 8.663 -12.043 10.120 718 HH11 ARG 595 HH11 ARG 595 9.070 -15.631 9.993 719 HH12 ARG 595 HH12 ARG 595 9.040 -15.789 11.669 720 HH21 ARG 595 HH21 ARG 595 8.620 -12.352 12.453 721 HH22 ARG 595 HH22 ARG 595 8.788 -13.925 13.089 722 H LEU 596 H LEU 596 9.383 -8.357 5.282 723 HA LEU 596 HA LEU 596 9.203 -9.489 2.717 724 HB2 LEU 596 HB2 LEU 596 9.620 -7.038 3.521 725 HB3 LEU 596 HB3 LEU 596 11.292 -7.523 3.638 726 HG LEU 596 HG LEU 596 10.729 -6.230 1.577 727 HD11 LEU 596 HD11 LEU 596 11.896 -7.641 -0.025 728 HD12 LEU 596 HD12 LEU 596 11.697 -9.030 1.043 729 HD13 LEU 596 HD13 LEU 596 12.688 -7.664 1.550 730 HD21 LEU 596 HD21 LEU 596 9.215 -8.695 0.787 731 HD22 LEU 596 HD22 LEU 596 9.398 -7.210 -0.166 732 HD23 LEU 596 HD23 LEU 596 8.486 -7.207 1.354 733 H VAL 597 H VAL 597 10.562 -10.907 1.708 734 HA VAL 597 HA VAL 597 12.443 -12.248 3.402 735 HB VAL 597 HB VAL 597 11.532 -12.869 0.589 736 HG11 VAL 597 HG11 VAL 597 13.807 -13.719 0.924 737 HG12 VAL 597 HG12 VAL 597 12.646 -15.047 0.889 738 HG13 VAL 597 HG13 VAL 597 13.308 -14.494 2.426 739 HG21 VAL 597 HG21 VAL 597 10.361 -14.707 1.684 740 HG22 VAL 597 HG22 VAL 597 9.834 -13.135 2.292 741 HG23 VAL 597 HG23 VAL 597 10.938 -14.129 3.248 742 H GLU 598 H GLU 598 14.377 -11.616 3.618 743 HA GLU 598 HA GLU 598 15.826 -10.241 1.542 744 HB2 GLU 598 HB2 GLU 598 16.848 -11.428 4.133 745 HB3 GLU 598 HB3 GLU 598 17.650 -10.232 3.130 746 HG2 GLU 598 HG2 GLU 598 15.906 -8.616 3.645 747 HG3 GLU 598 HG3 GLU 598 15.096 -9.816 4.652 748 H MET 599 H MET 599 17.158 -11.276 0.165 749 HA MET 599 HA MET 599 16.936 -14.169 0.137 750 HB2 MET 599 HB2 MET 599 18.043 -12.265 -1.921 751 HB3 MET 599 HB3 MET 599 17.910 -14.006 -2.122 752 HG2 MET 599 HG2 MET 599 15.618 -12.113 -1.691 753 HG3 MET 599 HG3 MET 599 16.095 -12.804 -3.239 754 HE1 MET 599 HE1 MET 599 13.173 -12.909 -2.093 755 HE2 MET 599 HE2 MET 599 12.712 -14.569 -2.458 756 HE3 MET 599 HE3 MET 599 13.631 -13.630 -3.635 757 H SER 600 H SER 600 19.118 -11.837 1.154 758 HA SER 600 HA SER 600 21.133 -13.927 1.333 759 HB2 SER 600 HB2 SER 600 21.692 -11.077 0.527 760 HB3 SER 600 HB3 SER 600 22.895 -12.347 0.771 761 HG SER 600 HG SER 600 20.995 -13.235 -0.849 762 H GLU 601 H GLU 601 20.771 -14.281 3.504 763 HA GLU 601 HA GLU 601 21.210 -12.040 5.278 764 HB2 GLU 601 HB2 GLU 601 20.906 -13.625 7.132 765 HB3 GLU 601 HB3 GLU 601 19.605 -13.846 5.989 766 HG2 GLU 601 HG2 GLU 601 22.037 -15.627 6.184 767 HG3 GLU 601 HG3 GLU 601 20.492 -15.955 6.954 768 H LYS 602 H LYS 602 22.695 -14.699 3.811 769 HA LYS 602 HA LYS 602 25.276 -14.472 5.053 770 HB2 LYS 602 HB2 LYS 602 24.331 -16.584 4.169 771 HB3 LYS 602 HB3 LYS 602 24.322 -15.890 2.561 772 HG2 LYS 602 HG2 LYS 602 26.200 -17.288 2.641 773 HG3 LYS 602 HG3 LYS 602 26.822 -15.651 2.804 774 HD2 LYS 602 HD2 LYS 602 27.107 -15.909 5.159 775 HD3 LYS 602 HD3 LYS 602 26.260 -17.458 5.145 776 HE2 LYS 602 HE2 LYS 602 28.922 -16.823 3.874 777 HE3 LYS 602 HE3 LYS 602 28.630 -17.857 5.270 778 HZ1 LYS 602 HZ1 LYS 602 27.820 -18.382 2.464 779 HZ2 LYS 602 HZ2 LYS 602 27.259 -19.271 3.776 780 HZ3 LYS 602 HZ3 LYS 602 28.897 -19.288 3.406 781 H LYS 603 H LYS 603 26.080 -12.401 4.599 782 HA LYS 603 HA LYS 603 26.150 -11.611 1.786 783 HB2 LYS 603 HB2 LYS 603 26.738 -10.014 4.283 784 HB3 LYS 603 HB3 LYS 603 27.003 -9.426 2.647 785 HG2 LYS 603 HG2 LYS 603 24.638 -9.648 2.156 786 HG3 LYS 603 HG3 LYS 603 24.352 -10.301 3.763 787 HD2 LYS 603 HD2 LYS 603 23.680 -7.982 3.709 788 HD3 LYS 603 HD3 LYS 603 25.088 -8.152 4.740 789 HE2 LYS 603 HE2 LYS 603 25.281 -7.268 1.854 790 HE3 LYS 603 HE3 LYS 603 25.002 -6.125 3.153 791 HZ1 LYS 603 HZ1 LYS 603 27.163 -6.910 4.134 792 HZ2 LYS 603 HZ2 LYS 603 27.298 -6.161 2.647 793 HZ3 LYS 603 HZ3 LYS 603 27.446 -7.800 2.727 794 H GLY 604 H GLY 604 28.034 -12.953 4.206 795 HA2 GLY 604 HA2 GLY 604 30.050 -13.801 2.640 796 HA3 GLY 604 HA3 GLY 604 30.566 -12.195 3.155 797 H GLY 605 H GLY 605 31.341 -11.913 5.120 798 HA2 GLY 605 HA2 GLY 605 31.827 -12.369 7.342 799 HA3 GLY 605 HA3 GLY 605 30.879 -13.845 7.220 800 H PHE 606 H PHE 606 33.221 -13.310 4.793 801 HA PHE 606 HA PHE 606 34.882 -15.355 6.044 802 HB2 PHE 606 HB2 PHE 606 34.569 -14.646 3.124 803 HB3 PHE 606 HB3 PHE 606 35.788 -15.760 3.735 804 HD1 PHE 606 HD1 PHE 606 35.084 -17.854 4.834 805 HD2 PHE 606 HD2 PHE 606 32.334 -15.314 2.831 806 HE1 PHE 606 HE1 PHE 606 33.463 -19.691 4.744 807 HE2 PHE 606 HE2 PHE 606 30.704 -17.147 2.734 808 HZ PHE 606 HZ PHE 606 31.262 -19.335 3.694 809 H THR 607 H THR 607 36.135 -14.189 7.259 810 HA THR 607 HA THR 607 37.985 -12.483 5.868 811 HB THR 607 HB THR 607 36.480 -10.938 6.970 812 HG1 THR 607 HG1 THR 607 38.152 -9.876 7.434 813 HG21 THR 607 HG21 THR 607 37.000 -12.467 9.523 814 HG22 THR 607 HG22 THR 607 35.482 -12.427 8.626 815 HG23 THR 607 HG23 THR 607 36.089 -10.961 9.404 816 H ILE 608 H ILE 608 40.062 -12.678 6.607 817 HA ILE 608 HA ILE 608 40.638 -15.163 7.786 818 HB ILE 608 HB ILE 608 42.220 -14.331 6.188 819 HG12 ILE 608 HG12 ILE 608 43.494 -14.288 8.939 820 HG13 ILE 608 HG13 ILE 608 43.124 -15.732 8.013 821 HG21 ILE 608 HG21 ILE 608 43.614 -12.347 6.546 822 HG22 ILE 608 HG22 ILE 608 42.702 -11.983 8.011 823 HG23 ILE 608 HG23 ILE 608 41.900 -11.942 6.442 824 HD11 ILE 608 HD11 ILE 608 45.084 -13.588 7.237 825 HD12 ILE 608 HD12 ILE 608 44.739 -15.058 6.319 826 HD13 ILE 608 HD13 ILE 608 45.478 -15.165 7.917 827 H THR 609 H THR 609 40.457 -15.691 9.780 828 HA THR 609 HA THR 609 40.774 -13.702 11.857 829 HB THR 609 HB THR 609 40.173 -16.676 12.084 830 HG1 THR 609 HG1 THR 609 38.709 -14.980 10.859 831 HG21 THR 609 HG21 THR 609 40.874 -15.550 14.171 832 HG22 THR 609 HG22 THR 609 39.177 -16.027 14.247 833 HG23 THR 609 HG23 THR 609 39.608 -14.345 13.940 834 H GLU 610 H GLU 610 42.921 -13.341 12.302 835 HA GLU 610 HA GLU 610 44.793 -15.427 11.645 836 HB2 GLU 610 HB2 GLU 610 45.066 -12.877 11.149 837 HB3 GLU 610 HB3 GLU 610 45.541 -12.759 12.830 838 HG2 GLU 610 HG2 GLU 610 46.925 -14.487 10.776 839 HG3 GLU 610 HG3 GLU 610 47.435 -12.869 11.226 840 H GLU 611 H GLU 611 43.938 -16.795 13.112 841 HA GLU 611 HA GLU 611 45.384 -17.087 15.501 842 HB2 GLU 611 HB2 GLU 611 43.572 -15.637 16.380 843 HB3 GLU 611 HB3 GLU 611 42.368 -16.662 15.617 844 HG2 GLU 611 HG2 GLU 611 42.512 -17.066 18.022 845 HG3 GLU 611 HG3 GLU 611 42.960 -18.495 17.093 846 H TYR 612 H TYR 612 45.486 -19.264 15.794 847 HA TYR 612 HA TYR 612 44.262 -20.743 13.650 848 HB2 TYR 612 HB2 TYR 612 46.459 -21.540 15.552 849 HB3 TYR 612 HB3 TYR 612 45.784 -22.613 14.317 850 HD1 TYR 612 HD1 TYR 612 45.896 -21.920 11.910 851 HD2 TYR 612 HD2 TYR 612 48.070 -19.901 14.951 852 HE1 TYR 612 HE1 TYR 612 47.309 -20.880 10.195 853 HE2 TYR 612 HE2 TYR 612 49.500 -18.859 13.244 854 HH TYR 612 HH TYR 612 48.656 -18.869 9.979 855 H ASP 613 H ASP 613 42.403 -21.243 13.907 856 HA ASP 613 HA ASP 613 40.524 -22.138 14.516 857 HB2 ASP 613 HB2 ASP 613 41.541 -24.257 15.035 858 HB3 ASP 613 HB3 ASP 613 42.077 -23.673 16.605 859 H ASP 614 H ASP 614 39.677 -20.234 14.924 860 HA ASP 614 HA ASP 614 38.543 -20.112 17.525 861 HB2 ASP 614 HB2 ASP 614 40.585 -18.631 17.760 862 HB3 ASP 614 HB3 ASP 614 39.939 -17.630 16.458 863 H LYS 615 H LYS 615 36.530 -18.979 17.406 864 HA LYS 615 HA LYS 615 35.739 -18.798 14.597 865 HB2 LYS 615 HB2 LYS 615 33.475 -19.374 15.243 866 HB3 LYS 615 HB3 LYS 615 34.611 -20.586 15.809 867 HG2 LYS 615 HG2 LYS 615 34.507 -19.543 18.060 868 HG3 LYS 615 HG3 LYS 615 33.259 -18.454 17.458 869 HD2 LYS 615 HD2 LYS 615 33.088 -21.474 17.563 870 HD3 LYS 615 HD3 LYS 615 32.289 -20.368 18.670 871 HE2 LYS 615 HE2 LYS 615 31.767 -20.567 15.694 872 HE3 LYS 615 HE3 LYS 615 30.767 -21.273 16.951 873 HZ1 LYS 615 HZ1 LYS 615 31.237 -18.365 16.527 874 HZ2 LYS 615 HZ2 LYS 615 30.262 -19.015 17.748 875 HZ3 LYS 615 HZ3 LYS 615 29.850 -19.210 16.139 876 H GLN 616 H GLN 616 36.575 -16.598 16.863 877 HA GLN 616 HA GLN 616 34.362 -14.828 16.116 878 HB2 GLN 616 HB2 GLN 616 36.268 -14.614 18.435 879 HB3 GLN 616 HB3 GLN 616 35.098 -13.380 18.005 880 HG2 GLN 616 HG2 GLN 616 33.300 -15.013 18.385 881 HG3 GLN 616 HG3 GLN 616 34.510 -16.189 18.909 882 HE21 GLN 616 HE21 GLN 616 33.753 -16.342 20.984 883 HE22 GLN 616 HE22 GLN 616 33.890 -15.058 22.130 884 HA PRO 617 HA PRO 617 37.688 -12.771 13.837 885 HB2 PRO 617 HB2 PRO 617 35.801 -12.052 11.825 886 HB3 PRO 617 HB3 PRO 617 37.047 -13.294 11.720 887 HG2 PRO 617 HG2 PRO 617 34.309 -13.777 11.727 888 HG3 PRO 617 HG3 PRO 617 35.559 -14.971 12.108 889 HD2 PRO 617 HD2 PRO 617 33.850 -13.358 13.948 890 HD3 PRO 617 HD3 PRO 617 34.409 -15.043 14.096 891 H LEU 618 H LEU 618 34.784 -11.884 15.251 892 HA LEU 618 HA LEU 618 33.755 -10.057 15.925 893 HB2 LEU 618 HB2 LEU 618 36.506 -8.816 15.797 894 HB3 LEU 618 HB3 LEU 618 35.115 -8.016 16.481 895 HG LEU 618 HG LEU 618 36.342 -8.794 18.296 896 HD11 LEU 618 HD11 LEU 618 33.988 -9.209 18.535 897 HD12 LEU 618 HD12 LEU 618 34.940 -10.398 19.418 898 HD13 LEU 618 HD13 LEU 618 34.189 -10.838 17.887 899 HD21 LEU 618 HD21 LEU 618 37.157 -11.097 18.575 900 HD22 LEU 618 HD22 LEU 618 37.845 -10.315 17.153 901 HD23 LEU 618 HD23 LEU 618 36.548 -11.492 16.966 902 H THR 619 H THR 619 32.460 -9.948 14.135 903 HA THR 619 HA THR 619 33.182 -7.958 12.170 904 HB THR 619 HB THR 619 30.722 -9.743 12.348 905 HG1 THR 619 HG1 THR 619 32.071 -11.210 11.654 906 HG21 THR 619 HG21 THR 619 30.399 -9.132 9.979 907 HG22 THR 619 HG22 THR 619 31.797 -8.060 10.066 908 HG23 THR 619 HG23 THR 619 30.355 -7.705 11.013 909 H SER 620 H SER 620 32.978 -6.010 13.169 910 HA SER 620 HA SER 620 30.810 -5.502 14.974 911 HB2 SER 620 HB2 SER 620 32.926 -3.615 13.916 912 HB3 SER 620 HB3 SER 620 31.886 -3.353 15.321 913 HG SER 620 HG SER 620 34.235 -4.526 15.260 914 H LYS 621 H LYS 621 29.014 -5.731 13.622 915 HA LYS 621 HA LYS 621 28.653 -3.492 11.789 916 HB2 LYS 621 HB2 LYS 621 27.352 -4.909 10.280 917 HB3 LYS 621 HB3 LYS 621 28.985 -5.527 10.449 918 HG2 LYS 621 HG2 LYS 621 28.241 -7.316 11.844 919 HG3 LYS 621 HG3 LYS 621 26.628 -6.614 11.979 920 HD2 LYS 621 HD2 LYS 621 26.336 -6.914 9.550 921 HD3 LYS 621 HD3 LYS 621 27.912 -7.701 9.471 922 HE2 LYS 621 HE2 LYS 621 27.149 -9.495 10.884 923 HE3 LYS 621 HE3 LYS 621 25.625 -8.670 11.191 924 HZ1 LYS 621 HZ1 LYS 621 26.521 -9.736 8.556 925 HZ2 LYS 621 HZ2 LYS 621 25.063 -8.931 8.845 926 HZ3 LYS 621 HZ3 LYS 621 25.357 -10.420 9.560 927 H GLU 622 H GLU 622 26.606 -2.662 11.697 928 HA GLU 622 HA GLU 622 24.355 -3.769 12.941 929 HB2 GLU 622 HB2 GLU 622 25.522 -2.976 14.983 930 HB3 GLU 622 HB3 GLU 622 25.559 -1.346 14.316 931 HG2 GLU 622 HG2 GLU 622 23.772 -1.554 15.935 932 HG3 GLU 622 HG3 GLU 622 23.098 -1.326 14.321 933 H GLU 623 H GLU 623 23.563 -3.352 10.903 934 HA GLU 623 HA GLU 623 23.113 -0.524 10.452 935 HB2 GLU 623 HB2 GLU 623 22.756 -1.025 8.047 936 HB3 GLU 623 HB3 GLU 623 24.390 -1.332 8.589 937 HG2 GLU 623 HG2 GLU 623 22.317 -3.491 8.236 938 HG3 GLU 623 HG3 GLU 623 23.443 -3.000 6.975 939 H GLU 624 H GLU 624 21.127 0.183 10.321 940 HA GLU 624 HA GLU 624 19.061 -1.672 11.070 941 HB2 GLU 624 HB2 GLU 624 19.475 0.642 12.063 942 HB3 GLU 624 HB3 GLU 624 18.859 1.292 10.556 943 HG2 GLU 624 HG2 GLU 624 16.728 0.239 10.937 944 HG3 GLU 624 HG3 GLU 624 17.336 -0.506 12.414 945 H GLU 625 H GLU 625 19.833 -2.480 8.767 946 HA GLU 625 HA GLU 625 18.862 -1.167 6.462 947 HB2 GLU 625 HB2 GLU 625 20.728 -2.807 6.436 948 HB3 GLU 625 HB3 GLU 625 19.567 -4.087 6.761 949 HG2 GLU 625 HG2 GLU 625 18.421 -3.580 4.663 950 HG3 GLU 625 HG3 GLU 625 19.590 -2.306 4.335 951 H ARG 626 H ARG 626 17.439 -3.367 8.715 952 HA ARG 626 HA ARG 626 15.255 -4.146 7.144 953 HB2 ARG 626 HB2 ARG 626 15.660 -3.958 10.099 954 HB3 ARG 626 HB3 ARG 626 14.073 -4.319 9.435 955 HG2 ARG 626 HG2 ARG 626 16.542 -5.904 8.788 956 HG3 ARG 626 HG3 ARG 626 15.409 -6.326 10.079 957 HD2 ARG 626 HD2 ARG 626 13.593 -6.458 8.454 958 HD3 ARG 626 HD3 ARG 626 14.691 -6.016 7.157 959 HE ARG 626 HE ARG 626 15.882 -8.095 7.649 960 HH11 ARG 626 HH11 ARG 626 12.470 -7.855 8.681 961 HH12 ARG 626 HH12 ARG 626 12.200 -9.534 8.497 962 HH21 ARG 626 HH21 ARG 626 15.429 -10.306 7.339 963 HH22 ARG 626 HH22 ARG 626 13.883 -10.962 7.719 964 H ARG 627 H ARG 627 15.801 -1.235 9.040 965 HA ARG 627 HA ARG 627 13.150 -0.303 8.582 966 HB2 ARG 627 HB2 ARG 627 14.660 0.356 10.527 967 HB3 ARG 627 HB3 ARG 627 15.565 1.338 9.385 968 HG2 ARG 627 HG2 ARG 627 12.622 1.712 9.869 969 HG3 ARG 627 HG3 ARG 627 13.871 2.491 10.842 970 HD2 ARG 627 HD2 ARG 627 14.669 3.705 8.971 971 HD3 ARG 627 HD3 ARG 627 13.697 2.749 7.852 972 HE ARG 627 HE ARG 627 11.942 3.931 9.601 973 HH11 ARG 627 HH11 ARG 627 14.385 5.115 7.342 974 HH12 ARG 627 HH12 ARG 627 13.471 6.479 6.878 975 HH21 ARG 627 HH21 ARG 627 10.712 5.788 8.927 976 HH22 ARG 627 HH22 ARG 627 11.354 6.866 7.762 977 H ILE 628 H ILE 628 16.261 -0.018 7.043 978 HA ILE 628 HA ILE 628 15.593 1.954 5.135 979 HB ILE 628 HB ILE 628 17.588 -0.331 4.899 980 HG12 ILE 628 HG12 ILE 628 17.993 2.571 5.670 981 HG13 ILE 628 HG13 ILE 628 18.028 1.206 6.780 982 HG21 ILE 628 HG21 ILE 628 17.331 2.159 3.210 983 HG22 ILE 628 HG22 ILE 628 17.042 0.503 2.681 984 HG23 ILE 628 HG23 ILE 628 18.668 1.015 3.132 985 HD11 ILE 628 HD11 ILE 628 19.960 1.725 4.528 986 HD12 ILE 628 HD12 ILE 628 20.022 0.346 5.623 987 HD13 ILE 628 HD13 ILE 628 20.268 1.980 6.243 988 H ALA 629 H ALA 629 15.201 -1.509 5.192 989 HA ALA 629 HA ALA 629 14.132 -1.712 2.553 990 HB1 ALA 629 HB1 ALA 629 13.666 -4.027 3.162 991 HB2 ALA 629 HB2 ALA 629 14.054 -3.666 4.844 992 HB3 ALA 629 HB3 ALA 629 15.309 -3.567 3.609 993 H GLU 630 H GLU 630 12.812 -0.905 5.647 994 HA GLU 630 HA GLU 630 10.203 -1.882 5.112 995 HB2 GLU 630 HB2 GLU 630 9.543 -1.160 7.214 996 HB3 GLU 630 HB3 GLU 630 11.241 -1.499 7.430 997 HG2 GLU 630 HG2 GLU 630 10.994 0.452 8.599 998 HG3 GLU 630 HG3 GLU 630 11.504 1.034 7.004 999 H MET 631 H MET 631 11.823 0.786 3.955 1000 HA MET 631 HA MET 631 9.741 2.649 3.597 1001 HB2 MET 631 HB2 MET 631 10.979 3.502 1.642 1002 HB3 MET 631 HB3 MET 631 12.062 3.233 2.992 1003 HG2 MET 631 HG2 MET 631 12.836 1.177 2.005 1004 HG3 MET 631 HG3 MET 631 11.679 1.344 0.691 1005 HE1 MET 631 HE1 MET 631 15.143 1.865 -1.033 1006 HE2 MET 631 HE2 MET 631 13.648 0.923 -0.981 1007 HE3 MET 631 HE3 MET 631 14.801 0.816 0.344 1008 H GLY 632 H GLY 632 10.335 -0.389 2.157 1009 HA2 GLY 632 HA2 GLY 632 7.873 -0.126 0.603 1010 HA3 GLY 632 HA3 GLY 632 9.307 -0.937 -0.046 1011 H ARG 633 H ARG 633 7.642 -0.931 3.096 1012 HA ARG 633 HA ARG 633 8.213 -3.759 3.285 1013 HB2 ARG 633 HB2 ARG 633 7.294 -3.695 5.547 1014 HB3 ARG 633 HB3 ARG 633 8.538 -2.490 5.383 1015 HG2 ARG 633 HG2 ARG 633 7.016 -0.739 5.457 1016 HG3 ARG 633 HG3 ARG 633 5.639 -1.784 5.065 1017 HD2 ARG 633 HD2 ARG 633 5.405 -1.413 7.371 1018 HD3 ARG 633 HD3 ARG 633 6.229 -2.970 7.212 1019 HE ARG 633 HE ARG 633 7.799 -0.571 7.741 1020 HH11 ARG 633 HH11 ARG 633 6.684 -3.806 8.816 1021 HH12 ARG 633 HH12 ARG 633 7.592 -3.770 10.249 1022 HH21 ARG 633 HH21 ARG 633 9.005 -0.564 9.720 1023 HH22 ARG 633 HH22 ARG 633 8.950 -1.925 10.769 1024 HA PRO 634 HA PRO 634 4.052 -4.895 2.324 1025 HB2 PRO 634 HB2 PRO 634 4.101 -7.439 3.309 1026 HB3 PRO 634 HB3 PRO 634 4.839 -7.013 1.764 1027 HG2 PRO 634 HG2 PRO 634 6.133 -7.533 4.391 1028 HG3 PRO 634 HG3 PRO 634 6.747 -7.830 2.766 1029 HD2 PRO 634 HD2 PRO 634 7.444 -5.700 4.401 1030 HD3 PRO 634 HD3 PRO 634 7.694 -5.775 2.649 1031 H ILE 635 H ILE 635 2.150 -4.738 3.489 1032 HA ILE 635 HA ILE 635 2.442 -4.933 6.358 1033 HB ILE 635 HB ILE 635 0.908 -2.999 6.667 1034 HG12 ILE 635 HG12 ILE 635 0.931 -1.313 4.635 1035 HG13 ILE 635 HG13 ILE 635 1.128 -2.771 3.675 1036 HG21 ILE 635 HG21 ILE 635 3.460 -2.409 5.225 1037 HG22 ILE 635 HG22 ILE 635 3.250 -2.655 6.960 1038 HG23 ILE 635 HG23 ILE 635 2.561 -1.228 6.176 1039 HD11 ILE 635 HD11 ILE 635 -1.155 -2.179 5.542 1040 HD12 ILE 635 HD12 ILE 635 -0.973 -3.636 4.567 1041 HD13 ILE 635 HD13 ILE 635 -1.196 -2.072 3.783 1042 H LEU 636 H LEU 636 0.200 -4.975 7.413 1043 HA LEU 636 HA LEU 636 -1.293 -6.878 5.818 1044 HB2 LEU 636 HB2 LEU 636 -2.128 -7.759 8.057 1045 HB3 LEU 636 HB3 LEU 636 -0.508 -8.160 7.558 1046 HG LEU 636 HG LEU 636 0.386 -6.484 9.151 1047 HD11 LEU 636 HD11 LEU 636 -1.475 -4.924 9.228 1048 HD12 LEU 636 HD12 LEU 636 -1.098 -5.514 10.850 1049 HD13 LEU 636 HD13 LEU 636 -2.489 -6.156 9.970 1050 HD21 LEU 636 HD21 LEU 636 -0.136 -7.732 11.171 1051 HD22 LEU 636 HD22 LEU 636 0.108 -8.815 9.795 1052 HD23 LEU 636 HD23 LEU 636 -1.525 -8.453 10.356 1053 H GLY 637 H GLY 637 -3.603 -7.158 6.836 1054 HA2 GLY 637 HA2 GLY 637 -4.905 -4.785 5.988 1055 HA3 GLY 637 HA3 GLY 637 -5.664 -6.271 6.542 1056 H GLU 638 H GLU 638 -7.069 -4.423 7.229 1057 HA GLU 638 HA GLU 638 -6.468 -2.604 9.245 1058 HB2 GLU 638 HB2 GLU 638 -8.443 -2.614 7.701 1059 HB3 GLU 638 HB3 GLU 638 -9.128 -3.909 8.668 1060 HG2 GLU 638 HG2 GLU 638 -10.140 -1.840 9.297 1061 HG3 GLU 638 HG3 GLU 638 -9.107 -2.388 10.617 1062 H HIS 639 H HIS 639 -7.919 -5.815 9.384 1063 HA HIS 639 HA HIS 639 -6.969 -6.093 12.090 1064 HB2 HIS 639 HB2 HIS 639 -9.137 -7.062 12.869 1065 HB3 HIS 639 HB3 HIS 639 -9.266 -5.361 12.462 1066 HD1 HIS 639 HD1 HIS 639 -10.847 -8.591 11.842 1067 HD2 HIS 639 HD2 HIS 639 -10.572 -4.946 9.868 1068 HE1 HIS 639 HE1 HIS 639 -12.708 -8.571 10.151 1069 H THR 640 H THR 640 -5.922 -7.912 12.241 1070 HA THR 640 HA THR 640 -6.536 -9.958 10.267 1071 HB THR 640 HB THR 640 -4.112 -10.649 10.691 1072 HG1 THR 640 HG1 THR 640 -3.658 -9.346 12.456 1073 HG21 THR 640 HG21 THR 640 -3.304 -9.086 9.009 1074 HG22 THR 640 HG22 THR 640 -4.663 -8.008 9.330 1075 HG23 THR 640 HG23 THR 640 -4.946 -9.595 8.617 1076 H LYS 641 H LYS 641 -7.864 -11.292 11.324 1077 HA LYS 641 HA LYS 641 -6.898 -12.981 13.324 1078 HB2 LYS 641 HB2 LYS 641 -7.173 -11.137 14.867 1079 HB3 LYS 641 HB3 LYS 641 -8.787 -10.810 14.257 1080 HG2 LYS 641 HG2 LYS 641 -9.578 -12.929 15.173 1081 HG3 LYS 641 HG3 LYS 641 -7.955 -13.304 15.741 1082 HD2 LYS 641 HD2 LYS 641 -9.412 -12.456 17.534 1083 HD3 LYS 641 HD3 LYS 641 -8.014 -11.420 17.257 1084 HE2 LYS 641 HE2 LYS 641 -10.032 -10.071 17.582 1085 HE3 LYS 641 HE3 LYS 641 -9.388 -9.902 15.953 1086 HZ1 LYS 641 HZ1 LYS 641 -11.697 -11.617 16.692 1087 HZ2 LYS 641 HZ2 LYS 641 -11.130 -11.356 15.121 1088 HZ3 LYS 641 HZ3 LYS 641 -11.794 -10.100 16.002 1089 H LEU 642 H LEU 642 -8.041 -14.702 13.329 1090 HA LEU 642 HA LEU 642 -10.580 -14.777 11.838 1091 HB2 LEU 642 HB2 LEU 642 -8.680 -15.837 10.761 1092 HB3 LEU 642 HB3 LEU 642 -8.374 -16.760 12.212 1093 HG LEU 642 HG LEU 642 -10.671 -17.809 11.837 1094 HD11 LEU 642 HD11 LEU 642 -10.234 -16.646 9.123 1095 HD12 LEU 642 HD12 LEU 642 -11.523 -16.194 10.246 1096 HD13 LEU 642 HD13 LEU 642 -11.456 -17.827 9.570 1097 HD21 LEU 642 HD21 LEU 642 -8.363 -18.213 9.988 1098 HD22 LEU 642 HD22 LEU 642 -9.735 -19.316 10.145 1099 HD23 LEU 642 HD23 LEU 642 -8.673 -19.025 11.527 1100 H GLU 643 H GLU 643 -12.255 -15.536 13.051 1101 HA GLU 643 HA GLU 643 -11.655 -16.876 15.582 1102 HB2 GLU 643 HB2 GLU 643 -13.276 -14.945 15.572 1103 HB3 GLU 643 HB3 GLU 643 -14.307 -15.874 14.505 1104 HG2 GLU 643 HG2 GLU 643 -14.654 -17.534 16.228 1105 HG3 GLU 643 HG3 GLU 643 -13.530 -16.694 17.293 1106 H VAL 644 H VAL 644 -11.509 -19.017 15.394 1107 HA VAL 644 HA VAL 644 -12.919 -20.347 13.195 1108 HB VAL 644 HB VAL 644 -10.770 -21.469 14.997 1109 HG11 VAL 644 HG11 VAL 644 -12.237 -23.126 13.955 1110 HG12 VAL 644 HG12 VAL 644 -10.589 -23.233 13.361 1111 HG13 VAL 644 HG13 VAL 644 -11.836 -22.482 12.360 1112 HG21 VAL 644 HG21 VAL 644 -9.231 -21.155 13.097 1113 HG22 VAL 644 HG22 VAL 644 -9.861 -19.623 13.710 1114 HG23 VAL 644 HG23 VAL 644 -10.511 -20.308 12.229 1115 H ILE 645 H ILE 645 -14.807 -21.074 13.790 1116 HA ILE 645 HA ILE 645 -15.223 -21.986 16.536 1117 HB ILE 645 HB ILE 645 -17.245 -21.582 14.325 1118 HG12 ILE 645 HG12 ILE 645 -16.665 -19.723 16.628 1119 HG13 ILE 645 HG13 ILE 645 -15.997 -19.503 15.014 1120 HG21 ILE 645 HG21 ILE 645 -17.586 -21.904 17.310 1121 HG22 ILE 645 HG22 ILE 645 -17.982 -23.110 16.089 1122 HG23 ILE 645 HG23 ILE 645 -18.885 -21.595 16.157 1123 HD11 ILE 645 HD11 ILE 645 -18.211 -19.322 14.104 1124 HD12 ILE 645 HD12 ILE 645 -17.937 -18.122 15.367 1125 HD13 ILE 645 HD13 ILE 645 -18.919 -19.561 15.704 1126 H ILE 646 H ILE 646 -15.028 -24.059 16.862 1127 HA ILE 646 HA ILE 646 -15.182 -25.991 14.693 1128 HB ILE 646 HB ILE 646 -14.649 -26.460 17.660 1129 HG12 ILE 646 HG12 ILE 646 -12.639 -26.335 15.398 1130 HG13 ILE 646 HG13 ILE 646 -12.912 -25.031 16.545 1131 HG21 ILE 646 HG21 ILE 646 -14.278 -28.268 15.291 1132 HG22 ILE 646 HG22 ILE 646 -15.504 -28.421 16.548 1133 HG23 ILE 646 HG23 ILE 646 -13.800 -28.633 16.950 1134 HD11 ILE 646 HD11 ILE 646 -12.196 -26.489 18.367 1135 HD12 ILE 646 HD12 ILE 646 -10.950 -26.318 17.137 1136 HD13 ILE 646 HD13 ILE 646 -11.914 -27.796 17.215 1137 H GLU 647 H GLU 647 -17.179 -26.499 14.182 1138 HA GLU 647 HA GLU 647 -19.092 -26.803 16.338 1139 HB2 GLU 647 HB2 GLU 647 -20.871 -26.297 14.592 1140 HB3 GLU 647 HB3 GLU 647 -19.871 -24.959 15.107 1141 HG2 GLU 647 HG2 GLU 647 -20.177 -24.728 12.769 1142 HG3 GLU 647 HG3 GLU 647 -18.527 -25.280 13.002 1143 H GLU 648 H GLU 648 -20.571 -28.496 16.243 1144 HA GLU 648 HA GLU 648 -19.286 -30.805 15.181 1145 HB2 GLU 648 HB2 GLU 648 -20.963 -32.092 16.391 1146 HB3 GLU 648 HB3 GLU 648 -20.074 -30.967 17.406 1147 HG2 GLU 648 HG2 GLU 648 -21.936 -29.442 17.454 1148 HG3 GLU 648 HG3 GLU 648 -22.816 -30.416 16.283 1149 H SER 649 H SER 649 -19.604 -31.598 13.392 1150 HA SER 649 HA SER 649 -22.254 -31.752 12.286 1151 HB2 SER 649 HB2 SER 649 -19.779 -30.735 10.897 1152 HB3 SER 649 HB3 SER 649 -21.171 -31.354 9.992 1153 HG SER 649 HG SER 649 -21.042 -29.041 11.705 1154 H TYR 650 H TYR 650 -22.427 -33.865 12.740 1155 HA TYR 650 HA TYR 650 -20.296 -35.724 12.009 1156 HB2 TYR 650 HB2 TYR 650 -23.019 -36.250 13.236 1157 HB3 TYR 650 HB3 TYR 650 -21.724 -37.421 13.051 1158 HD1 TYR 650 HD2 TYR 650 -22.871 -34.509 14.843 1159 HD2 TYR 650 HD1 TYR 650 -19.895 -37.465 14.584 1160 HE1 TYR 650 HE2 TYR 650 -22.075 -33.875 17.133 1161 HE2 TYR 650 HE1 TYR 650 -19.065 -36.876 16.856 1162 HH TYR 650 HH TYR 650 -19.094 -35.074 18.424 1163 H GLU 651 H GLU 651 -22.778 -34.142 10.630 1164 HA GLU 651 HA GLU 651 -24.052 -36.113 9.203 1165 HB2 GLU 651 HB2 GLU 651 -23.643 -33.251 8.324 1166 HB3 GLU 651 HB3 GLU 651 -24.866 -34.338 7.685 1167 HG2 GLU 651 HG2 GLU 651 -24.694 -33.157 10.443 1168 HG3 GLU 651 HG3 GLU 651 -25.915 -32.853 9.213 1169 H PHE 652 H PHE 652 -21.409 -33.937 8.439 1170 HA PHE 652 HA PHE 652 -20.481 -35.651 6.270 1171 HB2 PHE 652 HB2 PHE 652 -20.560 -33.254 5.701 1172 HB3 PHE 652 HB3 PHE 652 -19.657 -32.858 7.155 1173 HD1 PHE 652 HD1 PHE 652 -19.387 -34.646 3.907 1174 HD2 PHE 652 HD2 PHE 652 -17.312 -32.779 7.121 1175 HE1 PHE 652 HE1 PHE 652 -17.285 -34.805 2.644 1176 HE2 PHE 652 HE2 PHE 652 -15.207 -32.939 5.860 1177 HZ PHE 652 HZ PHE 652 -15.193 -33.956 3.619 1178 H LYS 653 H LYS 653 -19.218 -37.188 7.042 1179 HA LYS 653 HA LYS 653 -17.689 -36.574 9.448 1180 HB2 LYS 653 HB2 LYS 653 -19.468 -38.269 9.767 1181 HB3 LYS 653 HB3 LYS 653 -18.739 -39.245 8.504 1182 HG2 LYS 653 HG2 LYS 653 -16.811 -39.671 9.834 1183 HG3 LYS 653 HG3 LYS 653 -17.312 -38.489 11.043 1184 HD2 LYS 653 HD2 LYS 653 -17.760 -40.752 11.831 1185 HD3 LYS 653 HD3 LYS 653 -19.267 -39.876 11.581 1186 HE2 LYS 653 HE2 LYS 653 -19.527 -41.009 9.400 1187 HE3 LYS 653 HE3 LYS 653 -18.049 -41.914 9.712 1188 HZ1 LYS 653 HZ1 LYS 653 -19.139 -42.882 11.674 1189 HZ2 LYS 653 HZ2 LYS 653 -19.968 -43.213 10.260 1190 HZ3 LYS 653 HZ3 LYS 653 -20.553 -42.027 11.296 1191 H SER 654 H SER 654 -15.596 -36.814 9.383 1192 HA SER 654 HA SER 654 -14.266 -37.020 6.918 1193 HB2 SER 654 HB2 SER 654 -12.178 -37.061 8.348 1194 HB3 SER 654 HB3 SER 654 -13.265 -35.703 8.637 1195 HG SER 654 HG SER 654 -14.089 -36.886 10.471 1196 H THR 655 H THR 655 -14.932 -39.380 9.417 1197 HA THR 655 HA THR 655 -13.490 -41.484 8.154 1198 HB THR 655 HB THR 655 -15.854 -41.657 10.057 1199 HG1 THR 655 HG1 THR 655 -13.060 -41.431 10.550 1200 HG21 THR 655 HG21 THR 655 -13.573 -43.573 9.511 1201 HG22 THR 655 HG22 THR 655 -15.235 -43.784 8.962 1202 HG23 THR 655 HG23 THR 655 -14.865 -43.816 10.687 1203 H VAL 656 H VAL 656 -14.041 -41.928 6.105 1204 HA VAL 656 HA VAL 656 -16.608 -41.386 5.016 1205 HB VAL 656 HB VAL 656 -14.263 -42.841 3.758 1206 HG11 VAL 656 HG11 VAL 656 -16.325 -43.308 2.564 1207 HG12 VAL 656 HG12 VAL 656 -15.295 -42.240 1.609 1208 HG13 VAL 656 HG13 VAL 656 -16.683 -41.585 2.476 1209 HG21 VAL 656 HG21 VAL 656 -15.059 -39.935 3.604 1210 HG22 VAL 656 HG22 VAL 656 -13.750 -40.687 2.694 1211 HG23 VAL 656 HG23 VAL 656 -13.656 -40.583 4.453 1212 H ASP 657 H ASP 657 -18.266 -42.674 4.733 1213 HA ASP 657 HA ASP 657 -17.968 -45.553 4.582 1214 HB2 ASP 657 HB2 ASP 657 -18.498 -45.231 6.961 1215 HB3 ASP 657 HB3 ASP 657 -19.865 -44.202 6.532 Start of MODEL 2 1 H HIS 501 H HIS 501 4.606 0.739 1.525 2 HA HIS 501 HA HIS 501 2.816 -1.317 2.596 3 HB2 HIS 501 HB2 HIS 501 1.949 0.994 2.870 4 HB3 HIS 501 HB3 HIS 501 2.094 1.247 1.139 5 HD1 HIS 501 HD1 HIS 501 -0.336 0.247 3.653 6 HD2 HIS 501 HD2 HIS 501 0.298 -0.564 -0.370 7 HE1 HIS 501 HE1 HIS 501 -2.511 -0.649 2.765 8 H ALA 502 H ALA 502 3.418 -2.953 1.369 9 HA ALA 502 HA ALA 502 3.471 -2.870 -1.525 10 HB1 ALA 502 HB1 ALA 502 4.788 -4.494 -0.186 11 HB2 ALA 502 HB2 ALA 502 3.748 -5.280 -1.384 12 HB3 ALA 502 HB3 ALA 502 3.273 -5.240 0.315 13 H GLY 503 H GLY 503 1.246 -4.029 0.969 14 HA2 GLY 503 HA2 GLY 503 -1.090 -3.408 -0.305 15 HA3 GLY 503 HA3 GLY 503 -0.712 -5.073 -0.751 16 H ILE 504 H ILE 504 -2.638 -5.692 0.517 17 HA ILE 504 HA ILE 504 -2.250 -5.461 3.408 18 HB ILE 504 HB ILE 504 -4.761 -5.567 1.741 19 HG12 ILE 504 HG12 ILE 504 -5.345 -3.476 3.146 20 HG13 ILE 504 HG13 ILE 504 -3.632 -3.432 3.538 21 HG21 ILE 504 HG21 ILE 504 -5.221 -7.006 3.519 22 HG22 ILE 504 HG22 ILE 504 -6.071 -5.485 3.836 23 HG23 ILE 504 HG23 ILE 504 -4.578 -5.869 4.697 24 HD11 ILE 504 HD11 ILE 504 -4.173 -1.931 1.704 25 HD12 ILE 504 HD12 ILE 504 -4.818 -3.289 0.777 26 HD13 ILE 504 HD13 ILE 504 -3.106 -3.227 1.158 27 H PHE 505 H PHE 505 -1.700 -7.404 4.288 28 HA PHE 505 HA PHE 505 -2.841 -9.862 3.153 29 HB2 PHE 505 HB2 PHE 505 -0.723 -9.379 5.246 30 HB3 PHE 505 HB3 PHE 505 -1.562 -10.917 5.187 31 HD1 PHE 505 HD2 PHE 505 -1.524 -12.142 2.919 32 HD2 PHE 505 HD1 PHE 505 1.173 -9.062 3.996 33 HE1 PHE 505 HE2 PHE 505 0.073 -12.966 1.237 34 HE2 PHE 505 HE1 PHE 505 2.780 -9.877 2.319 35 HZ PHE 505 HZ PHE 505 2.228 -11.835 0.938 36 H THR 506 H THR 506 -4.478 -10.969 4.116 37 HA THR 506 HA THR 506 -5.129 -10.708 6.835 38 HB THR 506 HB THR 506 -6.047 -8.505 6.082 39 HG1 THR 506 HG1 THR 506 -7.472 -8.882 7.604 40 HG21 THR 506 HG21 THR 506 -6.610 -9.104 3.758 41 HG22 THR 506 HG22 THR 506 -8.011 -8.428 4.588 42 HG23 THR 506 HG23 THR 506 -7.887 -10.171 4.345 43 H PHE 507 H PHE 507 -7.568 -11.686 7.011 44 HA PHE 507 HA PHE 507 -7.310 -14.245 5.653 45 HB2 PHE 507 HB2 PHE 507 -9.090 -13.295 7.907 46 HB3 PHE 507 HB3 PHE 507 -9.198 -14.902 7.193 47 HD1 PHE 507 HD2 PHE 507 -7.429 -16.508 7.535 48 HD2 PHE 507 HD1 PHE 507 -7.289 -12.681 9.368 49 HE1 PHE 507 HE2 PHE 507 -5.736 -17.331 9.110 50 HE2 PHE 507 HE1 PHE 507 -5.600 -13.492 10.949 51 HZ PHE 507 HZ PHE 507 -4.825 -15.824 10.827 52 H GLU 508 H GLU 508 -9.095 -15.189 4.422 53 HA GLU 508 HA GLU 508 -10.368 -13.282 2.809 54 HB2 GLU 508 HB2 GLU 508 -9.702 -15.631 2.125 55 HB3 GLU 508 HB3 GLU 508 -11.090 -16.210 3.040 56 HG2 GLU 508 HG2 GLU 508 -12.568 -14.876 1.648 57 HG3 GLU 508 HG3 GLU 508 -11.155 -14.295 0.761 58 H GLU 509 H GLU 509 -11.423 -15.190 5.563 59 HA GLU 509 HA GLU 509 -13.759 -13.450 5.693 60 HB2 GLU 509 HB2 GLU 509 -14.968 -15.301 6.870 61 HB3 GLU 509 HB3 GLU 509 -14.667 -15.608 5.169 62 HG2 GLU 509 HG2 GLU 509 -12.819 -16.674 7.258 63 HG3 GLU 509 HG3 GLU 509 -14.337 -17.498 6.916 64 HA PRO 510 HA PRO 510 -12.191 -12.592 9.723 65 HB2 PRO 510 HB2 PRO 510 -14.415 -11.626 10.938 66 HB3 PRO 510 HB3 PRO 510 -13.535 -10.708 9.712 67 HG2 PRO 510 HG2 PRO 510 -16.045 -12.299 9.455 68 HG3 PRO 510 HG3 PRO 510 -15.629 -10.741 8.726 69 HD2 PRO 510 HD2 PRO 510 -15.500 -13.122 7.380 70 HD3 PRO 510 HD3 PRO 510 -14.492 -11.717 6.994 71 H VAL 511 H VAL 511 -15.026 -14.636 9.311 72 HA VAL 511 HA VAL 511 -14.307 -16.144 11.714 73 HB VAL 511 HB VAL 511 -17.158 -15.514 10.880 74 HG11 VAL 511 HG11 VAL 511 -16.130 -16.922 13.328 75 HG12 VAL 511 HG12 VAL 511 -16.920 -17.664 11.944 76 HG13 VAL 511 HG13 VAL 511 -17.819 -16.555 12.974 77 HG21 VAL 511 HG21 VAL 511 -17.346 -14.128 12.903 78 HG22 VAL 511 HG22 VAL 511 -16.136 -13.486 11.793 79 HG23 VAL 511 HG23 VAL 511 -15.631 -14.365 13.231 80 H THR 512 H THR 512 -14.311 -18.313 11.335 81 HA THR 512 HA THR 512 -15.706 -19.296 8.979 82 HB THR 512 HB THR 512 -13.248 -19.069 8.477 83 HG1 THR 512 HG1 THR 512 -13.022 -21.522 8.084 84 HG21 THR 512 HG21 THR 512 -12.926 -21.149 10.640 85 HG22 THR 512 HG22 THR 512 -12.362 -19.482 10.714 86 HG23 THR 512 HG23 THR 512 -11.652 -20.600 9.547 87 H HIS 513 H HIS 513 -16.717 -21.294 9.322 88 HA HIS 513 HA HIS 513 -16.328 -22.375 11.992 89 HB2 HIS 513 HB2 HIS 513 -18.648 -23.182 12.025 90 HB3 HIS 513 HB3 HIS 513 -18.609 -21.453 11.763 91 HD1 HIS 513 HD1 HIS 513 -19.516 -20.607 9.413 92 HD2 HIS 513 HD2 HIS 513 -19.735 -24.720 10.009 93 HE1 HIS 513 HE1 HIS 513 -21.074 -21.493 7.649 94 H VAL 514 H VAL 514 -15.711 -24.341 12.203 95 HA VAL 514 HA VAL 514 -15.439 -25.919 9.768 96 HB VAL 514 HB VAL 514 -13.416 -26.910 10.666 97 HG11 VAL 514 HG11 VAL 514 -13.390 -23.907 10.811 98 HG12 VAL 514 HG12 VAL 514 -13.108 -24.904 9.385 99 HG13 VAL 514 HG13 VAL 514 -11.946 -24.906 10.713 100 HG21 VAL 514 HG21 VAL 514 -12.386 -26.128 12.761 101 HG22 VAL 514 HG22 VAL 514 -13.954 -26.881 13.055 102 HG23 VAL 514 HG23 VAL 514 -13.802 -25.124 13.077 103 H SER 515 H SER 515 -15.243 -28.305 10.311 104 HA SER 515 HA SER 515 -17.614 -28.847 11.908 105 HB2 SER 515 HB2 SER 515 -17.503 -29.408 9.450 106 HB3 SER 515 HB3 SER 515 -16.274 -30.578 9.868 107 HG SER 515 HG SER 515 -18.988 -30.582 10.475 108 H GLU 516 H GLU 516 -17.710 -30.867 12.952 109 HA GLU 516 HA GLU 516 -15.435 -31.645 14.531 110 HB2 GLU 516 HB2 GLU 516 -17.698 -31.578 15.485 111 HB3 GLU 516 HB3 GLU 516 -18.296 -32.725 14.313 112 HG2 GLU 516 HG2 GLU 516 -18.033 -33.786 16.416 113 HG3 GLU 516 HG3 GLU 516 -16.796 -34.411 15.332 114 H SER 517 H SER 517 -16.882 -32.517 11.528 115 HA SER 517 HA SER 517 -15.492 -35.103 11.482 116 HB2 SER 517 HB2 SER 517 -17.859 -34.147 9.874 117 HB3 SER 517 HB3 SER 517 -17.182 -35.779 9.882 118 HG SER 517 HG SER 517 -17.909 -36.097 11.896 119 H ILE 518 H ILE 518 -14.233 -32.429 10.797 120 HA ILE 518 HA ILE 518 -14.032 -32.722 7.910 121 HB ILE 518 HB ILE 518 -14.559 -30.471 8.706 122 HG12 ILE 518 HG12 ILE 518 -11.801 -30.660 7.500 123 HG13 ILE 518 HG13 ILE 518 -13.324 -30.735 6.617 124 HG21 ILE 518 HG21 ILE 518 -11.877 -30.537 10.085 125 HG22 ILE 518 HG22 ILE 518 -13.470 -30.473 10.860 126 HG23 ILE 518 HG23 ILE 518 -12.905 -29.112 9.895 127 HD11 ILE 518 HD11 ILE 518 -12.294 -28.562 6.417 128 HD12 ILE 518 HD12 ILE 518 -12.283 -28.421 8.182 129 HD13 ILE 518 HD13 ILE 518 -13.821 -28.453 7.315 130 H GLY 519 H GLY 519 -11.943 -32.852 10.775 131 HA2 GLY 519 HA2 GLY 519 -9.894 -34.052 10.908 132 HA3 GLY 519 HA3 GLY 519 -9.907 -34.161 9.150 133 H ILE 520 H ILE 520 -9.591 -32.070 8.033 134 HA ILE 520 HA ILE 520 -7.698 -30.363 9.484 135 HB ILE 520 HB ILE 520 -7.358 -31.486 6.694 136 HG12 ILE 520 HG12 ILE 520 -6.585 -32.994 8.491 137 HG13 ILE 520 HG13 ILE 520 -5.266 -32.451 7.458 138 HG21 ILE 520 HG21 ILE 520 -5.254 -30.162 6.582 139 HG22 ILE 520 HG22 ILE 520 -5.727 -29.363 8.081 140 HG23 ILE 520 HG23 ILE 520 -6.713 -29.171 6.632 141 HD11 ILE 520 HD11 ILE 520 -4.721 -30.755 9.200 142 HD12 ILE 520 HD12 ILE 520 -4.515 -32.431 9.687 143 HD13 ILE 520 HD13 ILE 520 -5.947 -31.528 10.219 144 H MET 521 H MET 521 -8.258 -28.346 9.287 145 HA MET 521 HA MET 521 -10.097 -27.660 7.121 146 HB2 MET 521 HB2 MET 521 -10.925 -25.867 8.487 147 HB3 MET 521 HB3 MET 521 -10.926 -27.329 9.453 148 HG2 MET 521 HG2 MET 521 -10.099 -25.814 10.983 149 HG3 MET 521 HG3 MET 521 -8.612 -26.367 10.240 150 HE1 MET 521 HE1 MET 521 -8.364 -22.406 10.958 151 HE2 MET 521 HE2 MET 521 -7.643 -23.943 11.392 152 HE3 MET 521 HE3 MET 521 -9.325 -23.603 11.833 153 H GLU 522 H GLU 522 -9.683 -25.774 5.914 154 HA GLU 522 HA GLU 522 -6.928 -24.817 6.107 155 HB2 GLU 522 HB2 GLU 522 -8.541 -25.362 3.637 156 HB3 GLU 522 HB3 GLU 522 -7.037 -24.474 3.636 157 HG2 GLU 522 HG2 GLU 522 -6.358 -26.549 2.990 158 HG3 GLU 522 HG3 GLU 522 -6.105 -26.601 4.733 159 H VAL 523 H VAL 523 -6.718 -22.758 6.206 160 HA VAL 523 HA VAL 523 -9.055 -21.078 5.595 161 HB VAL 523 HB VAL 523 -6.678 -20.260 7.278 162 HG11 VAL 523 HG11 VAL 523 -9.394 -19.022 6.962 163 HG12 VAL 523 HG12 VAL 523 -7.899 -18.433 6.232 164 HG13 VAL 523 HG13 VAL 523 -8.082 -18.443 7.987 165 HG21 VAL 523 HG21 VAL 523 -7.869 -22.116 8.330 166 HG22 VAL 523 HG22 VAL 523 -9.379 -21.214 8.193 167 HG23 VAL 523 HG23 VAL 523 -8.080 -20.613 9.221 168 H LYS 524 H LYS 524 -8.904 -19.691 4.000 169 HA LYS 524 HA LYS 524 -6.499 -19.502 2.393 170 HB2 LYS 524 HB2 LYS 524 -9.225 -18.255 2.017 171 HB3 LYS 524 HB3 LYS 524 -7.881 -18.303 0.860 172 HG2 LYS 524 HG2 LYS 524 -9.007 -20.859 1.908 173 HG3 LYS 524 HG3 LYS 524 -9.865 -19.983 0.638 174 HD2 LYS 524 HD2 LYS 524 -6.946 -20.481 0.339 175 HD3 LYS 524 HD3 LYS 524 -8.084 -21.801 0.006 176 HE2 LYS 524 HE2 LYS 524 -8.142 -19.051 -1.216 177 HE3 LYS 524 HE3 LYS 524 -7.455 -20.494 -1.978 178 HZ1 LYS 524 HZ1 LYS 524 -9.682 -20.034 -2.756 179 HZ2 LYS 524 HZ2 LYS 524 -10.304 -20.163 -1.195 180 HZ3 LYS 524 HZ3 LYS 524 -9.617 -21.507 -1.948 181 H VAL 525 H VAL 525 -5.120 -17.981 2.751 182 HA VAL 525 HA VAL 525 -5.922 -15.545 4.176 183 HB VAL 525 HB VAL 525 -3.127 -16.564 3.591 184 HG11 VAL 525 HG11 VAL 525 -4.061 -14.359 5.428 185 HG12 VAL 525 HG12 VAL 525 -3.194 -14.139 3.907 186 HG13 VAL 525 HG13 VAL 525 -2.396 -14.923 5.274 187 HG21 VAL 525 HG21 VAL 525 -3.052 -17.181 5.960 188 HG22 VAL 525 HG22 VAL 525 -4.287 -18.071 5.071 189 HG23 VAL 525 HG23 VAL 525 -4.750 -16.728 6.121 190 H LEU 526 H LEU 526 -6.145 -13.729 3.106 191 HA LEU 526 HA LEU 526 -5.822 -13.620 0.286 192 HB2 LEU 526 HB2 LEU 526 -6.532 -11.497 2.309 193 HB3 LEU 526 HB3 LEU 526 -6.517 -11.233 0.581 194 HG LEU 526 HG LEU 526 -8.377 -13.148 2.037 195 HD11 LEU 526 HD11 LEU 526 -10.105 -11.538 1.458 196 HD12 LEU 526 HD12 LEU 526 -8.884 -10.459 0.789 197 HD13 LEU 526 HD13 LEU 526 -8.889 -10.823 2.515 198 HD21 LEU 526 HD21 LEU 526 -8.254 -12.294 -0.851 199 HD22 LEU 526 HD22 LEU 526 -9.518 -13.278 -0.121 200 HD23 LEU 526 HD23 LEU 526 -7.872 -13.899 -0.226 201 H ARG 527 H ARG 527 -4.191 -13.013 -0.791 202 HA ARG 527 HA ARG 527 -1.696 -12.258 0.363 203 HB2 ARG 527 HB2 ARG 527 -1.973 -13.699 -1.661 204 HB3 ARG 527 HB3 ARG 527 -2.609 -12.317 -2.529 205 HG2 ARG 527 HG2 ARG 527 -0.431 -11.187 -2.267 206 HG3 ARG 527 HG3 ARG 527 0.188 -12.621 -1.446 207 HD2 ARG 527 HD2 ARG 527 0.866 -12.674 -3.762 208 HD3 ARG 527 HD3 ARG 527 -0.305 -13.952 -3.464 209 HE ARG 527 HE ARG 527 -1.713 -11.722 -4.356 210 HH11 ARG 527 HH11 ARG 527 0.631 -14.017 -5.681 211 HH12 ARG 527 HH12 ARG 527 0.126 -13.808 -7.294 212 HH21 ARG 527 HH21 ARG 527 -2.431 -11.495 -6.547 213 HH22 ARG 527 HH22 ARG 527 -1.663 -12.342 -7.806 214 H THR 528 H THR 528 -0.526 -10.210 -0.287 215 HA THR 528 HA THR 528 -1.897 -7.914 0.205 216 HB THR 528 HB THR 528 0.191 -6.936 -0.995 217 HG1 THR 528 HG1 THR 528 1.348 -8.336 -1.899 218 HG21 THR 528 HG21 THR 528 1.566 -7.373 0.984 219 HG22 THR 528 HG22 THR 528 0.447 -8.646 1.472 220 HG23 THR 528 HG23 THR 528 -0.092 -6.967 1.423 221 H SER 529 H SER 529 -2.942 -6.462 -1.027 222 HA SER 529 HA SER 529 -3.974 -6.763 -3.472 223 HB2 SER 529 HB2 SER 529 -3.020 -4.149 -2.317 224 HB3 SER 529 HB3 SER 529 -4.537 -4.482 -3.180 225 HG SER 529 HG SER 529 -5.251 -5.645 -1.441 226 H GLY 530 H GLY 530 -0.795 -5.511 -2.604 227 HA2 GLY 530 HA2 GLY 530 -0.024 -5.692 -5.418 228 HA3 GLY 530 HA3 GLY 530 0.705 -4.561 -4.268 229 H ALA 531 H ALA 531 0.917 -7.664 -5.579 230 HA ALA 531 HA ALA 531 2.378 -8.709 -3.310 231 HB1 ALA 531 HB1 ALA 531 0.808 -10.155 -4.567 232 HB2 ALA 531 HB2 ALA 531 2.448 -10.781 -4.530 233 HB3 ALA 531 HB3 ALA 531 1.835 -9.992 -5.994 234 H ARG 532 H ARG 532 4.279 -7.768 -3.111 235 HA ARG 532 HA ARG 532 5.935 -7.516 -5.507 236 HB2 ARG 532 HB2 ARG 532 5.945 -5.821 -3.005 237 HB3 ARG 532 HB3 ARG 532 7.020 -5.620 -4.383 238 HG2 ARG 532 HG2 ARG 532 4.022 -5.379 -4.528 239 HG3 ARG 532 HG3 ARG 532 5.114 -4.008 -4.338 240 HD2 ARG 532 HD2 ARG 532 6.114 -4.436 -6.463 241 HD3 ARG 532 HD3 ARG 532 5.261 -5.969 -6.626 242 HE ARG 532 HE ARG 532 3.215 -4.417 -6.504 243 HH11 ARG 532 HH11 ARG 532 6.243 -3.648 -8.140 244 HH12 ARG 532 HH12 ARG 532 5.520 -2.768 -9.400 245 HH21 ARG 532 HH21 ARG 532 2.207 -3.220 -8.206 246 HH22 ARG 532 HH22 ARG 532 3.138 -2.519 -9.449 247 H GLY 533 H GLY 533 7.088 -9.346 -5.425 248 HA2 GLY 533 HA2 GLY 533 9.157 -10.285 -4.894 249 HA3 GLY 533 HA3 GLY 533 9.178 -9.350 -3.409 250 H ASN 534 H ASN 534 9.867 -11.231 -2.318 251 HA ASN 534 HA ASN 534 7.849 -13.330 -1.993 252 HB2 ASN 534 HB2 ASN 534 10.000 -14.172 -2.786 253 HB3 ASN 534 HB3 ASN 534 10.843 -13.322 -1.505 254 HD21 ASN 534 HD21 ASN 534 7.842 -15.192 -0.996 255 HD22 ASN 534 HD22 ASN 534 8.616 -16.387 -0.036 256 H VAL 535 H VAL 535 6.864 -13.494 -0.077 257 HA VAL 535 HA VAL 535 7.887 -11.912 2.174 258 HB VAL 535 HB VAL 535 5.000 -12.132 1.307 259 HG11 VAL 535 HG11 VAL 535 6.293 -10.487 3.462 260 HG12 VAL 535 HG12 VAL 535 5.223 -11.871 3.684 261 HG13 VAL 535 HG13 VAL 535 4.601 -10.378 2.981 262 HG21 VAL 535 HG21 VAL 535 6.179 -10.788 -0.293 263 HG22 VAL 535 HG22 VAL 535 6.933 -9.858 0.989 264 HG23 VAL 535 HG23 VAL 535 5.185 -9.719 0.710 265 H ILE 536 H ILE 536 7.638 -12.927 4.126 266 HA ILE 536 HA ILE 536 6.213 -15.482 4.113 267 HB ILE 536 HB ILE 536 8.372 -14.498 6.005 268 HG12 ILE 536 HG12 ILE 536 9.257 -15.262 3.872 269 HG13 ILE 536 HG13 ILE 536 9.694 -16.385 5.157 270 HG21 ILE 536 HG21 ILE 536 6.704 -15.756 7.187 271 HG22 ILE 536 HG22 ILE 536 8.195 -16.704 7.059 272 HG23 ILE 536 HG23 ILE 536 6.817 -17.046 5.996 273 HD11 ILE 536 HD11 ILE 536 7.801 -17.815 4.408 274 HD12 ILE 536 HD12 ILE 536 9.089 -17.621 3.216 275 HD13 ILE 536 HD13 ILE 536 7.589 -16.728 3.035 276 H VAL 537 H VAL 537 4.509 -15.703 5.407 277 HA VAL 537 HA VAL 537 3.963 -13.478 7.199 278 HB VAL 537 HB VAL 537 1.885 -15.189 5.800 279 HG11 VAL 537 HG11 VAL 537 1.112 -14.364 7.956 280 HG12 VAL 537 HG12 VAL 537 0.261 -13.551 6.640 281 HG13 VAL 537 HG13 VAL 537 1.554 -12.719 7.504 282 HG21 VAL 537 HG21 VAL 537 2.727 -12.351 5.266 283 HG22 VAL 537 HG22 VAL 537 1.396 -13.194 4.459 284 HG23 VAL 537 HG23 VAL 537 3.064 -13.744 4.246 285 HA PRO 538 HA PRO 538 4.251 -17.012 10.039 286 HB2 PRO 538 HB2 PRO 538 4.304 -15.493 12.304 287 HB3 PRO 538 HB3 PRO 538 5.738 -15.856 11.343 288 HG2 PRO 538 HG2 PRO 538 4.092 -13.371 11.440 289 HG3 PRO 538 HG3 PRO 538 5.841 -13.543 11.234 290 HD2 PRO 538 HD2 PRO 538 4.094 -13.011 9.199 291 HD3 PRO 538 HD3 PRO 538 5.660 -13.814 8.970 292 H TYR 539 H TYR 539 2.763 -17.931 11.450 293 HA TYR 539 HA TYR 539 0.389 -16.430 12.145 294 HB2 TYR 539 HB2 TYR 539 -1.186 -18.003 11.150 295 HB3 TYR 539 HB3 TYR 539 -0.133 -17.349 9.905 296 HD1 TYR 539 HD1 TYR 539 1.559 -18.764 8.847 297 HD2 TYR 539 HD2 TYR 539 -1.157 -20.349 11.697 298 HE1 TYR 539 HE1 TYR 539 2.088 -21.035 8.084 299 HE2 TYR 539 HE2 TYR 539 -0.639 -22.618 10.950 300 HH TYR 539 HH TYR 539 2.018 -23.264 8.899 301 H LYS 540 H LYS 540 -0.928 -17.526 13.673 302 HA LYS 540 HA LYS 540 -0.059 -19.993 14.774 303 HB2 LYS 540 HB2 LYS 540 0.442 -19.089 17.078 304 HB3 LYS 540 HB3 LYS 540 1.622 -18.650 15.862 305 HG2 LYS 540 HG2 LYS 540 1.356 -16.732 17.154 306 HG3 LYS 540 HG3 LYS 540 0.411 -16.424 15.700 307 HD2 LYS 540 HD2 LYS 540 -1.616 -17.167 16.981 308 HD3 LYS 540 HD3 LYS 540 -0.602 -17.227 18.422 309 HE2 LYS 540 HE2 LYS 540 -1.016 -14.837 16.683 310 HE3 LYS 540 HE3 LYS 540 -1.868 -15.112 18.207 311 HZ1 LYS 540 HZ1 LYS 540 0.345 -15.021 19.307 312 HZ2 LYS 540 HZ2 LYS 540 -0.045 -13.607 18.490 313 HZ3 LYS 540 HZ3 LYS 540 1.058 -14.655 17.814 314 H THR 541 H THR 541 -1.489 -20.844 16.279 315 HA THR 541 HA THR 541 -4.174 -19.840 16.004 316 HB THR 541 HB THR 541 -4.685 -21.885 17.424 317 HG1 THR 541 HG1 THR 541 -2.168 -21.829 17.878 318 HG21 THR 541 HG21 THR 541 -4.290 -23.471 15.582 319 HG22 THR 541 HG22 THR 541 -3.217 -22.293 14.822 320 HG23 THR 541 HG23 THR 541 -4.937 -21.937 15.003 321 H ILE 542 H ILE 542 -5.421 -19.067 17.661 322 HA ILE 542 HA ILE 542 -3.990 -18.304 20.096 323 HB ILE 542 HB ILE 542 -6.520 -17.251 18.852 324 HG12 ILE 542 HG12 ILE 542 -3.817 -15.942 19.079 325 HG13 ILE 542 HG13 ILE 542 -4.426 -16.724 17.626 326 HG21 ILE 542 HG21 ILE 542 -4.985 -16.255 21.271 327 HG22 ILE 542 HG22 ILE 542 -6.570 -17.024 21.297 328 HG23 ILE 542 HG23 ILE 542 -6.371 -15.438 20.550 329 HD11 ILE 542 HD11 ILE 542 -6.154 -15.106 17.410 330 HD12 ILE 542 HD12 ILE 542 -4.608 -14.261 17.631 331 HD13 ILE 542 HD13 ILE 542 -5.747 -14.391 18.971 332 H GLU 543 H GLU 543 -4.501 -19.389 21.840 333 HA GLU 543 HA GLU 543 -6.676 -21.268 21.838 334 HB2 GLU 543 HB2 GLU 543 -4.583 -20.561 23.887 335 HB3 GLU 543 HB3 GLU 543 -5.791 -21.818 24.106 336 HG2 GLU 543 HG2 GLU 543 -4.890 -23.080 22.270 337 HG3 GLU 543 HG3 GLU 543 -3.772 -21.774 21.874 338 H GLY 544 H GLY 544 -8.438 -21.197 23.188 339 HA2 GLY 544 HA2 GLY 544 -8.876 -19.212 25.159 340 HA3 GLY 544 HA3 GLY 544 -9.654 -18.746 23.651 341 H THR 545 H THR 545 -11.407 -19.684 22.965 342 HA THR 545 HA THR 545 -12.975 -21.054 24.925 343 HB THR 545 HB THR 545 -13.825 -20.432 22.127 344 HG1 THR 545 HG1 THR 545 -12.952 -18.652 24.142 345 HG21 THR 545 HG21 THR 545 -15.006 -19.974 24.845 346 HG22 THR 545 HG22 THR 545 -15.426 -21.315 23.758 347 HG23 THR 545 HG23 THR 545 -15.810 -19.637 23.311 348 H ALA 546 H ALA 546 -10.720 -22.467 23.649 349 HA ALA 546 HA ALA 546 -11.860 -24.969 23.102 350 HB1 ALA 546 HB1 ALA 546 -10.425 -23.570 20.825 351 HB2 ALA 546 HB2 ALA 546 -12.135 -23.991 20.845 352 HB3 ALA 546 HB3 ALA 546 -10.914 -25.266 20.835 353 H ARG 547 H ARG 547 -10.238 -26.548 23.355 354 HA ARG 547 HA ARG 547 -7.960 -25.540 24.771 355 HB2 ARG 547 HB2 ARG 547 -9.031 -28.281 24.313 356 HB3 ARG 547 HB3 ARG 547 -7.614 -27.916 25.293 357 HG2 ARG 547 HG2 ARG 547 -8.826 -26.686 26.787 358 HG3 ARG 547 HG3 ARG 547 -10.273 -26.648 25.775 359 HD2 ARG 547 HD2 ARG 547 -9.054 -29.098 27.019 360 HD3 ARG 547 HD3 ARG 547 -10.542 -28.306 27.566 361 HE ARG 547 HE ARG 547 -10.991 -28.822 24.932 362 HH11 ARG 547 HH11 ARG 547 -10.192 -30.910 27.704 363 HH12 ARG 547 HH12 ARG 547 -10.839 -32.314 26.976 364 HH21 ARG 547 HH21 ARG 547 -11.871 -30.726 23.980 365 HH22 ARG 547 HH22 ARG 547 -11.787 -32.235 24.783 366 H GLY 548 H GLY 548 -6.068 -25.425 24.082 367 HA2 GLY 548 HA2 GLY 548 -5.322 -26.311 21.394 368 HA3 GLY 548 HA3 GLY 548 -4.334 -25.319 22.463 369 H GLY 549 H GLY 549 -2.572 -26.868 21.712 370 HA2 GLY 549 HA2 GLY 549 -1.102 -28.450 22.371 371 HA3 GLY 549 HA3 GLY 549 -2.102 -28.735 23.788 372 H GLY 550 H GLY 550 -3.646 -28.993 20.749 373 HA2 GLY 550 HA2 GLY 550 -4.301 -30.815 19.493 374 HA3 GLY 550 HA3 GLY 550 -3.091 -31.775 20.339 375 H GLU 551 H GLU 551 -5.819 -29.927 21.591 376 HA GLU 551 HA GLU 551 -6.785 -32.444 22.769 377 HB2 GLU 551 HB2 GLU 551 -5.919 -30.655 24.327 378 HB3 GLU 551 HB3 GLU 551 -7.312 -29.693 23.849 379 HG2 GLU 551 HG2 GLU 551 -7.869 -30.758 25.858 380 HG3 GLU 551 HG3 GLU 551 -8.752 -31.574 24.582 381 H ASP 552 H ASP 552 -8.120 -29.194 21.953 382 HA ASP 552 HA ASP 552 -10.417 -30.614 20.773 383 HB2 ASP 552 HB2 ASP 552 -10.064 -27.657 21.389 384 HB3 ASP 552 HB3 ASP 552 -11.428 -28.299 20.490 385 H PHE 553 H PHE 553 -7.824 -28.442 20.153 386 HA PHE 553 HA PHE 553 -7.911 -29.198 17.359 387 HB2 PHE 553 HB2 PHE 553 -7.615 -26.931 16.570 388 HB3 PHE 553 HB3 PHE 553 -9.074 -26.968 17.541 389 HD1 PHE 553 HD1 PHE 553 -9.015 -25.970 19.847 390 HD2 PHE 553 HD2 PHE 553 -5.788 -25.540 17.116 391 HE1 PHE 553 HE1 PHE 553 -8.151 -24.078 21.160 392 HE2 PHE 553 HE2 PHE 553 -4.922 -23.659 18.429 393 HZ PHE 553 HZ PHE 553 -6.102 -22.921 20.450 394 H GLU 554 H GLU 554 -5.972 -29.146 16.433 395 HA GLU 554 HA GLU 554 -3.711 -29.306 18.206 396 HB2 GLU 554 HB2 GLU 554 -4.473 -30.368 15.730 397 HB3 GLU 554 HB3 GLU 554 -3.135 -29.290 15.369 398 HG2 GLU 554 HG2 GLU 554 -3.120 -31.564 17.342 399 HG3 GLU 554 HG3 GLU 554 -2.375 -31.578 15.747 400 H ASP 555 H ASP 555 -2.724 -27.480 18.790 401 HA ASP 555 HA ASP 555 -3.316 -25.054 17.376 402 HB2 ASP 555 HB2 ASP 555 -2.119 -23.872 19.119 403 HB3 ASP 555 HB3 ASP 555 -3.140 -25.079 19.881 404 H THR 556 H THR 556 -2.027 -23.957 16.083 405 HA THR 556 HA THR 556 0.472 -25.272 15.418 406 HB THR 556 HB THR 556 -1.196 -26.112 13.823 407 HG1 THR 556 HG1 THR 556 0.663 -25.969 12.769 408 HG21 THR 556 HG21 THR 556 -2.273 -24.583 12.197 409 HG22 THR 556 HG22 THR 556 -1.640 -23.209 13.103 410 HG23 THR 556 HG23 THR 556 -2.816 -24.291 13.847 411 H CYS 557 H CYS 557 2.010 -24.020 14.563 412 HA CYS 557 HA CYS 557 1.545 -21.210 14.152 413 HB2 CYS 557 HB2 CYS 557 3.599 -20.666 15.457 414 HB3 CYS 557 HB3 CYS 557 2.337 -21.340 16.478 415 HG CYS 557 HG CYS 557 3.575 -23.505 17.233 416 H GLY 558 H GLY 558 3.163 -20.364 12.679 417 HA2 GLY 558 HA2 GLY 558 5.340 -21.749 11.757 418 HA3 GLY 558 HA3 GLY 558 3.953 -22.297 10.819 419 H GLU 559 H GLU 559 5.038 -21.354 9.020 420 HA GLU 559 HA GLU 559 4.476 -18.515 8.778 421 HB2 GLU 559 HB2 GLU 559 7.134 -19.819 8.234 422 HB3 GLU 559 HB3 GLU 559 6.699 -18.232 7.611 423 HG2 GLU 559 HG2 GLU 559 6.452 -17.444 9.949 424 HG3 GLU 559 HG3 GLU 559 6.969 -19.030 10.512 425 H LEU 560 H LEU 560 3.543 -18.032 6.912 426 HA LEU 560 HA LEU 560 3.303 -20.074 4.841 427 HB2 LEU 560 HB2 LEU 560 1.910 -17.424 5.228 428 HB3 LEU 560 HB3 LEU 560 1.593 -18.537 3.917 429 HG LEU 560 HG LEU 560 1.039 -19.061 6.846 430 HD11 LEU 560 HD11 LEU 560 -0.427 -17.390 5.878 431 HD12 LEU 560 HD12 LEU 560 -1.277 -18.891 6.226 432 HD13 LEU 560 HD13 LEU 560 -0.831 -18.499 4.567 433 HD21 LEU 560 HD21 LEU 560 0.455 -20.708 4.385 434 HD22 LEU 560 HD22 LEU 560 -0.132 -21.055 6.009 435 HD23 LEU 560 HD23 LEU 560 1.596 -21.118 5.664 436 H GLU 561 H GLU 561 4.035 -19.697 2.757 437 HA GLU 561 HA GLU 561 5.769 -17.353 2.505 438 HB2 GLU 561 HB2 GLU 561 6.854 -19.624 2.376 439 HB3 GLU 561 HB3 GLU 561 5.926 -19.895 0.904 440 HG2 GLU 561 HG2 GLU 561 7.043 -17.865 -0.075 441 HG3 GLU 561 HG3 GLU 561 8.000 -17.786 1.362 442 H PHE 562 H PHE 562 5.081 -15.817 1.253 443 HA PHE 562 HA PHE 562 3.329 -16.456 -1.012 444 HB2 PHE 562 HB2 PHE 562 3.411 -14.031 0.773 445 HB3 PHE 562 HB3 PHE 562 2.584 -14.051 -0.773 446 HD1 PHE 562 HD1 PHE 562 2.566 -15.292 2.669 447 HD2 PHE 562 HD2 PHE 562 0.537 -15.213 -1.055 448 HE1 PHE 562 HE1 PHE 562 0.528 -16.124 3.768 449 HE2 PHE 562 HE2 PHE 562 -1.503 -16.039 0.028 450 HZ PHE 562 HZ PHE 562 -1.511 -16.499 2.441 451 H GLN 563 H GLN 563 3.631 -15.079 -2.856 452 HA GLN 563 HA GLN 563 6.021 -13.488 -2.994 453 HB2 GLN 563 HB2 GLN 563 5.570 -15.863 -4.826 454 HB3 GLN 563 HB3 GLN 563 6.778 -14.618 -5.074 455 HG2 GLN 563 HG2 GLN 563 7.758 -15.290 -2.887 456 HG3 GLN 563 HG3 GLN 563 6.641 -16.638 -2.877 457 HE21 GLN 563 HE21 GLN 563 9.376 -15.247 -4.523 458 HE22 GLN 563 HE22 GLN 563 9.857 -16.688 -5.306 459 H ASN 564 H ASN 564 6.094 -12.650 -5.323 460 HA ASN 564 HA ASN 564 3.633 -11.504 -6.004 461 HB2 ASN 564 HB2 ASN 564 4.810 -10.747 -8.089 462 HB3 ASN 564 HB3 ASN 564 5.684 -10.371 -6.613 463 HD21 ASN 564 HD21 ASN 564 5.683 -12.205 -9.549 464 HD22 ASN 564 HD22 ASN 564 7.287 -12.808 -9.387 465 H ASP 565 H ASP 565 5.318 -14.350 -6.925 466 HA ASP 565 HA ASP 565 3.611 -15.050 -9.160 467 HB2 ASP 565 HB2 ASP 565 6.047 -15.625 -9.014 468 HB3 ASP 565 HB3 ASP 565 5.654 -16.748 -7.721 469 H GLU 566 H GLU 566 4.145 -16.205 -5.828 470 HA GLU 566 HA GLU 566 2.298 -18.312 -5.821 471 HB2 GLU 566 HB2 GLU 566 3.446 -16.621 -3.631 472 HB3 GLU 566 HB3 GLU 566 2.446 -18.034 -3.362 473 HG2 GLU 566 HG2 GLU 566 5.133 -17.949 -4.694 474 HG3 GLU 566 HG3 GLU 566 4.758 -18.561 -3.081 475 H ILE 567 H ILE 567 0.178 -18.361 -5.302 476 HA ILE 567 HA ILE 567 -1.126 -15.789 -5.246 477 HB ILE 567 HB ILE 567 -3.282 -17.187 -5.517 478 HG12 ILE 567 HG12 ILE 567 -1.294 -19.242 -6.518 479 HG13 ILE 567 HG13 ILE 567 -2.106 -19.421 -4.983 480 HG21 ILE 567 HG21 ILE 567 -1.215 -17.045 -7.699 481 HG22 ILE 567 HG22 ILE 567 -2.351 -15.773 -7.237 482 HG23 ILE 567 HG23 ILE 567 -2.948 -17.275 -7.940 483 HD11 ILE 567 HD11 ILE 567 -3.165 -20.742 -6.698 484 HD12 ILE 567 HD12 ILE 567 -3.418 -19.300 -7.690 485 HD13 ILE 567 HD13 ILE 567 -4.239 -19.467 -6.132 486 H VAL 568 H VAL 568 -2.578 -18.587 -3.676 487 HA VAL 568 HA VAL 568 -2.707 -16.985 -1.232 488 HB VAL 568 HB VAL 568 -4.903 -17.130 -2.376 489 HG11 VAL 568 HG11 VAL 568 -6.091 -19.205 -2.573 490 HG12 VAL 568 HG12 VAL 568 -4.655 -20.096 -2.066 491 HG13 VAL 568 HG13 VAL 568 -4.644 -19.188 -3.589 492 HG21 VAL 568 HG21 VAL 568 -4.811 -18.766 0.149 493 HG22 VAL 568 HG22 VAL 568 -6.252 -18.022 -0.541 494 HG23 VAL 568 HG23 VAL 568 -4.933 -17.008 0.045 495 H LYS 569 H LYS 569 -2.541 -18.145 0.711 496 HA LYS 569 HA LYS 569 -1.638 -20.917 0.448 497 HB2 LYS 569 HB2 LYS 569 -0.841 -18.821 2.463 498 HB3 LYS 569 HB3 LYS 569 -0.567 -20.545 2.676 499 HG2 LYS 569 HG2 LYS 569 0.465 -19.678 0.138 500 HG3 LYS 569 HG3 LYS 569 1.109 -18.676 1.436 501 HD2 LYS 569 HD2 LYS 569 2.585 -20.571 1.080 502 HD3 LYS 569 HD3 LYS 569 1.797 -20.724 2.640 503 HE2 LYS 569 HE2 LYS 569 0.181 -22.302 1.654 504 HE3 LYS 569 HE3 LYS 569 1.015 -22.173 0.105 505 HZ1 LYS 569 HZ1 LYS 569 1.684 -24.147 1.362 506 HZ2 LYS 569 HZ2 LYS 569 2.213 -23.191 2.630 507 HZ3 LYS 569 HZ3 LYS 569 2.989 -23.114 1.136 508 H THR 570 H THR 570 -2.225 -22.287 2.152 509 HA THR 570 HA THR 570 -4.562 -21.412 3.659 510 HB THR 570 HB THR 570 -5.116 -23.968 3.532 511 HG1 THR 570 HG1 THR 570 -4.525 -24.951 1.623 512 HG21 THR 570 HG21 THR 570 -6.575 -23.580 1.586 513 HG22 THR 570 HG22 THR 570 -5.690 -22.094 1.227 514 HG23 THR 570 HG23 THR 570 -6.618 -22.236 2.718 515 H ILE 571 H ILE 571 -4.657 -21.844 5.639 516 HA ILE 571 HA ILE 571 -2.369 -23.043 6.960 517 HB ILE 571 HB ILE 571 -4.769 -21.509 7.943 518 HG12 ILE 571 HG12 ILE 571 -1.950 -20.665 8.266 519 HG13 ILE 571 HG13 ILE 571 -2.683 -20.525 6.659 520 HG21 ILE 571 HG21 ILE 571 -4.072 -23.151 9.654 521 HG22 ILE 571 HG22 ILE 571 -3.699 -21.504 10.162 522 HG23 ILE 571 HG23 ILE 571 -2.418 -22.547 9.552 523 HD11 ILE 571 HD11 ILE 571 -3.727 -19.351 9.197 524 HD12 ILE 571 HD12 ILE 571 -4.341 -19.141 7.519 525 HD13 ILE 571 HD13 ILE 571 -2.747 -18.521 7.967 526 H SER 572 H SER 572 -2.506 -25.138 7.433 527 HA SER 572 HA SER 572 -5.061 -26.517 7.410 528 HB2 SER 572 HB2 SER 572 -3.476 -28.512 7.461 529 HB3 SER 572 HB3 SER 572 -3.404 -27.489 6.027 530 HG SER 572 HG SER 572 -1.652 -27.421 8.263 531 H VAL 573 H VAL 573 -6.071 -26.703 9.325 532 HA VAL 573 HA VAL 573 -4.407 -27.181 11.700 533 HB VAL 573 HB VAL 573 -7.097 -25.794 11.620 534 HG11 VAL 573 HG11 VAL 573 -5.309 -26.353 13.993 535 HG12 VAL 573 HG12 VAL 573 -6.870 -27.107 13.659 536 HG13 VAL 573 HG13 VAL 573 -6.785 -25.384 14.019 537 HG21 VAL 573 HG21 VAL 573 -5.835 -23.817 12.421 538 HG22 VAL 573 HG22 VAL 573 -5.334 -24.356 10.817 539 HG23 VAL 573 HG23 VAL 573 -4.343 -24.737 12.224 540 H LYS 574 H LYS 574 -4.718 -28.976 12.740 541 HA LYS 574 HA LYS 574 -6.708 -30.882 11.904 542 HB2 LYS 574 HB2 LYS 574 -4.533 -31.751 12.232 543 HB3 LYS 574 HB3 LYS 574 -4.337 -30.938 13.764 544 HG2 LYS 574 HG2 LYS 574 -4.597 -33.300 14.151 545 HG3 LYS 574 HG3 LYS 574 -6.019 -32.461 14.750 546 HD2 LYS 574 HD2 LYS 574 -6.643 -34.531 13.625 547 HD3 LYS 574 HD3 LYS 574 -7.259 -33.138 12.740 548 HE2 LYS 574 HE2 LYS 574 -6.321 -34.879 11.271 549 HE3 LYS 574 HE3 LYS 574 -5.493 -33.335 11.121 550 HZ1 LYS 574 HZ1 LYS 574 -4.517 -35.700 12.642 551 HZ2 LYS 574 HZ2 LYS 574 -3.712 -34.232 12.541 552 HZ3 LYS 574 HZ3 LYS 574 -3.924 -35.157 11.169 553 H VAL 575 H VAL 575 -8.600 -30.930 12.745 554 HA VAL 575 HA VAL 575 -9.092 -29.794 15.367 555 HB VAL 575 HB VAL 575 -11.065 -31.140 13.474 556 HG11 VAL 575 HG11 VAL 575 -11.548 -29.211 15.749 557 HG12 VAL 575 HG12 VAL 575 -11.783 -30.947 15.835 558 HG13 VAL 575 HG13 VAL 575 -12.784 -29.974 14.754 559 HG21 VAL 575 HG21 VAL 575 -10.047 -29.232 12.349 560 HG22 VAL 575 HG22 VAL 575 -10.427 -28.198 13.725 561 HG23 VAL 575 HG23 VAL 575 -11.728 -28.889 12.755 562 H ILE 576 H ILE 576 -9.096 -31.047 17.112 563 HA ILE 576 HA ILE 576 -8.284 -33.799 16.814 564 HB ILE 576 HB ILE 576 -8.679 -32.088 19.268 565 HG12 ILE 576 HG12 ILE 576 -6.948 -31.241 17.781 566 HG13 ILE 576 HG13 ILE 576 -6.259 -31.844 19.282 567 HG21 ILE 576 HG21 ILE 576 -7.373 -33.681 20.517 568 HG22 ILE 576 HG22 ILE 576 -7.223 -34.733 19.108 569 HG23 ILE 576 HG23 ILE 576 -8.805 -34.467 19.861 570 HD11 ILE 576 HD11 ILE 576 -4.909 -32.438 17.351 571 HD12 ILE 576 HD12 ILE 576 -6.276 -33.298 16.643 572 HD13 ILE 576 HD13 ILE 576 -5.549 -33.876 18.143 573 H ASP 577 H ASP 577 -9.336 -35.534 17.443 574 HA ASP 577 HA ASP 577 -12.226 -35.345 17.851 575 HB2 ASP 577 HB2 ASP 577 -11.506 -36.896 16.106 576 HB3 ASP 577 HB3 ASP 577 -10.406 -37.680 17.229 577 H ASP 578 H ASP 578 -12.815 -35.241 19.898 578 HA ASP 578 HA ASP 578 -11.287 -36.761 21.880 579 HB2 ASP 578 HB2 ASP 578 -10.565 -34.435 21.992 580 HB3 ASP 578 HB3 ASP 578 -12.235 -33.906 22.141 581 H GLU 579 H GLU 579 -12.503 -37.885 23.250 582 HA GLU 579 HA GLU 579 -15.362 -37.637 22.893 583 HB2 GLU 579 HB2 GLU 579 -14.213 -39.876 22.640 584 HB3 GLU 579 HB3 GLU 579 -13.909 -39.827 24.372 585 HG2 GLU 579 HG2 GLU 579 -15.879 -41.159 23.851 586 HG3 GLU 579 HG3 GLU 579 -16.301 -39.732 24.803 587 H GLU 580 H GLU 580 -15.930 -36.003 24.091 588 HA GLU 580 HA GLU 580 -15.798 -36.209 26.997 589 HB2 GLU 580 HB2 GLU 580 -14.831 -33.964 25.261 590 HB3 GLU 580 HB3 GLU 580 -15.558 -33.579 26.808 591 HG2 GLU 580 HG2 GLU 580 -13.222 -35.441 26.483 592 HG3 GLU 580 HG3 GLU 580 -13.056 -33.709 26.761 593 H TYR 581 H TYR 581 -17.231 -33.942 27.527 594 HA TYR 581 HA TYR 581 -19.539 -34.121 25.774 595 HB2 TYR 581 HB2 TYR 581 -20.878 -33.428 27.908 596 HB3 TYR 581 HB3 TYR 581 -20.371 -35.101 27.755 597 HD1 TYR 581 HD1 TYR 581 -18.581 -35.989 29.178 598 HD2 TYR 581 HD2 TYR 581 -19.968 -31.997 29.671 599 HE1 TYR 581 HE1 TYR 581 -17.500 -35.894 31.379 600 HE2 TYR 581 HE2 TYR 581 -18.883 -31.893 31.877 601 HH TYR 581 HH TYR 581 -16.645 -34.264 32.893 602 H GLU 582 H GLU 582 -18.306 -32.537 24.602 603 HA GLU 582 HA GLU 582 -18.007 -30.056 25.997 604 HB2 GLU 582 HB2 GLU 582 -16.728 -31.078 23.508 605 HB3 GLU 582 HB3 GLU 582 -16.610 -29.397 24.019 606 HG2 GLU 582 HG2 GLU 582 -15.658 -31.831 25.499 607 HG3 GLU 582 HG3 GLU 582 -14.674 -30.537 24.807 608 H LYS 583 H LYS 583 -18.635 -28.222 25.404 609 HA LYS 583 HA LYS 583 -20.937 -27.927 23.676 610 HB2 LYS 583 HB2 LYS 583 -20.787 -26.994 25.973 611 HB3 LYS 583 HB3 LYS 583 -19.398 -26.056 25.477 612 HG2 LYS 583 HG2 LYS 583 -20.830 -24.762 23.966 613 HG3 LYS 583 HG3 LYS 583 -22.222 -25.727 24.472 614 HD2 LYS 583 HD2 LYS 583 -22.196 -23.626 25.694 615 HD3 LYS 583 HD3 LYS 583 -21.875 -24.969 26.787 616 HE2 LYS 583 HE2 LYS 583 -19.445 -24.485 26.607 617 HE3 LYS 583 HE3 LYS 583 -19.830 -23.086 25.607 618 HZ1 LYS 583 HZ1 LYS 583 -21.045 -22.158 27.492 619 HZ2 LYS 583 HZ2 LYS 583 -19.459 -22.475 27.922 620 HZ3 LYS 583 HZ3 LYS 583 -20.683 -23.510 28.412 621 H ASN 584 H ASN 584 -20.843 -25.867 22.249 622 HA ASN 584 HA ASN 584 -19.211 -26.030 20.084 623 HB2 ASN 584 HB2 ASN 584 -21.242 -24.647 20.209 624 HB3 ASN 584 HB3 ASN 584 -20.396 -23.497 21.226 625 HD21 ASN 584 HD21 ASN 584 -20.887 -24.677 18.054 626 HD22 ASN 584 HD22 ASN 584 -20.023 -23.449 17.206 627 H LYS 585 H LYS 585 -17.130 -25.893 19.834 628 HA LYS 585 HA LYS 585 -15.446 -24.349 21.662 629 HB2 LYS 585 HB2 LYS 585 -14.887 -26.524 19.651 630 HB3 LYS 585 HB3 LYS 585 -13.625 -25.676 20.536 631 HG2 LYS 585 HG2 LYS 585 -15.864 -27.120 21.903 632 HG3 LYS 585 HG3 LYS 585 -14.357 -27.919 21.443 633 HD2 LYS 585 HD2 LYS 585 -13.083 -26.492 22.816 634 HD3 LYS 585 HD3 LYS 585 -14.458 -25.424 23.136 635 HE2 LYS 585 HE2 LYS 585 -14.381 -28.327 23.911 636 HE3 LYS 585 HE3 LYS 585 -13.829 -27.031 24.979 637 HZ1 LYS 585 HZ1 LYS 585 -16.007 -26.094 24.920 638 HZ2 LYS 585 HZ2 LYS 585 -16.058 -27.705 25.406 639 HZ3 LYS 585 HZ3 LYS 585 -16.561 -27.268 23.828 640 H THR 586 H THR 586 -14.015 -22.779 20.890 641 HA THR 586 HA THR 586 -13.776 -22.345 18.090 642 HB THR 586 HB THR 586 -15.887 -21.250 18.311 643 HG1 THR 586 HG1 THR 586 -14.083 -20.091 17.238 644 HG21 THR 586 HG21 THR 586 -15.839 -20.973 20.772 645 HG22 THR 586 HG22 THR 586 -16.436 -19.578 19.894 646 HG23 THR 586 HG23 THR 586 -14.792 -19.555 20.551 647 H PHE 587 H PHE 587 -11.969 -21.263 17.542 648 HA PHE 587 HA PHE 587 -10.460 -19.997 19.677 649 HB2 PHE 587 HB2 PHE 587 -8.384 -21.069 18.936 650 HB3 PHE 587 HB3 PHE 587 -9.546 -22.280 19.435 651 HD1 PHE 587 HD1 PHE 587 -10.712 -23.639 17.661 652 HD2 PHE 587 HD2 PHE 587 -7.472 -21.031 16.787 653 HE1 PHE 587 HE1 PHE 587 -10.316 -24.832 15.537 654 HE2 PHE 587 HE2 PHE 587 -7.081 -22.214 14.667 655 HZ PHE 587 HZ PHE 587 -8.508 -24.119 14.047 656 H PHE 588 H PHE 588 -8.361 -18.992 18.347 657 HA PHE 588 HA PHE 588 -9.628 -17.656 16.093 658 HB2 PHE 588 HB2 PHE 588 -8.032 -16.304 18.310 659 HB3 PHE 588 HB3 PHE 588 -8.593 -15.527 16.841 660 HD1 PHE 588 HD2 PHE 588 -9.688 -17.110 20.020 661 HD2 PHE 588 HD1 PHE 588 -10.793 -14.729 16.659 662 HE1 PHE 588 HE2 PHE 588 -11.802 -16.521 21.135 663 HE2 PHE 588 HE1 PHE 588 -12.899 -14.139 17.775 664 HZ PHE 588 HZ PHE 588 -13.404 -15.031 20.012 665 H LEU 589 H LEU 589 -8.142 -16.833 14.583 666 HA LEU 589 HA LEU 589 -5.464 -18.088 14.719 667 HB2 LEU 589 HB2 LEU 589 -7.412 -18.709 12.912 668 HB3 LEU 589 HB3 LEU 589 -6.665 -17.348 12.108 669 HG LEU 589 HG LEU 589 -5.801 -19.372 11.196 670 HD11 LEU 589 HD11 LEU 589 -3.414 -19.189 11.539 671 HD12 LEU 589 HD12 LEU 589 -3.693 -18.127 12.925 672 HD13 LEU 589 HD13 LEU 589 -4.183 -17.624 11.305 673 HD21 LEU 589 HD21 LEU 589 -4.584 -21.014 12.570 674 HD22 LEU 589 HD22 LEU 589 -6.300 -20.876 12.976 675 HD23 LEU 589 HD23 LEU 589 -5.096 -20.122 14.008 676 H GLU 590 H GLU 590 -3.848 -16.630 14.568 677 HA GLU 590 HA GLU 590 -4.494 -14.015 13.442 678 HB2 GLU 590 HB2 GLU 590 -4.322 -13.741 15.798 679 HB3 GLU 590 HB3 GLU 590 -2.803 -14.628 15.870 680 HG2 GLU 590 HG2 GLU 590 -1.768 -12.806 14.526 681 HG3 GLU 590 HG3 GLU 590 -3.293 -11.933 14.592 682 H ILE 591 H ILE 591 -3.112 -13.266 12.030 683 HA ILE 591 HA ILE 591 -0.721 -14.819 11.524 684 HB ILE 591 HB ILE 591 -0.679 -13.607 9.311 685 HG12 ILE 591 HG12 ILE 591 -3.492 -12.810 10.117 686 HG13 ILE 591 HG13 ILE 591 -2.136 -11.718 9.882 687 HG21 ILE 591 HG21 ILE 591 -3.047 -15.380 9.839 688 HG22 ILE 591 HG22 ILE 591 -1.410 -15.900 9.475 689 HG23 ILE 591 HG23 ILE 591 -2.355 -15.047 8.249 690 HD11 ILE 591 HD11 ILE 591 -3.660 -11.645 8.009 691 HD12 ILE 591 HD12 ILE 591 -3.494 -13.379 7.766 692 HD13 ILE 591 HD13 ILE 591 -2.110 -12.312 7.489 693 H GLY 592 H GLY 592 1.178 -13.796 11.418 694 HA2 GLY 592 HA2 GLY 592 1.272 -11.386 13.007 695 HA3 GLY 592 HA3 GLY 592 2.652 -12.384 12.549 696 H GLU 593 H GLU 593 3.155 -9.892 12.270 697 HA GLU 593 HA GLU 593 2.170 -8.785 9.893 698 HB2 GLU 593 HB2 GLU 593 4.525 -8.004 11.591 699 HB3 GLU 593 HB3 GLU 593 3.944 -7.063 10.218 700 HG2 GLU 593 HG2 GLU 593 1.785 -6.823 11.252 701 HG3 GLU 593 HG3 GLU 593 2.300 -7.803 12.618 702 HA PRO 594 HA PRO 594 4.339 -11.081 6.949 703 HB2 PRO 594 HB2 PRO 594 4.152 -9.273 4.905 704 HB3 PRO 594 HB3 PRO 594 2.838 -10.347 5.385 705 HG2 PRO 594 HG2 PRO 594 3.318 -7.497 6.091 706 HG3 PRO 594 HG3 PRO 594 1.788 -8.267 5.672 707 HD2 PRO 594 HD2 PRO 594 2.440 -7.703 8.172 708 HD3 PRO 594 HD3 PRO 594 1.547 -9.187 7.799 709 H ARG 595 H ARG 595 6.366 -11.347 6.583 710 HA ARG 595 HA ARG 595 8.138 -9.040 6.803 711 HB2 ARG 595 HB2 ARG 595 9.862 -10.674 7.609 712 HB3 ARG 595 HB3 ARG 595 8.474 -10.518 8.670 713 HG2 ARG 595 HG2 ARG 595 7.547 -12.605 7.677 714 HG3 ARG 595 HG3 ARG 595 9.043 -12.757 6.756 715 HD2 ARG 595 HD2 ARG 595 9.100 -14.164 8.743 716 HD3 ARG 595 HD3 ARG 595 10.318 -12.895 8.836 717 HE ARG 595 HE ARG 595 8.498 -11.716 10.238 718 HH11 ARG 595 HH11 ARG 595 8.894 -15.297 10.261 719 HH12 ARG 595 HH12 ARG 595 8.620 -15.385 11.926 720 HH21 ARG 595 HH21 ARG 595 8.081 -11.978 12.562 721 HH22 ARG 595 HH22 ARG 595 8.138 -13.538 13.231 722 H LEU 596 H LEU 596 9.006 -8.451 4.976 723 HA LEU 596 HA LEU 596 8.921 -9.883 2.587 724 HB2 LEU 596 HB2 LEU 596 9.142 -7.352 3.070 725 HB3 LEU 596 HB3 LEU 596 10.838 -7.670 3.294 726 HG LEU 596 HG LEU 596 10.226 -6.668 1.083 727 HD11 LEU 596 HD11 LEU 596 11.600 -8.097 -0.301 728 HD12 LEU 596 HD12 LEU 596 11.510 -9.373 0.915 729 HD13 LEU 596 HD13 LEU 596 12.320 -7.847 1.290 730 HD21 LEU 596 HD21 LEU 596 9.031 -9.357 0.554 731 HD22 LEU 596 HD22 LEU 596 9.128 -8.001 -0.589 732 HD23 LEU 596 HD23 LEU 596 8.131 -7.887 0.877 733 H VAL 597 H VAL 597 10.347 -11.262 1.700 734 HA VAL 597 HA VAL 597 12.516 -12.186 3.389 735 HB VAL 597 HB VAL 597 11.583 -13.348 0.767 736 HG11 VAL 597 HG11 VAL 597 12.743 -15.377 1.534 737 HG12 VAL 597 HG12 VAL 597 13.286 -14.514 2.973 738 HG13 VAL 597 HG13 VAL 597 13.846 -14.009 1.380 739 HG21 VAL 597 HG21 VAL 597 10.825 -14.075 3.570 740 HG22 VAL 597 HG22 VAL 597 10.415 -15.006 2.118 741 HG23 VAL 597 HG23 VAL 597 9.773 -13.375 2.335 742 H GLU 598 H GLU 598 14.082 -10.824 3.178 743 HA GLU 598 HA GLU 598 15.121 -10.158 0.568 744 HB2 GLU 598 HB2 GLU 598 16.146 -9.568 3.362 745 HB3 GLU 598 HB3 GLU 598 16.791 -8.888 1.871 746 HG2 GLU 598 HG2 GLU 598 14.650 -7.782 1.447 747 HG3 GLU 598 HG3 GLU 598 14.008 -8.454 2.943 748 H MET 599 H MET 599 16.403 -11.601 -0.399 749 HA MET 599 HA MET 599 17.049 -14.016 0.920 750 HB2 MET 599 HB2 MET 599 16.606 -13.794 -1.556 751 HB3 MET 599 HB3 MET 599 18.224 -13.129 -1.720 752 HG2 MET 599 HG2 MET 599 19.189 -15.195 -0.883 753 HG3 MET 599 HG3 MET 599 17.579 -15.867 -0.640 754 HE1 MET 599 HE1 MET 599 18.861 -18.011 -3.620 755 HE2 MET 599 HE2 MET 599 18.119 -18.025 -2.021 756 HE3 MET 599 HE3 MET 599 19.772 -17.443 -2.219 757 H SER 600 H SER 600 18.745 -11.083 0.658 758 HA SER 600 HA SER 600 21.274 -12.111 1.505 759 HB2 SER 600 HB2 SER 600 21.032 -9.841 0.429 760 HB3 SER 600 HB3 SER 600 20.084 -9.314 1.817 761 HG SER 600 HG SER 600 22.749 -9.355 1.524 762 H GLU 601 H GLU 601 21.404 -13.113 3.389 763 HA GLU 601 HA GLU 601 19.265 -12.930 5.252 764 HB2 GLU 601 HB2 GLU 601 20.460 -15.039 4.595 765 HB3 GLU 601 HB3 GLU 601 21.828 -14.470 5.536 766 HG2 GLU 601 HG2 GLU 601 20.565 -14.560 7.553 767 HG3 GLU 601 HG3 GLU 601 19.078 -14.903 6.664 768 H LYS 602 H LYS 602 19.127 -11.368 6.535 769 HA LYS 602 HA LYS 602 21.482 -9.889 7.424 770 HB2 LYS 602 HB2 LYS 602 19.679 -8.751 6.129 771 HB3 LYS 602 HB3 LYS 602 18.568 -9.160 7.420 772 HG2 LYS 602 HG2 LYS 602 19.149 -6.900 7.729 773 HG3 LYS 602 HG3 LYS 602 20.024 -7.810 8.958 774 HD2 LYS 602 HD2 LYS 602 22.054 -7.700 7.628 775 HD3 LYS 602 HD3 LYS 602 21.175 -6.891 6.330 776 HE2 LYS 602 HE2 LYS 602 20.660 -5.036 7.855 777 HE3 LYS 602 HE3 LYS 602 21.600 -5.828 9.115 778 HZ1 LYS 602 HZ1 LYS 602 23.572 -5.601 7.734 779 HZ2 LYS 602 HZ2 LYS 602 22.838 -4.100 7.971 780 HZ3 LYS 602 HZ3 LYS 602 22.665 -4.884 6.512 781 H LYS 603 H LYS 603 22.103 -10.365 9.427 782 HA LYS 603 HA LYS 603 20.192 -11.326 11.420 783 HB2 LYS 603 HB2 LYS 603 23.169 -10.783 11.611 784 HB3 LYS 603 HB3 LYS 603 22.190 -11.482 12.879 785 HG2 LYS 603 HG2 LYS 603 22.561 -12.811 10.198 786 HG3 LYS 603 HG3 LYS 603 23.678 -13.054 11.530 787 HD2 LYS 603 HD2 LYS 603 22.251 -14.889 11.685 788 HD3 LYS 603 HD3 LYS 603 21.584 -13.783 12.872 789 HE2 LYS 603 HE2 LYS 603 19.833 -13.122 11.207 790 HE3 LYS 603 HE3 LYS 603 20.534 -14.272 10.074 791 HZ1 LYS 603 HZ1 LYS 603 19.985 -16.053 11.683 792 HZ2 LYS 603 HZ2 LYS 603 18.640 -15.195 11.154 793 HZ3 LYS 603 HZ3 LYS 603 19.240 -14.899 12.680 794 H GLY 604 H GLY 604 22.228 -8.614 10.652 795 HA2 GLY 604 HA2 GLY 604 22.051 -6.394 11.187 796 HA3 GLY 604 HA3 GLY 604 20.462 -6.744 11.863 797 H GLY 605 H GLY 605 20.888 -5.359 13.610 798 HA2 GLY 605 HA2 GLY 605 23.036 -6.065 15.382 799 HA3 GLY 605 HA3 GLY 605 21.849 -4.786 15.622 800 H PHE 606 H PHE 606 22.535 -8.140 15.947 801 HA PHE 606 HA PHE 606 20.015 -8.836 17.097 802 HB2 PHE 606 HB2 PHE 606 21.105 -11.057 17.577 803 HB3 PHE 606 HB3 PHE 606 21.199 -10.574 15.896 804 HD1 PHE 606 HD2 PHE 606 23.400 -9.744 14.998 805 HD2 PHE 606 HD1 PHE 606 23.033 -11.503 18.856 806 HE1 PHE 606 HE2 PHE 606 25.821 -10.159 15.040 807 HE2 PHE 606 HE1 PHE 606 25.451 -11.924 18.898 808 HZ PHE 606 HZ PHE 606 26.849 -11.250 16.991 809 H THR 607 H THR 607 20.868 -6.730 18.339 810 HA THR 607 HA THR 607 22.208 -7.195 20.805 811 HB THR 607 HB THR 607 20.551 -4.841 19.861 812 HG1 THR 607 HG1 THR 607 23.193 -5.666 19.334 813 HG21 THR 607 HG21 THR 607 22.821 -5.031 21.869 814 HG22 THR 607 HG22 THR 607 21.118 -4.805 22.263 815 HG23 THR 607 HG23 THR 607 21.994 -3.549 21.388 816 H ILE 608 H ILE 608 21.237 -7.429 22.754 817 HA ILE 608 HA ILE 608 18.389 -7.996 22.770 818 HB ILE 608 HB ILE 608 18.838 -8.876 25.070 819 HG12 ILE 608 HG12 ILE 608 21.743 -8.453 24.334 820 HG13 ILE 608 HG13 ILE 608 20.859 -7.484 25.503 821 HG21 ILE 608 HG21 ILE 608 20.001 -10.908 24.328 822 HG22 ILE 608 HG22 ILE 608 20.482 -10.076 22.849 823 HG23 ILE 608 HG23 ILE 608 18.774 -10.377 23.178 824 HD11 ILE 608 HD11 ILE 608 20.552 -9.478 26.887 825 HD12 ILE 608 HD12 ILE 608 22.254 -9.130 26.584 826 HD13 ILE 608 HD13 ILE 608 21.448 -10.428 25.701 827 H THR 609 H THR 609 17.038 -6.979 24.306 828 HA THR 609 HA THR 609 17.621 -4.258 24.764 829 HB THR 609 HB THR 609 15.451 -5.954 26.049 830 HG1 THR 609 HG1 THR 609 15.836 -5.040 23.429 831 HG21 THR 609 HG21 THR 609 15.675 -3.675 26.963 832 HG22 THR 609 HG22 THR 609 14.179 -3.837 26.040 833 HG23 THR 609 HG23 THR 609 15.567 -3.008 25.335 834 H GLU 610 H GLU 610 17.507 -7.143 26.832 835 HA GLU 610 HA GLU 610 18.484 -7.757 28.760 836 HB2 GLU 610 HB2 GLU 610 20.539 -7.080 27.483 837 HB3 GLU 610 HB3 GLU 610 20.460 -5.506 28.250 838 HG2 GLU 610 HG2 GLU 610 20.815 -6.546 30.429 839 HG3 GLU 610 HG3 GLU 610 20.850 -8.134 29.671 840 H GLU 611 H GLU 611 16.564 -5.401 28.664 841 HA GLU 611 HA GLU 611 17.056 -4.162 31.236 842 HB2 GLU 611 HB2 GLU 611 14.713 -3.998 29.326 843 HB3 GLU 611 HB3 GLU 611 14.810 -3.120 30.842 844 HG2 GLU 611 HG2 GLU 611 16.724 -2.806 28.542 845 HG3 GLU 611 HG3 GLU 611 15.360 -1.738 28.882 846 H TYR 612 H TYR 612 16.678 -5.396 32.966 847 HA TYR 612 HA TYR 612 14.936 -7.640 32.799 848 HB2 TYR 612 HB2 TYR 612 17.053 -7.470 34.252 849 HB3 TYR 612 HB3 TYR 612 16.077 -6.498 35.351 850 HD1 TYR 612 HD1 TYR 612 14.243 -7.536 36.625 851 HD2 TYR 612 HD2 TYR 612 16.692 -9.822 34.009 852 HE1 TYR 612 HE1 TYR 612 13.396 -9.604 37.643 853 HE2 TYR 612 HE2 TYR 612 15.851 -11.890 35.015 854 HH TYR 612 HH TYR 612 13.149 -11.987 36.960 855 H ASP 613 H ASP 613 13.048 -6.889 32.324 856 HA ASP 613 HA ASP 613 11.470 -5.600 34.402 857 HB2 ASP 613 HB2 ASP 613 12.211 -3.746 32.972 858 HB3 ASP 613 HB3 ASP 613 11.693 -4.613 31.539 859 H ASP 614 H ASP 614 11.153 -6.301 30.967 860 HA ASP 614 HA ASP 614 9.724 -7.500 29.750 861 HB2 ASP 614 HB2 ASP 614 9.867 -9.939 30.035 862 HB3 ASP 614 HB3 ASP 614 11.428 -9.164 30.165 863 H LYS 615 H LYS 615 8.280 -6.063 31.699 864 HA LYS 615 HA LYS 615 6.196 -7.805 32.662 865 HB2 LYS 615 HB2 LYS 615 5.111 -5.824 33.489 866 HB3 LYS 615 HB3 LYS 615 6.826 -5.697 33.836 867 HG2 LYS 615 HG2 LYS 615 6.997 -4.238 31.776 868 HG3 LYS 615 HG3 LYS 615 5.232 -4.216 31.760 869 HD2 LYS 615 HD2 LYS 615 7.046 -3.233 33.966 870 HD3 LYS 615 HD3 LYS 615 6.033 -2.254 32.914 871 HE2 LYS 615 HE2 LYS 615 4.029 -3.257 33.879 872 HE3 LYS 615 HE3 LYS 615 5.028 -4.298 34.888 873 HZ1 LYS 615 HZ1 LYS 615 4.174 -2.349 36.053 874 HZ2 LYS 615 HZ2 LYS 615 5.070 -1.341 35.031 875 HZ3 LYS 615 HZ3 LYS 615 5.856 -2.425 36.055 876 H GLN 616 H GLN 616 6.992 -6.931 29.755 877 HA GLN 616 HA GLN 616 4.581 -7.765 28.539 878 HB2 GLN 616 HB2 GLN 616 4.507 -5.802 26.987 879 HB3 GLN 616 HB3 GLN 616 4.114 -5.346 28.637 880 HG2 GLN 616 HG2 GLN 616 6.316 -4.428 28.953 881 HG3 GLN 616 HG3 GLN 616 6.807 -4.978 27.351 882 HE21 GLN 616 HE21 GLN 616 7.309 -2.900 26.749 883 HE22 GLN 616 HE22 GLN 616 6.124 -1.732 26.345 884 HA PRO 617 HA PRO 617 7.993 -9.304 26.094 885 HB2 PRO 617 HB2 PRO 617 6.705 -9.837 23.720 886 HB3 PRO 617 HB3 PRO 617 6.650 -10.909 25.122 887 HG2 PRO 617 HG2 PRO 617 4.621 -8.943 24.157 888 HG3 PRO 617 HG3 PRO 617 4.378 -10.532 24.895 889 HD2 PRO 617 HD2 PRO 617 4.060 -8.186 26.257 890 HD3 PRO 617 HD3 PRO 617 4.552 -9.701 27.031 891 H LEU 618 H LEU 618 9.166 -7.420 25.936 892 HA LEU 618 HA LEU 618 8.503 -5.612 23.723 893 HB2 LEU 618 HB2 LEU 618 8.461 -4.541 25.898 894 HB3 LEU 618 HB3 LEU 618 10.084 -5.104 26.238 895 HG LEU 618 HG LEU 618 10.931 -3.671 24.401 896 HD11 LEU 618 HD11 LEU 618 8.964 -3.546 23.011 897 HD12 LEU 618 HD12 LEU 618 9.471 -1.923 23.483 898 HD13 LEU 618 HD13 LEU 618 8.092 -2.687 24.278 899 HD21 LEU 618 HD21 LEU 618 10.638 -1.545 25.582 900 HD22 LEU 618 HD22 LEU 618 10.976 -2.877 26.687 901 HD23 LEU 618 HD23 LEU 618 9.333 -2.260 26.530 902 H THR 619 H THR 619 9.622 -6.214 22.011 903 HA THR 619 HA THR 619 12.360 -7.108 22.324 904 HB THR 619 HB THR 619 10.631 -7.004 19.839 905 HG1 THR 619 HG1 THR 619 10.930 -8.887 21.910 906 HG21 THR 619 HG21 THR 619 13.122 -8.590 20.497 907 HG22 THR 619 HG22 THR 619 13.060 -7.186 19.429 908 HG23 THR 619 HG23 THR 619 12.216 -8.671 18.984 909 H SER 620 H SER 620 13.480 -5.148 22.716 910 HA SER 620 HA SER 620 13.290 -3.180 20.566 911 HB2 SER 620 HB2 SER 620 14.485 -2.921 23.332 912 HB3 SER 620 HB3 SER 620 14.414 -1.645 22.114 913 HG SER 620 HG SER 620 12.045 -2.101 22.170 914 H LYS 621 H LYS 621 14.718 -3.426 19.048 915 HA LYS 621 HA LYS 621 17.435 -4.235 19.733 916 HB2 LYS 621 HB2 LYS 621 15.743 -5.320 17.470 917 HB3 LYS 621 HB3 LYS 621 17.475 -5.580 17.616 918 HG2 LYS 621 HG2 LYS 621 17.128 -6.759 19.717 919 HG3 LYS 621 HG3 LYS 621 15.393 -6.477 19.595 920 HD2 LYS 621 HD2 LYS 621 15.297 -7.805 17.569 921 HD3 LYS 621 HD3 LYS 621 17.049 -8.025 17.608 922 HE2 LYS 621 HE2 LYS 621 15.153 -8.935 19.769 923 HE3 LYS 621 HE3 LYS 621 15.788 -9.971 18.492 924 HZ1 LYS 621 HZ1 LYS 621 17.975 -9.676 19.313 925 HZ2 LYS 621 HZ2 LYS 621 17.014 -10.143 20.597 926 HZ3 LYS 621 HZ3 LYS 621 17.503 -8.529 20.456 927 H GLU 622 H GLU 622 18.642 -4.012 17.412 928 HA GLU 622 HA GLU 622 18.628 -1.206 16.953 929 HB2 GLU 622 HB2 GLU 622 20.172 -3.467 15.713 930 HB3 GLU 622 HB3 GLU 622 20.433 -1.771 15.337 931 HG2 GLU 622 HG2 GLU 622 20.731 -3.012 18.060 932 HG3 GLU 622 HG3 GLU 622 22.053 -2.618 16.957 933 H GLU 623 H GLU 623 17.656 -0.143 15.401 934 HA GLU 623 HA GLU 623 16.112 -1.616 13.497 935 HB2 GLU 623 HB2 GLU 623 15.292 0.683 12.765 936 HB3 GLU 623 HB3 GLU 623 14.875 0.191 14.390 937 HG2 GLU 623 HG2 GLU 623 17.182 2.029 13.764 938 HG3 GLU 623 HG3 GLU 623 15.550 2.607 14.080 939 H GLU 624 H GLU 624 16.764 -2.173 11.667 940 HA GLU 624 HA GLU 624 19.229 -1.066 10.611 941 HB2 GLU 624 HB2 GLU 624 18.689 -3.260 9.049 942 HB3 GLU 624 HB3 GLU 624 19.729 -3.259 10.458 943 HG2 GLU 624 HG2 GLU 624 18.141 -5.164 10.422 944 HG3 GLU 624 HG3 GLU 624 17.955 -4.149 11.838 945 H GLU 625 H GLU 625 18.045 0.860 9.928 946 HA GLU 625 HA GLU 625 17.085 2.213 8.364 947 HB2 GLU 625 HB2 GLU 625 17.671 -0.119 6.501 948 HB3 GLU 625 HB3 GLU 625 17.232 1.502 5.985 949 HG2 GLU 625 HG2 GLU 625 19.289 2.375 7.008 950 HG3 GLU 625 HG3 GLU 625 19.730 0.740 7.490 951 H ARG 626 H ARG 626 15.561 0.455 9.906 952 HA ARG 626 HA ARG 626 13.665 -1.141 8.670 953 HB2 ARG 626 HB2 ARG 626 14.362 -1.043 11.105 954 HB3 ARG 626 HB3 ARG 626 13.252 0.305 11.272 955 HG2 ARG 626 HG2 ARG 626 12.188 -1.710 12.037 956 HG3 ARG 626 HG3 ARG 626 11.409 -1.183 10.542 957 HD2 ARG 626 HD2 ARG 626 12.606 -2.822 9.264 958 HD3 ARG 626 HD3 ARG 626 13.605 -3.241 10.653 959 HE ARG 626 HE ARG 626 10.775 -3.620 10.999 960 HH11 ARG 626 HH11 ARG 626 13.889 -5.095 10.093 961 HH12 ARG 626 HH12 ARG 626 13.351 -6.695 10.253 962 HH21 ARG 626 HH21 ARG 626 10.042 -5.840 11.302 963 HH22 ARG 626 HH22 ARG 626 11.088 -7.140 10.998 964 H ARG 627 H ARG 627 13.176 2.133 10.000 965 HA ARG 627 HA ARG 627 10.482 2.329 9.225 966 HB2 ARG 627 HB2 ARG 627 11.712 3.679 11.012 967 HB3 ARG 627 HB3 ARG 627 12.396 4.633 9.715 968 HG2 ARG 627 HG2 ARG 627 9.425 4.405 10.218 969 HG3 ARG 627 HG3 ARG 627 10.445 5.644 10.935 970 HD2 ARG 627 HD2 ARG 627 10.985 6.521 8.767 971 HD3 ARG 627 HD3 ARG 627 10.153 5.190 7.973 972 HE ARG 627 HE ARG 627 8.848 7.270 9.584 973 HH11 ARG 627 HH11 ARG 627 8.769 4.904 6.948 974 HH12 ARG 627 HH12 ARG 627 7.285 5.442 6.306 975 HH21 ARG 627 HH21 ARG 627 6.792 8.056 8.648 976 HH22 ARG 627 HH22 ARG 627 6.158 7.303 7.271 977 H ILE 628 H ILE 628 13.442 3.114 7.581 978 HA ILE 628 HA ILE 628 12.260 4.584 5.433 979 HB ILE 628 HB ILE 628 14.907 3.088 5.452 980 HG12 ILE 628 HG12 ILE 628 14.330 5.997 6.079 981 HG13 ILE 628 HG13 ILE 628 14.748 4.764 7.261 982 HG21 ILE 628 HG21 ILE 628 13.906 5.312 3.665 983 HG22 ILE 628 HG22 ILE 628 14.158 3.631 3.191 984 HG23 ILE 628 HG23 ILE 628 15.536 4.641 3.639 985 HD11 ILE 628 HD11 ILE 628 16.934 4.499 6.201 986 HD12 ILE 628 HD12 ILE 628 16.662 6.156 6.739 987 HD13 ILE 628 HD13 ILE 628 16.514 5.748 5.029 988 H ALA 629 H ALA 629 13.256 1.257 5.929 989 HA ALA 629 HA ALA 629 12.661 0.263 3.383 990 HB1 ALA 629 HB1 ALA 629 12.616 -1.222 6.002 991 HB2 ALA 629 HB2 ALA 629 14.060 -0.893 5.057 992 HB3 ALA 629 HB3 ALA 629 12.793 -1.932 4.395 993 H GLU 630 H GLU 630 10.759 0.466 6.330 994 HA GLU 630 HA GLU 630 8.653 -1.134 5.491 995 HB2 GLU 630 HB2 GLU 630 8.745 0.879 7.692 996 HB3 GLU 630 HB3 GLU 630 7.401 -0.232 7.429 997 HG2 GLU 630 HG2 GLU 630 8.956 -2.123 7.637 998 HG3 GLU 630 HG3 GLU 630 10.261 -0.985 7.966 999 H MET 631 H MET 631 9.202 1.912 4.319 1000 HA MET 631 HA MET 631 6.394 2.472 3.867 1001 HB2 MET 631 HB2 MET 631 7.081 4.360 2.551 1002 HB3 MET 631 HB3 MET 631 8.115 4.303 3.970 1003 HG2 MET 631 HG2 MET 631 9.897 3.330 2.653 1004 HG3 MET 631 HG3 MET 631 8.852 3.301 1.237 1005 HE1 MET 631 HE1 MET 631 11.702 4.566 1.143 1006 HE2 MET 631 HE2 MET 631 11.345 6.012 0.186 1007 HE3 MET 631 HE3 MET 631 10.552 4.478 -0.185 1008 H GLY 632 H GLY 632 8.636 0.371 2.539 1009 HA2 GLY 632 HA2 GLY 632 6.889 -0.069 0.221 1010 HA3 GLY 632 HA3 GLY 632 8.646 -0.058 0.048 1011 H ARG 633 H ARG 633 6.490 -1.414 2.508 1012 HA ARG 633 HA ARG 633 7.711 -4.056 2.051 1013 HB2 ARG 633 HB2 ARG 633 7.143 -2.726 4.712 1014 HB3 ARG 633 HB3 ARG 633 7.613 -4.405 4.527 1015 HG2 ARG 633 HG2 ARG 633 9.315 -2.100 3.600 1016 HG3 ARG 633 HG3 ARG 633 9.424 -2.835 5.198 1017 HD2 ARG 633 HD2 ARG 633 9.718 -4.453 2.703 1018 HD3 ARG 633 HD3 ARG 633 11.073 -3.609 3.458 1019 HE ARG 633 HE ARG 633 9.418 -5.398 5.049 1020 HH11 ARG 633 HH11 ARG 633 12.575 -4.705 3.551 1021 HH12 ARG 633 HH12 ARG 633 13.435 -5.829 4.473 1022 HH21 ARG 633 HH21 ARG 633 10.598 -6.899 6.407 1023 HH22 ARG 633 HH22 ARG 633 12.261 -7.120 6.151 1024 HA PRO 634 HA PRO 634 3.488 -5.522 2.180 1025 HB2 PRO 634 HB2 PRO 634 3.833 -7.962 3.315 1026 HB3 PRO 634 HB3 PRO 634 4.277 -7.637 1.637 1027 HG2 PRO 634 HG2 PRO 634 6.034 -7.720 4.066 1028 HG3 PRO 634 HG3 PRO 634 6.324 -8.395 2.461 1029 HD2 PRO 634 HD2 PRO 634 7.418 -6.071 3.226 1030 HD3 PRO 634 HD3 PRO 634 6.910 -6.351 1.551 1031 H ILE 635 H ILE 635 1.848 -5.190 3.599 1032 HA ILE 635 HA ILE 635 2.520 -5.311 6.406 1033 HB ILE 635 HB ILE 635 1.228 -3.221 6.807 1034 HG12 ILE 635 HG12 ILE 635 1.025 -1.633 4.737 1035 HG13 ILE 635 HG13 ILE 635 1.077 -3.107 3.789 1036 HG21 ILE 635 HG21 ILE 635 2.931 -1.631 5.975 1037 HG22 ILE 635 HG22 ILE 635 3.534 -2.902 4.910 1038 HG23 ILE 635 HG23 ILE 635 3.650 -3.098 6.660 1039 HD11 ILE 635 HD11 ILE 635 -0.953 -3.884 4.914 1040 HD12 ILE 635 HD12 ILE 635 -1.194 -2.334 4.105 1041 HD13 ILE 635 HD13 ILE 635 -0.988 -2.393 5.855 1042 H LEU 636 H LEU 636 0.472 -5.401 7.758 1043 HA LEU 636 HA LEU 636 -1.334 -7.030 6.216 1044 HB2 LEU 636 HB2 LEU 636 -2.224 -7.797 8.445 1045 HB3 LEU 636 HB3 LEU 636 -0.661 -8.395 7.945 1046 HG LEU 636 HG LEU 636 0.405 -6.845 9.559 1047 HD11 LEU 636 HD11 LEU 636 -1.298 -5.107 9.603 1048 HD12 LEU 636 HD12 LEU 636 -0.951 -5.696 11.233 1049 HD13 LEU 636 HD13 LEU 636 -2.425 -6.205 10.400 1050 HD21 LEU 636 HD21 LEU 636 -0.121 -9.117 10.156 1051 HD22 LEU 636 HD22 LEU 636 -1.734 -8.610 10.664 1052 HD23 LEU 636 HD23 LEU 636 -0.312 -8.045 11.552 1053 H GLY 637 H GLY 637 -3.609 -7.059 7.008 1054 HA2 GLY 637 HA2 GLY 637 -4.633 -4.547 6.247 1055 HA3 GLY 637 HA3 GLY 637 -5.534 -5.979 6.734 1056 H GLU 638 H GLU 638 -6.902 -4.240 7.451 1057 HA GLU 638 HA GLU 638 -6.213 -2.601 9.662 1058 HB2 GLU 638 HB2 GLU 638 -8.048 -2.222 7.932 1059 HB3 GLU 638 HB3 GLU 638 -8.979 -3.437 8.792 1060 HG2 GLU 638 HG2 GLU 638 -9.682 -1.253 9.490 1061 HG3 GLU 638 HG3 GLU 638 -8.842 -2.041 10.827 1062 H HIS 639 H HIS 639 -7.823 -5.684 9.184 1063 HA HIS 639 HA HIS 639 -7.317 -6.293 11.947 1064 HB2 HIS 639 HB2 HIS 639 -9.590 -7.377 12.189 1065 HB3 HIS 639 HB3 HIS 639 -9.617 -5.626 12.115 1066 HD1 HIS 639 HD1 HIS 639 -11.078 -8.623 10.542 1067 HD2 HIS 639 HD2 HIS 639 -10.594 -4.609 9.592 1068 HE1 HIS 639 HE1 HIS 639 -12.715 -8.139 8.700 1069 H THR 640 H THR 640 -6.274 -8.091 12.101 1070 HA THR 640 HA THR 640 -6.679 -10.085 10.028 1071 HB THR 640 HB THR 640 -4.289 -10.769 10.544 1072 HG1 THR 640 HG1 THR 640 -4.097 -9.490 12.427 1073 HG21 THR 640 HG21 THR 640 -3.375 -9.237 8.956 1074 HG22 THR 640 HG22 THR 640 -4.629 -8.044 9.307 1075 HG23 THR 640 HG23 THR 640 -5.053 -9.554 8.499 1076 H LYS 641 H LYS 641 -8.070 -11.313 11.063 1077 HA LYS 641 HA LYS 641 -7.174 -12.913 13.227 1078 HB2 LYS 641 HB2 LYS 641 -7.856 -10.895 14.484 1079 HB3 LYS 641 HB3 LYS 641 -9.431 -10.938 13.717 1080 HG2 LYS 641 HG2 LYS 641 -9.904 -13.086 14.800 1081 HG3 LYS 641 HG3 LYS 641 -8.322 -13.047 15.566 1082 HD2 LYS 641 HD2 LYS 641 -10.391 -10.890 15.989 1083 HD3 LYS 641 HD3 LYS 641 -10.334 -12.339 16.977 1084 HE2 LYS 641 HE2 LYS 641 -9.170 -10.642 18.200 1085 HE3 LYS 641 HE3 LYS 641 -7.967 -11.738 17.545 1086 HZ1 LYS 641 HZ1 LYS 641 -7.361 -9.392 17.380 1087 HZ2 LYS 641 HZ2 LYS 641 -8.632 -9.095 16.318 1088 HZ3 LYS 641 HZ3 LYS 641 -7.378 -10.137 15.895 1089 H LEU 642 H LEU 642 -8.362 -14.707 13.268 1090 HA LEU 642 HA LEU 642 -10.714 -14.854 11.514 1091 HB2 LEU 642 HB2 LEU 642 -8.672 -15.877 10.571 1092 HB3 LEU 642 HB3 LEU 642 -8.560 -16.858 12.013 1093 HG LEU 642 HG LEU 642 -10.858 -17.772 11.358 1094 HD11 LEU 642 HD11 LEU 642 -11.356 -17.753 9.013 1095 HD12 LEU 642 HD12 LEU 642 -9.987 -16.701 8.707 1096 HD13 LEU 642 HD13 LEU 642 -11.369 -16.100 9.645 1097 HD21 LEU 642 HD21 LEU 642 -8.330 -18.298 9.873 1098 HD22 LEU 642 HD22 LEU 642 -9.757 -19.331 9.791 1099 HD23 LEU 642 HD23 LEU 642 -8.920 -19.099 11.329 1100 H GLU 643 H GLU 643 -12.399 -15.495 12.705 1101 HA GLU 643 HA GLU 643 -11.944 -16.770 15.284 1102 HB2 GLU 643 HB2 GLU 643 -13.553 -14.867 15.009 1103 HB3 GLU 643 HB3 GLU 643 -14.504 -15.889 13.950 1104 HG2 GLU 643 HG2 GLU 643 -14.898 -17.435 15.793 1105 HG3 GLU 643 HG3 GLU 643 -13.936 -16.407 16.856 1106 H VAL 644 H VAL 644 -11.735 -18.938 15.175 1107 HA VAL 644 HA VAL 644 -13.116 -20.337 13.007 1108 HB VAL 644 HB VAL 644 -10.892 -21.372 14.781 1109 HG11 VAL 644 HG11 VAL 644 -12.063 -22.509 12.238 1110 HG12 VAL 644 HG12 VAL 644 -12.385 -23.091 13.870 1111 HG13 VAL 644 HG13 VAL 644 -10.760 -23.215 13.206 1112 HG21 VAL 644 HG21 VAL 644 -9.443 -21.121 12.802 1113 HG22 VAL 644 HG22 VAL 644 -10.068 -19.573 13.364 1114 HG23 VAL 644 HG23 VAL 644 -10.770 -20.341 11.946 1115 H ILE 645 H ILE 645 -14.944 -21.141 13.602 1116 HA ILE 645 HA ILE 645 -15.368 -21.935 16.386 1117 HB ILE 645 HB ILE 645 -17.382 -21.720 14.139 1118 HG12 ILE 645 HG12 ILE 645 -16.817 -19.649 16.262 1119 HG13 ILE 645 HG13 ILE 645 -16.172 -19.559 14.627 1120 HG21 ILE 645 HG21 ILE 645 -19.002 -21.602 15.968 1121 HG22 ILE 645 HG22 ILE 645 -17.700 -21.750 17.143 1122 HG23 ILE 645 HG23 ILE 645 -18.061 -23.091 16.055 1123 HD11 ILE 645 HD11 ILE 645 -19.079 -19.603 15.370 1124 HD12 ILE 645 HD12 ILE 645 -18.410 -19.492 13.737 1125 HD13 ILE 645 HD13 ILE 645 -18.143 -18.184 14.887 1126 H ILE 646 H ILE 646 -15.454 -24.053 16.868 1127 HA ILE 646 HA ILE 646 -15.425 -25.998 14.672 1128 HB ILE 646 HB ILE 646 -14.703 -26.449 17.595 1129 HG12 ILE 646 HG12 ILE 646 -12.779 -26.143 15.274 1130 HG13 ILE 646 HG13 ILE 646 -13.091 -24.885 16.466 1131 HG21 ILE 646 HG21 ILE 646 -13.732 -28.536 16.793 1132 HG22 ILE 646 HG22 ILE 646 -14.299 -28.165 15.163 1133 HG23 ILE 646 HG23 ILE 646 -15.462 -28.430 16.461 1134 HD11 ILE 646 HD11 ILE 646 -11.941 -27.610 17.038 1135 HD12 ILE 646 HD12 ILE 646 -12.247 -26.348 18.229 1136 HD13 ILE 646 HD13 ILE 646 -11.038 -26.097 16.972 1137 H GLU 647 H GLU 647 -17.510 -26.586 14.348 1138 HA GLU 647 HA GLU 647 -18.934 -27.339 16.737 1139 HB2 GLU 647 HB2 GLU 647 -21.086 -26.522 15.609 1140 HB3 GLU 647 HB3 GLU 647 -20.024 -25.343 16.352 1141 HG2 GLU 647 HG2 GLU 647 -19.109 -24.861 14.082 1142 HG3 GLU 647 HG3 GLU 647 -20.364 -25.915 13.421 1143 H GLU 648 H GLU 648 -20.415 -28.991 16.620 1144 HA GLU 648 HA GLU 648 -19.426 -31.028 14.913 1145 HB2 GLU 648 HB2 GLU 648 -21.887 -31.224 16.637 1146 HB3 GLU 648 HB3 GLU 648 -20.888 -32.489 15.914 1147 HG2 GLU 648 HG2 GLU 648 -19.081 -32.015 17.394 1148 HG3 GLU 648 HG3 GLU 648 -19.953 -30.645 18.088 1149 H SER 649 H SER 649 -19.942 -31.341 12.951 1150 HA SER 649 HA SER 649 -22.699 -31.425 12.238 1151 HB2 SER 649 HB2 SER 649 -22.080 -30.224 10.028 1152 HB3 SER 649 HB3 SER 649 -22.276 -29.234 11.471 1153 HG SER 649 HG SER 649 -20.439 -28.533 10.864 1154 H TYR 650 H TYR 650 -22.332 -33.580 12.431 1155 HA TYR 650 HA TYR 650 -20.218 -34.979 11.224 1156 HB2 TYR 650 HB2 TYR 650 -22.825 -35.824 12.422 1157 HB3 TYR 650 HB3 TYR 650 -21.769 -36.980 11.625 1158 HD1 TYR 650 HD1 TYR 650 -21.744 -34.411 14.325 1159 HD2 TYR 650 HD2 TYR 650 -20.121 -37.956 12.742 1160 HE1 TYR 650 HE1 TYR 650 -20.426 -34.704 16.407 1161 HE2 TYR 650 HE2 TYR 650 -18.778 -38.291 14.801 1162 HH TYR 650 HH TYR 650 -19.274 -36.371 17.643 1163 H GLU 651 H GLU 651 -23.628 -34.805 10.298 1164 HA GLU 651 HA GLU 651 -23.029 -36.141 7.870 1165 HB2 GLU 651 HB2 GLU 651 -25.193 -36.434 9.005 1166 HB3 GLU 651 HB3 GLU 651 -25.557 -34.732 8.785 1167 HG2 GLU 651 HG2 GLU 651 -26.809 -36.047 7.217 1168 HG3 GLU 651 HG3 GLU 651 -25.609 -35.089 6.354 1169 H PHE 652 H PHE 652 -23.266 -32.967 9.082 1170 HA PHE 652 HA PHE 652 -22.886 -30.871 8.387 1171 HB2 PHE 652 HB2 PHE 652 -20.952 -31.981 7.071 1172 HB3 PHE 652 HB3 PHE 652 -22.024 -31.949 5.680 1173 HD1 PHE 652 HD1 PHE 652 -20.488 -29.728 8.231 1174 HD2 PHE 652 HD2 PHE 652 -22.045 -30.074 4.286 1175 HE1 PHE 652 HE1 PHE 652 -19.726 -27.443 7.735 1176 HE2 PHE 652 HE2 PHE 652 -21.288 -27.791 3.786 1177 HZ PHE 652 HZ PHE 652 -20.128 -26.472 5.511 1178 H LYS 653 H LYS 653 -25.225 -32.430 7.961 1179 HA LYS 653 HA LYS 653 -26.641 -30.855 5.931 1180 HB2 LYS 653 HB2 LYS 653 -26.716 -33.246 5.463 1181 HB3 LYS 653 HB3 LYS 653 -27.195 -33.584 7.113 1182 HG2 LYS 653 HG2 LYS 653 -29.327 -32.420 6.712 1183 HG3 LYS 653 HG3 LYS 653 -28.836 -32.154 5.038 1184 HD2 LYS 653 HD2 LYS 653 -28.743 -34.536 4.640 1185 HD3 LYS 653 HD3 LYS 653 -29.104 -34.860 6.337 1186 HE2 LYS 653 HE2 LYS 653 -31.095 -35.148 4.976 1187 HE3 LYS 653 HE3 LYS 653 -31.290 -33.780 6.068 1188 HZ1 LYS 653 HZ1 LYS 653 -32.111 -33.274 3.888 1189 HZ2 LYS 653 HZ2 LYS 653 -30.641 -33.649 3.173 1190 HZ3 LYS 653 HZ3 LYS 653 -30.773 -32.306 4.185 1191 H SER 654 H SER 654 -28.072 -29.464 6.761 1192 HA SER 654 HA SER 654 -28.487 -29.393 9.599 1193 HB2 SER 654 HB2 SER 654 -29.773 -27.719 7.423 1194 HB3 SER 654 HB3 SER 654 -29.823 -27.382 9.154 1195 HG SER 654 HG SER 654 -27.411 -27.622 7.689 1196 H THR 655 H THR 655 -29.453 -31.384 9.923 1197 HA THR 655 HA THR 655 -31.850 -32.174 8.620 1198 HB THR 655 HB THR 655 -30.692 -33.169 11.241 1199 HG1 THR 655 HG1 THR 655 -29.084 -33.650 9.934 1200 HG21 THR 655 HG21 THR 655 -32.987 -33.933 10.755 1201 HG22 THR 655 HG22 THR 655 -31.831 -35.262 10.648 1202 HG23 THR 655 HG23 THR 655 -32.456 -34.517 9.177 1203 H VAL 656 H VAL 656 -30.984 -30.696 11.683 1204 HA VAL 656 HA VAL 656 -33.787 -29.914 12.040 1205 HB VAL 656 HB VAL 656 -31.716 -30.370 14.217 1206 HG11 VAL 656 HG11 VAL 656 -34.657 -29.743 14.421 1207 HG12 VAL 656 HG12 VAL 656 -33.328 -28.650 14.804 1208 HG13 VAL 656 HG13 VAL 656 -33.587 -30.098 15.777 1209 HG21 VAL 656 HG21 VAL 656 -33.054 -32.310 14.882 1210 HG22 VAL 656 HG22 VAL 656 -32.401 -32.496 13.254 1211 HG23 VAL 656 HG23 VAL 656 -34.098 -32.070 13.482 1212 H ASP 657 H ASP 657 -33.946 -27.810 11.640 1213 HA ASP 657 HA ASP 657 -31.615 -26.120 11.560 1214 HB2 ASP 657 HB2 ASP 657 -34.556 -25.419 11.243 1215 HB3 ASP 657 HB3 ASP 657 -33.255 -24.257 11.080 Start of MODEL 3 1 H HIS 501 H HIS 501 4.481 0.558 0.016 2 HA HIS 501 HA HIS 501 3.156 0.409 -2.342 3 HB2 HIS 501 HB2 HIS 501 5.591 0.530 -2.248 4 HB3 HIS 501 HB3 HIS 501 5.686 -1.079 -1.552 5 HD1 HIS 501 HD1 HIS 501 5.024 0.669 -4.842 6 HD2 HIS 501 HD2 HIS 501 5.619 -3.160 -3.359 7 HE1 HIS 501 HE1 HIS 501 5.275 -0.825 -6.850 8 H ALA 502 H ALA 502 3.308 -1.974 0.072 9 HA ALA 502 HA ALA 502 2.756 -4.177 -1.610 10 HB1 ALA 502 HB1 ALA 502 3.927 -4.434 0.491 11 HB2 ALA 502 HB2 ALA 502 2.526 -5.506 0.389 12 HB3 ALA 502 HB3 ALA 502 2.454 -4.037 1.372 13 H GLY 503 H GLY 503 0.519 -3.562 1.141 14 HA2 GLY 503 HA2 GLY 503 -1.787 -2.989 -0.174 15 HA3 GLY 503 HA3 GLY 503 -1.459 -4.680 -0.569 16 H ILE 504 H ILE 504 -2.962 -5.783 0.477 17 HA ILE 504 HA ILE 504 -3.258 -5.273 3.341 18 HB ILE 504 HB ILE 504 -5.433 -5.922 1.340 19 HG12 ILE 504 HG12 ILE 504 -6.490 -3.796 2.381 20 HG13 ILE 504 HG13 ILE 504 -4.858 -3.433 2.909 21 HG21 ILE 504 HG21 ILE 504 -5.671 -5.686 4.312 22 HG22 ILE 504 HG22 ILE 504 -5.864 -7.139 3.317 23 HG23 ILE 504 HG23 ILE 504 -7.019 -5.809 3.174 24 HD11 ILE 504 HD11 ILE 504 -4.104 -3.427 0.574 25 HD12 ILE 504 HD12 ILE 504 -5.401 -2.261 0.833 26 HD13 ILE 504 HD13 ILE 504 -5.741 -3.802 0.043 27 H PHE 505 H PHE 505 -2.612 -7.035 4.410 28 HA PHE 505 HA PHE 505 -3.316 -9.683 3.353 29 HB2 PHE 505 HB2 PHE 505 -1.166 -8.793 5.265 30 HB3 PHE 505 HB3 PHE 505 -1.824 -10.411 5.397 31 HD1 PHE 505 HD2 PHE 505 -1.783 -11.833 3.248 32 HD2 PHE 505 HD1 PHE 505 0.634 -8.391 3.869 33 HE1 PHE 505 HE2 PHE 505 -0.197 -12.658 1.566 34 HE2 PHE 505 HE1 PHE 505 2.235 -9.216 2.189 35 HZ PHE 505 HZ PHE 505 1.809 -11.366 1.029 36 H THR 506 H THR 506 -4.977 -10.688 4.314 37 HA THR 506 HA THR 506 -5.418 -10.653 7.062 38 HB THR 506 HB THR 506 -6.313 -8.332 6.554 39 HG1 THR 506 HG1 THR 506 -7.627 -8.765 8.185 40 HG21 THR 506 HG21 THR 506 -7.196 -8.782 4.291 41 HG22 THR 506 HG22 THR 506 -8.454 -8.130 5.341 42 HG23 THR 506 HG23 THR 506 -8.411 -9.855 4.985 43 H PHE 507 H PHE 507 -7.892 -11.506 7.289 44 HA PHE 507 HA PHE 507 -7.827 -13.930 5.701 45 HB2 PHE 507 HB2 PHE 507 -9.314 -13.149 8.193 46 HB3 PHE 507 HB3 PHE 507 -9.755 -14.590 7.282 47 HD1 PHE 507 HD1 PHE 507 -8.190 -16.430 7.082 48 HD2 PHE 507 HD2 PHE 507 -7.346 -13.074 9.544 49 HE1 PHE 507 HE1 PHE 507 -6.507 -17.742 8.253 50 HE2 PHE 507 HE2 PHE 507 -5.640 -14.375 10.742 51 HZ PHE 507 HZ PHE 507 -5.209 -16.720 10.096 52 H GLU 508 H GLU 508 -9.674 -14.723 4.564 53 HA GLU 508 HA GLU 508 -10.988 -12.865 2.928 54 HB2 GLU 508 HB2 GLU 508 -11.962 -15.628 3.619 55 HB3 GLU 508 HB3 GLU 508 -12.388 -14.687 2.208 56 HG2 GLU 508 HG2 GLU 508 -10.033 -14.864 1.460 57 HG3 GLU 508 HG3 GLU 508 -9.727 -15.931 2.835 58 H GLU 509 H GLU 509 -11.962 -14.504 5.849 59 HA GLU 509 HA GLU 509 -14.281 -12.797 6.103 60 HB2 GLU 509 HB2 GLU 509 -15.543 -14.836 6.893 61 HB3 GLU 509 HB3 GLU 509 -15.173 -14.824 5.176 62 HG2 GLU 509 HG2 GLU 509 -13.183 -16.280 5.723 63 HG3 GLU 509 HG3 GLU 509 -13.865 -16.419 7.343 64 HA PRO 510 HA PRO 510 -12.558 -12.441 10.148 65 HB2 PRO 510 HB2 PRO 510 -14.783 -11.724 11.552 66 HB3 PRO 510 HB3 PRO 510 -13.892 -10.619 10.500 67 HG2 PRO 510 HG2 PRO 510 -16.414 -12.127 9.967 68 HG3 PRO 510 HG3 PRO 510 -15.987 -10.469 9.509 69 HD2 PRO 510 HD2 PRO 510 -15.868 -12.570 7.766 70 HD3 PRO 510 HD3 PRO 510 -14.793 -11.159 7.660 71 H VAL 511 H VAL 511 -15.390 -14.446 9.654 72 HA VAL 511 HA VAL 511 -14.583 -16.142 11.927 73 HB VAL 511 HB VAL 511 -17.453 -15.586 11.134 74 HG11 VAL 511 HG11 VAL 511 -17.134 -17.719 12.193 75 HG12 VAL 511 HG12 VAL 511 -18.032 -16.636 13.260 76 HG13 VAL 511 HG13 VAL 511 -16.324 -16.953 13.558 77 HG21 VAL 511 HG21 VAL 511 -16.496 -13.526 12.027 78 HG22 VAL 511 HG22 VAL 511 -15.981 -14.385 13.481 79 HG23 VAL 511 HG23 VAL 511 -17.698 -14.208 13.113 80 H THR 512 H THR 512 -14.593 -18.305 11.403 81 HA THR 512 HA THR 512 -15.989 -19.053 8.978 82 HB THR 512 HB THR 512 -13.480 -18.719 8.578 83 HG1 THR 512 HG1 THR 512 -14.705 -19.832 7.243 84 HG21 THR 512 HG21 THR 512 -12.643 -19.726 10.670 85 HG22 THR 512 HG22 THR 512 -11.996 -20.580 9.266 86 HG23 THR 512 HG23 THR 512 -13.325 -21.278 10.193 87 H HIS 513 H HIS 513 -16.930 -21.081 9.113 88 HA HIS 513 HA HIS 513 -16.545 -22.338 11.723 89 HB2 HIS 513 HB2 HIS 513 -18.787 -23.158 11.756 90 HB3 HIS 513 HB3 HIS 513 -18.895 -21.476 11.293 91 HD1 HIS 513 HD1 HIS 513 -20.648 -24.289 10.720 92 HD2 HIS 513 HD2 HIS 513 -18.831 -21.658 8.081 93 HE1 HIS 513 HE1 HIS 513 -21.760 -24.677 8.473 94 H VAL 514 H VAL 514 -15.938 -24.383 11.863 95 HA VAL 514 HA VAL 514 -15.635 -25.833 9.350 96 HB VAL 514 HB VAL 514 -13.500 -26.748 10.083 97 HG11 VAL 514 HG11 VAL 514 -13.508 -23.741 10.229 98 HG12 VAL 514 HG12 VAL 514 -13.381 -24.733 8.776 99 HG13 VAL 514 HG13 VAL 514 -12.084 -24.746 9.968 100 HG21 VAL 514 HG21 VAL 514 -12.334 -25.920 12.091 101 HG22 VAL 514 HG22 VAL 514 -13.845 -26.731 12.503 102 HG23 VAL 514 HG23 VAL 514 -13.759 -24.971 12.518 103 H SER 515 H SER 515 -15.285 -28.195 9.803 104 HA SER 515 HA SER 515 -17.317 -29.013 11.628 105 HB2 SER 515 HB2 SER 515 -15.811 -30.140 9.341 106 HB3 SER 515 HB3 SER 515 -16.941 -31.124 10.251 107 HG SER 515 HG SER 515 -18.412 -29.223 9.747 108 H GLU 516 H GLU 516 -16.907 -30.570 13.162 109 HA GLU 516 HA GLU 516 -14.366 -30.838 14.335 110 HB2 GLU 516 HB2 GLU 516 -16.440 -31.112 15.623 111 HB3 GLU 516 HB3 GLU 516 -16.906 -32.469 14.630 112 HG2 GLU 516 HG2 GLU 516 -14.463 -32.571 16.383 113 HG3 GLU 516 HG3 GLU 516 -16.069 -32.924 17.007 114 H SER 517 H SER 517 -16.319 -33.133 12.508 115 HA SER 517 HA SER 517 -14.366 -35.197 12.402 116 HB2 SER 517 HB2 SER 517 -16.851 -35.047 10.785 117 HB3 SER 517 HB3 SER 517 -16.207 -36.386 11.749 118 HG SER 517 HG SER 517 -16.729 -35.134 13.655 119 H ILE 518 H ILE 518 -13.367 -32.833 11.085 120 HA ILE 518 HA ILE 518 -13.714 -33.346 8.199 121 HB ILE 518 HB ILE 518 -14.239 -31.100 9.031 122 HG12 ILE 518 HG12 ILE 518 -11.829 -31.176 7.222 123 HG13 ILE 518 HG13 ILE 518 -13.513 -31.336 6.720 124 HG21 ILE 518 HG21 ILE 518 -12.466 -29.577 9.757 125 HG22 ILE 518 HG22 ILE 518 -11.317 -30.925 9.758 126 HG23 ILE 518 HG23 ILE 518 -12.703 -30.929 10.861 127 HD11 ILE 518 HD11 ILE 518 -13.949 -29.072 7.526 128 HD12 ILE 518 HD12 ILE 518 -12.686 -29.100 6.273 129 HD13 ILE 518 HD13 ILE 518 -12.249 -28.927 7.975 130 H GLY 519 H GLY 519 -11.345 -33.387 10.763 131 HA2 GLY 519 HA2 GLY 519 -9.246 -34.388 10.644 132 HA3 GLY 519 HA3 GLY 519 -9.346 -34.321 8.886 133 H ILE 520 H ILE 520 -9.225 -32.183 7.918 134 HA ILE 520 HA ILE 520 -7.454 -30.384 9.427 135 HB ILE 520 HB ILE 520 -7.070 -31.300 6.568 136 HG12 ILE 520 HG12 ILE 520 -6.293 -33.009 8.196 137 HG13 ILE 520 HG13 ILE 520 -4.976 -32.350 7.237 138 HG21 ILE 520 HG21 ILE 520 -6.459 -28.995 6.744 139 HG22 ILE 520 HG22 ILE 520 -4.980 -29.948 6.587 140 HG23 ILE 520 HG23 ILE 520 -5.464 -29.311 8.161 141 HD11 ILE 520 HD11 ILE 520 -4.305 -32.640 9.535 142 HD12 ILE 520 HD12 ILE 520 -5.652 -31.645 10.079 143 HD13 ILE 520 HD13 ILE 520 -4.348 -30.920 9.136 144 H MET 521 H MET 521 -8.076 -28.323 9.154 145 HA MET 521 HA MET 521 -9.945 -27.806 6.966 146 HB2 MET 521 HB2 MET 521 -10.912 -26.012 8.240 147 HB3 MET 521 HB3 MET 521 -10.864 -27.431 9.256 148 HG2 MET 521 HG2 MET 521 -10.196 -25.728 10.751 149 HG3 MET 521 HG3 MET 521 -8.679 -26.363 10.154 150 HE1 MET 521 HE1 MET 521 -8.439 -22.336 10.562 151 HE2 MET 521 HE2 MET 521 -8.014 -23.864 11.342 152 HE3 MET 521 HE3 MET 521 -9.686 -23.301 11.349 153 H GLU 522 H GLU 522 -9.598 -26.003 5.657 154 HA GLU 522 HA GLU 522 -6.991 -24.709 5.952 155 HB2 GLU 522 HB2 GLU 522 -8.209 -25.966 3.541 156 HB3 GLU 522 HB3 GLU 522 -7.161 -24.573 3.347 157 HG2 GLU 522 HG2 GLU 522 -5.359 -25.721 4.401 158 HG3 GLU 522 HG3 GLU 522 -6.373 -27.132 4.732 159 H VAL 523 H VAL 523 -7.171 -22.638 6.207 160 HA VAL 523 HA VAL 523 -9.460 -21.272 4.969 161 HB VAL 523 HB VAL 523 -7.825 -20.394 7.369 162 HG11 VAL 523 HG11 VAL 523 -10.233 -19.123 6.051 163 HG12 VAL 523 HG12 VAL 523 -8.592 -18.458 6.135 164 HG13 VAL 523 HG13 VAL 523 -9.551 -18.632 7.599 165 HG21 VAL 523 HG21 VAL 523 -10.678 -21.351 7.215 166 HG22 VAL 523 HG22 VAL 523 -9.796 -20.860 8.678 167 HG23 VAL 523 HG23 VAL 523 -9.305 -22.290 7.789 168 H LYS 524 H LYS 524 -9.045 -19.796 3.485 169 HA LYS 524 HA LYS 524 -6.298 -19.454 2.648 170 HB2 LYS 524 HB2 LYS 524 -8.781 -18.356 1.356 171 HB3 LYS 524 HB3 LYS 524 -7.181 -18.550 0.657 172 HG2 LYS 524 HG2 LYS 524 -7.530 -21.061 1.099 173 HG3 LYS 524 HG3 LYS 524 -9.232 -20.631 1.238 174 HD2 LYS 524 HD2 LYS 524 -7.407 -20.252 -1.107 175 HD3 LYS 524 HD3 LYS 524 -8.832 -21.302 -1.025 176 HE2 LYS 524 HE2 LYS 524 -10.148 -19.134 -0.662 177 HE3 LYS 524 HE3 LYS 524 -8.622 -18.342 -1.078 178 HZ1 LYS 524 HZ1 LYS 524 -10.093 -20.181 -2.887 179 HZ2 LYS 524 HZ2 LYS 524 -8.653 -19.376 -3.235 180 HZ3 LYS 524 HZ3 LYS 524 -10.059 -18.502 -2.993 181 H VAL 525 H VAL 525 -5.252 -17.571 2.565 182 HA VAL 525 HA VAL 525 -6.358 -15.322 4.121 183 HB VAL 525 HB VAL 525 -3.482 -15.871 3.347 184 HG11 VAL 525 HG11 VAL 525 -3.898 -13.515 3.815 185 HG12 VAL 525 HG12 VAL 525 -2.904 -14.234 5.086 186 HG13 VAL 525 HG13 VAL 525 -4.624 -13.948 5.363 187 HG21 VAL 525 HG21 VAL 525 -4.290 -17.612 4.802 188 HG22 VAL 525 HG22 VAL 525 -4.872 -16.412 5.953 189 HG23 VAL 525 HG23 VAL 525 -3.142 -16.585 5.655 190 H LEU 526 H LEU 526 -6.427 -13.265 3.223 191 HA LEU 526 HA LEU 526 -6.398 -13.089 0.360 192 HB2 LEU 526 HB2 LEU 526 -6.725 -10.945 2.464 193 HB3 LEU 526 HB3 LEU 526 -6.965 -10.717 0.747 194 HG LEU 526 HG LEU 526 -8.647 -12.456 2.552 195 HD11 LEU 526 HD11 LEU 526 -10.383 -10.791 2.134 196 HD12 LEU 526 HD12 LEU 526 -9.236 -9.831 1.200 197 HD13 LEU 526 HD13 LEU 526 -8.982 -10.078 2.929 198 HD21 LEU 526 HD21 LEU 526 -8.910 -11.819 -0.385 199 HD22 LEU 526 HD22 LEU 526 -10.129 -12.640 0.586 200 HD23 LEU 526 HD23 LEU 526 -8.558 -13.398 0.320 201 H ARG 527 H ARG 527 -4.650 -12.778 -0.769 202 HA ARG 527 HA ARG 527 -2.177 -12.087 0.457 203 HB2 ARG 527 HB2 ARG 527 -2.350 -13.626 -1.494 204 HB3 ARG 527 HB3 ARG 527 -2.877 -12.287 -2.492 205 HG2 ARG 527 HG2 ARG 527 -0.695 -11.165 -2.015 206 HG3 ARG 527 HG3 ARG 527 -0.181 -12.627 -1.178 207 HD2 ARG 527 HD2 ARG 527 0.703 -12.667 -3.405 208 HD3 ARG 527 HD3 ARG 527 -0.561 -13.888 -3.280 209 HE ARG 527 HE ARG 527 -1.753 -11.563 -4.211 210 HH11 ARG 527 HH11 ARG 527 0.604 -13.959 -5.406 211 HH12 ARG 527 HH12 ARG 527 0.315 -13.601 -7.045 212 HH21 ARG 527 HH21 ARG 527 -2.110 -11.097 -6.497 213 HH22 ARG 527 HH22 ARG 527 -1.262 -12.001 -7.660 214 H THR 528 H THR 528 -0.952 -10.223 0.017 215 HA THR 528 HA THR 528 -2.225 -7.794 0.085 216 HB THR 528 HB THR 528 0.025 -8.292 0.967 217 HG1 THR 528 HG1 THR 528 0.649 -6.346 0.642 218 HG21 THR 528 HG21 THR 528 1.945 -8.363 -0.543 219 HG22 THR 528 HG22 THR 528 0.846 -8.337 -1.924 220 HG23 THR 528 HG23 THR 528 0.849 -9.720 -0.825 221 H SER 529 H SER 529 -2.093 -6.090 -1.455 222 HA SER 529 HA SER 529 -2.972 -6.818 -4.033 223 HB2 SER 529 HB2 SER 529 -3.846 -4.881 -2.796 224 HB3 SER 529 HB3 SER 529 -2.261 -4.139 -2.807 225 HG SER 529 HG SER 529 -3.955 -4.667 -4.993 226 H GLY 530 H GLY 530 0.041 -5.923 -2.600 227 HA2 GLY 530 HA2 GLY 530 1.317 -5.987 -5.246 228 HA3 GLY 530 HA3 GLY 530 1.772 -4.810 -4.020 229 H ALA 531 H ALA 531 1.702 -8.223 -4.789 230 HA ALA 531 HA ALA 531 3.613 -8.741 -2.655 231 HB1 ALA 531 HB1 ALA 531 1.848 -10.411 -3.025 232 HB2 ALA 531 HB2 ALA 531 3.432 -11.102 -3.384 233 HB3 ALA 531 HB3 ALA 531 2.369 -10.601 -4.698 234 H ARG 532 H ARG 532 5.505 -7.894 -3.210 235 HA ARG 532 HA ARG 532 6.438 -8.446 -5.904 236 HB2 ARG 532 HB2 ARG 532 7.009 -6.093 -4.121 237 HB3 ARG 532 HB3 ARG 532 7.902 -6.412 -5.603 238 HG2 ARG 532 HG2 ARG 532 4.935 -5.941 -5.391 239 HG3 ARG 532 HG3 ARG 532 6.117 -4.758 -5.946 240 HD2 ARG 532 HD2 ARG 532 6.702 -6.244 -7.826 241 HD3 ARG 532 HD3 ARG 532 5.531 -7.427 -7.256 242 HE ARG 532 HE ARG 532 4.281 -4.958 -7.647 243 HH11 ARG 532 HH11 ARG 532 5.621 -7.692 -9.499 244 HH12 ARG 532 HH12 ARG 532 4.607 -7.416 -10.851 245 HH21 ARG 532 HH21 ARG 532 2.907 -4.652 -9.510 246 HH22 ARG 532 HH22 ARG 532 3.066 -5.699 -10.863 247 H GLY 533 H GLY 533 7.440 -10.231 -5.737 248 HA2 GLY 533 HA2 GLY 533 9.615 -11.200 -5.539 249 HA3 GLY 533 HA3 GLY 533 9.866 -10.229 -4.087 250 H ASN 534 H ASN 534 9.897 -11.417 -2.342 251 HA ASN 534 HA ASN 534 7.883 -13.509 -2.031 252 HB2 ASN 534 HB2 ASN 534 9.951 -14.627 -2.646 253 HB3 ASN 534 HB3 ASN 534 10.836 -13.743 -1.418 254 HD21 ASN 534 HD21 ASN 534 7.611 -15.155 -0.807 255 HD22 ASN 534 HD22 ASN 534 8.222 -16.351 0.254 256 H VAL 535 H VAL 535 6.805 -13.383 -0.185 257 HA VAL 535 HA VAL 535 7.905 -11.842 2.040 258 HB VAL 535 HB VAL 535 5.054 -11.781 0.994 259 HG11 VAL 535 HG11 VAL 535 4.663 -10.041 2.668 260 HG12 VAL 535 HG12 VAL 535 6.298 -10.279 3.286 261 HG13 VAL 535 HG13 VAL 535 5.115 -11.578 3.404 262 HG21 VAL 535 HG21 VAL 535 7.184 -9.662 0.927 263 HG22 VAL 535 HG22 VAL 535 5.492 -9.409 0.468 264 HG23 VAL 535 HG23 VAL 535 6.512 -10.522 -0.454 265 H ILE 536 H ILE 536 7.576 -12.833 3.957 266 HA ILE 536 HA ILE 536 6.038 -15.333 3.933 267 HB ILE 536 HB ILE 536 8.260 -14.421 5.776 268 HG12 ILE 536 HG12 ILE 536 9.105 -15.201 3.645 269 HG13 ILE 536 HG13 ILE 536 9.474 -16.380 4.902 270 HG21 ILE 536 HG21 ILE 536 6.675 -16.949 5.842 271 HG22 ILE 536 HG22 ILE 536 6.586 -15.634 7.009 272 HG23 ILE 536 HG23 ILE 536 8.073 -16.594 6.869 273 HD11 ILE 536 HD11 ILE 536 7.478 -17.661 4.122 274 HD12 ILE 536 HD12 ILE 536 8.811 -17.556 2.974 275 HD13 ILE 536 HD13 ILE 536 7.389 -16.547 2.752 276 H VAL 537 H VAL 537 4.366 -15.576 5.328 277 HA VAL 537 HA VAL 537 3.902 -13.368 7.171 278 HB VAL 537 HB VAL 537 1.753 -14.936 5.702 279 HG11 VAL 537 HG11 VAL 537 1.504 -12.563 7.553 280 HG12 VAL 537 HG12 VAL 537 1.013 -14.217 7.915 281 HG13 VAL 537 HG13 VAL 537 0.180 -13.307 6.656 282 HG21 VAL 537 HG21 VAL 537 2.962 -13.426 4.232 283 HG22 VAL 537 HG22 VAL 537 2.680 -12.099 5.353 284 HG23 VAL 537 HG23 VAL 537 1.314 -12.838 4.502 285 HA PRO 538 HA PRO 538 4.036 -16.969 9.948 286 HB2 PRO 538 HB2 PRO 538 4.181 -15.536 12.237 287 HB3 PRO 538 HB3 PRO 538 5.588 -15.849 11.226 288 HG2 PRO 538 HG2 PRO 538 3.910 -13.389 11.439 289 HG3 PRO 538 HG3 PRO 538 5.663 -13.527 11.237 290 HD2 PRO 538 HD2 PRO 538 3.943 -12.938 9.198 291 HD3 PRO 538 HD3 PRO 538 5.501 -13.751 8.964 292 H TYR 539 H TYR 539 2.576 -17.862 11.433 293 HA TYR 539 HA TYR 539 0.275 -16.310 12.239 294 HB2 TYR 539 HB2 TYR 539 -1.424 -17.690 11.259 295 HB3 TYR 539 HB3 TYR 539 -0.309 -17.242 9.973 296 HD1 TYR 539 HD2 TYR 539 -1.454 -20.009 12.134 297 HD2 TYR 539 HD1 TYR 539 0.868 -18.937 8.739 298 HE1 TYR 539 HE2 TYR 539 -1.342 -22.366 11.487 299 HE2 TYR 539 HE1 TYR 539 0.971 -21.308 8.067 300 HH TYR 539 HH TYR 539 0.749 -23.558 9.118 301 H LYS 540 H LYS 540 -0.972 -17.322 13.848 302 HA LYS 540 HA LYS 540 -0.172 -19.893 14.767 303 HB2 LYS 540 HB2 LYS 540 0.227 -19.152 17.138 304 HB3 LYS 540 HB3 LYS 540 1.489 -18.763 15.986 305 HG2 LYS 540 HG2 LYS 540 1.210 -16.986 17.587 306 HG3 LYS 540 HG3 LYS 540 0.731 -16.429 15.991 307 HD2 LYS 540 HD2 LYS 540 -1.541 -16.430 16.561 308 HD3 LYS 540 HD3 LYS 540 -1.281 -17.461 17.964 309 HE2 LYS 540 HE2 LYS 540 -1.724 -15.138 18.597 310 HE3 LYS 540 HE3 LYS 540 -0.142 -15.713 19.115 311 HZ1 LYS 540 HZ1 LYS 540 0.104 -13.534 18.308 312 HZ2 LYS 540 HZ2 LYS 540 -0.745 -13.797 16.909 313 HZ3 LYS 540 HZ3 LYS 540 0.782 -14.504 17.112 314 H THR 541 H THR 541 -1.544 -20.840 16.358 315 HA THR 541 HA THR 541 -4.239 -19.986 16.063 316 HB THR 541 HB THR 541 -4.611 -21.922 17.674 317 HG1 THR 541 HG1 THR 541 -2.750 -22.219 18.677 318 HG21 THR 541 HG21 THR 541 -3.135 -22.505 15.088 319 HG22 THR 541 HG22 THR 541 -4.851 -22.171 15.234 320 HG23 THR 541 HG23 THR 541 -4.192 -23.647 15.923 321 H ILE 542 H ILE 542 -5.575 -19.398 17.802 322 HA ILE 542 HA ILE 542 -4.169 -18.371 20.146 323 HB ILE 542 HB ILE 542 -6.684 -17.411 18.810 324 HG12 ILE 542 HG12 ILE 542 -4.015 -16.038 19.107 325 HG13 ILE 542 HG13 ILE 542 -4.613 -16.784 17.633 326 HG21 ILE 542 HG21 ILE 542 -6.857 -17.154 21.244 327 HG22 ILE 542 HG22 ILE 542 -6.673 -15.568 20.493 328 HG23 ILE 542 HG23 ILE 542 -5.295 -16.333 21.286 329 HD11 ILE 542 HD11 ILE 542 -6.364 -15.161 17.465 330 HD12 ILE 542 HD12 ILE 542 -4.811 -14.332 17.662 331 HD13 ILE 542 HD13 ILE 542 -5.923 -14.460 19.024 332 H GLU 543 H GLU 543 -4.567 -19.606 21.762 333 HA GLU 543 HA GLU 543 -6.809 -21.404 21.772 334 HB2 GLU 543 HB2 GLU 543 -4.626 -20.991 23.838 335 HB3 GLU 543 HB3 GLU 543 -5.811 -22.277 23.834 336 HG2 GLU 543 HG2 GLU 543 -3.754 -23.200 23.112 337 HG3 GLU 543 HG3 GLU 543 -4.796 -23.127 21.707 338 H GLY 544 H GLY 544 -8.436 -21.357 23.352 339 HA2 GLY 544 HA2 GLY 544 -8.565 -19.597 25.521 340 HA3 GLY 544 HA3 GLY 544 -9.340 -18.807 24.151 341 H THR 545 H THR 545 -11.294 -19.585 23.357 342 HA THR 545 HA THR 545 -12.871 -21.039 25.193 343 HB THR 545 HB THR 545 -14.468 -20.777 23.058 344 HG1 THR 545 HG1 THR 545 -12.965 -19.980 21.637 345 HG21 THR 545 HG21 THR 545 -14.801 -19.734 25.248 346 HG22 THR 545 HG22 THR 545 -15.077 -18.555 23.958 347 HG23 THR 545 HG23 THR 545 -13.569 -18.531 24.875 348 H ALA 546 H ALA 546 -10.733 -22.031 22.980 349 HA ALA 546 HA ALA 546 -11.640 -24.744 23.182 350 HB1 ALA 546 HB1 ALA 546 -10.752 -23.434 20.593 351 HB2 ALA 546 HB2 ALA 546 -12.336 -24.139 20.904 352 HB3 ALA 546 HB3 ALA 546 -10.910 -25.176 20.807 353 H ARG 547 H ARG 547 -9.795 -26.076 23.415 354 HA ARG 547 HA ARG 547 -7.417 -24.509 24.069 355 HB2 ARG 547 HB2 ARG 547 -8.308 -27.209 25.007 356 HB3 ARG 547 HB3 ARG 547 -6.842 -26.391 25.521 357 HG2 ARG 547 HG2 ARG 547 -8.112 -24.631 26.478 358 HG3 ARG 547 HG3 ARG 547 -9.631 -25.347 25.913 359 HD2 ARG 547 HD2 ARG 547 -8.983 -27.406 27.224 360 HD3 ARG 547 HD3 ARG 547 -7.707 -26.433 27.951 361 HE ARG 547 HE ARG 547 -9.661 -24.908 28.555 362 HH11 ARG 547 HH11 ARG 547 -9.802 -28.459 28.448 363 HH12 ARG 547 HH12 ARG 547 -10.974 -28.594 29.679 364 HH21 ARG 547 HH21 ARG 547 -11.280 -25.117 30.284 365 HH22 ARG 547 HH22 ARG 547 -11.824 -26.662 30.731 366 H GLY 548 H GLY 548 -5.478 -25.102 23.487 367 HA2 GLY 548 HA2 GLY 548 -5.245 -26.852 21.181 368 HA3 GLY 548 HA3 GLY 548 -3.994 -25.768 21.796 369 H GLY 549 H GLY 549 -2.439 -27.458 21.821 370 HA2 GLY 549 HA2 GLY 549 -1.215 -28.973 22.978 371 HA3 GLY 549 HA3 GLY 549 -2.457 -29.014 24.230 372 H GLY 550 H GLY 550 -3.690 -29.450 21.142 373 HA2 GLY 550 HA2 GLY 550 -4.432 -31.304 20.006 374 HA3 GLY 550 HA3 GLY 550 -3.414 -32.302 21.043 375 H GLU 551 H GLU 551 -5.685 -30.010 22.340 376 HA GLU 551 HA GLU 551 -7.134 -32.237 23.543 377 HB2 GLU 551 HB2 GLU 551 -6.167 -30.325 24.924 378 HB3 GLU 551 HB3 GLU 551 -7.413 -29.312 24.209 379 HG2 GLU 551 HG2 GLU 551 -9.148 -30.652 25.202 380 HG3 GLU 551 HG3 GLU 551 -7.964 -31.812 25.795 381 H ASP 552 H ASP 552 -8.027 -29.033 22.189 382 HA ASP 552 HA ASP 552 -10.453 -30.301 21.109 383 HB2 ASP 552 HB2 ASP 552 -9.770 -27.355 21.400 384 HB3 ASP 552 HB3 ASP 552 -11.243 -27.967 20.666 385 H PHE 553 H PHE 553 -7.715 -28.307 20.287 386 HA PHE 553 HA PHE 553 -7.953 -29.330 17.588 387 HB2 PHE 553 HB2 PHE 553 -7.454 -27.153 16.583 388 HB3 PHE 553 HB3 PHE 553 -8.918 -27.055 17.548 389 HD1 PHE 553 HD1 PHE 553 -8.966 -25.747 19.603 390 HD2 PHE 553 HD2 PHE 553 -5.468 -25.955 17.197 391 HE1 PHE 553 HE1 PHE 553 -8.052 -23.777 20.753 392 HE2 PHE 553 HE2 PHE 553 -4.552 -24.001 18.344 393 HZ PHE 553 HZ PHE 553 -5.850 -22.898 20.119 394 H GLU 554 H GLU 554 -5.951 -29.231 16.421 395 HA GLU 554 HA GLU 554 -3.747 -29.843 18.163 396 HB2 GLU 554 HB2 GLU 554 -4.510 -30.968 15.907 397 HB3 GLU 554 HB3 GLU 554 -3.562 -29.656 15.193 398 HG2 GLU 554 HG2 GLU 554 -1.664 -30.448 16.683 399 HG3 GLU 554 HG3 GLU 554 -2.721 -31.826 16.994 400 H ASP 555 H ASP 555 -1.943 -28.560 18.359 401 HA ASP 555 HA ASP 555 -2.264 -25.751 17.910 402 HB2 ASP 555 HB2 ASP 555 0.270 -27.201 18.670 403 HB3 ASP 555 HB3 ASP 555 -0.065 -25.492 18.877 404 H THR 556 H THR 556 -1.856 -24.749 16.063 405 HA THR 556 HA THR 556 0.416 -25.719 14.579 406 HB THR 556 HB THR 556 -1.673 -26.446 13.390 407 HG1 THR 556 HG1 THR 556 -1.009 -25.216 11.346 408 HG21 THR 556 HG21 THR 556 -3.168 -24.625 13.895 409 HG22 THR 556 HG22 THR 556 -2.916 -24.689 12.137 410 HG23 THR 556 HG23 THR 556 -2.087 -23.477 13.108 411 H CYS 557 H CYS 557 1.566 -24.224 13.542 412 HA CYS 557 HA CYS 557 0.998 -21.499 13.443 413 HB2 CYS 557 HB2 CYS 557 2.927 -20.864 15.009 414 HB3 CYS 557 HB3 CYS 557 1.435 -21.374 15.786 415 HG CYS 557 HG CYS 557 2.361 -23.325 17.087 416 H GLY 558 H GLY 558 2.807 -20.420 12.372 417 HA2 GLY 558 HA2 GLY 558 5.152 -21.528 11.665 418 HA3 GLY 558 HA3 GLY 558 3.981 -22.256 10.566 419 H GLU 559 H GLU 559 4.860 -21.232 8.816 420 HA GLU 559 HA GLU 559 4.193 -18.416 8.613 421 HB2 GLU 559 HB2 GLU 559 6.907 -19.619 8.108 422 HB3 GLU 559 HB3 GLU 559 6.429 -18.043 7.489 423 HG2 GLU 559 HG2 GLU 559 6.176 -17.202 9.744 424 HG3 GLU 559 HG3 GLU 559 6.515 -18.799 10.411 425 H LEU 560 H LEU 560 3.334 -17.918 6.730 426 HA LEU 560 HA LEU 560 3.124 -19.975 4.651 427 HB2 LEU 560 HB2 LEU 560 1.668 -17.383 5.099 428 HB3 LEU 560 HB3 LEU 560 1.371 -18.475 3.765 429 HG LEU 560 HG LEU 560 0.925 -19.114 6.675 430 HD11 LEU 560 HD11 LEU 560 -1.038 -18.510 4.476 431 HD12 LEU 560 HD12 LEU 560 -0.655 -17.471 5.848 432 HD13 LEU 560 HD13 LEU 560 -1.433 -19.030 6.111 433 HD21 LEU 560 HD21 LEU 560 1.445 -21.133 5.560 434 HD22 LEU 560 HD22 LEU 560 0.536 -20.679 4.147 435 HD23 LEU 560 HD23 LEU 560 -0.323 -21.081 5.651 436 H GLU 561 H GLU 561 3.947 -19.682 2.654 437 HA GLU 561 HA GLU 561 5.649 -17.352 2.358 438 HB2 GLU 561 HB2 GLU 561 6.565 -19.686 2.113 439 HB3 GLU 561 HB3 GLU 561 5.568 -19.831 0.665 440 HG2 GLU 561 HG2 GLU 561 6.794 -17.842 -0.273 441 HG3 GLU 561 HG3 GLU 561 7.773 -17.880 1.152 442 H PHE 562 H PHE 562 4.843 -15.706 1.272 443 HA PHE 562 HA PHE 562 3.044 -16.250 -0.965 444 HB2 PHE 562 HB2 PHE 562 3.278 -13.829 0.832 445 HB3 PHE 562 HB3 PHE 562 2.395 -13.808 -0.687 446 HD1 PHE 562 HD2 PHE 562 2.443 -15.073 2.750 447 HD2 PHE 562 HD1 PHE 562 0.285 -14.925 -0.907 448 HE1 PHE 562 HE2 PHE 562 0.427 -15.873 3.910 449 HE2 PHE 562 HE1 PHE 562 -1.736 -15.723 0.243 450 HZ PHE 562 HZ PHE 562 -1.660 -16.200 2.659 451 H GLN 563 H GLN 563 3.474 -15.175 -2.899 452 HA GLN 563 HA GLN 563 5.946 -13.688 -3.114 453 HB2 GLN 563 HB2 GLN 563 5.460 -16.240 -4.689 454 HB3 GLN 563 HB3 GLN 563 6.781 -15.116 -4.942 455 HG2 GLN 563 HG2 GLN 563 7.538 -15.630 -2.629 456 HG3 GLN 563 HG3 GLN 563 6.299 -16.873 -2.566 457 HE21 GLN 563 HE21 GLN 563 9.284 -15.894 -4.039 458 HE22 GLN 563 HE22 GLN 563 9.716 -17.438 -4.636 459 H ASN 564 H ASN 564 6.182 -13.320 -5.601 460 HA ASN 564 HA ASN 564 3.859 -12.061 -6.566 461 HB2 ASN 564 HB2 ASN 564 5.163 -11.794 -8.701 462 HB3 ASN 564 HB3 ASN 564 6.045 -11.258 -7.281 463 HD21 ASN 564 HD21 ASN 564 7.004 -12.110 -9.923 464 HD22 ASN 564 HD22 ASN 564 8.105 -13.398 -9.638 465 H ASP 565 H ASP 565 5.338 -15.150 -6.930 466 HA ASP 565 HA ASP 565 3.600 -16.145 -9.015 467 HB2 ASP 565 HB2 ASP 565 5.946 -16.866 -8.855 468 HB3 ASP 565 HB3 ASP 565 5.603 -17.610 -7.296 469 H GLU 566 H GLU 566 3.884 -16.531 -5.506 470 HA GLU 566 HA GLU 566 1.881 -18.541 -5.346 471 HB2 GLU 566 HB2 GLU 566 3.290 -16.827 -3.344 472 HB3 GLU 566 HB3 GLU 566 1.949 -17.878 -2.912 473 HG2 GLU 566 HG2 GLU 566 4.508 -18.768 -4.207 474 HG3 GLU 566 HG3 GLU 566 4.142 -18.879 -2.482 475 H ILE 567 H ILE 567 -0.196 -18.296 -5.164 476 HA ILE 567 HA ILE 567 -1.243 -15.597 -5.204 477 HB ILE 567 HB ILE 567 -3.505 -16.827 -5.568 478 HG12 ILE 567 HG12 ILE 567 -1.754 -18.986 -6.715 479 HG13 ILE 567 HG13 ILE 567 -2.332 -19.138 -5.070 480 HG21 ILE 567 HG21 ILE 567 -1.375 -16.801 -7.686 481 HG22 ILE 567 HG22 ILE 567 -2.418 -15.451 -7.237 482 HG23 ILE 567 HG23 ILE 567 -3.111 -16.894 -7.983 483 HD11 ILE 567 HD11 ILE 567 -4.591 -19.012 -5.842 484 HD12 ILE 567 HD12 ILE 567 -3.724 -20.348 -6.606 485 HD13 ILE 567 HD13 ILE 567 -4.053 -18.861 -7.519 486 H VAL 568 H VAL 568 -2.438 -18.554 -3.584 487 HA VAL 568 HA VAL 568 -2.825 -16.870 -1.262 488 HB VAL 568 HB VAL 568 -4.944 -17.078 -2.522 489 HG11 VAL 568 HG11 VAL 568 -4.715 -19.264 -3.524 490 HG12 VAL 568 HG12 VAL 568 -6.180 -19.160 -2.519 491 HG13 VAL 568 HG13 VAL 568 -4.761 -20.002 -1.911 492 HG21 VAL 568 HG21 VAL 568 -5.031 -18.526 0.093 493 HG22 VAL 568 HG22 VAL 568 -6.352 -17.677 -0.743 494 HG23 VAL 568 HG23 VAL 568 -4.973 -16.770 -0.122 495 H LYS 569 H LYS 569 -2.697 -17.941 0.699 496 HA LYS 569 HA LYS 569 -1.763 -20.699 0.573 497 HB2 LYS 569 HB2 LYS 569 -0.970 -18.478 2.424 498 HB3 LYS 569 HB3 LYS 569 -0.594 -20.184 2.669 499 HG2 LYS 569 HG2 LYS 569 0.116 -19.127 0.086 500 HG3 LYS 569 HG3 LYS 569 1.026 -18.379 1.412 501 HD2 LYS 569 HD2 LYS 569 2.326 -20.247 0.651 502 HD3 LYS 569 HD3 LYS 569 1.532 -20.775 2.105 503 HE2 LYS 569 HE2 LYS 569 1.469 -22.500 0.345 504 HE3 LYS 569 HE3 LYS 569 -0.129 -21.992 0.868 505 HZ1 LYS 569 HZ1 LYS 569 0.108 -22.276 -1.544 506 HZ2 LYS 569 HZ2 LYS 569 1.219 -21.043 -1.645 507 HZ3 LYS 569 HZ3 LYS 569 -0.386 -20.726 -1.184 508 H THR 570 H THR 570 -2.302 -21.923 2.360 509 HA THR 570 HA THR 570 -4.730 -21.016 3.733 510 HB THR 570 HB THR 570 -5.185 -23.573 3.847 511 HG1 THR 570 HG1 THR 570 -4.381 -24.716 2.116 512 HG21 THR 570 HG21 THR 570 -5.542 -22.022 1.271 513 HG22 THR 570 HG22 THR 570 -6.586 -21.965 2.695 514 HG23 THR 570 HG23 THR 570 -6.450 -23.458 1.778 515 H ILE 571 H ILE 571 -5.033 -21.509 5.812 516 HA ILE 571 HA ILE 571 -2.745 -22.542 7.301 517 HB ILE 571 HB ILE 571 -5.334 -21.229 8.240 518 HG12 ILE 571 HG12 ILE 571 -3.745 -19.610 9.368 519 HG13 ILE 571 HG13 ILE 571 -2.445 -20.394 8.489 520 HG21 ILE 571 HG21 ILE 571 -4.827 -23.025 9.753 521 HG22 ILE 571 HG22 ILE 571 -4.584 -21.465 10.543 522 HG23 ILE 571 HG23 ILE 571 -3.193 -22.406 9.995 523 HD11 ILE 571 HD11 ILE 571 -4.768 -18.941 7.288 524 HD12 ILE 571 HD12 ILE 571 -3.458 -19.737 6.408 525 HD13 ILE 571 HD13 ILE 571 -3.109 -18.353 7.447 526 H SER 572 H SER 572 -2.710 -24.592 7.831 527 HA SER 572 HA SER 572 -5.154 -26.190 7.562 528 HB2 SER 572 HB2 SER 572 -2.258 -27.046 7.669 529 HB3 SER 572 HB3 SER 572 -3.656 -28.048 7.254 530 HG SER 572 HG SER 572 -3.677 -25.871 5.757 531 H VAL 573 H VAL 573 -6.123 -26.592 9.386 532 HA VAL 573 HA VAL 573 -4.503 -26.932 11.832 533 HB VAL 573 HB VAL 573 -7.357 -25.871 11.687 534 HG11 VAL 573 HG11 VAL 573 -6.923 -27.242 13.705 535 HG12 VAL 573 HG12 VAL 573 -7.273 -25.553 14.036 536 HG13 VAL 573 HG13 VAL 573 -5.609 -26.123 14.139 537 HG21 VAL 573 HG21 VAL 573 -6.415 -23.790 12.570 538 HG22 VAL 573 HG22 VAL 573 -5.743 -24.213 10.994 539 HG23 VAL 573 HG23 VAL 573 -4.807 -24.494 12.466 540 H LYS 574 H LYS 574 -4.624 -28.851 12.725 541 HA LYS 574 HA LYS 574 -6.471 -30.831 11.751 542 HB2 LYS 574 HB2 LYS 574 -4.159 -31.458 12.161 543 HB3 LYS 574 HB3 LYS 574 -4.253 -30.897 13.812 544 HG2 LYS 574 HG2 LYS 574 -4.322 -33.268 13.827 545 HG3 LYS 574 HG3 LYS 574 -5.932 -32.698 14.254 546 HD2 LYS 574 HD2 LYS 574 -6.616 -33.022 11.906 547 HD3 LYS 574 HD3 LYS 574 -4.991 -33.635 11.570 548 HE2 LYS 574 HE2 LYS 574 -6.983 -34.862 13.472 549 HE3 LYS 574 HE3 LYS 574 -6.616 -35.453 11.856 550 HZ1 LYS 574 HZ1 LYS 574 -4.300 -35.790 12.596 551 HZ2 LYS 574 HZ2 LYS 574 -5.414 -36.725 13.447 552 HZ3 LYS 574 HZ3 LYS 574 -4.764 -35.375 14.174 553 H VAL 575 H VAL 575 -8.355 -31.199 12.658 554 HA VAL 575 HA VAL 575 -8.906 -29.989 15.244 555 HB VAL 575 HB VAL 575 -10.840 -31.326 13.319 556 HG11 VAL 575 HG11 VAL 575 -12.559 -30.138 14.648 557 HG12 VAL 575 HG12 VAL 575 -11.303 -29.655 15.786 558 HG13 VAL 575 HG13 VAL 575 -11.688 -31.361 15.571 559 HG21 VAL 575 HG21 VAL 575 -11.562 -29.047 12.735 560 HG22 VAL 575 HG22 VAL 575 -9.873 -29.325 12.315 561 HG23 VAL 575 HG23 VAL 575 -10.281 -28.387 13.751 562 H ILE 576 H ILE 576 -9.060 -31.149 17.031 563 HA ILE 576 HA ILE 576 -8.391 -33.952 16.932 564 HB ILE 576 HB ILE 576 -8.959 -32.126 19.296 565 HG12 ILE 576 HG12 ILE 576 -7.087 -31.254 18.031 566 HG13 ILE 576 HG13 ILE 576 -6.519 -31.939 19.545 567 HG21 ILE 576 HG21 ILE 576 -9.156 -34.473 19.896 568 HG22 ILE 576 HG22 ILE 576 -7.732 -33.747 20.645 569 HG23 ILE 576 HG23 ILE 576 -7.552 -34.786 19.232 570 HD11 ILE 576 HD11 ILE 576 -6.326 -33.208 16.821 571 HD12 ILE 576 HD12 ILE 576 -5.767 -33.932 18.327 572 HD13 ILE 576 HD13 ILE 576 -5.007 -32.453 17.721 573 H ASP 577 H ASP 577 -9.744 -35.598 17.814 574 HA ASP 577 HA ASP 577 -12.553 -35.212 17.378 575 HB2 ASP 577 HB2 ASP 577 -11.379 -37.383 16.894 576 HB3 ASP 577 HB3 ASP 577 -11.098 -37.567 18.615 577 H ASP 578 H ASP 578 -13.179 -33.696 18.832 578 HA ASP 578 HA ASP 578 -12.480 -33.867 21.585 579 HB2 ASP 578 HB2 ASP 578 -12.761 -31.676 20.604 580 HB3 ASP 578 HB3 ASP 578 -14.436 -32.031 20.200 581 H GLU 579 H GLU 579 -13.512 -34.560 23.260 582 HA GLU 579 HA GLU 579 -16.059 -35.968 22.836 583 HB2 GLU 579 HB2 GLU 579 -14.070 -37.284 23.598 584 HB3 GLU 579 HB3 GLU 579 -14.043 -36.309 25.056 585 HG2 GLU 579 HG2 GLU 579 -16.241 -37.123 25.672 586 HG3 GLU 579 HG3 GLU 579 -16.317 -38.062 24.181 587 H GLU 580 H GLU 580 -14.567 -33.320 24.316 588 HA GLU 580 HA GLU 580 -16.566 -33.039 26.409 589 HB2 GLU 580 HB2 GLU 580 -13.866 -31.932 25.853 590 HB3 GLU 580 HB3 GLU 580 -14.966 -30.992 26.855 591 HG2 GLU 580 HG2 GLU 580 -13.409 -32.343 28.172 592 HG3 GLU 580 HG3 GLU 580 -15.090 -32.776 28.438 593 H TYR 581 H TYR 581 -17.501 -32.840 23.923 594 HA TYR 581 HA TYR 581 -17.531 -30.167 22.888 595 HB2 TYR 581 HB2 TYR 581 -19.385 -31.131 21.394 596 HB3 TYR 581 HB3 TYR 581 -17.784 -31.832 21.247 597 HD1 TYR 581 HD2 TYR 581 -21.082 -32.388 22.912 598 HD2 TYR 581 HD1 TYR 581 -17.509 -34.135 21.416 599 HE1 TYR 581 HE2 TYR 581 -22.021 -34.626 23.287 600 HE2 TYR 581 HE1 TYR 581 -18.440 -36.375 21.783 601 HH TYR 581 HH TYR 581 -20.128 -37.447 23.145 602 H GLU 582 H GLU 582 -18.293 -30.336 25.546 603 HA GLU 582 HA GLU 582 -21.018 -30.113 26.196 604 HB2 GLU 582 HB2 GLU 582 -18.677 -28.639 27.422 605 HB3 GLU 582 HB3 GLU 582 -20.208 -29.015 28.189 606 HG2 GLU 582 HG2 GLU 582 -19.654 -31.384 28.195 607 HG3 GLU 582 HG3 GLU 582 -18.157 -31.056 27.325 608 H LYS 583 H LYS 583 -18.563 -27.857 25.179 609 HA LYS 583 HA LYS 583 -20.554 -25.736 24.763 610 HB2 LYS 583 HB2 LYS 583 -18.627 -25.523 26.554 611 HB3 LYS 583 HB3 LYS 583 -17.584 -25.354 25.166 612 HG2 LYS 583 HG2 LYS 583 -19.862 -23.489 25.862 613 HG3 LYS 583 HG3 LYS 583 -18.161 -23.210 26.207 614 HD2 LYS 583 HD2 LYS 583 -17.704 -23.246 23.792 615 HD3 LYS 583 HD3 LYS 583 -19.420 -23.475 23.488 616 HE2 LYS 583 HE2 LYS 583 -19.838 -21.316 24.660 617 HE3 LYS 583 HE3 LYS 583 -18.089 -21.088 24.749 618 HZ1 LYS 583 HZ1 LYS 583 -19.729 -21.302 22.288 619 HZ2 LYS 583 HZ2 LYS 583 -18.068 -21.252 22.263 620 HZ3 LYS 583 HZ3 LYS 583 -18.946 -19.934 22.846 621 H ASN 584 H ASN 584 -20.521 -24.920 22.667 622 HA ASN 584 HA ASN 584 -19.308 -26.263 20.520 623 HB2 ASN 584 HB2 ASN 584 -21.278 -24.761 20.313 624 HB3 ASN 584 HB3 ASN 584 -20.258 -23.389 20.704 625 HD21 ASN 584 HD21 ASN 584 -19.485 -26.095 18.515 626 HD22 ASN 584 HD22 ASN 584 -19.347 -25.116 17.126 627 H LYS 585 H LYS 585 -17.200 -26.220 19.860 628 HA LYS 585 HA LYS 585 -15.412 -24.553 21.415 629 HB2 LYS 585 HB2 LYS 585 -14.816 -26.776 19.459 630 HB3 LYS 585 HB3 LYS 585 -13.637 -25.980 20.493 631 HG2 LYS 585 HG2 LYS 585 -15.993 -27.600 21.445 632 HG3 LYS 585 HG3 LYS 585 -14.318 -28.148 21.394 633 HD2 LYS 585 HD2 LYS 585 -13.673 -26.469 23.007 634 HD3 LYS 585 HD3 LYS 585 -15.289 -25.768 22.982 635 HE2 LYS 585 HE2 LYS 585 -14.959 -27.155 24.952 636 HE3 LYS 585 HE3 LYS 585 -16.212 -27.808 23.911 637 HZ1 LYS 585 HZ1 LYS 585 -14.609 -29.452 24.821 638 HZ2 LYS 585 HZ2 LYS 585 -13.414 -28.796 23.792 639 HZ3 LYS 585 HZ3 LYS 585 -14.766 -29.507 23.162 640 H THR 586 H THR 586 -14.162 -22.979 20.669 641 HA THR 586 HA THR 586 -13.871 -22.567 17.870 642 HB THR 586 HB THR 586 -16.035 -21.500 18.176 643 HG1 THR 586 HG1 THR 586 -14.195 -20.397 17.022 644 HG21 THR 586 HG21 THR 586 -16.366 -19.617 19.686 645 HG22 THR 586 HG22 THR 586 -14.750 -19.864 20.362 646 HG23 THR 586 HG23 THR 586 -16.002 -21.103 20.565 647 H PHE 587 H PHE 587 -12.041 -21.495 17.424 648 HA PHE 587 HA PHE 587 -10.589 -20.258 19.627 649 HB2 PHE 587 HB2 PHE 587 -8.499 -21.266 18.858 650 HB3 PHE 587 HB3 PHE 587 -9.633 -22.533 19.267 651 HD1 PHE 587 HD1 PHE 587 -10.792 -23.771 17.381 652 HD2 PHE 587 HD2 PHE 587 -7.544 -21.106 16.734 653 HE1 PHE 587 HE1 PHE 587 -10.375 -24.796 15.177 654 HE2 PHE 587 HE2 PHE 587 -7.135 -22.128 14.546 655 HZ PHE 587 HZ PHE 587 -8.554 -23.970 13.766 656 H PHE 588 H PHE 588 -8.527 -19.147 18.391 657 HA PHE 588 HA PHE 588 -9.769 -17.816 16.117 658 HB2 PHE 588 HB2 PHE 588 -8.150 -16.429 18.298 659 HB3 PHE 588 HB3 PHE 588 -8.861 -15.688 16.876 660 HD1 PHE 588 HD2 PHE 588 -9.570 -17.225 20.152 661 HD2 PHE 588 HD1 PHE 588 -11.165 -15.152 16.783 662 HE1 PHE 588 HE2 PHE 588 -11.626 -16.789 21.396 663 HE2 PHE 588 HE1 PHE 588 -13.229 -14.720 18.034 664 HZ PHE 588 HZ PHE 588 -13.466 -15.533 20.337 665 H LEU 589 H LEU 589 -8.276 -16.992 14.633 666 HA LEU 589 HA LEU 589 -5.586 -18.184 14.835 667 HB2 LEU 589 HB2 LEU 589 -7.474 -18.973 13.041 668 HB3 LEU 589 HB3 LEU 589 -6.815 -17.603 12.183 669 HG LEU 589 HG LEU 589 -5.780 -19.569 11.342 670 HD11 LEU 589 HD11 LEU 589 -4.249 -17.689 11.560 671 HD12 LEU 589 HD12 LEU 589 -3.434 -19.245 11.769 672 HD13 LEU 589 HD13 LEU 589 -3.815 -18.259 13.176 673 HD21 LEU 589 HD21 LEU 589 -4.484 -21.081 12.800 674 HD22 LEU 589 HD22 LEU 589 -6.227 -21.107 13.060 675 HD23 LEU 589 HD23 LEU 589 -5.182 -20.248 14.198 676 H GLU 590 H GLU 590 -4.004 -16.649 14.627 677 HA GLU 590 HA GLU 590 -4.792 -14.120 13.395 678 HB2 GLU 590 HB2 GLU 590 -4.668 -13.777 15.781 679 HB3 GLU 590 HB3 GLU 590 -3.051 -14.478 15.844 680 HG2 GLU 590 HG2 GLU 590 -2.273 -12.611 14.395 681 HG3 GLU 590 HG3 GLU 590 -3.886 -11.912 14.506 682 H ILE 591 H ILE 591 -3.388 -13.283 12.027 683 HA ILE 591 HA ILE 591 -0.946 -14.783 11.553 684 HB ILE 591 HB ILE 591 -0.953 -13.727 9.268 685 HG12 ILE 591 HG12 ILE 591 -3.752 -12.887 10.050 686 HG13 ILE 591 HG13 ILE 591 -2.399 -11.796 9.765 687 HG21 ILE 591 HG21 ILE 591 -2.659 -15.219 8.329 688 HG22 ILE 591 HG22 ILE 591 -3.366 -15.397 9.936 689 HG23 ILE 591 HG23 ILE 591 -1.750 -16.005 9.626 690 HD11 ILE 591 HD11 ILE 591 -2.371 -12.504 7.405 691 HD12 ILE 591 HD12 ILE 591 -3.925 -11.815 7.886 692 HD13 ILE 591 HD13 ILE 591 -3.755 -13.555 7.725 693 H GLY 592 H GLY 592 0.953 -13.701 11.370 694 HA2 GLY 592 HA2 GLY 592 1.014 -11.259 12.940 695 HA3 GLY 592 HA3 GLY 592 2.393 -12.255 12.499 696 H GLU 593 H GLU 593 2.965 -9.804 12.175 697 HA GLU 593 HA GLU 593 2.043 -8.696 9.744 698 HB2 GLU 593 HB2 GLU 593 4.365 -7.952 11.505 699 HB3 GLU 593 HB3 GLU 593 3.941 -7.061 10.046 700 HG2 GLU 593 HG2 GLU 593 1.734 -6.620 10.978 701 HG3 GLU 593 HG3 GLU 593 2.192 -7.466 12.456 702 HA PRO 594 HA PRO 594 4.334 -11.022 6.893 703 HB2 PRO 594 HB2 PRO 594 4.431 -9.144 4.877 704 HB3 PRO 594 HB3 PRO 594 3.037 -10.171 5.194 705 HG2 PRO 594 HG2 PRO 594 3.548 -7.360 6.008 706 HG3 PRO 594 HG3 PRO 594 2.039 -8.085 5.454 707 HD2 PRO 594 HD2 PRO 594 2.520 -7.568 8.023 708 HD3 PRO 594 HD3 PRO 594 1.579 -8.990 7.551 709 H ARG 595 H ARG 595 6.398 -11.246 6.154 710 HA ARG 595 HA ARG 595 8.239 -9.066 6.765 711 HB2 ARG 595 HB2 ARG 595 9.845 -10.733 7.579 712 HB3 ARG 595 HB3 ARG 595 8.354 -10.802 8.501 713 HG2 ARG 595 HG2 ARG 595 7.709 -12.690 6.885 714 HG3 ARG 595 HG3 ARG 595 9.428 -12.747 6.502 715 HD2 ARG 595 HD2 ARG 595 8.077 -13.216 9.157 716 HD3 ARG 595 HD3 ARG 595 9.019 -14.362 8.212 717 HE ARG 595 HE ARG 595 10.571 -12.115 8.946 718 HH11 ARG 595 HH11 ARG 595 9.393 -15.277 10.157 719 HH12 ARG 595 HH12 ARG 595 10.403 -15.215 11.524 720 HH21 ARG 595 HH21 ARG 595 11.956 -12.147 10.765 721 HH22 ARG 595 HH22 ARG 595 11.920 -13.468 11.858 722 H LEU 596 H LEU 596 9.408 -8.438 5.098 723 HA LEU 596 HA LEU 596 9.194 -9.704 2.581 724 HB2 LEU 596 HB2 LEU 596 9.546 -7.196 3.209 725 HB3 LEU 596 HB3 LEU 596 11.224 -7.645 3.388 726 HG LEU 596 HG LEU 596 10.642 -6.520 1.211 727 HD11 LEU 596 HD11 LEU 596 11.757 -9.299 0.964 728 HD12 LEU 596 HD12 LEU 596 12.668 -7.843 1.371 729 HD13 LEU 596 HD13 LEU 596 11.924 -8.003 -0.221 730 HD21 LEU 596 HD21 LEU 596 9.455 -7.749 -0.474 731 HD22 LEU 596 HD22 LEU 596 8.468 -7.639 1.012 732 HD23 LEU 596 HD23 LEU 596 9.312 -9.127 0.625 733 H VAL 597 H VAL 597 10.507 -11.200 1.762 734 HA VAL 597 HA VAL 597 12.589 -12.254 3.457 735 HB VAL 597 HB VAL 597 11.692 -13.192 0.716 736 HG11 VAL 597 HG11 VAL 597 13.366 -14.578 2.820 737 HG12 VAL 597 HG12 VAL 597 13.955 -13.955 1.278 738 HG13 VAL 597 HG13 VAL 597 12.811 -15.298 1.309 739 HG21 VAL 597 HG21 VAL 597 10.939 -14.149 3.464 740 HG22 VAL 597 HG22 VAL 597 10.471 -14.917 1.946 741 HG23 VAL 597 HG23 VAL 597 9.892 -13.294 2.331 742 H GLU 598 H GLU 598 14.376 -11.236 3.469 743 HA GLU 598 HA GLU 598 15.181 -9.681 1.249 744 HB2 GLU 598 HB2 GLU 598 16.176 -9.960 4.029 745 HB3 GLU 598 HB3 GLU 598 17.171 -9.180 2.804 746 HG2 GLU 598 HG2 GLU 598 14.341 -8.373 3.422 747 HG3 GLU 598 HG3 GLU 598 15.776 -7.636 4.139 748 H MET 599 H MET 599 16.227 -10.291 -0.312 749 HA MET 599 HA MET 599 18.069 -12.550 -0.130 750 HB2 MET 599 HB2 MET 599 17.145 -10.954 -2.528 751 HB3 MET 599 HB3 MET 599 18.138 -12.401 -2.597 752 HG2 MET 599 HG2 MET 599 15.282 -12.227 -1.651 753 HG3 MET 599 HG3 MET 599 15.825 -12.874 -3.195 754 HE1 MET 599 HE1 MET 599 17.766 -16.111 -2.023 755 HE2 MET 599 HE2 MET 599 18.468 -14.511 -2.247 756 HE3 MET 599 HE3 MET 599 17.295 -15.128 -3.410 757 H SER 600 H SER 600 18.000 -9.361 0.370 758 HA SER 600 HA SER 600 20.835 -8.998 -0.127 759 HB2 SER 600 HB2 SER 600 18.623 -6.956 -0.523 760 HB3 SER 600 HB3 SER 600 20.350 -6.625 -0.658 761 HG SER 600 HG SER 600 18.646 -8.041 -2.349 762 H GLU 601 H GLU 601 21.834 -8.255 1.689 763 HA GLU 601 HA GLU 601 20.245 -8.147 4.099 764 HB2 GLU 601 HB2 GLU 601 23.222 -7.913 3.673 765 HB3 GLU 601 HB3 GLU 601 22.424 -8.019 5.236 766 HG2 GLU 601 HG2 GLU 601 21.622 -10.243 4.705 767 HG3 GLU 601 HG3 GLU 601 22.343 -10.136 3.099 768 H LYS 602 H LYS 602 20.332 -6.380 5.600 769 HA LYS 602 HA LYS 602 20.431 -3.803 4.280 770 HB2 LYS 602 HB2 LYS 602 19.753 -4.590 7.121 771 HB3 LYS 602 HB3 LYS 602 19.894 -2.924 6.620 772 HG2 LYS 602 HG2 LYS 602 17.592 -3.425 6.675 773 HG3 LYS 602 HG3 LYS 602 18.046 -3.375 4.978 774 HD2 LYS 602 HD2 LYS 602 18.022 -5.761 4.833 775 HD3 LYS 602 HD3 LYS 602 17.836 -5.911 6.583 776 HE2 LYS 602 HE2 LYS 602 15.686 -6.279 5.530 777 HE3 LYS 602 HE3 LYS 602 15.670 -4.779 6.432 778 HZ1 LYS 602 HZ1 LYS 602 15.942 -5.057 3.491 779 HZ2 LYS 602 HZ2 LYS 602 16.034 -3.582 4.324 780 HZ3 LYS 602 HZ3 LYS 602 14.604 -4.473 4.326 781 H LYS 603 H LYS 603 21.837 -2.144 4.838 782 HA LYS 603 HA LYS 603 24.422 -3.081 5.612 783 HB2 LYS 603 HB2 LYS 603 23.492 -0.240 5.085 784 HB3 LYS 603 HB3 LYS 603 25.143 -0.694 5.444 785 HG2 LYS 603 HG2 LYS 603 25.130 -0.460 3.122 786 HG3 LYS 603 HG3 LYS 603 25.018 -2.196 3.372 787 HD2 LYS 603 HD2 LYS 603 23.480 -1.598 1.630 788 HD3 LYS 603 HD3 LYS 603 22.530 -1.986 3.066 789 HE2 LYS 603 HE2 LYS 603 22.306 0.409 3.568 790 HE3 LYS 603 HE3 LYS 603 23.286 0.791 2.157 791 HZ1 LYS 603 HZ1 LYS 603 20.975 1.076 1.724 792 HZ2 LYS 603 HZ2 LYS 603 20.611 -0.511 2.117 793 HZ3 LYS 603 HZ3 LYS 603 21.569 -0.170 0.759 794 H GLY 604 H GLY 604 24.811 -3.572 7.547 795 HA2 GLY 604 HA2 GLY 604 25.213 -2.249 9.739 796 HA3 GLY 604 HA3 GLY 604 23.444 -2.259 9.752 797 H GLY 605 H GLY 605 23.198 -4.752 8.404 798 HA2 GLY 605 HA2 GLY 605 23.748 -7.029 8.726 799 HA3 GLY 605 HA3 GLY 605 24.374 -6.623 10.317 800 H PHE 606 H PHE 606 23.085 -8.326 11.102 801 HA PHE 606 HA PHE 606 21.381 -9.165 12.311 802 HB2 PHE 606 HB2 PHE 606 20.534 -6.266 12.380 803 HB3 PHE 606 HB3 PHE 606 19.764 -7.527 13.328 804 HD1 PHE 606 HD1 PHE 606 22.845 -5.559 12.868 805 HD2 PHE 606 HD2 PHE 606 20.803 -8.396 15.290 806 HE1 PHE 606 HE1 PHE 606 24.489 -5.201 14.668 807 HE2 PHE 606 HE2 PHE 606 22.441 -8.044 17.089 808 HZ PHE 606 HZ PHE 606 24.287 -6.447 16.778 809 H THR 607 H THR 607 20.990 -8.820 9.279 810 HA THR 607 HA THR 607 18.224 -8.246 8.925 811 HB THR 607 HB THR 607 20.163 -9.513 6.952 812 HG1 THR 607 HG1 THR 607 20.312 -7.193 8.041 813 HG21 THR 607 HG21 THR 607 18.639 -8.588 5.224 814 HG22 THR 607 HG22 THR 607 17.559 -8.020 6.497 815 HG23 THR 607 HG23 THR 607 17.804 -9.746 6.258 816 H ILE 608 H ILE 608 19.731 -10.992 10.072 817 HA ILE 608 HA ILE 608 17.928 -12.978 9.067 818 HB ILE 608 HB ILE 608 18.694 -14.378 11.001 819 HG12 ILE 608 HG12 ILE 608 20.469 -11.987 11.603 820 HG13 ILE 608 HG13 ILE 608 19.135 -12.545 12.597 821 HG21 ILE 608 HG21 ILE 608 20.815 -13.160 9.263 822 HG22 ILE 608 HG22 ILE 608 19.792 -14.541 8.882 823 HG23 ILE 608 HG23 ILE 608 20.988 -14.659 10.174 824 HD11 ILE 608 HD11 ILE 608 21.278 -13.222 13.521 825 HD12 ILE 608 HD12 ILE 608 21.667 -14.075 12.025 826 HD13 ILE 608 HD13 ILE 608 20.334 -14.629 13.036 827 H THR 609 H THR 609 17.379 -10.425 11.091 828 HA THR 609 HA THR 609 14.877 -11.549 12.027 829 HB THR 609 HB THR 609 16.807 -10.054 13.860 830 HG1 THR 609 HG1 THR 609 16.658 -12.646 13.122 831 HG21 THR 609 HG21 THR 609 15.296 -10.809 15.651 832 HG22 THR 609 HG22 THR 609 14.284 -11.629 14.465 833 HG23 THR 609 HG23 THR 609 14.403 -9.871 14.454 834 H GLU 610 H GLU 610 13.370 -9.672 12.483 835 HA GLU 610 HA GLU 610 14.158 -7.426 10.895 836 HB2 GLU 610 HB2 GLU 610 11.810 -8.366 10.854 837 HB3 GLU 610 HB3 GLU 610 11.597 -7.733 12.481 838 HG2 GLU 610 HG2 GLU 610 10.652 -6.285 10.703 839 HG3 GLU 610 HG3 GLU 610 11.853 -5.482 11.714 840 H GLU 611 H GLU 611 12.892 -7.688 14.238 841 HA GLU 611 HA GLU 611 14.983 -5.890 15.098 842 HB2 GLU 611 HB2 GLU 611 12.053 -5.349 15.604 843 HB3 GLU 611 HB3 GLU 611 13.372 -4.506 16.407 844 HG2 GLU 611 HG2 GLU 611 14.152 -3.707 14.219 845 HG3 GLU 611 HG3 GLU 611 12.776 -4.497 13.463 846 H TYR 612 H TYR 612 15.217 -5.880 17.418 847 HA TYR 612 HA TYR 612 15.286 -8.475 18.372 848 HB2 TYR 612 HB2 TYR 612 16.162 -7.622 20.484 849 HB3 TYR 612 HB3 TYR 612 16.884 -6.767 19.139 850 HD1 TYR 612 HD2 TYR 612 15.451 -4.459 18.571 851 HD2 TYR 612 HD1 TYR 612 15.686 -6.405 22.342 852 HE1 TYR 612 HE2 TYR 612 14.864 -2.352 19.701 853 HE2 TYR 612 HE1 TYR 612 15.098 -4.318 23.469 854 HH TYR 612 HH TYR 612 15.268 -1.891 22.993 855 H ASP 613 H ASP 613 13.238 -5.922 19.858 856 HA ASP 613 HA ASP 613 10.876 -7.354 20.037 857 HB2 ASP 613 HB2 ASP 613 12.097 -8.897 21.564 858 HB3 ASP 613 HB3 ASP 613 12.543 -7.517 22.559 859 H ASP 614 H ASP 614 9.551 -5.669 20.134 860 HA ASP 614 HA ASP 614 9.765 -3.703 22.206 861 HB2 ASP 614 HB2 ASP 614 9.821 -1.754 20.701 862 HB3 ASP 614 HB3 ASP 614 11.287 -2.711 20.539 863 H LYS 615 H LYS 615 7.951 -2.106 21.898 864 HA LYS 615 HA LYS 615 5.722 -3.131 20.343 865 HB2 LYS 615 HB2 LYS 615 4.186 -2.861 22.265 866 HB3 LYS 615 HB3 LYS 615 5.385 -4.109 22.570 867 HG2 LYS 615 HG2 LYS 615 6.622 -2.625 24.002 868 HG3 LYS 615 HG3 LYS 615 5.572 -1.278 23.593 869 HD2 LYS 615 HD2 LYS 615 4.862 -1.991 25.728 870 HD3 LYS 615 HD3 LYS 615 3.673 -2.637 24.614 871 HE2 LYS 615 HE2 LYS 615 5.984 -4.212 25.781 872 HE3 LYS 615 HE3 LYS 615 4.356 -4.213 26.437 873 HZ1 LYS 615 HZ1 LYS 615 4.671 -6.145 25.122 874 HZ2 LYS 615 HZ2 LYS 615 5.265 -5.296 23.828 875 HZ3 LYS 615 HZ3 LYS 615 3.635 -5.161 24.226 876 H GLN 616 H GLN 616 4.009 -1.453 20.178 877 HA GLN 616 HA GLN 616 3.186 0.642 19.908 878 HB2 GLN 616 HB2 GLN 616 5.394 1.513 21.797 879 HB3 GLN 616 HB3 GLN 616 4.059 2.527 21.288 880 HG2 GLN 616 HG2 GLN 616 2.504 0.969 22.387 881 HG3 GLN 616 HG3 GLN 616 3.883 0.014 22.932 882 HE21 GLN 616 HE21 GLN 616 1.873 1.361 24.483 883 HE22 GLN 616 HE22 GLN 616 2.694 2.474 25.508 884 HA PRO 617 HA PRO 617 5.482 2.710 16.616 885 HB2 PRO 617 HB2 PRO 617 4.958 5.263 18.098 886 HB3 PRO 617 HB3 PRO 617 4.721 4.904 16.382 887 HG2 PRO 617 HG2 PRO 617 2.629 4.986 17.983 888 HG3 PRO 617 HG3 PRO 617 2.759 3.701 16.771 889 HD2 PRO 617 HD2 PRO 617 3.234 3.577 19.716 890 HD3 PRO 617 HD3 PRO 617 2.484 2.374 18.646 891 H LEU 618 H LEU 618 7.564 3.414 16.298 892 HA LEU 618 HA LEU 618 9.246 3.126 18.603 893 HB2 LEU 618 HB2 LEU 618 9.884 3.386 15.690 894 HB3 LEU 618 HB3 LEU 618 11.080 3.147 16.944 895 HG LEU 618 HG LEU 618 8.892 1.212 16.201 896 HD11 LEU 618 HD11 LEU 618 11.858 1.201 15.760 897 HD12 LEU 618 HD12 LEU 618 10.619 1.393 14.524 898 HD13 LEU 618 HD13 LEU 618 10.781 -0.140 15.385 899 HD21 LEU 618 HD21 LEU 618 10.062 -0.325 17.720 900 HD22 LEU 618 HD22 LEU 618 9.434 1.071 18.584 901 HD23 LEU 618 HD23 LEU 618 11.152 0.972 18.195 902 H THR 619 H THR 619 11.373 4.430 18.354 903 HA THR 619 HA THR 619 10.655 7.241 18.483 904 HB THR 619 HB THR 619 13.056 5.744 19.594 905 HG1 THR 619 HG1 THR 619 10.846 5.301 20.424 906 HG21 THR 619 HG21 THR 619 12.018 8.528 20.229 907 HG22 THR 619 HG22 THR 619 13.453 8.183 19.264 908 HG23 THR 619 HG23 THR 619 13.416 7.747 20.971 909 H SER 620 H SER 620 12.153 8.760 17.459 910 HA SER 620 HA SER 620 12.819 7.987 14.854 911 HB2 SER 620 HB2 SER 620 12.075 10.282 15.579 912 HB3 SER 620 HB3 SER 620 13.664 10.504 16.308 913 HG SER 620 HG SER 620 13.296 9.784 13.617 914 H LYS 621 H LYS 621 14.740 7.661 13.865 915 HA LYS 621 HA LYS 621 17.259 7.735 15.352 916 HB2 LYS 621 HB2 LYS 621 16.267 5.331 13.804 917 HB3 LYS 621 HB3 LYS 621 17.903 5.539 14.382 918 HG2 LYS 621 HG2 LYS 621 17.052 5.476 16.695 919 HG3 LYS 621 HG3 LYS 621 15.426 5.186 16.057 920 HD2 LYS 621 HD2 LYS 621 16.248 3.195 14.900 921 HD3 LYS 621 HD3 LYS 621 17.851 3.468 15.574 922 HE2 LYS 621 HE2 LYS 621 16.924 3.198 17.831 923 HE3 LYS 621 HE3 LYS 621 15.337 2.895 17.129 924 HZ1 LYS 621 HZ1 LYS 621 16.479 0.815 17.663 925 HZ2 LYS 621 HZ2 LYS 621 17.755 1.247 16.651 926 HZ3 LYS 621 HZ3 LYS 621 16.235 0.966 16.003 927 H GLU 622 H GLU 622 19.058 7.824 13.866 928 HA GLU 622 HA GLU 622 18.300 8.872 11.280 929 HB2 GLU 622 HB2 GLU 622 20.996 8.681 12.637 930 HB3 GLU 622 HB3 GLU 622 20.741 9.376 11.041 931 HG2 GLU 622 HG2 GLU 622 19.612 10.382 13.641 932 HG3 GLU 622 HG3 GLU 622 20.891 11.132 12.678 933 H GLU 623 H GLU 623 17.456 6.866 10.645 934 HA GLU 623 HA GLU 623 19.181 5.246 9.081 935 HB2 GLU 623 HB2 GLU 623 19.576 4.320 11.417 936 HB3 GLU 623 HB3 GLU 623 17.862 4.040 11.563 937 HG2 GLU 623 HG2 GLU 623 19.275 2.018 11.080 938 HG3 GLU 623 HG3 GLU 623 17.912 2.270 9.993 939 H GLU 624 H GLU 624 17.470 3.252 8.451 940 HA GLU 624 HA GLU 624 15.102 4.537 7.551 941 HB2 GLU 624 HB2 GLU 624 15.837 1.607 7.608 942 HB3 GLU 624 HB3 GLU 624 14.437 2.274 6.786 943 HG2 GLU 624 HG2 GLU 624 15.932 3.558 5.325 944 HG3 GLU 624 HG3 GLU 624 17.319 2.837 6.144 945 H GLU 625 H GLU 625 14.061 5.285 9.308 946 HA GLU 625 HA GLU 625 13.353 3.934 11.652 947 HB2 GLU 625 HB2 GLU 625 11.714 6.007 10.189 948 HB3 GLU 625 HB3 GLU 625 11.625 5.614 11.890 949 HG2 GLU 625 HG2 GLU 625 13.864 6.489 12.226 950 HG3 GLU 625 HG3 GLU 625 13.973 6.878 10.508 951 H ARG 626 H ARG 626 11.245 2.985 12.193 952 HA ARG 626 HA ARG 626 10.470 1.175 10.193 953 HB2 ARG 626 HB2 ARG 626 10.250 0.590 12.592 954 HB3 ARG 626 HB3 ARG 626 8.934 1.754 12.743 955 HG2 ARG 626 HG2 ARG 626 7.570 0.518 11.243 956 HG3 ARG 626 HG3 ARG 626 8.896 -0.552 10.821 957 HD2 ARG 626 HD2 ARG 626 8.876 -1.377 13.165 958 HD3 ARG 626 HD3 ARG 626 7.443 -0.380 13.457 959 HE ARG 626 HE ARG 626 6.786 -1.768 11.242 960 HH11 ARG 626 HH11 ARG 626 7.941 -2.848 14.419 961 HH12 ARG 626 HH12 ARG 626 7.142 -4.345 14.372 962 HH21 ARG 626 HH21 ARG 626 5.646 -3.824 11.195 963 HH22 ARG 626 HH22 ARG 626 5.777 -4.904 12.486 964 H ARG 627 H ARG 627 9.062 4.190 11.236 965 HA ARG 627 HA ARG 627 6.661 4.006 9.764 966 HB2 ARG 627 HB2 ARG 627 7.137 5.648 11.594 967 HB3 ARG 627 HB3 ARG 627 8.259 6.472 10.538 968 HG2 ARG 627 HG2 ARG 627 5.364 6.197 9.810 969 HG3 ARG 627 HG3 ARG 627 5.912 7.454 10.913 970 HD2 ARG 627 HD2 ARG 627 7.383 8.338 9.184 971 HD3 ARG 627 HD3 ARG 627 6.912 7.038 8.089 972 HE ARG 627 HE ARG 627 4.656 8.465 8.975 973 HH11 ARG 627 HH11 ARG 627 7.441 8.870 6.842 974 HH12 ARG 627 HH12 ARG 627 6.639 9.859 5.727 975 HH21 ARG 627 HH21 ARG 627 3.543 9.878 7.455 976 HH22 ARG 627 HH22 ARG 627 4.370 10.448 6.090 977 H ILE 628 H ILE 628 9.892 4.724 8.746 978 HA ILE 628 HA ILE 628 9.141 5.690 6.124 979 HB ILE 628 HB ILE 628 11.826 4.665 7.127 980 HG12 ILE 628 HG12 ILE 628 10.853 7.515 6.846 981 HG13 ILE 628 HG13 ILE 628 11.006 6.647 8.370 982 HG21 ILE 628 HG21 ILE 628 12.785 5.854 5.196 983 HG22 ILE 628 HG22 ILE 628 11.159 6.288 4.668 984 HG23 ILE 628 HG23 ILE 628 11.650 4.598 4.692 985 HD11 ILE 628 HD11 ILE 628 13.429 6.492 8.009 986 HD12 ILE 628 HD12 ILE 628 12.864 8.163 8.024 987 HD13 ILE 628 HD13 ILE 628 13.245 7.373 6.492 988 H ALA 629 H ALA 629 10.368 2.767 7.599 989 HA ALA 629 HA ALA 629 10.645 1.217 5.276 990 HB1 ALA 629 HB1 ALA 629 10.841 -0.670 6.784 991 HB2 ALA 629 HB2 ALA 629 10.188 0.299 8.103 992 HB3 ALA 629 HB3 ALA 629 11.753 0.711 7.400 993 H GLU 630 H GLU 630 7.945 1.673 7.483 994 HA GLU 630 HA GLU 630 6.315 -0.411 6.662 995 HB2 GLU 630 HB2 GLU 630 5.601 2.261 7.855 996 HB3 GLU 630 HB3 GLU 630 4.401 1.009 7.541 997 HG2 GLU 630 HG2 GLU 630 6.768 0.880 9.385 998 HG3 GLU 630 HG3 GLU 630 5.078 1.029 9.854 999 H MET 631 H MET 631 7.023 2.443 4.851 1000 HA MET 631 HA MET 631 4.604 2.062 3.239 1001 HB2 MET 631 HB2 MET 631 5.189 4.038 1.992 1002 HB3 MET 631 HB3 MET 631 5.418 4.403 3.696 1003 HG2 MET 631 HG2 MET 631 7.801 4.171 3.469 1004 HG3 MET 631 HG3 MET 631 7.622 3.628 1.805 1005 HE1 MET 631 HE1 MET 631 9.390 5.366 1.004 1006 HE2 MET 631 HE2 MET 631 9.609 5.909 2.667 1007 HE3 MET 631 HE3 MET 631 9.340 7.089 1.380 1008 H GLY 632 H GLY 632 7.677 0.810 3.375 1009 HA2 GLY 632 HA2 GLY 632 7.714 0.274 0.476 1010 HA3 GLY 632 HA3 GLY 632 9.138 0.279 1.507 1011 H ARG 633 H ARG 633 8.018 -1.167 3.648 1012 HA ARG 633 HA ARG 633 8.385 -3.821 2.607 1013 HB2 ARG 633 HB2 ARG 633 8.343 -4.546 4.942 1014 HB3 ARG 633 HB3 ARG 633 9.349 -3.118 4.778 1015 HG2 ARG 633 HG2 ARG 633 7.698 -1.737 5.739 1016 HG3 ARG 633 HG3 ARG 633 6.498 -3.031 5.693 1017 HD2 ARG 633 HD2 ARG 633 7.439 -2.686 7.930 1018 HD3 ARG 633 HD3 ARG 633 7.762 -4.300 7.304 1019 HE ARG 633 HE ARG 633 10.000 -3.119 6.627 1020 HH11 ARG 633 HH11 ARG 633 8.201 -2.514 9.570 1021 HH12 ARG 633 HH12 ARG 633 9.578 -2.510 10.589 1022 HH21 ARG 633 HH21 ARG 633 11.888 -3.033 7.943 1023 HH22 ARG 633 HH22 ARG 633 11.749 -2.771 9.625 1024 HA PRO 634 HA PRO 634 4.117 -5.003 2.398 1025 HB2 PRO 634 HB2 PRO 634 4.207 -7.573 3.258 1026 HB3 PRO 634 HB3 PRO 634 4.800 -7.059 1.667 1027 HG2 PRO 634 HG2 PRO 634 6.359 -7.516 4.194 1028 HG3 PRO 634 HG3 PRO 634 6.737 -8.096 2.566 1029 HD2 PRO 634 HD2 PRO 634 7.919 -5.938 3.574 1030 HD3 PRO 634 HD3 PRO 634 7.463 -6.006 1.862 1031 H ILE 635 H ILE 635 2.460 -4.632 3.716 1032 HA ILE 635 HA ILE 635 2.808 -5.126 6.562 1033 HB ILE 635 HB ILE 635 1.636 -3.168 7.108 1034 HG12 ILE 635 HG12 ILE 635 -0.104 -2.946 5.451 1035 HG13 ILE 635 HG13 ILE 635 0.837 -1.464 5.440 1036 HG21 ILE 635 HG21 ILE 635 3.052 -1.339 6.215 1037 HG22 ILE 635 HG22 ILE 635 3.686 -2.483 5.033 1038 HG23 ILE 635 HG23 ILE 635 3.947 -2.758 6.755 1039 HD11 ILE 635 HD11 ILE 635 0.898 -3.701 3.527 1040 HD12 ILE 635 HD12 ILE 635 2.042 -2.353 3.495 1041 HD13 ILE 635 HD13 ILE 635 0.302 -2.058 3.202 1042 H LEU 636 H LEU 636 0.429 -4.949 7.547 1043 HA LEU 636 HA LEU 636 -1.099 -6.618 5.777 1044 HB2 LEU 636 HB2 LEU 636 -2.215 -7.513 7.922 1045 HB3 LEU 636 HB3 LEU 636 -0.608 -8.050 7.518 1046 HG LEU 636 HG LEU 636 0.313 -6.486 9.222 1047 HD11 LEU 636 HD11 LEU 636 -2.570 -6.009 9.950 1048 HD12 LEU 636 HD12 LEU 636 -1.453 -4.829 9.261 1049 HD13 LEU 636 HD13 LEU 636 -1.160 -5.481 10.873 1050 HD21 LEU 636 HD21 LEU 636 -0.131 -8.824 9.748 1051 HD22 LEU 636 HD22 LEU 636 -1.766 -8.389 10.257 1052 HD23 LEU 636 HD23 LEU 636 -0.372 -7.776 11.145 1053 H GLY 637 H GLY 637 -3.561 -6.674 6.895 1054 HA2 GLY 637 HA2 GLY 637 -4.539 -4.130 5.987 1055 HA3 GLY 637 HA3 GLY 637 -5.477 -5.545 6.444 1056 H GLU 638 H GLU 638 -6.899 -4.255 7.523 1057 HA GLU 638 HA GLU 638 -6.197 -2.464 9.603 1058 HB2 GLU 638 HB2 GLU 638 -8.224 -2.319 8.206 1059 HB3 GLU 638 HB3 GLU 638 -8.812 -3.803 8.932 1060 HG2 GLU 638 HG2 GLU 638 -8.895 -2.681 11.103 1061 HG3 GLU 638 HG3 GLU 638 -8.331 -1.197 10.338 1062 H HIS 639 H HIS 639 -7.813 -5.634 9.624 1063 HA HIS 639 HA HIS 639 -6.574 -6.162 12.220 1064 HB2 HIS 639 HB2 HIS 639 -9.515 -6.548 11.616 1065 HB3 HIS 639 HB3 HIS 639 -8.701 -7.275 12.994 1066 HD1 HIS 639 HD1 HIS 639 -7.738 -5.507 14.796 1067 HD2 HIS 639 HD2 HIS 639 -10.337 -4.020 11.935 1068 HE1 HIS 639 HE1 HIS 639 -8.505 -3.267 15.648 1069 H THR 640 H THR 640 -5.944 -8.217 12.516 1070 HA THR 640 HA THR 640 -6.614 -10.038 10.356 1071 HB THR 640 HB THR 640 -4.292 -10.987 10.610 1072 HG1 THR 640 HG1 THR 640 -2.958 -10.091 11.979 1073 HG21 THR 640 HG21 THR 640 -3.287 -9.321 9.135 1074 HG22 THR 640 HG22 THR 640 -4.488 -8.137 9.661 1075 HG23 THR 640 HG23 THR 640 -4.997 -9.555 8.749 1076 H LYS 641 H LYS 641 -8.032 -11.343 11.324 1077 HA LYS 641 HA LYS 641 -7.059 -13.223 13.189 1078 HB2 LYS 641 HB2 LYS 641 -7.670 -11.265 14.710 1079 HB3 LYS 641 HB3 LYS 641 -9.327 -11.466 14.164 1080 HG2 LYS 641 HG2 LYS 641 -9.270 -13.810 15.024 1081 HG3 LYS 641 HG3 LYS 641 -7.673 -13.483 15.687 1082 HD2 LYS 641 HD2 LYS 641 -9.297 -13.250 17.442 1083 HD3 LYS 641 HD3 LYS 641 -8.689 -11.646 17.041 1084 HE2 LYS 641 HE2 LYS 641 -10.685 -11.224 15.683 1085 HE3 LYS 641 HE3 LYS 641 -11.265 -12.854 16.041 1086 HZ1 LYS 641 HZ1 LYS 641 -11.376 -12.219 18.391 1087 HZ2 LYS 641 HZ2 LYS 641 -12.326 -11.220 17.430 1088 HZ3 LYS 641 HZ3 LYS 641 -10.854 -10.671 17.989 1089 H LEU 642 H LEU 642 -8.444 -14.925 13.306 1090 HA LEU 642 HA LEU 642 -10.867 -14.836 11.655 1091 HB2 LEU 642 HB2 LEU 642 -8.972 -15.917 10.522 1092 HB3 LEU 642 HB3 LEU 642 -8.797 -16.992 11.889 1093 HG LEU 642 HG LEU 642 -11.133 -17.829 11.375 1094 HD11 LEU 642 HD11 LEU 642 -11.895 -15.983 10.007 1095 HD12 LEU 642 HD12 LEU 642 -11.926 -17.504 9.113 1096 HD13 LEU 642 HD13 LEU 642 -10.644 -16.343 8.817 1097 HD21 LEU 642 HD21 LEU 642 -10.317 -19.215 9.550 1098 HD22 LEU 642 HD22 LEU 642 -9.179 -19.097 10.895 1099 HD23 LEU 642 HD23 LEU 642 -8.890 -18.179 9.417 1100 H GLU 643 H GLU 643 -12.552 -15.611 12.758 1101 HA GLU 643 HA GLU 643 -12.137 -16.900 15.343 1102 HB2 GLU 643 HB2 GLU 643 -13.642 -14.884 15.043 1103 HB3 GLU 643 HB3 GLU 643 -14.644 -15.867 14.004 1104 HG2 GLU 643 HG2 GLU 643 -15.258 -17.276 15.847 1105 HG3 GLU 643 HG3 GLU 643 -14.133 -16.429 16.912 1106 H VAL 644 H VAL 644 -11.861 -19.061 15.045 1107 HA VAL 644 HA VAL 644 -13.309 -20.384 12.879 1108 HB VAL 644 HB VAL 644 -11.069 -21.484 14.582 1109 HG11 VAL 644 HG11 VAL 644 -12.546 -23.157 13.565 1110 HG12 VAL 644 HG12 VAL 644 -10.917 -23.225 12.919 1111 HG13 VAL 644 HG13 VAL 644 -12.209 -22.480 11.968 1112 HG21 VAL 644 HG21 VAL 644 -10.962 -20.277 11.823 1113 HG22 VAL 644 HG22 VAL 644 -9.628 -21.108 12.621 1114 HG23 VAL 644 HG23 VAL 644 -10.256 -19.598 13.288 1115 H ILE 645 H ILE 645 -15.136 -21.220 13.466 1116 HA ILE 645 HA ILE 645 -15.531 -22.227 16.190 1117 HB ILE 645 HB ILE 645 -17.505 -21.817 13.939 1118 HG12 ILE 645 HG12 ILE 645 -17.023 -20.035 16.328 1119 HG13 ILE 645 HG13 ILE 645 -16.380 -19.718 14.721 1120 HG21 ILE 645 HG21 ILE 645 -17.900 -22.296 16.887 1121 HG22 ILE 645 HG22 ILE 645 -18.246 -23.440 15.587 1122 HG23 ILE 645 HG23 ILE 645 -19.173 -21.944 15.723 1123 HD11 ILE 645 HD11 ILE 645 -18.616 -19.582 13.844 1124 HD12 ILE 645 HD12 ILE 645 -18.359 -18.414 15.140 1125 HD13 ILE 645 HD13 ILE 645 -19.297 -19.889 15.447 1126 H ILE 646 H ILE 646 -15.523 -24.354 16.570 1127 HA ILE 646 HA ILE 646 -15.426 -26.186 14.288 1128 HB ILE 646 HB ILE 646 -14.649 -26.723 17.179 1129 HG12 ILE 646 HG12 ILE 646 -12.798 -26.198 14.838 1130 HG13 ILE 646 HG13 ILE 646 -13.141 -25.035 16.114 1131 HG21 ILE 646 HG21 ILE 646 -14.174 -28.308 14.667 1132 HG22 ILE 646 HG22 ILE 646 -15.317 -28.695 15.949 1133 HG23 ILE 646 HG23 ILE 646 -13.584 -28.722 16.276 1134 HD11 ILE 646 HD11 ILE 646 -11.009 -26.167 16.502 1135 HD12 ILE 646 HD12 ILE 646 -11.830 -27.723 16.482 1136 HD13 ILE 646 HD13 ILE 646 -12.177 -26.565 17.761 1137 H GLU 647 H GLU 647 -17.402 -26.931 13.925 1138 HA GLU 647 HA GLU 647 -18.980 -27.751 16.253 1139 HB2 GLU 647 HB2 GLU 647 -21.009 -27.356 14.860 1140 HB3 GLU 647 HB3 GLU 647 -20.096 -25.903 15.218 1141 HG2 GLU 647 HG2 GLU 647 -19.116 -25.989 12.966 1142 HG3 GLU 647 HG3 GLU 647 -20.084 -27.424 12.619 1143 H GLU 648 H GLU 648 -20.262 -29.721 16.007 1144 HA GLU 648 HA GLU 648 -18.745 -31.590 14.460 1145 HB2 GLU 648 HB2 GLU 648 -20.020 -33.340 15.625 1146 HB3 GLU 648 HB3 GLU 648 -19.260 -32.239 16.753 1147 HG2 GLU 648 HG2 GLU 648 -22.113 -31.904 15.942 1148 HG3 GLU 648 HG3 GLU 648 -21.676 -33.049 17.197 1149 H SER 649 H SER 649 -19.261 -32.214 12.580 1150 HA SER 649 HA SER 649 -21.968 -31.642 11.676 1151 HB2 SER 649 HB2 SER 649 -19.380 -31.333 10.202 1152 HB3 SER 649 HB3 SER 649 -20.989 -30.925 9.562 1153 HG SER 649 HG SER 649 -20.959 -29.524 11.622 1154 H TYR 650 H TYR 650 -22.348 -33.894 12.242 1155 HA TYR 650 HA TYR 650 -21.165 -35.853 10.419 1156 HB2 TYR 650 HB2 TYR 650 -23.297 -36.280 12.521 1157 HB3 TYR 650 HB3 TYR 650 -22.358 -37.520 11.696 1158 HD1 TYR 650 HD1 TYR 650 -19.853 -37.519 12.103 1159 HD2 TYR 650 HD2 TYR 650 -22.618 -35.422 14.465 1160 HE1 TYR 650 HE1 TYR 650 -18.179 -37.423 13.921 1161 HE2 TYR 650 HE2 TYR 650 -20.978 -35.293 16.323 1162 HH TYR 650 HH TYR 650 -17.731 -35.920 15.874 1163 H GLU 651 H GLU 651 -24.324 -34.809 11.543 1164 HA GLU 651 HA GLU 651 -25.624 -35.775 9.250 1165 HB2 GLU 651 HB2 GLU 651 -26.756 -35.632 11.415 1166 HB3 GLU 651 HB3 GLU 651 -26.541 -33.895 11.438 1167 HG2 GLU 651 HG2 GLU 651 -28.815 -34.458 10.902 1168 HG3 GLU 651 HG3 GLU 651 -28.023 -33.694 9.524 1169 H PHE 652 H PHE 652 -24.731 -32.669 10.594 1170 HA PHE 652 HA PHE 652 -24.305 -30.646 9.847 1171 HB2 PHE 652 HB2 PHE 652 -22.533 -31.802 8.537 1172 HB3 PHE 652 HB3 PHE 652 -23.660 -31.971 7.203 1173 HD1 PHE 652 HD2 PHE 652 -22.371 -29.238 9.412 1174 HD2 PHE 652 HD1 PHE 652 -23.449 -30.463 5.484 1175 HE1 PHE 652 HE2 PHE 652 -21.688 -27.042 8.549 1176 HE2 PHE 652 HE1 PHE 652 -22.772 -28.267 4.612 1177 HZ PHE 652 HZ PHE 652 -21.891 -26.550 6.145 1178 H LYS 653 H LYS 653 -26.400 -30.055 10.151 1179 HA LYS 653 HA LYS 653 -28.079 -29.981 7.777 1180 HB2 LYS 653 HB2 LYS 653 -28.699 -29.251 10.626 1181 HB3 LYS 653 HB3 LYS 653 -29.860 -29.210 9.311 1182 HG2 LYS 653 HG2 LYS 653 -28.481 -31.656 10.413 1183 HG3 LYS 653 HG3 LYS 653 -30.156 -31.189 10.691 1184 HD2 LYS 653 HD2 LYS 653 -28.956 -31.892 8.003 1185 HD3 LYS 653 HD3 LYS 653 -29.944 -32.957 8.993 1186 HE2 LYS 653 HE2 LYS 653 -31.811 -31.379 8.809 1187 HE3 LYS 653 HE3 LYS 653 -30.819 -30.337 7.790 1188 HZ1 LYS 653 HZ1 LYS 653 -31.557 -33.131 7.148 1189 HZ2 LYS 653 HZ2 LYS 653 -30.720 -32.071 6.135 1190 HZ3 LYS 653 HZ3 LYS 653 -32.315 -31.760 6.547 1191 H SER 654 H SER 654 -27.234 -28.391 6.588 1192 HA SER 654 HA SER 654 -26.861 -25.830 7.918 1193 HB2 SER 654 HB2 SER 654 -25.092 -26.864 6.313 1194 HB3 SER 654 HB3 SER 654 -26.209 -26.435 5.022 1195 HG SER 654 HG SER 654 -24.943 -24.750 6.882 1196 H THR 655 H THR 655 -29.017 -25.398 8.256 1197 HA THR 655 HA THR 655 -30.503 -24.415 5.987 1198 HB THR 655 HB THR 655 -31.617 -26.590 7.797 1199 HG1 THR 655 HG1 THR 655 -30.292 -26.650 5.469 1200 HG21 THR 655 HG21 THR 655 -33.611 -26.488 6.352 1201 HG22 THR 655 HG22 THR 655 -32.900 -25.139 5.464 1202 HG23 THR 655 HG23 THR 655 -33.332 -24.948 7.161 1203 H VAL 656 H VAL 656 -31.745 -22.680 6.637 1204 HA VAL 656 HA VAL 656 -31.572 -21.938 9.433 1205 HB VAL 656 HB VAL 656 -32.708 -20.393 7.077 1206 HG11 VAL 656 HG11 VAL 656 -32.491 -18.438 8.513 1207 HG12 VAL 656 HG12 VAL 656 -31.935 -19.468 9.830 1208 HG13 VAL 656 HG13 VAL 656 -33.580 -19.638 9.214 1209 HG21 VAL 656 HG21 VAL 656 -30.610 -19.125 7.102 1210 HG22 VAL 656 HG22 VAL 656 -30.331 -20.832 6.753 1211 HG23 VAL 656 HG23 VAL 656 -29.984 -20.193 8.359 1212 H ASP 657 H ASP 657 -33.137 -22.666 10.708 1213 HA ASP 657 HA ASP 657 -35.738 -23.384 9.588 1214 HB2 ASP 657 HB2 ASP 657 -34.596 -23.824 12.357 1215 HB3 ASP 657 HB3 ASP 657 -36.255 -24.210 11.938 Start of MODEL 4 1 H HIS 501 H HIS 501 5.026 -0.754 -3.889 2 HA HIS 501 HA HIS 501 5.049 -0.571 -1.171 3 HB2 HIS 501 HB2 HIS 501 3.719 1.498 -1.565 4 HB3 HIS 501 HB3 HIS 501 2.566 0.574 -2.516 5 HD1 HIS 501 HD1 HIS 501 3.803 0.881 1.104 6 HD2 HIS 501 HD2 HIS 501 0.545 -0.552 -1.063 7 HE1 HIS 501 HE1 HIS 501 2.060 0.234 2.794 8 H ALA 502 H ALA 502 3.669 -2.231 -0.363 9 HA ALA 502 HA ALA 502 3.274 -4.275 -2.369 10 HB1 ALA 502 HB1 ALA 502 3.253 -4.452 0.605 11 HB2 ALA 502 HB2 ALA 502 4.632 -4.848 -0.424 12 HB3 ALA 502 HB3 ALA 502 3.163 -5.839 -0.478 13 H GLY 503 H GLY 503 1.410 -4.100 0.657 14 HA2 GLY 503 HA2 GLY 503 -0.992 -3.218 -0.126 15 HA3 GLY 503 HA3 GLY 503 -0.898 -4.834 -0.835 16 H ILE 504 H ILE 504 -2.498 -5.740 0.472 17 HA ILE 504 HA ILE 504 -2.164 -5.478 3.383 18 HB ILE 504 HB ILE 504 -4.706 -5.785 1.765 19 HG12 ILE 504 HG12 ILE 504 -5.306 -3.596 3.021 20 HG13 ILE 504 HG13 ILE 504 -3.568 -3.434 3.238 21 HG21 ILE 504 HG21 ILE 504 -5.959 -5.583 3.817 22 HG22 ILE 504 HG22 ILE 504 -4.444 -5.704 4.725 23 HG23 ILE 504 HG23 ILE 504 -4.980 -7.047 3.710 24 HD11 ILE 504 HD11 ILE 504 -3.276 -3.493 0.822 25 HD12 ILE 504 HD12 ILE 504 -4.351 -2.177 1.322 26 HD13 ILE 504 HD13 ILE 504 -5.015 -3.657 0.618 27 H PHE 505 H PHE 505 -1.846 -7.325 4.434 28 HA PHE 505 HA PHE 505 -2.888 -9.810 3.281 29 HB2 PHE 505 HB2 PHE 505 -0.708 -9.308 5.296 30 HB3 PHE 505 HB3 PHE 505 -1.475 -10.883 5.148 31 HD1 PHE 505 HD1 PHE 505 -1.374 -12.067 2.990 32 HD2 PHE 505 HD2 PHE 505 0.957 -8.629 3.813 33 HE1 PHE 505 HE1 PHE 505 0.133 -12.675 1.157 34 HE2 PHE 505 HE2 PHE 505 2.489 -9.225 1.968 35 HZ PHE 505 HZ PHE 505 2.050 -11.280 0.632 36 H THR 506 H THR 506 -4.530 -10.839 4.264 37 HA THR 506 HA THR 506 -5.054 -10.642 7.011 38 HB THR 506 HB THR 506 -5.913 -8.390 6.365 39 HG1 THR 506 HG1 THR 506 -7.602 -8.615 7.661 40 HG21 THR 506 HG21 THR 506 -7.933 -8.212 4.975 41 HG22 THR 506 HG22 THR 506 -7.870 -9.945 4.659 42 HG23 THR 506 HG23 THR 506 -6.591 -8.892 4.051 43 H PHE 507 H PHE 507 -7.377 -11.596 7.367 44 HA PHE 507 HA PHE 507 -7.337 -14.090 5.938 45 HB2 PHE 507 HB2 PHE 507 -9.034 -13.082 8.204 46 HB3 PHE 507 HB3 PHE 507 -9.334 -14.619 7.410 47 HD1 PHE 507 HD1 PHE 507 -7.706 -16.400 7.507 48 HD2 PHE 507 HD2 PHE 507 -7.220 -12.820 9.737 49 HE1 PHE 507 HE1 PHE 507 -6.097 -17.535 8.911 50 HE2 PHE 507 HE2 PHE 507 -5.574 -13.936 11.181 51 HZ PHE 507 HZ PHE 507 -4.993 -16.291 10.779 52 H GLU 508 H GLU 508 -8.939 -14.931 4.684 53 HA GLU 508 HA GLU 508 -10.277 -13.124 2.990 54 HB2 GLU 508 HB2 GLU 508 -9.381 -15.350 2.382 55 HB3 GLU 508 HB3 GLU 508 -10.620 -16.086 3.382 56 HG2 GLU 508 HG2 GLU 508 -12.333 -15.205 1.951 57 HG3 GLU 508 HG3 GLU 508 -11.097 -14.374 0.994 58 H GLU 509 H GLU 509 -11.198 -15.006 5.755 59 HA GLU 509 HA GLU 509 -13.798 -13.702 5.768 60 HB2 GLU 509 HB2 GLU 509 -14.695 -15.821 6.760 61 HB3 GLU 509 HB3 GLU 509 -14.214 -15.990 5.087 62 HG2 GLU 509 HG2 GLU 509 -11.970 -16.825 6.103 63 HG3 GLU 509 HG3 GLU 509 -12.933 -17.049 7.560 64 HA PRO 510 HA PRO 510 -12.366 -12.533 9.795 65 HB2 PRO 510 HB2 PRO 510 -14.716 -11.858 10.962 66 HB3 PRO 510 HB3 PRO 510 -13.969 -10.860 9.713 67 HG2 PRO 510 HG2 PRO 510 -16.196 -12.845 9.479 68 HG3 PRO 510 HG3 PRO 510 -16.047 -11.244 8.732 69 HD2 PRO 510 HD2 PRO 510 -15.531 -13.572 7.402 70 HD3 PRO 510 HD3 PRO 510 -14.714 -12.039 7.026 71 H VAL 511 H VAL 511 -14.917 -14.871 9.457 72 HA VAL 511 HA VAL 511 -14.074 -16.246 11.878 73 HB VAL 511 HB VAL 511 -16.986 -15.681 11.181 74 HG11 VAL 511 HG11 VAL 511 -16.709 -17.835 12.215 75 HG12 VAL 511 HG12 VAL 511 -17.496 -16.730 13.342 76 HG13 VAL 511 HG13 VAL 511 -15.790 -17.119 13.535 77 HG21 VAL 511 HG21 VAL 511 -15.356 -14.540 13.460 78 HG22 VAL 511 HG22 VAL 511 -17.095 -14.354 13.259 79 HG23 VAL 511 HG23 VAL 511 -15.991 -13.652 12.077 80 H THR 512 H THR 512 -14.144 -18.430 11.536 81 HA THR 512 HA THR 512 -15.457 -19.316 9.115 82 HB THR 512 HB THR 512 -12.958 -19.014 8.721 83 HG1 THR 512 HG1 THR 512 -14.037 -20.317 7.455 84 HG21 THR 512 HG21 THR 512 -12.134 -19.732 10.902 85 HG22 THR 512 HG22 THR 512 -11.451 -20.739 9.620 86 HG23 THR 512 HG23 THR 512 -12.768 -21.353 10.621 87 H HIS 513 H HIS 513 -16.393 -21.306 9.336 88 HA HIS 513 HA HIS 513 -15.996 -22.544 11.905 89 HB2 HIS 513 HB2 HIS 513 -18.414 -23.249 11.908 90 HB3 HIS 513 HB3 HIS 513 -18.164 -21.528 12.090 91 HD1 HIS 513 HD1 HIS 513 -20.480 -23.597 10.700 92 HD2 HIS 513 HD2 HIS 513 -18.335 -20.409 9.139 93 HE1 HIS 513 HE1 HIS 513 -21.882 -22.666 8.797 94 H VAL 514 H VAL 514 -15.484 -24.523 11.930 95 HA VAL 514 HA VAL 514 -15.360 -25.887 9.347 96 HB VAL 514 HB VAL 514 -13.233 -26.857 9.998 97 HG11 VAL 514 HG11 VAL 514 -13.071 -24.704 8.916 98 HG12 VAL 514 HG12 VAL 514 -11.811 -24.815 10.153 99 HG13 VAL 514 HG13 VAL 514 -13.257 -23.876 10.459 100 HG21 VAL 514 HG21 VAL 514 -13.612 -27.086 12.417 101 HG22 VAL 514 HG22 VAL 514 -13.512 -25.336 12.606 102 HG23 VAL 514 HG23 VAL 514 -12.090 -26.251 12.105 103 H SER 515 H SER 515 -15.074 -28.292 9.704 104 HA SER 515 HA SER 515 -17.206 -29.117 11.511 105 HB2 SER 515 HB2 SER 515 -17.224 -29.653 9.018 106 HB3 SER 515 HB3 SER 515 -15.829 -30.649 9.333 107 HG SER 515 HG SER 515 -17.873 -31.773 9.334 108 H GLU 516 H GLU 516 -16.901 -30.789 12.921 109 HA GLU 516 HA GLU 516 -14.366 -31.440 13.976 110 HB2 GLU 516 HB2 GLU 516 -16.424 -31.740 15.314 111 HB3 GLU 516 HB3 GLU 516 -17.060 -32.867 14.155 112 HG2 GLU 516 HG2 GLU 516 -14.617 -33.412 15.837 113 HG3 GLU 516 HG3 GLU 516 -16.255 -33.851 16.309 114 H SER 517 H SER 517 -16.454 -32.884 11.574 115 HA SER 517 HA SER 517 -14.707 -35.148 11.204 116 HB2 SER 517 HB2 SER 517 -17.297 -34.464 9.841 117 HB3 SER 517 HB3 SER 517 -16.491 -36.030 9.875 118 HG SER 517 HG SER 517 -16.791 -35.348 12.416 119 H ILE 518 H ILE 518 -13.950 -32.299 10.260 120 HA ILE 518 HA ILE 518 -13.869 -32.737 7.376 121 HB ILE 518 HB ILE 518 -14.342 -30.430 8.214 122 HG12 ILE 518 HG12 ILE 518 -11.767 -30.713 6.673 123 HG13 ILE 518 HG13 ILE 518 -13.393 -30.668 6.000 124 HG21 ILE 518 HG21 ILE 518 -12.546 -29.080 9.168 125 HG22 ILE 518 HG22 ILE 518 -11.526 -30.528 9.296 126 HG23 ILE 518 HG23 ILE 518 -13.035 -30.408 10.210 127 HD11 ILE 518 HD11 ILE 518 -11.978 -28.462 7.441 128 HD12 ILE 518 HD12 ILE 518 -13.633 -28.362 6.843 129 HD13 ILE 518 HD13 ILE 518 -12.278 -28.535 5.703 130 H GLY 519 H GLY 519 -11.929 -33.220 10.153 131 HA2 GLY 519 HA2 GLY 519 -9.882 -34.329 10.279 132 HA3 GLY 519 HA3 GLY 519 -9.779 -34.230 8.528 133 H ILE 520 H ILE 520 -9.409 -32.075 7.640 134 HA ILE 520 HA ILE 520 -7.600 -30.502 9.324 135 HB ILE 520 HB ILE 520 -7.096 -31.396 6.477 136 HG12 ILE 520 HG12 ILE 520 -6.615 -33.214 8.070 137 HG13 ILE 520 HG13 ILE 520 -5.147 -32.641 7.290 138 HG21 ILE 520 HG21 ILE 520 -5.397 -29.642 8.246 139 HG22 ILE 520 HG22 ILE 520 -6.277 -29.151 6.802 140 HG23 ILE 520 HG23 ILE 520 -4.908 -30.257 6.666 141 HD11 ILE 520 HD11 ILE 520 -6.067 -31.990 10.076 142 HD12 ILE 520 HD12 ILE 520 -4.608 -31.358 9.314 143 HD13 ILE 520 HD13 ILE 520 -4.761 -33.088 9.632 144 H MET 521 H MET 521 -8.070 -28.417 9.098 145 HA MET 521 HA MET 521 -9.857 -27.698 6.894 146 HB2 MET 521 HB2 MET 521 -10.691 -25.884 8.247 147 HB3 MET 521 HB3 MET 521 -10.771 -27.365 9.174 148 HG2 MET 521 HG2 MET 521 -9.990 -25.866 10.786 149 HG3 MET 521 HG3 MET 521 -8.500 -26.510 10.136 150 HE1 MET 521 HE1 MET 521 -9.301 -23.652 11.652 151 HE2 MET 521 HE2 MET 521 -8.160 -22.533 10.905 152 HE3 MET 521 HE3 MET 521 -7.600 -24.098 11.483 153 H GLU 522 H GLU 522 -9.429 -25.850 5.660 154 HA GLU 522 HA GLU 522 -6.777 -24.682 5.993 155 HB2 GLU 522 HB2 GLU 522 -7.982 -25.865 3.529 156 HB3 GLU 522 HB3 GLU 522 -6.903 -24.493 3.376 157 HG2 GLU 522 HG2 GLU 522 -5.168 -25.702 4.483 158 HG3 GLU 522 HG3 GLU 522 -6.209 -27.122 4.684 159 H VAL 523 H VAL 523 -7.004 -22.669 6.416 160 HA VAL 523 HA VAL 523 -9.273 -21.169 5.298 161 HB VAL 523 HB VAL 523 -7.355 -20.461 7.543 162 HG11 VAL 523 HG11 VAL 523 -8.774 -18.547 7.959 163 HG12 VAL 523 HG12 VAL 523 -9.816 -18.973 6.601 164 HG13 VAL 523 HG13 VAL 523 -8.141 -18.470 6.320 165 HG21 VAL 523 HG21 VAL 523 -9.201 -20.861 9.014 166 HG22 VAL 523 HG22 VAL 523 -8.993 -22.277 7.986 167 HG23 VAL 523 HG23 VAL 523 -10.284 -21.124 7.651 168 H LYS 524 H LYS 524 -8.917 -19.710 3.722 169 HA LYS 524 HA LYS 524 -6.213 -19.447 2.749 170 HB2 LYS 524 HB2 LYS 524 -8.719 -18.297 1.575 171 HB3 LYS 524 HB3 LYS 524 -7.162 -18.537 0.795 172 HG2 LYS 524 HG2 LYS 524 -7.637 -21.082 1.355 173 HG3 LYS 524 HG3 LYS 524 -9.300 -20.478 1.412 174 HD2 LYS 524 HD2 LYS 524 -7.410 -20.216 -0.892 175 HD3 LYS 524 HD3 LYS 524 -8.781 -21.327 -0.782 176 HE2 LYS 524 HE2 LYS 524 -8.935 -18.408 -0.510 177 HE3 LYS 524 HE3 LYS 524 -9.173 -19.195 -2.089 178 HZ1 LYS 524 HZ1 LYS 524 -10.855 -19.433 0.382 179 HZ2 LYS 524 HZ2 LYS 524 -11.140 -20.331 -1.006 180 HZ3 LYS 524 HZ3 LYS 524 -11.250 -18.648 -1.030 181 H VAL 525 H VAL 525 -5.099 -17.634 2.698 182 HA VAL 525 HA VAL 525 -6.172 -15.333 4.171 183 HB VAL 525 HB VAL 525 -3.295 -16.140 3.673 184 HG11 VAL 525 HG11 VAL 525 -2.710 -14.441 5.338 185 HG12 VAL 525 HG12 VAL 525 -4.407 -13.983 5.460 186 HG13 VAL 525 HG13 VAL 525 -3.530 -13.719 3.951 187 HG21 VAL 525 HG21 VAL 525 -4.392 -17.686 5.109 188 HG22 VAL 525 HG22 VAL 525 -4.972 -16.379 6.150 189 HG23 VAL 525 HG23 VAL 525 -3.241 -16.725 6.035 190 H LEU 526 H LEU 526 -6.342 -13.442 3.146 191 HA LEU 526 HA LEU 526 -6.185 -13.355 0.322 192 HB2 LEU 526 HB2 LEU 526 -6.634 -11.181 2.361 193 HB3 LEU 526 HB3 LEU 526 -6.734 -10.936 0.632 194 HG LEU 526 HG LEU 526 -8.524 -12.790 2.207 195 HD11 LEU 526 HD11 LEU 526 -8.921 -10.447 2.787 196 HD12 LEU 526 HD12 LEU 526 -10.253 -11.090 1.829 197 HD13 LEU 526 HD13 LEU 526 -9.052 -10.038 1.077 198 HD21 LEU 526 HD21 LEU 526 -8.612 -11.861 -0.660 199 HD22 LEU 526 HD22 LEU 526 -9.869 -12.784 0.152 200 HD23 LEU 526 HD23 LEU 526 -8.278 -13.503 -0.096 201 H ARG 527 H ARG 527 -4.655 -12.694 -0.914 202 HA ARG 527 HA ARG 527 -2.092 -12.113 0.240 203 HB2 ARG 527 HB2 ARG 527 -2.334 -13.660 -1.683 204 HB3 ARG 527 HB3 ARG 527 -2.929 -12.326 -2.653 205 HG2 ARG 527 HG2 ARG 527 -0.754 -11.182 -2.352 206 HG3 ARG 527 HG3 ARG 527 -0.166 -12.601 -1.486 207 HD2 ARG 527 HD2 ARG 527 0.556 -12.639 -3.799 208 HD3 ARG 527 HD3 ARG 527 -0.557 -13.961 -3.463 209 HE ARG 527 HE ARG 527 -2.020 -11.767 -4.416 210 HH11 ARG 527 HH11 ARG 527 0.282 -14.149 -5.677 211 HH12 ARG 527 HH12 ARG 527 -0.279 -14.026 -7.285 212 HH21 ARG 527 HH21 ARG 527 -2.792 -11.643 -6.585 213 HH22 ARG 527 HH22 ARG 527 -2.066 -12.601 -7.796 214 H THR 528 H THR 528 -0.894 -10.335 -0.284 215 HA THR 528 HA THR 528 -1.955 -7.833 -0.114 216 HB THR 528 HB THR 528 0.308 -8.233 0.498 217 HG1 THR 528 HG1 THR 528 1.303 -6.896 -1.466 218 HG21 THR 528 HG21 THR 528 0.770 -9.023 -2.341 219 HG22 THR 528 HG22 THR 528 0.763 -10.104 -0.935 220 HG23 THR 528 HG23 THR 528 2.024 -8.868 -1.104 221 H SER 529 H SER 529 -2.404 -6.256 -1.550 222 HA SER 529 HA SER 529 -3.360 -6.751 -4.066 223 HB2 SER 529 HB2 SER 529 -3.954 -4.833 -2.564 224 HB3 SER 529 HB3 SER 529 -2.394 -4.112 -2.922 225 HG SER 529 HG SER 529 -3.392 -3.224 -4.501 226 H GLY 530 H GLY 530 -0.224 -5.823 -2.903 227 HA2 GLY 530 HA2 GLY 530 0.928 -6.027 -5.623 228 HA3 GLY 530 HA3 GLY 530 1.529 -4.953 -4.371 229 H ALA 531 H ALA 531 1.481 -8.142 -5.550 230 HA ALA 531 HA ALA 531 2.836 -9.223 -3.244 231 HB1 ALA 531 HB1 ALA 531 2.191 -10.447 -5.933 232 HB2 ALA 531 HB2 ALA 531 1.210 -10.586 -4.479 233 HB3 ALA 531 HB3 ALA 531 2.816 -11.315 -4.526 234 H ARG 532 H ARG 532 4.805 -8.501 -3.024 235 HA ARG 532 HA ARG 532 6.385 -7.978 -5.431 236 HB2 ARG 532 HB2 ARG 532 6.873 -6.907 -2.667 237 HB3 ARG 532 HB3 ARG 532 7.577 -6.364 -4.179 238 HG2 ARG 532 HG2 ARG 532 4.683 -6.071 -3.372 239 HG3 ARG 532 HG3 ARG 532 5.849 -4.767 -3.360 240 HD2 ARG 532 HD2 ARG 532 6.117 -5.065 -5.802 241 HD3 ARG 532 HD3 ARG 532 4.849 -6.291 -5.749 242 HE ARG 532 HE ARG 532 4.114 -3.757 -4.603 243 HH11 ARG 532 HH11 ARG 532 4.187 -5.665 -7.585 244 HH12 ARG 532 HH12 ARG 532 2.966 -4.780 -8.346 245 HH21 ARG 532 HH21 ARG 532 2.434 -2.540 -5.643 246 HH22 ARG 532 HH22 ARG 532 1.960 -2.952 -7.220 247 H GLY 533 H GLY 533 7.385 -9.958 -5.728 248 HA2 GLY 533 HA2 GLY 533 9.310 -11.183 -5.497 249 HA3 GLY 533 HA3 GLY 533 9.668 -10.286 -4.035 250 H ASN 534 H ASN 534 9.615 -11.350 -2.266 251 HA ASN 534 HA ASN 534 7.756 -13.566 -1.931 252 HB2 ASN 534 HB2 ASN 534 9.958 -14.532 -2.523 253 HB3 ASN 534 HB3 ASN 534 10.700 -13.642 -1.204 254 HD21 ASN 534 HD21 ASN 534 7.555 -15.253 -0.951 255 HD22 ASN 534 HD22 ASN 534 8.096 -16.438 0.155 256 H VAL 535 H VAL 535 6.690 -13.475 -0.048 257 HA VAL 535 HA VAL 535 7.675 -11.730 2.095 258 HB VAL 535 HB VAL 535 4.825 -11.952 1.077 259 HG11 VAL 535 HG11 VAL 535 5.952 -10.271 3.309 260 HG12 VAL 535 HG12 VAL 535 4.888 -11.661 3.487 261 HG13 VAL 535 HG13 VAL 535 4.287 -10.196 2.732 262 HG21 VAL 535 HG21 VAL 535 5.086 -9.566 0.458 263 HG22 VAL 535 HG22 VAL 535 6.173 -10.659 -0.417 264 HG23 VAL 535 HG23 VAL 535 6.798 -9.689 0.912 265 H ILE 536 H ILE 536 7.473 -12.653 4.073 266 HA ILE 536 HA ILE 536 6.025 -15.195 4.172 267 HB ILE 536 HB ILE 536 8.339 -14.268 5.899 268 HG12 ILE 536 HG12 ILE 536 9.057 -15.095 3.729 269 HG13 ILE 536 HG13 ILE 536 9.491 -16.264 4.974 270 HG21 ILE 536 HG21 ILE 536 6.703 -16.764 6.058 271 HG22 ILE 536 HG22 ILE 536 6.701 -15.457 7.234 272 HG23 ILE 536 HG23 ILE 536 8.150 -16.460 7.025 273 HD11 ILE 536 HD11 ILE 536 8.677 -17.477 3.091 274 HD12 ILE 536 HD12 ILE 536 7.310 -16.413 2.928 275 HD13 ILE 536 HD13 ILE 536 7.387 -17.517 4.305 276 H VAL 537 H VAL 537 4.366 -15.407 5.462 277 HA VAL 537 HA VAL 537 3.842 -13.239 7.351 278 HB VAL 537 HB VAL 537 1.746 -14.916 5.942 279 HG11 VAL 537 HG11 VAL 537 1.464 -12.418 7.604 280 HG12 VAL 537 HG12 VAL 537 1.003 -14.050 8.082 281 HG13 VAL 537 HG13 VAL 537 0.152 -13.245 6.761 282 HG21 VAL 537 HG21 VAL 537 2.891 -13.555 4.320 283 HG22 VAL 537 HG22 VAL 537 2.693 -12.133 5.330 284 HG23 VAL 537 HG23 VAL 537 1.272 -12.893 4.592 285 HA PRO 538 HA PRO 538 4.157 -16.927 10.020 286 HB2 PRO 538 HB2 PRO 538 4.361 -15.553 12.342 287 HB3 PRO 538 HB3 PRO 538 5.735 -15.841 11.274 288 HG2 PRO 538 HG2 PRO 538 4.061 -13.387 11.614 289 HG3 PRO 538 HG3 PRO 538 5.807 -13.518 11.344 290 HD2 PRO 538 HD2 PRO 538 4.008 -12.881 9.393 291 HD3 PRO 538 HD3 PRO 538 5.559 -13.677 9.069 292 H TYR 539 H TYR 539 2.752 -17.903 11.515 293 HA TYR 539 HA TYR 539 0.411 -16.448 12.387 294 HB2 TYR 539 HB2 TYR 539 -1.224 -17.940 11.359 295 HB3 TYR 539 HB3 TYR 539 -0.206 -17.192 10.131 296 HD1 TYR 539 HD1 TYR 539 -0.965 -20.352 11.870 297 HD2 TYR 539 HD2 TYR 539 1.192 -18.482 8.732 298 HE1 TYR 539 HE1 TYR 539 -0.491 -22.547 10.913 299 HE2 TYR 539 HE2 TYR 539 1.679 -20.677 7.756 300 HH TYR 539 HH TYR 539 0.094 -23.495 8.791 301 H LYS 540 H LYS 540 -0.903 -17.659 13.826 302 HA LYS 540 HA LYS 540 0.020 -20.182 14.776 303 HB2 LYS 540 HB2 LYS 540 0.426 -19.361 17.156 304 HB3 LYS 540 HB3 LYS 540 1.643 -18.982 15.952 305 HG2 LYS 540 HG2 LYS 540 1.365 -17.114 17.424 306 HG3 LYS 540 HG3 LYS 540 0.812 -16.691 15.809 307 HD2 LYS 540 HD2 LYS 540 -1.507 -17.015 16.551 308 HD3 LYS 540 HD3 LYS 540 -0.930 -17.422 18.165 309 HE2 LYS 540 HE2 LYS 540 -0.427 -14.825 16.746 310 HE3 LYS 540 HE3 LYS 540 -1.695 -15.070 17.952 311 HZ1 LYS 540 HZ1 LYS 540 1.246 -15.249 18.398 312 HZ2 LYS 540 HZ2 LYS 540 0.087 -15.593 19.563 313 HZ3 LYS 540 HZ3 LYS 540 0.219 -14.034 18.934 314 H THR 541 H THR 541 -1.343 -21.161 16.379 315 HA THR 541 HA THR 541 -4.056 -20.271 16.216 316 HB THR 541 HB THR 541 -4.356 -22.372 17.692 317 HG1 THR 541 HG1 THR 541 -2.354 -22.924 18.394 318 HG21 THR 541 HG21 THR 541 -4.181 -23.877 15.738 319 HG22 THR 541 HG22 THR 541 -3.212 -22.656 14.911 320 HG23 THR 541 HG23 THR 541 -4.890 -22.323 15.301 321 H ILE 542 H ILE 542 -5.250 -19.499 17.905 322 HA ILE 542 HA ILE 542 -3.731 -18.662 20.259 323 HB ILE 542 HB ILE 542 -6.272 -17.548 19.069 324 HG12 ILE 542 HG12 ILE 542 -3.488 -16.392 19.126 325 HG13 ILE 542 HG13 ILE 542 -4.272 -17.086 17.714 326 HG21 ILE 542 HG21 ILE 542 -6.016 -15.718 20.685 327 HG22 ILE 542 HG22 ILE 542 -4.600 -16.514 21.368 328 HG23 ILE 542 HG23 ILE 542 -6.188 -17.270 21.508 329 HD11 ILE 542 HD11 ILE 542 -4.277 -14.630 17.757 330 HD12 ILE 542 HD12 ILE 542 -5.289 -14.676 19.208 331 HD13 ILE 542 HD13 ILE 542 -5.888 -15.336 17.679 332 H GLU 543 H GLU 543 -4.405 -19.305 22.192 333 HA GLU 543 HA GLU 543 -6.469 -21.314 22.312 334 HB2 GLU 543 HB2 GLU 543 -4.639 -20.258 24.463 335 HB3 GLU 543 HB3 GLU 543 -5.694 -21.657 24.601 336 HG2 GLU 543 HG2 GLU 543 -4.453 -22.774 22.838 337 HG3 GLU 543 HG3 GLU 543 -3.381 -21.382 22.699 338 H GLY 544 H GLY 544 -8.322 -21.155 23.426 339 HA2 GLY 544 HA2 GLY 544 -9.281 -19.650 25.356 340 HA3 GLY 544 HA3 GLY 544 -9.396 -18.512 24.022 341 H THR 545 H THR 545 -11.424 -19.931 25.535 342 HA THR 545 HA THR 545 -13.152 -21.073 25.421 343 HB THR 545 HB THR 545 -14.386 -21.153 22.997 344 HG1 THR 545 HG1 THR 545 -12.477 -20.124 22.060 345 HG21 THR 545 HG21 THR 545 -15.274 -20.153 25.022 346 HG22 THR 545 HG22 THR 545 -15.455 -19.046 23.662 347 HG23 THR 545 HG23 THR 545 -14.173 -18.787 24.849 348 H ALA 546 H ALA 546 -11.217 -22.191 22.751 349 HA ALA 546 HA ALA 546 -12.057 -24.932 23.349 350 HB1 ALA 546 HB1 ALA 546 -10.604 -23.817 20.951 351 HB2 ALA 546 HB2 ALA 546 -12.311 -24.244 20.998 352 HB3 ALA 546 HB3 ALA 546 -11.081 -25.502 21.162 353 H ARG 547 H ARG 547 -10.416 -26.469 23.692 354 HA ARG 547 HA ARG 547 -8.050 -25.316 24.862 355 HB2 ARG 547 HB2 ARG 547 -9.405 -27.976 25.091 356 HB3 ARG 547 HB3 ARG 547 -7.785 -27.704 25.738 357 HG2 ARG 547 HG2 ARG 547 -8.499 -26.157 27.271 358 HG3 ARG 547 HG3 ARG 547 -9.986 -25.813 26.398 359 HD2 ARG 547 HD2 ARG 547 -10.440 -27.036 28.435 360 HD3 ARG 547 HD3 ARG 547 -10.864 -27.961 26.991 361 HE ARG 547 HE ARG 547 -8.407 -28.887 27.555 362 HH11 ARG 547 HH11 ARG 547 -11.237 -28.465 29.673 363 HH12 ARG 547 HH12 ARG 547 -10.953 -29.857 30.575 364 HH21 ARG 547 HH21 ARG 547 -8.011 -30.777 28.793 365 HH22 ARG 547 HH22 ARG 547 -9.031 -31.211 30.091 366 H GLY 548 H GLY 548 -6.133 -25.541 24.112 367 HA2 GLY 548 HA2 GLY 548 -5.834 -26.542 21.397 368 HA3 GLY 548 HA3 GLY 548 -4.665 -25.569 22.272 369 H GLY 549 H GLY 549 -2.994 -26.912 21.629 370 HA2 GLY 549 HA2 GLY 549 -1.512 -28.640 21.776 371 HA3 GLY 549 HA3 GLY 549 -2.185 -28.901 23.374 372 H GLY 550 H GLY 550 -4.065 -29.250 20.425 373 HA2 GLY 550 HA2 GLY 550 -4.885 -31.115 19.362 374 HA3 GLY 550 HA3 GLY 550 -3.670 -32.070 20.198 375 H GLU 551 H GLU 551 -6.142 -30.036 21.649 376 HA GLU 551 HA GLU 551 -7.236 -32.483 22.817 377 HB2 GLU 551 HB2 GLU 551 -6.110 -31.043 24.415 378 HB3 GLU 551 HB3 GLU 551 -7.174 -29.713 23.983 379 HG2 GLU 551 HG2 GLU 551 -8.985 -30.671 25.059 380 HG3 GLU 551 HG3 GLU 551 -8.254 -32.278 25.033 381 H ASP 552 H ASP 552 -8.316 -29.187 21.955 382 HA ASP 552 HA ASP 552 -10.742 -30.479 20.885 383 HB2 ASP 552 HB2 ASP 552 -10.249 -27.555 21.542 384 HB3 ASP 552 HB3 ASP 552 -11.695 -28.156 20.750 385 H PHE 553 H PHE 553 -8.046 -28.411 20.267 386 HA PHE 553 HA PHE 553 -8.293 -29.009 17.444 387 HB2 PHE 553 HB2 PHE 553 -7.774 -26.728 16.777 388 HB3 PHE 553 HB3 PHE 553 -9.220 -26.716 17.766 389 HD1 PHE 553 HD2 PHE 553 -9.177 -25.726 20.017 390 HD2 PHE 553 HD1 PHE 553 -5.742 -25.653 17.510 391 HE1 PHE 553 HE2 PHE 553 -8.176 -23.981 21.435 392 HE2 PHE 553 HE1 PHE 553 -4.739 -23.915 18.926 393 HZ PHE 553 HZ PHE 553 -5.955 -23.072 20.887 394 H GLU 554 H GLU 554 -6.300 -29.154 16.432 395 HA GLU 554 HA GLU 554 -4.093 -29.619 18.195 396 HB2 GLU 554 HB2 GLU 554 -4.865 -30.588 15.769 397 HB3 GLU 554 HB3 GLU 554 -3.636 -29.431 15.286 398 HG2 GLU 554 HG2 GLU 554 -3.292 -31.760 17.166 399 HG3 GLU 554 HG3 GLU 554 -2.686 -31.622 15.518 400 H ASP 555 H ASP 555 -2.345 -28.310 18.430 401 HA ASP 555 HA ASP 555 -2.869 -25.494 17.785 402 HB2 ASP 555 HB2 ASP 555 -2.404 -26.120 20.136 403 HB3 ASP 555 HB3 ASP 555 -0.810 -26.691 19.661 404 H THR 556 H THR 556 -1.819 -24.532 16.178 405 HA THR 556 HA THR 556 0.648 -25.773 15.245 406 HB THR 556 HB THR 556 -1.183 -26.551 13.777 407 HG1 THR 556 HG1 THR 556 -0.336 -25.356 11.763 408 HG21 THR 556 HG21 THR 556 -2.774 -24.733 14.003 409 HG22 THR 556 HG22 THR 556 -2.352 -24.937 12.299 410 HG23 THR 556 HG23 THR 556 -1.648 -23.620 13.228 411 H CYS 557 H CYS 557 2.056 -24.386 14.109 412 HA CYS 557 HA CYS 557 1.454 -21.594 13.860 413 HB2 CYS 557 HB2 CYS 557 3.546 -20.929 15.015 414 HB3 CYS 557 HB3 CYS 557 2.418 -21.688 16.127 415 HG CYS 557 HG CYS 557 3.907 -23.650 16.859 416 H GLY 558 H GLY 558 3.109 -20.592 12.439 417 HA2 GLY 558 HA2 GLY 558 5.215 -21.883 11.309 418 HA3 GLY 558 HA3 GLY 558 3.802 -22.396 10.383 419 H GLU 559 H GLU 559 5.024 -21.225 8.685 420 HA GLU 559 HA GLU 559 4.242 -18.416 8.733 421 HB2 GLU 559 HB2 GLU 559 6.837 -19.616 7.808 422 HB3 GLU 559 HB3 GLU 559 6.346 -17.945 7.539 423 HG2 GLU 559 HG2 GLU 559 6.419 -17.482 9.877 424 HG3 GLU 559 HG3 GLU 559 6.670 -19.185 10.255 425 H LEU 560 H LEU 560 3.357 -17.734 6.873 426 HA LEU 560 HA LEU 560 2.962 -19.703 4.754 427 HB2 LEU 560 HB2 LEU 560 1.668 -17.044 5.282 428 HB3 LEU 560 HB3 LEU 560 1.342 -18.032 3.876 429 HG LEU 560 HG LEU 560 0.749 -18.744 6.735 430 HD11 LEU 560 HD11 LEU 560 -0.742 -17.072 5.870 431 HD12 LEU 560 HD12 LEU 560 -1.577 -18.625 5.984 432 HD13 LEU 560 HD13 LEU 560 -1.026 -18.034 4.422 433 HD21 LEU 560 HD21 LEU 560 0.411 -20.308 4.181 434 HD22 LEU 560 HD22 LEU 560 -0.451 -20.685 5.668 435 HD23 LEU 560 HD23 LEU 560 1.310 -20.760 5.624 436 H GLU 561 H GLU 561 3.792 -19.491 2.818 437 HA GLU 561 HA GLU 561 5.652 -17.291 2.452 438 HB2 GLU 561 HB2 GLU 561 6.477 -19.621 2.359 439 HB3 GLU 561 HB3 GLU 561 5.433 -19.906 0.975 440 HG2 GLU 561 HG2 GLU 561 6.720 -17.893 -0.065 441 HG3 GLU 561 HG3 GLU 561 7.852 -18.209 1.210 442 H PHE 562 H PHE 562 4.683 -15.655 1.438 443 HA PHE 562 HA PHE 562 2.969 -16.262 -0.857 444 HB2 PHE 562 HB2 PHE 562 3.180 -13.829 0.902 445 HB3 PHE 562 HB3 PHE 562 2.411 -13.771 -0.675 446 HD1 PHE 562 HD2 PHE 562 2.153 -15.011 2.756 447 HD2 PHE 562 HD1 PHE 562 0.307 -14.832 -1.067 448 HE1 PHE 562 HE2 PHE 562 0.019 -15.723 3.751 449 HE2 PHE 562 HE1 PHE 562 -1.825 -15.536 -0.081 450 HZ PHE 562 HZ PHE 562 -1.973 -15.983 2.316 451 H GLN 563 H GLN 563 3.385 -15.170 -2.813 452 HA GLN 563 HA GLN 563 5.897 -13.746 -2.978 453 HB2 GLN 563 HB2 GLN 563 5.346 -16.080 -4.825 454 HB3 GLN 563 HB3 GLN 563 6.786 -15.087 -4.720 455 HG2 GLN 563 HG2 GLN 563 7.111 -16.035 -2.412 456 HG3 GLN 563 HG3 GLN 563 5.850 -17.198 -2.817 457 HE21 GLN 563 HE21 GLN 563 8.299 -15.943 -5.035 458 HE22 GLN 563 HE22 GLN 563 9.097 -17.455 -5.182 459 H ASN 564 H ASN 564 6.122 -13.234 -5.443 460 HA ASN 564 HA ASN 564 3.810 -11.846 -6.306 461 HB2 ASN 564 HB2 ASN 564 6.117 -11.177 -6.928 462 HB3 ASN 564 HB3 ASN 564 6.280 -12.645 -7.875 463 HD21 ASN 564 HD21 ASN 564 6.664 -11.534 -9.742 464 HD22 ASN 564 HD22 ASN 564 5.474 -10.652 -10.602 465 H ASP 565 H ASP 565 5.232 -14.930 -6.925 466 HA ASP 565 HA ASP 565 3.380 -15.708 -9.007 467 HB2 ASP 565 HB2 ASP 565 5.633 -16.698 -8.921 468 HB3 ASP 565 HB3 ASP 565 5.218 -17.485 -7.399 469 H GLU 566 H GLU 566 3.839 -16.746 -5.610 470 HA GLU 566 HA GLU 566 1.754 -18.526 -5.414 471 HB2 GLU 566 HB2 GLU 566 3.133 -16.797 -3.404 472 HB3 GLU 566 HB3 GLU 566 1.808 -17.878 -2.986 473 HG2 GLU 566 HG2 GLU 566 4.343 -18.772 -4.336 474 HG3 GLU 566 HG3 GLU 566 4.087 -18.812 -2.590 475 H ILE 567 H ILE 567 -0.270 -18.382 -5.295 476 HA ILE 567 HA ILE 567 -1.499 -15.784 -5.587 477 HB ILE 567 HB ILE 567 -3.644 -17.172 -5.925 478 HG12 ILE 567 HG12 ILE 567 -1.793 -19.398 -6.679 479 HG13 ILE 567 HG13 ILE 567 -2.322 -19.314 -5.014 480 HG21 ILE 567 HG21 ILE 567 -2.495 -16.021 -7.714 481 HG22 ILE 567 HG22 ILE 567 -3.059 -17.598 -8.273 482 HG23 ILE 567 HG23 ILE 567 -1.357 -17.359 -7.876 483 HD11 ILE 567 HD11 ILE 567 -4.596 -19.380 -5.731 484 HD12 ILE 567 HD12 ILE 567 -3.698 -20.797 -6.278 485 HD13 ILE 567 HD13 ILE 567 -4.102 -19.500 -7.427 486 H VAL 568 H VAL 568 -2.339 -18.629 -3.583 487 HA VAL 568 HA VAL 568 -2.887 -16.812 -1.403 488 HB VAL 568 HB VAL 568 -5.011 -17.142 -2.689 489 HG11 VAL 568 HG11 VAL 568 -4.832 -19.990 -1.771 490 HG12 VAL 568 HG12 VAL 568 -4.715 -19.423 -3.441 491 HG13 VAL 568 HG13 VAL 568 -6.230 -19.248 -2.548 492 HG21 VAL 568 HG21 VAL 568 -5.042 -18.232 0.116 493 HG22 VAL 568 HG22 VAL 568 -6.438 -17.622 -0.781 494 HG23 VAL 568 HG23 VAL 568 -5.119 -16.534 -0.356 495 H LYS 569 H LYS 569 -2.806 -17.855 0.613 496 HA LYS 569 HA LYS 569 -1.689 -20.567 0.566 497 HB2 LYS 569 HB2 LYS 569 -1.083 -18.242 2.363 498 HB3 LYS 569 HB3 LYS 569 -0.615 -19.905 2.699 499 HG2 LYS 569 HG2 LYS 569 0.129 -18.945 0.088 500 HG3 LYS 569 HG3 LYS 569 0.915 -18.051 1.399 501 HD2 LYS 569 HD2 LYS 569 2.398 -19.854 0.846 502 HD3 LYS 569 HD3 LYS 569 1.561 -20.364 2.292 503 HE2 LYS 569 HE2 LYS 569 0.022 -21.713 0.951 504 HE3 LYS 569 HE3 LYS 569 0.842 -21.192 -0.515 505 HZ1 LYS 569 HZ1 LYS 569 2.848 -22.272 0.223 506 HZ2 LYS 569 HZ2 LYS 569 1.600 -23.374 0.198 507 HZ3 LYS 569 HZ3 LYS 569 2.140 -22.750 1.674 508 H THR 570 H THR 570 -2.019 -21.674 2.648 509 HA THR 570 HA THR 570 -4.598 -21.008 3.861 510 HB THR 570 HB THR 570 -4.914 -23.598 3.813 511 HG1 THR 570 HG1 THR 570 -3.980 -24.632 2.185 512 HG21 THR 570 HG21 THR 570 -5.369 -21.893 1.335 513 HG22 THR 570 HG22 THR 570 -6.438 -22.041 2.735 514 HG23 THR 570 HG23 THR 570 -6.145 -23.438 1.710 515 H ILE 571 H ILE 571 -4.847 -21.634 5.970 516 HA ILE 571 HA ILE 571 -2.506 -22.812 7.287 517 HB ILE 571 HB ILE 571 -4.932 -21.431 8.512 518 HG12 ILE 571 HG12 ILE 571 -3.133 -19.918 9.519 519 HG13 ILE 571 HG13 ILE 571 -2.037 -20.666 8.365 520 HG21 ILE 571 HG21 ILE 571 -3.916 -21.760 10.708 521 HG22 ILE 571 HG22 ILE 571 -2.599 -22.659 9.957 522 HG23 ILE 571 HG23 ILE 571 -4.239 -23.299 9.902 523 HD11 ILE 571 HD11 ILE 571 -3.362 -19.816 6.544 524 HD12 ILE 571 HD12 ILE 571 -2.829 -18.520 7.622 525 HD13 ILE 571 HD13 ILE 571 -4.498 -19.092 7.688 526 H SER 572 H SER 572 -2.567 -24.894 7.583 527 HA SER 572 HA SER 572 -5.080 -26.331 7.441 528 HB2 SER 572 HB2 SER 572 -3.333 -28.251 7.347 529 HB3 SER 572 HB3 SER 572 -3.510 -27.192 5.946 530 HG SER 572 HG SER 572 -1.318 -27.682 7.172 531 H VAL 573 H VAL 573 -6.042 -26.809 9.282 532 HA VAL 573 HA VAL 573 -4.376 -27.365 11.662 533 HB VAL 573 HB VAL 573 -7.070 -25.967 11.645 534 HG11 VAL 573 HG11 VAL 573 -6.909 -27.393 13.596 535 HG12 VAL 573 HG12 VAL 573 -6.800 -25.692 14.053 536 HG13 VAL 573 HG13 VAL 573 -5.342 -26.681 14.016 537 HG21 VAL 573 HG21 VAL 573 -5.826 -24.065 12.611 538 HG22 VAL 573 HG22 VAL 573 -5.316 -24.492 10.978 539 HG23 VAL 573 HG23 VAL 573 -4.331 -24.971 12.365 540 H LYS 574 H LYS 574 -4.695 -29.229 12.608 541 HA LYS 574 HA LYS 574 -6.747 -31.029 11.730 542 HB2 LYS 574 HB2 LYS 574 -4.589 -31.984 12.220 543 HB3 LYS 574 HB3 LYS 574 -4.557 -31.255 13.813 544 HG2 LYS 574 HG2 LYS 574 -4.992 -33.660 13.935 545 HG3 LYS 574 HG3 LYS 574 -6.365 -32.733 14.537 546 HD2 LYS 574 HD2 LYS 574 -7.487 -33.023 12.372 547 HD3 LYS 574 HD3 LYS 574 -6.116 -33.971 11.800 548 HE2 LYS 574 HE2 LYS 574 -6.547 -35.641 13.533 549 HE3 LYS 574 HE3 LYS 574 -7.881 -34.665 14.149 550 HZ1 LYS 574 HZ1 LYS 574 -7.743 -35.875 11.436 551 HZ2 LYS 574 HZ2 LYS 574 -9.034 -34.970 12.050 552 HZ3 LYS 574 HZ3 LYS 574 -8.661 -36.456 12.719 553 H VAL 575 H VAL 575 -8.664 -31.176 12.537 554 HA VAL 575 HA VAL 575 -9.329 -29.746 14.976 555 HB VAL 575 HB VAL 575 -11.158 -31.182 13.001 556 HG11 VAL 575 HG11 VAL 575 -11.797 -29.232 15.215 557 HG12 VAL 575 HG12 VAL 575 -12.167 -30.954 15.212 558 HG13 VAL 575 HG13 VAL 575 -12.946 -29.878 14.050 559 HG21 VAL 575 HG21 VAL 575 -10.501 -28.248 13.244 560 HG22 VAL 575 HG22 VAL 575 -11.701 -28.947 12.158 561 HG23 VAL 575 HG23 VAL 575 -9.992 -29.322 11.942 562 H ILE 576 H ILE 576 -9.628 -30.769 16.886 563 HA ILE 576 HA ILE 576 -9.331 -33.671 16.931 564 HB ILE 576 HB ILE 576 -9.240 -31.725 19.257 565 HG12 ILE 576 HG12 ILE 576 -7.537 -31.131 17.601 566 HG13 ILE 576 HG13 ILE 576 -6.827 -31.749 19.080 567 HG21 ILE 576 HG21 ILE 576 -7.992 -33.506 20.395 568 HG22 ILE 576 HG22 ILE 576 -8.162 -34.532 18.971 569 HG23 ILE 576 HG23 ILE 576 -9.592 -34.068 19.897 570 HD11 ILE 576 HD11 ILE 576 -7.181 -33.272 16.510 571 HD12 ILE 576 HD12 ILE 576 -6.434 -33.887 17.985 572 HD13 ILE 576 HD13 ILE 576 -5.674 -32.557 17.096 573 H ASP 577 H ASP 577 -10.719 -34.931 18.221 574 HA ASP 577 HA ASP 577 -13.497 -34.190 18.167 575 HB2 ASP 577 HB2 ASP 577 -12.935 -36.477 17.705 576 HB3 ASP 577 HB3 ASP 577 -12.017 -36.615 19.196 577 H ASP 578 H ASP 578 -14.518 -33.067 19.724 578 HA ASP 578 HA ASP 578 -13.470 -32.718 22.401 579 HB2 ASP 578 HB2 ASP 578 -15.054 -31.029 21.349 580 HB3 ASP 578 HB3 ASP 578 -16.322 -32.239 21.391 581 H GLU 579 H GLU 579 -14.123 -33.824 24.187 582 HA GLU 579 HA GLU 579 -14.643 -36.518 24.023 583 HB2 GLU 579 HB2 GLU 579 -15.324 -34.679 26.296 584 HB3 GLU 579 HB3 GLU 579 -15.105 -36.414 26.410 585 HG2 GLU 579 HG2 GLU 579 -12.777 -36.188 25.766 586 HG3 GLU 579 HG3 GLU 579 -12.986 -34.440 25.610 587 H GLU 580 H GLU 580 -16.909 -33.882 24.645 588 HA GLU 580 HA GLU 580 -19.142 -35.671 23.925 589 HB2 GLU 580 HB2 GLU 580 -19.289 -33.509 26.083 590 HB3 GLU 580 HB3 GLU 580 -20.540 -34.648 25.638 591 HG2 GLU 580 HG2 GLU 580 -17.926 -35.345 26.950 592 HG3 GLU 580 HG3 GLU 580 -19.463 -35.140 27.781 593 H TYR 581 H TYR 581 -18.884 -32.385 24.980 594 HA TYR 581 HA TYR 581 -18.311 -30.850 22.961 595 HB2 TYR 581 HB2 TYR 581 -20.492 -31.791 21.821 596 HB3 TYR 581 HB3 TYR 581 -21.356 -30.837 23.029 597 HD1 TYR 581 HD1 TYR 581 -18.694 -30.504 20.453 598 HD2 TYR 581 HD2 TYR 581 -21.877 -28.583 22.526 599 HE1 TYR 581 HE1 TYR 581 -18.410 -28.530 19.026 600 HE2 TYR 581 HE2 TYR 581 -21.600 -26.590 21.095 601 HH TYR 581 HH TYR 581 -19.612 -26.636 18.273 602 H GLU 582 H GLU 582 -17.431 -30.123 24.766 603 HA GLU 582 HA GLU 582 -18.758 -29.536 27.194 604 HB2 GLU 582 HB2 GLU 582 -16.428 -29.983 27.186 605 HB3 GLU 582 HB3 GLU 582 -16.106 -28.708 26.031 606 HG2 GLU 582 HG2 GLU 582 -15.329 -28.078 28.230 607 HG3 GLU 582 HG3 GLU 582 -16.670 -27.047 27.747 608 H LYS 583 H LYS 583 -17.804 -27.516 24.498 609 HA LYS 583 HA LYS 583 -19.505 -25.339 25.366 610 HB2 LYS 583 HB2 LYS 583 -17.338 -25.063 26.547 611 HB3 LYS 583 HB3 LYS 583 -16.487 -25.252 25.046 612 HG2 LYS 583 HG2 LYS 583 -16.333 -22.984 25.415 613 HG3 LYS 583 HG3 LYS 583 -17.707 -23.087 24.329 614 HD2 LYS 583 HD2 LYS 583 -17.985 -22.924 27.331 615 HD3 LYS 583 HD3 LYS 583 -17.902 -21.499 26.311 616 HE2 LYS 583 HE2 LYS 583 -19.906 -22.355 25.093 617 HE3 LYS 583 HE3 LYS 583 -19.996 -23.658 26.279 618 HZ1 LYS 583 HZ1 LYS 583 -20.111 -20.779 26.961 619 HZ2 LYS 583 HZ2 LYS 583 -20.345 -22.077 28.015 620 HZ3 LYS 583 HZ3 LYS 583 -21.450 -21.778 26.783 621 H ASN 584 H ASN 584 -19.780 -23.950 23.433 622 HA ASN 584 HA ASN 584 -19.304 -25.062 20.889 623 HB2 ASN 584 HB2 ASN 584 -20.888 -23.162 21.256 624 HB3 ASN 584 HB3 ASN 584 -19.534 -22.113 21.657 625 HD21 ASN 584 HD21 ASN 584 -19.729 -24.505 19.000 626 HD22 ASN 584 HD22 ASN 584 -19.634 -23.317 17.756 627 H LYS 585 H LYS 585 -17.328 -25.607 20.305 628 HA LYS 585 HA LYS 585 -15.108 -24.292 21.571 629 HB2 LYS 585 HB2 LYS 585 -15.244 -26.747 19.812 630 HB3 LYS 585 HB3 LYS 585 -13.754 -26.114 20.495 631 HG2 LYS 585 HG2 LYS 585 -16.124 -27.101 22.099 632 HG3 LYS 585 HG3 LYS 585 -14.641 -28.011 21.798 633 HD2 LYS 585 HD2 LYS 585 -13.345 -26.345 22.963 634 HD3 LYS 585 HD3 LYS 585 -14.768 -25.341 23.227 635 HE2 LYS 585 HE2 LYS 585 -14.196 -26.549 25.252 636 HE3 LYS 585 HE3 LYS 585 -15.729 -27.130 24.611 637 HZ1 LYS 585 HZ1 LYS 585 -14.701 -29.102 23.832 638 HZ2 LYS 585 HZ2 LYS 585 -14.111 -28.886 25.397 639 HZ3 LYS 585 HZ3 LYS 585 -13.153 -28.498 24.080 640 H THR 586 H THR 586 -14.043 -22.765 20.752 641 HA THR 586 HA THR 586 -13.636 -22.592 17.948 642 HB THR 586 HB THR 586 -15.754 -21.403 18.171 643 HG1 THR 586 HG1 THR 586 -13.871 -20.490 16.968 644 HG21 THR 586 HG21 THR 586 -14.408 -19.699 20.272 645 HG22 THR 586 HG22 THR 586 -15.703 -20.868 20.548 646 HG23 THR 586 HG23 THR 586 -16.009 -19.422 19.581 647 H PHE 587 H PHE 587 -11.837 -21.320 17.510 648 HA PHE 587 HA PHE 587 -10.397 -20.192 19.763 649 HB2 PHE 587 HB2 PHE 587 -8.303 -21.279 19.078 650 HB3 PHE 587 HB3 PHE 587 -9.505 -22.483 19.496 651 HD1 PHE 587 HD1 PHE 587 -10.619 -23.787 17.649 652 HD2 PHE 587 HD2 PHE 587 -7.319 -21.194 16.942 653 HE1 PHE 587 HE1 PHE 587 -10.178 -24.918 15.493 654 HE2 PHE 587 HE2 PHE 587 -6.891 -22.322 14.800 655 HZ PHE 587 HZ PHE 587 -8.320 -24.182 14.084 656 H PHE 588 H PHE 588 -8.237 -19.159 18.558 657 HA PHE 588 HA PHE 588 -9.408 -17.775 16.279 658 HB2 PHE 588 HB2 PHE 588 -7.799 -16.540 18.539 659 HB3 PHE 588 HB3 PHE 588 -8.204 -15.717 17.041 660 HD1 PHE 588 HD1 PHE 588 -9.583 -17.216 20.115 661 HD2 PHE 588 HD2 PHE 588 -10.313 -14.721 16.746 662 HE1 PHE 588 HE1 PHE 588 -11.698 -16.474 21.129 663 HE2 PHE 588 HE2 PHE 588 -12.418 -13.979 17.741 664 HZ PHE 588 HZ PHE 588 -13.124 -14.857 19.941 665 H LEU 589 H LEU 589 -7.977 -17.067 14.755 666 HA LEU 589 HA LEU 589 -5.301 -18.293 14.881 667 HB2 LEU 589 HB2 LEU 589 -7.289 -18.929 13.107 668 HB3 LEU 589 HB3 LEU 589 -6.526 -17.602 12.272 669 HG LEU 589 HG LEU 589 -5.656 -19.654 11.408 670 HD11 LEU 589 HD11 LEU 589 -3.268 -19.459 11.819 671 HD12 LEU 589 HD12 LEU 589 -3.601 -18.363 13.159 672 HD13 LEU 589 HD13 LEU 589 -4.026 -17.895 11.509 673 HD21 LEU 589 HD21 LEU 589 -6.147 -21.139 13.203 674 HD22 LEU 589 HD22 LEU 589 -4.989 -20.335 14.248 675 HD23 LEU 589 HD23 LEU 589 -4.419 -21.241 12.839 676 H GLU 590 H GLU 590 -3.696 -16.812 14.658 677 HA GLU 590 HA GLU 590 -4.450 -14.212 13.572 678 HB2 GLU 590 HB2 GLU 590 -4.313 -13.929 15.948 679 HB3 GLU 590 HB3 GLU 590 -2.719 -14.686 16.001 680 HG2 GLU 590 HG2 GLU 590 -1.801 -12.820 14.726 681 HG3 GLU 590 HG3 GLU 590 -3.398 -12.088 14.619 682 H ILE 591 H ILE 591 -3.135 -13.368 12.198 683 HA ILE 591 HA ILE 591 -0.664 -14.780 11.628 684 HB ILE 591 HB ILE 591 -0.765 -13.653 9.399 685 HG12 ILE 591 HG12 ILE 591 -3.545 -12.821 10.295 686 HG13 ILE 591 HG13 ILE 591 -2.187 -11.738 10.014 687 HG21 ILE 591 HG21 ILE 591 -1.536 -15.935 9.659 688 HG22 ILE 591 HG22 ILE 591 -2.531 -15.099 8.464 689 HG23 ILE 591 HG23 ILE 591 -3.138 -15.366 10.100 690 HD11 ILE 591 HD11 ILE 591 -3.577 -13.428 7.955 691 HD12 ILE 591 HD12 ILE 591 -2.211 -12.351 7.642 692 HD13 ILE 591 HD13 ILE 591 -3.759 -11.687 8.175 693 H GLY 592 H GLY 592 1.175 -13.605 11.466 694 HA2 GLY 592 HA2 GLY 592 1.121 -11.187 13.078 695 HA3 GLY 592 HA3 GLY 592 2.552 -12.116 12.633 696 H GLU 593 H GLU 593 3.106 -9.735 12.296 697 HA GLU 593 HA GLU 593 2.089 -8.532 9.964 698 HB2 GLU 593 HB2 GLU 593 4.535 -7.914 11.608 699 HB3 GLU 593 HB3 GLU 593 3.964 -6.911 10.275 700 HG2 GLU 593 HG2 GLU 593 1.853 -6.584 11.408 701 HG3 GLU 593 HG3 GLU 593 2.391 -7.589 12.748 702 HA PRO 594 HA PRO 594 4.272 -10.864 6.968 703 HB2 PRO 594 HB2 PRO 594 3.990 -9.114 4.899 704 HB3 PRO 594 HB3 PRO 594 2.695 -10.188 5.398 705 HG2 PRO 594 HG2 PRO 594 3.147 -7.314 5.996 706 HG3 PRO 594 HG3 PRO 594 1.612 -8.120 5.688 707 HD2 PRO 594 HD2 PRO 594 2.436 -7.417 8.148 708 HD3 PRO 594 HD3 PRO 594 1.435 -8.852 7.899 709 H ARG 595 H ARG 595 6.356 -11.002 6.548 710 HA ARG 595 HA ARG 595 7.897 -8.522 6.600 711 HB2 ARG 595 HB2 ARG 595 9.826 -9.830 7.368 712 HB3 ARG 595 HB3 ARG 595 8.477 -9.957 8.483 713 HG2 ARG 595 HG2 ARG 595 7.946 -12.170 7.565 714 HG3 ARG 595 HG3 ARG 595 9.315 -12.031 6.463 715 HD2 ARG 595 HD2 ARG 595 9.436 -12.039 9.470 716 HD3 ARG 595 HD3 ARG 595 9.903 -13.369 8.410 717 HE ARG 595 HE ARG 595 11.262 -10.757 8.300 718 HH11 ARG 595 HH11 ARG 595 11.457 -14.267 8.730 719 HH12 ARG 595 HH12 ARG 595 13.154 -14.285 8.768 720 HH21 ARG 595 HH21 ARG 595 13.555 -10.807 8.387 721 HH22 ARG 595 HH22 ARG 595 14.381 -12.289 8.572 722 H LEU 596 H LEU 596 9.124 -8.023 4.924 723 HA LEU 596 HA LEU 596 8.875 -9.448 2.498 724 HB2 LEU 596 HB2 LEU 596 9.226 -6.897 2.991 725 HB3 LEU 596 HB3 LEU 596 10.910 -7.326 3.121 726 HG LEU 596 HG LEU 596 10.202 -6.333 0.910 727 HD11 LEU 596 HD11 LEU 596 12.280 -7.610 1.074 728 HD12 LEU 596 HD12 LEU 596 11.486 -7.871 -0.478 729 HD13 LEU 596 HD13 LEU 596 11.389 -9.102 0.783 730 HD21 LEU 596 HD21 LEU 596 8.938 -7.645 -0.628 731 HD22 LEU 596 HD22 LEU 596 8.044 -7.598 0.923 732 HD23 LEU 596 HD23 LEU 596 8.961 -9.017 0.478 733 H VAL 597 H VAL 597 10.245 -10.970 1.722 734 HA VAL 597 HA VAL 597 12.366 -11.851 3.461 735 HB VAL 597 HB VAL 597 11.506 -12.971 0.779 736 HG11 VAL 597 HG11 VAL 597 13.208 -14.179 2.957 737 HG12 VAL 597 HG12 VAL 597 13.789 -13.600 1.397 738 HG13 VAL 597 HG13 VAL 597 12.701 -14.990 1.475 739 HG21 VAL 597 HG21 VAL 597 10.350 -14.673 2.086 740 HG22 VAL 597 HG22 VAL 597 9.711 -13.057 2.396 741 HG23 VAL 597 HG23 VAL 597 10.787 -13.823 3.568 742 H GLU 598 H GLU 598 13.833 -10.328 3.406 743 HA GLU 598 HA GLU 598 14.881 -9.250 0.949 744 HB2 GLU 598 HB2 GLU 598 14.626 -7.912 3.049 745 HB3 GLU 598 HB3 GLU 598 15.828 -8.943 3.801 746 HG2 GLU 598 HG2 GLU 598 16.755 -6.796 3.106 747 HG3 GLU 598 HG3 GLU 598 17.518 -8.145 2.266 748 H MET 599 H MET 599 16.680 -9.971 -0.068 749 HA MET 599 HA MET 599 17.787 -12.491 0.703 750 HB2 MET 599 HB2 MET 599 18.668 -10.528 -1.426 751 HB3 MET 599 HB3 MET 599 19.366 -12.124 -1.209 752 HG2 MET 599 HG2 MET 599 16.494 -11.536 -1.897 753 HG3 MET 599 HG3 MET 599 17.736 -12.092 -3.016 754 HE1 MET 599 HE1 MET 599 19.342 -14.205 -1.272 755 HE2 MET 599 HE2 MET 599 18.833 -14.495 -2.937 756 HE3 MET 599 HE3 MET 599 18.494 -15.691 -1.695 757 H SER 600 H SER 600 18.608 -9.203 1.112 758 HA SER 600 HA SER 600 19.988 -8.121 2.470 759 HB2 SER 600 HB2 SER 600 19.392 -9.694 4.245 760 HB3 SER 600 HB3 SER 600 20.577 -10.857 3.655 761 HG SER 600 HG SER 600 22.075 -9.076 3.935 762 H GLU 601 H GLU 601 20.808 -9.389 -0.119 763 HA GLU 601 HA GLU 601 23.624 -9.772 0.106 764 HB2 GLU 601 HB2 GLU 601 21.969 -9.078 -2.327 765 HB3 GLU 601 HB3 GLU 601 23.647 -9.596 -2.359 766 HG2 GLU 601 HG2 GLU 601 21.287 -11.218 -1.449 767 HG3 GLU 601 HG3 GLU 601 22.239 -11.455 -2.916 768 H LYS 602 H LYS 602 21.473 -7.196 -0.151 769 HA LYS 602 HA LYS 602 23.722 -5.408 0.249 770 HB2 LYS 602 HB2 LYS 602 22.499 -4.720 -1.763 771 HB3 LYS 602 HB3 LYS 602 20.975 -4.786 -0.894 772 HG2 LYS 602 HG2 LYS 602 21.754 -2.486 -1.218 773 HG3 LYS 602 HG3 LYS 602 21.647 -2.907 0.490 774 HD2 LYS 602 HD2 LYS 602 24.087 -3.323 0.508 775 HD3 LYS 602 HD3 LYS 602 24.164 -2.825 -1.183 776 HE2 LYS 602 HE2 LYS 602 23.224 -1.111 1.117 777 HE3 LYS 602 HE3 LYS 602 24.814 -1.022 0.363 778 HZ1 LYS 602 HZ1 LYS 602 23.759 -0.397 -1.703 779 HZ2 LYS 602 HZ2 LYS 602 23.360 0.679 -0.494 780 HZ3 LYS 602 HZ3 LYS 602 22.224 -0.464 -1.010 781 H LYS 603 H LYS 603 23.792 -5.929 2.414 782 HA LYS 603 HA LYS 603 21.403 -5.641 4.024 783 HB2 LYS 603 HB2 LYS 603 22.960 -7.412 4.691 784 HB3 LYS 603 HB3 LYS 603 24.281 -6.253 4.796 785 HG2 LYS 603 HG2 LYS 603 23.038 -5.095 6.629 786 HG3 LYS 603 HG3 LYS 603 21.850 -6.388 6.579 787 HD2 LYS 603 HD2 LYS 603 24.739 -7.067 6.975 788 HD3 LYS 603 HD3 LYS 603 23.830 -6.406 8.323 789 HE2 LYS 603 HE2 LYS 603 23.847 -8.821 8.462 790 HE3 LYS 603 HE3 LYS 603 22.215 -8.280 8.102 791 HZ1 LYS 603 HZ1 LYS 603 22.499 -9.037 5.838 792 HZ2 LYS 603 HZ2 LYS 603 22.975 -10.253 6.903 793 HZ3 LYS 603 HZ3 LYS 603 24.141 -9.364 6.116 794 H GLY 604 H GLY 604 20.788 -3.727 4.756 795 HA2 GLY 604 HA2 GLY 604 22.573 -1.467 4.595 796 HA3 GLY 604 HA3 GLY 604 20.915 -1.430 5.198 797 H GLY 605 H GLY 605 20.831 -3.150 7.158 798 HA2 GLY 605 HA2 GLY 605 22.622 -3.840 8.881 799 HA3 GLY 605 HA3 GLY 605 22.670 -2.091 9.112 800 H PHE 606 H PHE 606 21.970 -3.162 11.265 801 HA PHE 606 HA PHE 606 19.065 -3.062 11.252 802 HB2 PHE 606 HB2 PHE 606 19.112 -4.452 13.335 803 HB3 PHE 606 HB3 PHE 606 19.722 -5.301 11.927 804 HD1 PHE 606 HD2 PHE 606 22.098 -5.861 11.750 805 HD2 PHE 606 HD1 PHE 606 20.537 -3.907 15.193 806 HE1 PHE 606 HE2 PHE 606 24.136 -6.436 12.998 807 HE2 PHE 606 HE1 PHE 606 22.563 -4.482 16.442 808 HZ PHE 606 HZ PHE 606 24.371 -5.750 15.346 809 H THR 607 H THR 607 18.162 -2.123 13.262 810 HA THR 607 HA THR 607 19.728 0.238 13.851 811 HB THR 607 HB THR 607 16.856 -0.477 14.524 812 HG1 THR 607 HG1 THR 607 17.758 -0.274 12.204 813 HG21 THR 607 HG21 THR 607 17.797 1.391 15.841 814 HG22 THR 607 HG22 THR 607 16.569 1.972 14.715 815 HG23 THR 607 HG23 THR 607 18.282 2.194 14.349 816 H ILE 608 H ILE 608 20.296 0.614 16.063 817 HA ILE 608 HA ILE 608 20.202 -1.664 17.736 818 HB ILE 608 HB ILE 608 21.029 -0.141 19.575 819 HG12 ILE 608 HG12 ILE 608 21.051 1.972 17.385 820 HG13 ILE 608 HG13 ILE 608 19.998 1.975 18.793 821 HG21 ILE 608 HG21 ILE 608 22.566 -0.094 16.985 822 HG22 ILE 608 HG22 ILE 608 22.582 -1.370 18.201 823 HG23 ILE 608 HG23 ILE 608 23.252 0.218 18.580 824 HD11 ILE 608 HD11 ILE 608 21.955 2.211 20.245 825 HD12 ILE 608 HD12 ILE 608 21.858 3.522 19.071 826 HD13 ILE 608 HD13 ILE 608 23.003 2.204 18.828 827 H THR 609 H THR 609 18.377 -2.422 18.236 828 HA THR 609 HA THR 609 16.348 -2.774 18.866 829 HB THR 609 HB THR 609 15.270 -1.302 20.680 830 HG1 THR 609 HG1 THR 609 17.116 0.371 19.992 831 HG21 THR 609 HG21 THR 609 16.776 -2.132 22.420 832 HG22 THR 609 HG22 THR 609 17.992 -2.481 21.193 833 HG23 THR 609 HG23 THR 609 16.459 -3.355 21.190 834 H GLU 610 H GLU 610 15.057 -2.815 17.228 835 HA GLU 610 HA GLU 610 14.034 -0.439 15.944 836 HB2 GLU 610 HB2 GLU 610 13.310 -3.373 15.699 837 HB3 GLU 610 HB3 GLU 610 12.439 -2.134 14.833 838 HG2 GLU 610 HG2 GLU 610 13.932 -3.091 13.297 839 HG3 GLU 610 HG3 GLU 610 14.639 -1.545 13.733 840 H GLU 611 H GLU 611 11.307 -0.952 15.628 841 HA GLU 611 HA GLU 611 10.361 -0.587 18.344 842 HB2 GLU 611 HB2 GLU 611 9.668 1.075 16.638 843 HB3 GLU 611 HB3 GLU 611 8.926 -0.206 15.694 844 HG2 GLU 611 HG2 GLU 611 7.318 1.149 17.003 845 HG3 GLU 611 HG3 GLU 611 7.265 -0.571 17.372 846 H TYR 612 H TYR 612 9.408 -2.152 19.391 847 HA TYR 612 HA TYR 612 8.231 -4.379 17.944 848 HB2 TYR 612 HB2 TYR 612 9.510 -6.010 19.419 849 HB3 TYR 612 HB3 TYR 612 10.426 -5.216 18.149 850 HD1 TYR 612 HD2 TYR 612 9.916 -5.482 21.781 851 HD2 TYR 612 HD1 TYR 612 12.216 -3.683 18.699 852 HE1 TYR 612 HE2 TYR 612 11.590 -4.758 23.442 853 HE2 TYR 612 HE1 TYR 612 13.885 -2.970 20.351 854 HH TYR 612 HH TYR 612 13.886 -2.468 22.814 855 H ASP 613 H ASP 613 7.296 -2.193 19.748 856 HA ASP 613 HA ASP 613 6.228 -3.801 21.980 857 HB2 ASP 613 HB2 ASP 613 7.145 -1.675 22.707 858 HB3 ASP 613 HB3 ASP 613 6.164 -0.818 21.528 859 H ASP 614 H ASP 614 5.180 -1.855 19.276 860 HA ASP 614 HA ASP 614 2.414 -2.193 20.019 861 HB2 ASP 614 HB2 ASP 614 3.169 -0.015 19.193 862 HB3 ASP 614 HB3 ASP 614 3.663 -0.753 17.675 863 H LYS 615 H LYS 615 0.872 -3.263 18.822 864 HA LYS 615 HA LYS 615 1.784 -4.964 16.615 865 HB2 LYS 615 HB2 LYS 615 0.389 -6.834 17.575 866 HB3 LYS 615 HB3 LYS 615 1.835 -6.459 18.491 867 HG2 LYS 615 HG2 LYS 615 0.443 -5.183 20.090 868 HG3 LYS 615 HG3 LYS 615 -0.992 -5.673 19.180 869 HD2 LYS 615 HD2 LYS 615 -0.535 -8.001 19.637 870 HD3 LYS 615 HD3 LYS 615 0.985 -7.585 20.422 871 HE2 LYS 615 HE2 LYS 615 -0.682 -8.072 22.094 872 HE3 LYS 615 HE3 LYS 615 -0.282 -6.358 22.144 873 HZ1 LYS 615 HZ1 LYS 615 -2.329 -5.885 20.934 874 HZ2 LYS 615 HZ2 LYS 615 -2.682 -6.781 22.321 875 HZ3 LYS 615 HZ3 LYS 615 -2.679 -7.524 20.832 876 H GLN 616 H GLN 616 0.352 -2.488 16.655 877 HA GLN 616 HA GLN 616 -2.256 -3.309 15.585 878 HB2 GLN 616 HB2 GLN 616 -1.472 -0.892 17.244 879 HB3 GLN 616 HB3 GLN 616 -3.008 -1.019 16.406 880 HG2 GLN 616 HG2 GLN 616 -2.046 -2.907 18.540 881 HG3 GLN 616 HG3 GLN 616 -3.129 -1.544 18.816 882 HE21 GLN 616 HE21 GLN 616 -2.800 -4.706 17.391 883 HE22 GLN 616 HE22 GLN 616 -4.475 -4.974 17.162 884 HA PRO 617 HA PRO 617 -1.009 -0.616 12.083 885 HB2 PRO 617 HB2 PRO 617 -3.363 1.151 12.575 886 HB3 PRO 617 HB3 PRO 617 -2.919 0.296 11.094 887 HG2 PRO 617 HG2 PRO 617 -4.963 -0.552 12.542 888 HG3 PRO 617 HG3 PRO 617 -3.824 -1.720 11.839 889 HD2 PRO 617 HD2 PRO 617 -3.981 -0.672 14.637 890 HD3 PRO 617 HD3 PRO 617 -3.763 -2.348 14.085 891 H LEU 618 H LEU 618 0.659 0.782 12.439 892 HA LEU 618 HA LEU 618 0.491 2.567 14.749 893 HB2 LEU 618 HB2 LEU 618 2.354 0.984 14.669 894 HB3 LEU 618 HB3 LEU 618 2.857 1.637 13.127 895 HG LEU 618 HG LEU 618 3.345 3.806 14.245 896 HD11 LEU 618 HD11 LEU 618 1.839 3.629 16.129 897 HD12 LEU 618 HD12 LEU 618 3.495 3.875 16.681 898 HD13 LEU 618 HD13 LEU 618 2.765 2.272 16.770 899 HD21 LEU 618 HD21 LEU 618 5.384 3.043 15.378 900 HD22 LEU 618 HD22 LEU 618 5.126 2.203 13.850 901 HD23 LEU 618 HD23 LEU 618 4.762 1.392 15.372 902 H THR 619 H THR 619 0.113 4.682 14.422 903 HA THR 619 HA THR 619 0.489 5.800 11.785 904 HB THR 619 HB THR 619 -0.465 7.882 12.915 905 HG1 THR 619 HG1 THR 619 0.055 7.177 15.070 906 HG21 THR 619 HG21 THR 619 -2.117 5.368 12.985 907 HG22 THR 619 HG22 THR 619 -1.864 6.397 11.570 908 HG23 THR 619 HG23 THR 619 -2.754 7.008 12.966 909 H SER 620 H SER 620 2.627 6.214 11.396 910 HA SER 620 HA SER 620 3.860 8.205 13.051 911 HB2 SER 620 HB2 SER 620 5.162 5.502 12.679 912 HB3 SER 620 HB3 SER 620 5.982 6.929 13.307 913 HG SER 620 HG SER 620 3.678 6.532 14.608 914 H LYS 621 H LYS 621 3.525 9.403 11.106 915 HA LYS 621 HA LYS 621 5.340 8.680 8.975 916 HB2 LYS 621 HB2 LYS 621 3.310 10.912 9.176 917 HB3 LYS 621 HB3 LYS 621 4.404 10.732 7.818 918 HG2 LYS 621 HG2 LYS 621 3.448 8.519 7.356 919 HG3 LYS 621 HG3 LYS 621 2.335 8.743 8.707 920 HD2 LYS 621 HD2 LYS 621 1.335 10.654 7.606 921 HD3 LYS 621 HD3 LYS 621 2.500 10.531 6.285 922 HE2 LYS 621 HE2 LYS 621 0.366 9.549 5.636 923 HE3 LYS 621 HE3 LYS 621 1.627 8.327 5.713 924 HZ1 LYS 621 HZ1 LYS 621 -0.415 7.530 6.724 925 HZ2 LYS 621 HZ2 LYS 621 -0.444 8.797 7.807 926 HZ3 LYS 621 HZ3 LYS 621 0.777 7.646 7.889 927 H GLU 622 H GLU 622 7.024 8.840 10.476 928 HA GLU 622 HA GLU 622 7.902 11.529 11.238 929 HB2 GLU 622 HB2 GLU 622 9.128 8.845 11.903 930 HB3 GLU 622 HB3 GLU 622 9.476 10.387 12.668 931 HG2 GLU 622 HG2 GLU 622 7.256 10.438 13.638 932 HG3 GLU 622 HG3 GLU 622 6.841 8.936 12.811 933 H GLU 623 H GLU 623 9.980 12.239 10.502 934 HA GLU 623 HA GLU 623 10.740 10.956 8.039 935 HB2 GLU 623 HB2 GLU 623 11.751 13.517 9.291 936 HB3 GLU 623 HB3 GLU 623 12.214 12.922 7.699 937 HG2 GLU 623 HG2 GLU 623 9.886 13.072 6.956 938 HG3 GLU 623 HG3 GLU 623 9.415 13.644 8.549 939 H GLU 624 H GLU 624 11.365 9.070 9.088 940 HA GLU 624 HA GLU 624 14.164 9.029 9.906 941 HB2 GLU 624 HB2 GLU 624 12.266 8.993 11.836 942 HB3 GLU 624 HB3 GLU 624 12.182 7.307 11.369 943 HG2 GLU 624 HG2 GLU 624 14.640 8.737 12.391 944 HG3 GLU 624 HG3 GLU 624 13.611 7.661 13.324 945 H GLU 625 H GLU 625 14.956 6.765 9.602 946 HA GLU 625 HA GLU 625 14.088 5.811 7.083 947 HB2 GLU 625 HB2 GLU 625 16.078 4.583 8.989 948 HB3 GLU 625 HB3 GLU 625 15.877 4.164 7.292 949 HG2 GLU 625 HG2 GLU 625 16.506 6.435 6.652 950 HG3 GLU 625 HG3 GLU 625 16.708 6.856 8.347 951 H ARG 626 H ARG 626 13.218 4.920 10.296 952 HA ARG 626 HA ARG 626 12.308 2.305 9.901 953 HB2 ARG 626 HB2 ARG 626 11.046 4.457 11.595 954 HB3 ARG 626 HB3 ARG 626 10.599 2.761 11.674 955 HG2 ARG 626 HG2 ARG 626 12.903 2.248 12.384 956 HG3 ARG 626 HG3 ARG 626 13.251 3.981 12.387 957 HD2 ARG 626 HD2 ARG 626 11.211 2.545 14.082 958 HD3 ARG 626 HD3 ARG 626 12.752 3.204 14.621 959 HE ARG 626 HE ARG 626 10.735 4.999 13.475 960 HH11 ARG 626 HH11 ARG 626 12.677 3.968 16.265 961 HH12 ARG 626 HH12 ARG 626 12.198 5.256 17.254 962 HH21 ARG 626 HH21 ARG 626 10.029 6.811 14.888 963 HH22 ARG 626 HH22 ARG 626 10.680 6.919 16.434 964 H ARG 627 H ARG 627 10.461 5.336 9.535 965 HA ARG 627 HA ARG 627 8.080 4.270 8.548 966 HB2 ARG 627 HB2 ARG 627 8.625 6.673 9.313 967 HB3 ARG 627 HB3 ARG 627 9.295 6.921 7.721 968 HG2 ARG 627 HG2 ARG 627 6.390 6.314 8.354 969 HG3 ARG 627 HG3 ARG 627 7.058 7.886 7.945 970 HD2 ARG 627 HD2 ARG 627 7.730 6.881 5.725 971 HD3 ARG 627 HD3 ARG 627 6.793 5.462 6.170 972 HE ARG 627 HE ARG 627 5.758 8.160 5.704 973 HH11 ARG 627 HH11 ARG 627 4.980 4.731 6.176 974 HH12 ARG 627 HH12 ARG 627 3.544 4.779 5.281 975 HH21 ARG 627 HH21 ARG 627 3.751 8.217 4.455 976 HH22 ARG 627 HH22 ARG 627 2.805 6.818 4.293 977 H ILE 628 H ILE 628 11.045 5.263 6.919 978 HA ILE 628 HA ILE 628 10.199 5.065 4.282 979 HB ILE 628 HB ILE 628 12.985 4.592 5.396 980 HG12 ILE 628 HG12 ILE 628 11.692 7.062 4.202 981 HG13 ILE 628 HG13 ILE 628 12.054 6.811 5.903 982 HG21 ILE 628 HG21 ILE 628 13.820 5.060 3.136 983 HG22 ILE 628 HG22 ILE 628 12.168 5.157 2.535 984 HG23 ILE 628 HG23 ILE 628 12.795 3.624 3.146 985 HD11 ILE 628 HD11 ILE 628 13.675 8.283 4.866 986 HD12 ILE 628 HD12 ILE 628 14.062 7.048 3.669 987 HD13 ILE 628 HD13 ILE 628 14.461 6.784 5.361 988 H ALA 629 H ALA 629 11.545 2.577 6.379 989 HA ALA 629 HA ALA 629 11.430 0.547 4.356 990 HB1 ALA 629 HB1 ALA 629 11.674 0.248 7.349 991 HB2 ALA 629 HB2 ALA 629 13.025 0.410 6.227 992 HB3 ALA 629 HB3 ALA 629 11.982 -1.010 6.153 993 H GLU 630 H GLU 630 9.445 1.443 7.109 994 HA GLU 630 HA GLU 630 7.661 -0.694 6.945 995 HB2 GLU 630 HB2 GLU 630 7.293 2.038 8.150 996 HB3 GLU 630 HB3 GLU 630 6.191 0.689 8.383 997 HG2 GLU 630 HG2 GLU 630 9.096 0.662 9.142 998 HG3 GLU 630 HG3 GLU 630 7.787 1.047 10.260 999 H MET 631 H MET 631 7.850 2.139 5.037 1000 HA MET 631 HA MET 631 5.063 1.945 4.178 1001 HB2 MET 631 HB2 MET 631 5.432 3.903 2.828 1002 HB3 MET 631 HB3 MET 631 6.122 4.185 4.417 1003 HG2 MET 631 HG2 MET 631 8.346 3.685 3.522 1004 HG3 MET 631 HG3 MET 631 7.631 3.435 1.933 1005 HE1 MET 631 HE1 MET 631 9.216 5.205 0.747 1006 HE2 MET 631 HE2 MET 631 10.034 5.264 2.297 1007 HE3 MET 631 HE3 MET 631 9.605 6.763 1.479 1008 H GLY 632 H GLY 632 8.056 0.644 3.250 1009 HA2 GLY 632 HA2 GLY 632 7.138 0.220 0.490 1010 HA3 GLY 632 HA3 GLY 632 8.785 -0.010 1.063 1011 H ARG 633 H ARG 633 7.782 -1.363 3.443 1012 HA ARG 633 HA ARG 633 7.964 -4.034 2.544 1013 HB2 ARG 633 HB2 ARG 633 7.626 -4.621 4.881 1014 HB3 ARG 633 HB3 ARG 633 8.721 -3.246 4.762 1015 HG2 ARG 633 HG2 ARG 633 7.000 -1.730 5.391 1016 HG3 ARG 633 HG3 ARG 633 5.781 -2.996 5.294 1017 HD2 ARG 633 HD2 ARG 633 8.104 -2.997 7.189 1018 HD3 ARG 633 HD3 ARG 633 6.491 -2.417 7.587 1019 HE ARG 633 HE ARG 633 6.186 -4.971 6.617 1020 HH11 ARG 633 HH11 ARG 633 7.816 -3.375 9.311 1021 HH12 ARG 633 HH12 ARG 633 7.645 -4.662 10.400 1022 HH21 ARG 633 HH21 ARG 633 5.981 -6.783 8.052 1023 HH22 ARG 633 HH22 ARG 633 6.579 -6.676 9.653 1024 HA PRO 634 HA PRO 634 3.592 -5.184 2.250 1025 HB2 PRO 634 HB2 PRO 634 3.733 -7.681 3.341 1026 HB3 PRO 634 HB3 PRO 634 4.256 -7.319 1.689 1027 HG2 PRO 634 HG2 PRO 634 5.940 -7.563 4.169 1028 HG3 PRO 634 HG3 PRO 634 6.257 -8.228 2.572 1029 HD2 PRO 634 HD2 PRO 634 7.432 -6.011 3.410 1030 HD3 PRO 634 HD3 PRO 634 6.918 -6.192 1.720 1031 H ILE 635 H ILE 635 1.834 -5.003 3.566 1032 HA ILE 635 HA ILE 635 2.365 -5.025 6.402 1033 HB ILE 635 HB ILE 635 0.886 -3.038 6.660 1034 HG12 ILE 635 HG12 ILE 635 0.844 -1.429 4.617 1035 HG13 ILE 635 HG13 ILE 635 1.155 -2.858 3.649 1036 HG21 ILE 635 HG21 ILE 635 2.626 -1.375 6.075 1037 HG22 ILE 635 HG22 ILE 635 3.419 -2.622 5.109 1038 HG23 ILE 635 HG23 ILE 635 3.288 -2.819 6.857 1039 HD11 ILE 635 HD11 ILE 635 -1.197 -2.269 3.648 1040 HD12 ILE 635 HD12 ILE 635 -1.247 -2.399 5.408 1041 HD13 ILE 635 HD13 ILE 635 -0.942 -3.829 4.426 1042 H LEU 636 H LEU 636 0.074 -4.783 7.572 1043 HA LEU 636 HA LEU 636 -1.569 -6.670 6.139 1044 HB2 LEU 636 HB2 LEU 636 -2.389 -7.456 8.402 1045 HB3 LEU 636 HB3 LEU 636 -0.810 -7.971 7.872 1046 HG LEU 636 HG LEU 636 0.216 -6.337 9.432 1047 HD11 LEU 636 HD11 LEU 636 -1.149 -5.249 11.131 1048 HD12 LEU 636 HD12 LEU 636 -2.614 -5.860 10.356 1049 HD13 LEU 636 HD13 LEU 636 -1.590 -4.696 9.513 1050 HD21 LEU 636 HD21 LEU 636 -0.171 -8.632 10.047 1051 HD22 LEU 636 HD22 LEU 636 -1.789 -8.208 10.610 1052 HD23 LEU 636 HD23 LEU 636 -0.365 -7.571 11.454 1053 H GLY 637 H GLY 637 -3.827 -6.785 7.178 1054 HA2 GLY 637 HA2 GLY 637 -4.941 -4.266 6.368 1055 HA3 GLY 637 HA3 GLY 637 -5.772 -5.772 6.714 1056 H GLU 638 H GLU 638 -7.280 -4.275 7.568 1057 HA GLU 638 HA GLU 638 -6.861 -2.671 9.857 1058 HB2 GLU 638 HB2 GLU 638 -8.678 -2.422 8.158 1059 HB3 GLU 638 HB3 GLU 638 -9.420 -3.875 8.803 1060 HG2 GLU 638 HG2 GLU 638 -10.546 -1.946 9.661 1061 HG3 GLU 638 HG3 GLU 638 -9.677 -2.745 10.970 1062 H HIS 639 H HIS 639 -8.348 -5.872 9.400 1063 HA HIS 639 HA HIS 639 -7.857 -6.451 12.241 1064 HB2 HIS 639 HB2 HIS 639 -10.331 -7.233 10.657 1065 HB3 HIS 639 HB3 HIS 639 -9.946 -7.818 12.262 1066 HD1 HIS 639 HD1 HIS 639 -10.379 -6.174 14.230 1067 HD2 HIS 639 HD2 HIS 639 -11.378 -4.686 10.504 1068 HE1 HIS 639 HE1 HIS 639 -11.797 -4.129 14.660 1069 H THR 640 H THR 640 -6.519 -8.120 12.358 1070 HA THR 640 HA THR 640 -6.691 -10.132 10.283 1071 HB THR 640 HB THR 640 -4.295 -10.638 10.869 1072 HG1 THR 640 HG1 THR 640 -3.419 -9.369 12.363 1073 HG21 THR 640 HG21 THR 640 -4.886 -8.009 9.504 1074 HG22 THR 640 HG22 THR 640 -5.021 -9.603 8.775 1075 HG23 THR 640 HG23 THR 640 -3.435 -8.995 9.267 1076 H LYS 641 H LYS 641 -8.144 -11.195 11.380 1077 HA LYS 641 HA LYS 641 -7.229 -12.891 13.529 1078 HB2 LYS 641 HB2 LYS 641 -8.000 -10.908 14.759 1079 HB3 LYS 641 HB3 LYS 641 -9.540 -10.978 13.926 1080 HG2 LYS 641 HG2 LYS 641 -10.012 -13.149 14.979 1081 HG3 LYS 641 HG3 LYS 641 -8.475 -13.058 15.835 1082 HD2 LYS 641 HD2 LYS 641 -10.691 -11.027 16.086 1083 HD3 LYS 641 HD3 LYS 641 -10.455 -12.380 17.188 1084 HE2 LYS 641 HE2 LYS 641 -8.420 -10.224 16.642 1085 HE3 LYS 641 HE3 LYS 641 -9.519 -10.237 18.017 1086 HZ1 LYS 641 HZ1 LYS 641 -7.388 -12.244 17.456 1087 HZ2 LYS 641 HZ2 LYS 641 -8.470 -12.313 18.763 1088 HZ3 LYS 641 HZ3 LYS 641 -7.368 -11.069 18.650 1089 H LEU 642 H LEU 642 -8.323 -14.756 13.513 1090 HA LEU 642 HA LEU 642 -10.717 -14.934 11.836 1091 HB2 LEU 642 HB2 LEU 642 -8.720 -15.845 10.766 1092 HB3 LEU 642 HB3 LEU 642 -8.455 -16.858 12.169 1093 HG LEU 642 HG LEU 642 -10.691 -17.917 11.671 1094 HD11 LEU 642 HD11 LEU 642 -11.485 -17.752 9.394 1095 HD12 LEU 642 HD12 LEU 642 -10.310 -16.483 9.068 1096 HD13 LEU 642 HD13 LEU 642 -11.604 -16.209 10.239 1097 HD21 LEU 642 HD21 LEU 642 -8.654 -19.059 11.254 1098 HD22 LEU 642 HD22 LEU 642 -8.370 -18.114 9.804 1099 HD23 LEU 642 HD23 LEU 642 -9.726 -19.264 9.861 1100 H GLU 643 H GLU 643 -12.351 -15.576 13.112 1101 HA GLU 643 HA GLU 643 -11.768 -17.075 15.544 1102 HB2 GLU 643 HB2 GLU 643 -13.413 -15.191 15.639 1103 HB3 GLU 643 HB3 GLU 643 -14.397 -16.017 14.453 1104 HG2 GLU 643 HG2 GLU 643 -14.833 -17.820 16.013 1105 HG3 GLU 643 HG3 GLU 643 -13.757 -17.078 17.194 1106 H VAL 644 H VAL 644 -11.598 -19.208 15.316 1107 HA VAL 644 HA VAL 644 -12.925 -20.503 13.035 1108 HB VAL 644 HB VAL 644 -10.731 -21.603 14.806 1109 HG11 VAL 644 HG11 VAL 644 -10.524 -23.343 13.158 1110 HG12 VAL 644 HG12 VAL 644 -11.782 -22.602 12.165 1111 HG13 VAL 644 HG13 VAL 644 -12.187 -23.279 13.746 1112 HG21 VAL 644 HG21 VAL 644 -10.544 -20.459 12.029 1113 HG22 VAL 644 HG22 VAL 644 -9.228 -21.225 12.912 1114 HG23 VAL 644 HG23 VAL 644 -9.919 -19.702 13.491 1115 H ILE 645 H ILE 645 -14.801 -21.294 13.595 1116 HA ILE 645 HA ILE 645 -15.253 -22.335 16.298 1117 HB ILE 645 HB ILE 645 -17.220 -21.931 14.032 1118 HG12 ILE 645 HG12 ILE 645 -16.738 -20.101 16.389 1119 HG13 ILE 645 HG13 ILE 645 -16.063 -19.829 14.788 1120 HG21 ILE 645 HG21 ILE 645 -18.023 -23.506 15.699 1121 HG22 ILE 645 HG22 ILE 645 -18.886 -21.975 15.884 1122 HG23 ILE 645 HG23 ILE 645 -17.604 -22.395 17.002 1123 HD11 ILE 645 HD11 ILE 645 -18.048 -18.496 15.165 1124 HD12 ILE 645 HD12 ILE 645 -18.992 -19.969 15.451 1125 HD13 ILE 645 HD13 ILE 645 -18.271 -19.662 13.864 1126 H ILE 646 H ILE 646 -15.531 -24.421 16.699 1127 HA ILE 646 HA ILE 646 -15.247 -26.286 14.482 1128 HB ILE 646 HB ILE 646 -14.816 -26.680 17.466 1129 HG12 ILE 646 HG12 ILE 646 -12.794 -26.618 15.215 1130 HG13 ILE 646 HG13 ILE 646 -13.109 -25.270 16.300 1131 HG21 ILE 646 HG21 ILE 646 -13.913 -28.873 16.871 1132 HG22 ILE 646 HG22 ILE 646 -14.390 -28.604 15.193 1133 HG23 ILE 646 HG23 ILE 646 -15.619 -28.720 16.451 1134 HD11 ILE 646 HD11 ILE 646 -11.116 -26.490 16.934 1135 HD12 ILE 646 HD12 ILE 646 -12.057 -27.974 17.110 1136 HD13 ILE 646 HD13 ILE 646 -12.351 -26.607 18.185 1137 H GLU 647 H GLU 647 -17.145 -26.902 13.792 1138 HA GLU 647 HA GLU 647 -19.259 -27.469 15.732 1139 HB2 GLU 647 HB2 GLU 647 -19.469 -27.110 12.731 1140 HB3 GLU 647 HB3 GLU 647 -20.805 -27.316 13.859 1141 HG2 GLU 647 HG2 GLU 647 -20.216 -25.199 14.930 1142 HG3 GLU 647 HG3 GLU 647 -18.917 -24.980 13.759 1143 H GLU 648 H GLU 648 -19.942 -29.531 15.940 1144 HA GLU 648 HA GLU 648 -18.275 -31.567 14.983 1145 HB2 GLU 648 HB2 GLU 648 -19.673 -33.090 16.246 1146 HB3 GLU 648 HB3 GLU 648 -19.150 -31.716 17.189 1147 HG2 GLU 648 HG2 GLU 648 -21.386 -31.969 17.854 1148 HG3 GLU 648 HG3 GLU 648 -21.480 -30.717 16.623 1149 H SER 649 H SER 649 -19.408 -33.713 14.165 1150 HA SER 649 HA SER 649 -21.597 -33.083 12.388 1151 HB2 SER 649 HB2 SER 649 -19.415 -32.604 11.150 1152 HB3 SER 649 HB3 SER 649 -19.077 -34.328 11.261 1153 HG SER 649 HG SER 649 -21.294 -34.498 10.247 1154 H TYR 650 H TYR 650 -21.307 -34.626 14.780 1155 HA TYR 650 HA TYR 650 -21.333 -37.401 13.945 1156 HB2 TYR 650 HB2 TYR 650 -21.656 -36.024 16.599 1157 HB3 TYR 650 HB3 TYR 650 -22.054 -37.717 16.392 1158 HD1 TYR 650 HD2 TYR 650 -19.355 -35.255 16.483 1159 HD2 TYR 650 HD1 TYR 650 -20.375 -39.344 16.153 1160 HE1 TYR 650 HE2 TYR 650 -17.015 -35.864 16.960 1161 HE2 TYR 650 HE1 TYR 650 -18.043 -39.987 16.635 1162 HH TYR 650 HH TYR 650 -15.784 -37.702 17.804 1163 H GLU 651 H GLU 651 -23.478 -35.183 15.656 1164 HA GLU 651 HA GLU 651 -25.681 -36.902 15.070 1165 HB2 GLU 651 HB2 GLU 651 -25.553 -34.243 16.468 1166 HB3 GLU 651 HB3 GLU 651 -27.038 -35.159 16.255 1167 HG2 GLU 651 HG2 GLU 651 -26.050 -37.025 17.499 1168 HG3 GLU 651 HG3 GLU 651 -24.588 -36.070 17.738 1169 H PHE 652 H PHE 652 -24.685 -33.628 14.172 1170 HA PHE 652 HA PHE 652 -26.106 -33.885 11.656 1171 HB2 PHE 652 HB2 PHE 652 -26.565 -31.487 13.493 1172 HB3 PHE 652 HB3 PHE 652 -27.168 -31.642 11.854 1173 HD1 PHE 652 HD1 PHE 652 -28.927 -33.393 11.395 1174 HD2 PHE 652 HD2 PHE 652 -27.733 -32.308 15.334 1175 HE1 PHE 652 HE1 PHE 652 -31.006 -34.357 12.290 1176 HE2 PHE 652 HE2 PHE 652 -29.805 -33.275 16.233 1177 HZ PHE 652 HZ PHE 652 -31.444 -34.302 14.712 1178 H LYS 653 H LYS 653 -24.899 -31.032 13.291 1179 HA LYS 653 HA LYS 653 -22.275 -31.013 12.660 1180 HB2 LYS 653 HB2 LYS 653 -22.949 -31.067 10.249 1181 HB3 LYS 653 HB3 LYS 653 -23.778 -29.542 10.482 1182 HG2 LYS 653 HG2 LYS 653 -21.743 -28.392 10.929 1183 HG3 LYS 653 HG3 LYS 653 -20.841 -29.899 11.002 1184 HD2 LYS 653 HD2 LYS 653 -22.268 -28.985 8.514 1185 HD3 LYS 653 HD3 LYS 653 -20.615 -28.509 8.875 1186 HE2 LYS 653 HE2 LYS 653 -20.574 -30.401 7.371 1187 HE3 LYS 653 HE3 LYS 653 -19.973 -30.906 8.938 1188 HZ1 LYS 653 HZ1 LYS 653 -22.756 -31.394 8.007 1189 HZ2 LYS 653 HZ2 LYS 653 -21.987 -32.128 9.342 1190 HZ3 LYS 653 HZ3 LYS 653 -21.499 -32.472 7.791 1191 H SER 654 H SER 654 -24.994 -28.816 12.263 1192 HA SER 654 HA SER 654 -23.604 -26.703 13.635 1193 HB2 SER 654 HB2 SER 654 -26.459 -26.867 12.686 1194 HB3 SER 654 HB3 SER 654 -25.516 -25.407 13.006 1195 HG SER 654 HG SER 654 -24.873 -25.511 11.051 1196 H THR 655 H THR 655 -24.300 -29.226 15.056 1197 HA THR 655 HA THR 655 -26.491 -28.749 16.802 1198 HB THR 655 HB THR 655 -24.285 -30.731 17.280 1199 HG1 THR 655 HG1 THR 655 -24.590 -31.568 15.444 1200 HG21 THR 655 HG21 THR 655 -26.208 -30.611 18.837 1201 HG22 THR 655 HG22 THR 655 -26.159 -32.148 17.977 1202 HG23 THR 655 HG23 THR 655 -27.303 -30.902 17.484 1203 H VAL 656 H VAL 656 -25.938 -26.774 17.798 1204 HA VAL 656 HA VAL 656 -23.583 -26.828 19.552 1205 HB VAL 656 HB VAL 656 -25.053 -24.401 18.468 1206 HG11 VAL 656 HG11 VAL 656 -24.114 -23.978 20.681 1207 HG12 VAL 656 HG12 VAL 656 -23.223 -23.084 19.450 1208 HG13 VAL 656 HG13 VAL 656 -22.539 -24.559 20.137 1209 HG21 VAL 656 HG21 VAL 656 -23.012 -23.982 17.166 1210 HG22 VAL 656 HG22 VAL 656 -23.759 -25.519 16.729 1211 HG23 VAL 656 HG23 VAL 656 -22.327 -25.494 17.760 1212 H ASP 657 H ASP 657 -24.001 -27.011 21.619 1213 HA ASP 657 HA ASP 657 -26.330 -25.786 22.797 1214 HB2 ASP 657 HB2 ASP 657 -27.269 -27.934 22.197 1215 HB3 ASP 657 HB3 ASP 657 -25.871 -28.774 22.855 Start of MODEL 5 1 H HIS 501 H HIS 501 6.964 -3.390 -1.971 2 HA HIS 501 HA HIS 501 5.302 -1.638 -0.932 3 HB2 HIS 501 HB2 HIS 501 4.825 -1.961 -3.903 4 HB3 HIS 501 HB3 HIS 501 3.552 -1.510 -2.777 5 HD1 HIS 501 HD1 HIS 501 6.393 -0.084 -4.688 6 HD2 HIS 501 HD2 HIS 501 3.927 1.009 -1.541 7 HE1 HIS 501 HE1 HIS 501 6.659 2.405 -4.428 8 H ALA 502 H ALA 502 3.152 -2.622 -0.763 9 HA ALA 502 HA ALA 502 3.097 -5.496 -1.205 10 HB1 ALA 502 HB1 ALA 502 2.518 -5.827 1.179 11 HB2 ALA 502 HB2 ALA 502 2.814 -4.104 1.463 12 HB3 ALA 502 HB3 ALA 502 4.130 -5.150 0.948 13 H GLY 503 H GLY 503 0.788 -5.259 0.893 14 HA2 GLY 503 HA2 GLY 503 -1.150 -3.576 -0.204 15 HA3 GLY 503 HA3 GLY 503 -1.332 -5.207 -0.851 16 H ILE 504 H ILE 504 -3.186 -5.775 0.236 17 HA ILE 504 HA ILE 504 -3.118 -5.543 3.123 18 HB ILE 504 HB ILE 504 -5.373 -5.866 1.140 19 HG12 ILE 504 HG12 ILE 504 -6.266 -3.785 2.324 20 HG13 ILE 504 HG13 ILE 504 -4.701 -3.670 3.112 21 HG21 ILE 504 HG21 ILE 504 -5.923 -7.307 2.910 22 HG22 ILE 504 HG22 ILE 504 -6.955 -5.874 2.976 23 HG23 ILE 504 HG23 ILE 504 -5.605 -6.053 4.117 24 HD11 ILE 504 HD11 ILE 504 -4.860 -2.158 1.214 25 HD12 ILE 504 HD12 ILE 504 -5.207 -3.517 0.140 26 HD13 ILE 504 HD13 ILE 504 -3.637 -3.397 0.921 27 H PHE 505 H PHE 505 -2.374 -7.343 4.118 28 HA PHE 505 HA PHE 505 -3.216 -10.001 3.161 29 HB2 PHE 505 HB2 PHE 505 -1.156 -9.126 5.190 30 HB3 PHE 505 HB3 PHE 505 -1.822 -10.739 5.251 31 HD1 PHE 505 HD1 PHE 505 -1.789 -11.824 2.694 32 HD2 PHE 505 HD2 PHE 505 0.934 -9.014 4.352 33 HE1 PHE 505 HE1 PHE 505 -0.040 -12.633 1.176 34 HE2 PHE 505 HE2 PHE 505 2.693 -9.806 2.819 35 HZ PHE 505 HZ PHE 505 2.204 -11.621 1.227 36 H THR 506 H THR 506 -4.946 -10.934 4.116 37 HA THR 506 HA THR 506 -5.363 -10.813 6.881 38 HB THR 506 HB THR 506 -6.220 -8.518 6.311 39 HG1 THR 506 HG1 THR 506 -7.661 -8.757 7.815 40 HG21 THR 506 HG21 THR 506 -8.331 -8.287 5.066 41 HG22 THR 506 HG22 THR 506 -8.350 -10.025 4.796 42 HG23 THR 506 HG23 THR 506 -7.094 -9.035 4.046 43 H PHE 507 H PHE 507 -7.671 -11.764 7.291 44 HA PHE 507 HA PHE 507 -7.718 -14.179 5.732 45 HB2 PHE 507 HB2 PHE 507 -9.253 -13.278 8.157 46 HB3 PHE 507 HB3 PHE 507 -9.630 -14.772 7.312 47 HD1 PHE 507 HD1 PHE 507 -7.927 -16.516 7.131 48 HD2 PHE 507 HD2 PHE 507 -7.430 -13.140 9.646 49 HE1 PHE 507 HE1 PHE 507 -6.255 -17.740 8.387 50 HE2 PHE 507 HE2 PHE 507 -5.719 -14.343 10.938 51 HZ PHE 507 HZ PHE 507 -5.116 -16.654 10.311 52 H GLU 508 H GLU 508 -9.494 -14.929 4.474 53 HA GLU 508 HA GLU 508 -10.926 -12.981 2.998 54 HB2 GLU 508 HB2 GLU 508 -11.688 -15.861 3.405 55 HB3 GLU 508 HB3 GLU 508 -12.215 -14.814 2.106 56 HG2 GLU 508 HG2 GLU 508 -9.818 -14.679 1.407 57 HG3 GLU 508 HG3 GLU 508 -9.501 -15.966 2.577 58 H GLU 509 H GLU 509 -11.645 -14.976 5.704 59 HA GLU 509 HA GLU 509 -14.166 -13.610 6.061 60 HB2 GLU 509 HB2 GLU 509 -15.020 -15.773 6.970 61 HB3 GLU 509 HB3 GLU 509 -14.653 -15.836 5.255 62 HG2 GLU 509 HG2 GLU 509 -12.359 -16.757 6.053 63 HG3 GLU 509 HG3 GLU 509 -13.220 -17.036 7.566 64 HA PRO 510 HA PRO 510 -12.161 -12.705 9.915 65 HB2 PRO 510 HB2 PRO 510 -14.303 -11.674 11.205 66 HB3 PRO 510 HB3 PRO 510 -13.493 -10.806 9.890 67 HG2 PRO 510 HG2 PRO 510 -15.994 -12.454 9.812 68 HG3 PRO 510 HG3 PRO 510 -15.675 -10.877 9.065 69 HD2 PRO 510 HD2 PRO 510 -15.515 -13.242 7.657 70 HD3 PRO 510 HD3 PRO 510 -14.515 -11.810 7.302 71 H VAL 511 H VAL 511 -14.977 -14.702 9.613 72 HA VAL 511 HA VAL 511 -14.244 -16.186 12.019 73 HB VAL 511 HB VAL 511 -17.104 -15.497 11.235 74 HG11 VAL 511 HG11 VAL 511 -17.722 -16.519 13.385 75 HG12 VAL 511 HG12 VAL 511 -16.042 -17.013 13.606 76 HG13 VAL 511 HG13 VAL 511 -16.973 -17.652 12.262 77 HG21 VAL 511 HG21 VAL 511 -16.059 -13.506 12.151 78 HG22 VAL 511 HG22 VAL 511 -15.492 -14.408 13.552 79 HG23 VAL 511 HG23 VAL 511 -17.219 -14.162 13.303 80 H THR 512 H THR 512 -14.251 -18.334 11.589 81 HA THR 512 HA THR 512 -15.645 -19.140 9.192 82 HB THR 512 HB THR 512 -13.162 -18.948 8.748 83 HG1 THR 512 HG1 THR 512 -14.139 -20.181 7.458 84 HG21 THR 512 HG21 THR 512 -12.307 -19.683 10.918 85 HG22 THR 512 HG22 THR 512 -11.686 -20.721 9.630 86 HG23 THR 512 HG23 THR 512 -13.000 -21.282 10.663 87 H HIS 513 H HIS 513 -16.821 -20.880 9.453 88 HA HIS 513 HA HIS 513 -16.560 -22.229 12.003 89 HB2 HIS 513 HB2 HIS 513 -18.982 -22.956 11.629 90 HB3 HIS 513 HB3 HIS 513 -18.725 -21.256 11.924 91 HD1 HIS 513 HD1 HIS 513 -19.951 -19.731 10.382 92 HD2 HIS 513 HD2 HIS 513 -19.332 -23.475 8.696 93 HE1 HIS 513 HE1 HIS 513 -21.153 -19.714 8.161 94 H VAL 514 H VAL 514 -15.863 -24.188 12.051 95 HA VAL 514 HA VAL 514 -15.702 -25.620 9.499 96 HB VAL 514 HB VAL 514 -13.654 -26.698 10.274 97 HG11 VAL 514 HG11 VAL 514 -13.351 -24.630 9.074 98 HG12 VAL 514 HG12 VAL 514 -12.123 -24.754 10.339 99 HG13 VAL 514 HG13 VAL 514 -13.517 -23.705 10.565 100 HG21 VAL 514 HG21 VAL 514 -12.528 -26.019 12.366 101 HG22 VAL 514 HG22 VAL 514 -14.086 -26.787 12.670 102 HG23 VAL 514 HG23 VAL 514 -13.931 -25.034 12.787 103 H SER 515 H SER 515 -15.352 -28.098 10.008 104 HA SER 515 HA SER 515 -17.581 -28.870 11.605 105 HB2 SER 515 HB2 SER 515 -15.857 -30.010 9.499 106 HB3 SER 515 HB3 SER 515 -16.999 -31.057 10.326 107 HG SER 515 HG SER 515 -18.335 -30.281 8.869 108 H GLU 516 H GLU 516 -17.286 -30.968 12.855 109 HA GLU 516 HA GLU 516 -15.235 -30.593 14.788 110 HB2 GLU 516 HB2 GLU 516 -16.689 -32.005 16.173 111 HB3 GLU 516 HB3 GLU 516 -17.655 -31.046 15.148 112 HG2 GLU 516 HG2 GLU 516 -17.095 -33.976 14.755 113 HG3 GLU 516 HG3 GLU 516 -18.596 -33.245 15.297 114 H SER 517 H SER 517 -16.079 -33.313 12.611 115 HA SER 517 HA SER 517 -13.597 -34.695 13.285 116 HB2 SER 517 HB2 SER 517 -16.198 -35.522 12.017 117 HB3 SER 517 HB3 SER 517 -14.844 -36.646 12.313 118 HG SER 517 HG SER 517 -15.127 -36.080 14.566 119 H ILE 518 H ILE 518 -13.837 -32.407 11.470 120 HA ILE 518 HA ILE 518 -13.911 -33.141 8.759 121 HB ILE 518 HB ILE 518 -14.274 -30.879 9.434 122 HG12 ILE 518 HG12 ILE 518 -11.795 -31.061 7.714 123 HG13 ILE 518 HG13 ILE 518 -13.453 -31.223 7.152 124 HG21 ILE 518 HG21 ILE 518 -11.390 -30.759 10.302 125 HG22 ILE 518 HG22 ILE 518 -12.829 -30.695 11.332 126 HG23 ILE 518 HG23 ILE 518 -12.498 -29.384 10.206 127 HD11 ILE 518 HD11 ILE 518 -12.172 -28.792 8.323 128 HD12 ILE 518 HD12 ILE 518 -13.873 -28.919 7.850 129 HD13 ILE 518 HD13 ILE 518 -12.590 -29.047 6.625 130 H GLY 519 H GLY 519 -11.273 -33.128 11.029 131 HA2 GLY 519 HA2 GLY 519 -9.319 -34.473 10.650 132 HA3 GLY 519 HA3 GLY 519 -9.541 -34.179 8.928 133 H ILE 520 H ILE 520 -9.166 -32.105 8.108 134 HA ILE 520 HA ILE 520 -7.459 -30.408 9.755 135 HB ILE 520 HB ILE 520 -6.858 -31.229 6.898 136 HG12 ILE 520 HG12 ILE 520 -6.332 -33.096 8.455 137 HG13 ILE 520 HG13 ILE 520 -4.896 -32.451 7.672 138 HG21 ILE 520 HG21 ILE 520 -5.317 -29.514 8.844 139 HG22 ILE 520 HG22 ILE 520 -6.118 -28.982 7.366 140 HG23 ILE 520 HG23 ILE 520 -4.703 -30.034 7.280 141 HD11 ILE 520 HD11 ILE 520 -5.809 -31.968 10.485 142 HD12 ILE 520 HD12 ILE 520 -4.422 -31.180 9.738 143 HD13 ILE 520 HD13 ILE 520 -4.424 -32.932 9.970 144 H MET 521 H MET 521 -7.946 -28.310 9.341 145 HA MET 521 HA MET 521 -9.801 -27.838 7.133 146 HB2 MET 521 HB2 MET 521 -10.805 -26.041 8.380 147 HB3 MET 521 HB3 MET 521 -10.790 -27.483 9.373 148 HG2 MET 521 HG2 MET 521 -10.134 -25.861 10.938 149 HG3 MET 521 HG3 MET 521 -8.599 -26.390 10.302 150 HE1 MET 521 HE1 MET 521 -8.476 -22.408 10.888 151 HE2 MET 521 HE2 MET 521 -7.873 -23.950 11.497 152 HE3 MET 521 HE3 MET 521 -9.575 -23.529 11.696 153 H GLU 522 H GLU 522 -9.405 -26.217 5.743 154 HA GLU 522 HA GLU 522 -6.872 -24.770 6.037 155 HB2 GLU 522 HB2 GLU 522 -8.264 -25.870 3.620 156 HB3 GLU 522 HB3 GLU 522 -7.259 -24.449 3.460 157 HG2 GLU 522 HG2 GLU 522 -5.983 -26.346 2.808 158 HG3 GLU 522 HG3 GLU 522 -5.351 -25.773 4.337 159 H VAL 523 H VAL 523 -6.989 -22.632 6.111 160 HA VAL 523 HA VAL 523 -9.419 -21.255 5.119 161 HB VAL 523 HB VAL 523 -7.697 -20.446 7.500 162 HG11 VAL 523 HG11 VAL 523 -10.106 -19.073 6.298 163 HG12 VAL 523 HG12 VAL 523 -8.443 -18.455 6.378 164 HG13 VAL 523 HG13 VAL 523 -9.375 -18.670 7.852 165 HG21 VAL 523 HG21 VAL 523 -10.572 -21.343 7.404 166 HG22 VAL 523 HG22 VAL 523 -9.652 -20.892 8.853 167 HG23 VAL 523 HG23 VAL 523 -9.203 -22.317 7.934 168 H LYS 524 H LYS 524 -9.061 -19.671 3.637 169 HA LYS 524 HA LYS 524 -6.332 -19.378 2.651 170 HB2 LYS 524 HB2 LYS 524 -8.835 -18.192 1.516 171 HB3 LYS 524 HB3 LYS 524 -7.278 -18.423 0.732 172 HG2 LYS 524 HG2 LYS 524 -7.801 -20.982 1.290 173 HG3 LYS 524 HG3 LYS 524 -9.444 -20.326 1.279 174 HD2 LYS 524 HD2 LYS 524 -7.471 -20.070 -0.948 175 HD3 LYS 524 HD3 LYS 524 -8.818 -21.215 -0.883 176 HE2 LYS 524 HE2 LYS 524 -9.009 -18.292 -0.672 177 HE3 LYS 524 HE3 LYS 524 -9.269 -19.142 -2.220 178 HZ1 LYS 524 HZ1 LYS 524 -11.123 -20.330 -0.815 179 HZ2 LYS 524 HZ2 LYS 524 -11.387 -18.756 -1.355 180 HZ3 LYS 524 HZ3 LYS 524 -10.940 -18.993 0.229 181 H VAL 525 H VAL 525 -5.159 -17.579 2.674 182 HA VAL 525 HA VAL 525 -6.227 -15.248 4.117 183 HB VAL 525 HB VAL 525 -3.340 -15.891 3.449 184 HG11 VAL 525 HG11 VAL 525 -3.753 -13.508 3.830 185 HG12 VAL 525 HG12 VAL 525 -2.803 -14.200 5.152 186 HG13 VAL 525 HG13 VAL 525 -4.528 -13.898 5.367 187 HG21 VAL 525 HG21 VAL 525 -3.101 -16.531 5.788 188 HG22 VAL 525 HG22 VAL 525 -4.245 -17.566 4.929 189 HG23 VAL 525 HG23 VAL 525 -4.835 -16.312 6.019 190 H LEU 526 H LEU 526 -6.593 -13.432 3.045 191 HA LEU 526 HA LEU 526 -6.534 -13.275 0.234 192 HB2 LEU 526 HB2 LEU 526 -6.830 -11.123 2.329 193 HB3 LEU 526 HB3 LEU 526 -7.056 -10.865 0.615 194 HG LEU 526 HG LEU 526 -8.740 -12.741 2.282 195 HD11 LEU 526 HD11 LEU 526 -9.291 -9.947 1.300 196 HD12 LEU 526 HD12 LEU 526 -9.062 -10.430 2.979 197 HD13 LEU 526 HD13 LEU 526 -10.466 -11.004 2.078 198 HD21 LEU 526 HD21 LEU 526 -9.084 -11.657 -0.505 199 HD22 LEU 526 HD22 LEU 526 -10.220 -12.705 0.343 200 HD23 LEU 526 HD23 LEU 526 -8.621 -13.309 -0.101 201 H ARG 527 H ARG 527 -4.890 -12.933 -1.016 202 HA ARG 527 HA ARG 527 -2.367 -12.194 -0.104 203 HB2 ARG 527 HB2 ARG 527 -2.694 -13.623 -2.068 204 HB3 ARG 527 HB3 ARG 527 -3.477 -12.297 -2.918 205 HG2 ARG 527 HG2 ARG 527 -1.188 -12.535 -3.665 206 HG3 ARG 527 HG3 ARG 527 -1.385 -11.010 -2.791 207 HD2 ARG 527 HD2 ARG 527 -0.623 -12.333 -0.724 208 HD3 ARG 527 HD3 ARG 527 -0.085 -13.541 -1.876 209 HE ARG 527 HE ARG 527 0.939 -10.845 -1.518 210 HH11 ARG 527 HH11 ARG 527 1.025 -13.873 -3.258 211 HH12 ARG 527 HH12 ARG 527 2.653 -13.795 -3.669 212 HH21 ARG 527 HH21 ARG 527 3.299 -10.762 -1.920 213 HH22 ARG 527 HH22 ARG 527 4.017 -12.019 -2.820 214 H THR 528 H THR 528 -1.212 -10.327 -0.422 215 HA THR 528 HA THR 528 -2.367 -7.891 -0.147 216 HB THR 528 HB THR 528 -0.081 -7.108 -0.959 217 HG1 THR 528 HG1 THR 528 1.028 -8.522 -1.885 218 HG21 THR 528 HG21 THR 528 -0.666 -7.321 1.386 219 HG22 THR 528 HG22 THR 528 0.995 -7.841 1.104 220 HG23 THR 528 HG23 THR 528 -0.278 -9.039 1.337 221 H SER 529 H SER 529 -3.054 -6.374 -1.499 222 HA SER 529 HA SER 529 -3.761 -6.632 -4.075 223 HB2 SER 529 HB2 SER 529 -2.935 -4.118 -2.614 224 HB3 SER 529 HB3 SER 529 -4.320 -4.339 -3.716 225 HG SER 529 HG SER 529 -5.341 -5.465 -2.180 226 H GLY 530 H GLY 530 -0.633 -5.850 -2.737 227 HA2 GLY 530 HA2 GLY 530 0.454 -5.701 -5.445 228 HA3 GLY 530 HA3 GLY 530 1.126 -4.802 -4.079 229 H ALA 531 H ALA 531 1.388 -7.593 -5.815 230 HA ALA 531 HA ALA 531 2.718 -8.965 -3.589 231 HB1 ALA 531 HB1 ALA 531 1.021 -10.337 -4.682 232 HB2 ALA 531 HB2 ALA 531 2.640 -10.994 -4.994 233 HB3 ALA 531 HB3 ALA 531 1.802 -10.086 -6.249 234 H ARG 532 H ARG 532 4.726 -8.167 -3.515 235 HA ARG 532 HA ARG 532 6.275 -8.278 -5.987 236 HB2 ARG 532 HB2 ARG 532 6.430 -6.154 -3.838 237 HB3 ARG 532 HB3 ARG 532 7.490 -6.277 -5.228 238 HG2 ARG 532 HG2 ARG 532 4.536 -5.702 -5.280 239 HG3 ARG 532 HG3 ARG 532 5.834 -4.541 -5.549 240 HD2 ARG 532 HD2 ARG 532 6.538 -5.856 -7.532 241 HD3 ARG 532 HD3 ARG 532 5.175 -6.939 -7.259 242 HE ARG 532 HE ARG 532 4.683 -4.098 -7.611 243 HH11 ARG 532 HH11 ARG 532 4.352 -7.403 -8.869 244 HH12 ARG 532 HH12 ARG 532 3.303 -6.955 -10.147 245 HH21 ARG 532 HH21 ARG 532 3.219 -3.523 -9.368 246 HH22 ARG 532 HH22 ARG 532 2.668 -4.730 -10.425 247 H GLY 533 H GLY 533 7.734 -9.813 -5.706 248 HA2 GLY 533 HA2 GLY 533 9.674 -10.747 -4.839 249 HA3 GLY 533 HA3 GLY 533 9.569 -9.628 -3.489 250 H ASN 534 H ASN 534 10.243 -11.548 -2.273 251 HA ASN 534 HA ASN 534 8.051 -13.418 -1.812 252 HB2 ASN 534 HB2 ASN 534 10.163 -14.502 -2.405 253 HB3 ASN 534 HB3 ASN 534 10.991 -13.655 -1.109 254 HD21 ASN 534 HD21 ASN 534 7.777 -15.068 -0.750 255 HD22 ASN 534 HD22 ASN 534 8.279 -16.308 0.342 256 H VAL 535 H VAL 535 6.867 -13.175 -0.086 257 HA VAL 535 HA VAL 535 8.008 -11.838 2.241 258 HB VAL 535 HB VAL 535 5.145 -11.687 1.239 259 HG11 VAL 535 HG11 VAL 535 5.267 -11.520 3.641 260 HG12 VAL 535 HG12 VAL 535 4.875 -9.940 2.953 261 HG13 VAL 535 HG13 VAL 535 6.508 -10.274 3.517 262 HG21 VAL 535 HG21 VAL 535 6.591 -10.439 -0.232 263 HG22 VAL 535 HG22 VAL 535 7.317 -9.610 1.138 264 HG23 VAL 535 HG23 VAL 535 5.619 -9.316 0.729 265 H ILE 536 H ILE 536 7.637 -12.939 4.121 266 HA ILE 536 HA ILE 536 6.049 -15.391 3.908 267 HB ILE 536 HB ILE 536 8.290 -14.691 5.819 268 HG12 ILE 536 HG12 ILE 536 9.107 -15.370 3.617 269 HG13 ILE 536 HG13 ILE 536 9.465 -16.620 4.804 270 HG21 ILE 536 HG21 ILE 536 6.589 -17.161 5.751 271 HG22 ILE 536 HG22 ILE 536 6.573 -15.914 6.985 272 HG23 ILE 536 HG23 ILE 536 8.011 -16.928 6.779 273 HD11 ILE 536 HD11 ILE 536 7.423 -17.806 3.960 274 HD12 ILE 536 HD12 ILE 536 8.767 -17.673 2.828 275 HD13 ILE 536 HD13 ILE 536 7.375 -16.614 2.655 276 H VAL 537 H VAL 537 4.352 -15.658 5.212 277 HA VAL 537 HA VAL 537 3.936 -13.591 7.214 278 HB VAL 537 HB VAL 537 1.756 -14.995 5.643 279 HG11 VAL 537 HG11 VAL 537 1.038 -14.347 7.892 280 HG12 VAL 537 HG12 VAL 537 0.248 -13.345 6.672 281 HG13 VAL 537 HG13 VAL 537 1.604 -12.702 7.600 282 HG21 VAL 537 HG21 VAL 537 3.031 -13.471 4.256 283 HG22 VAL 537 HG22 VAL 537 2.792 -12.181 5.431 284 HG23 VAL 537 HG23 VAL 537 1.408 -12.833 4.540 285 HA PRO 538 HA PRO 538 3.914 -17.380 9.684 286 HB2 PRO 538 HB2 PRO 538 4.173 -16.131 12.066 287 HB3 PRO 538 HB3 PRO 538 5.556 -16.432 11.008 288 HG2 PRO 538 HG2 PRO 538 4.015 -13.925 11.473 289 HG3 PRO 538 HG3 PRO 538 5.749 -14.137 11.182 290 HD2 PRO 538 HD2 PRO 538 3.940 -13.311 9.284 291 HD3 PRO 538 HD3 PRO 538 5.486 -14.101 8.915 292 H TYR 539 H TYR 539 2.436 -18.245 11.204 293 HA TYR 539 HA TYR 539 0.256 -16.541 12.067 294 HB2 TYR 539 HB2 TYR 539 -1.515 -18.021 11.315 295 HB3 TYR 539 HB3 TYR 539 -0.527 -17.575 9.936 296 HD1 TYR 539 HD2 TYR 539 -1.267 -20.323 12.311 297 HD2 TYR 539 HD1 TYR 539 0.495 -19.245 8.602 298 HE1 TYR 539 HE2 TYR 539 -1.096 -22.693 11.720 299 HE2 TYR 539 HE1 TYR 539 0.664 -21.611 7.986 300 HH TYR 539 HH TYR 539 0.698 -23.809 9.055 301 H LYS 540 H LYS 540 -1.079 -17.608 13.714 302 HA LYS 540 HA LYS 540 0.055 -19.949 15.002 303 HB2 LYS 540 HB2 LYS 540 0.405 -18.846 17.144 304 HB3 LYS 540 HB3 LYS 540 1.413 -18.087 15.920 305 HG2 LYS 540 HG2 LYS 540 -0.105 -16.227 15.752 306 HG3 LYS 540 HG3 LYS 540 -1.238 -17.007 16.856 307 HD2 LYS 540 HD2 LYS 540 0.544 -16.955 18.593 308 HD3 LYS 540 HD3 LYS 540 1.530 -16.006 17.479 309 HE2 LYS 540 HE2 LYS 540 -0.137 -14.264 17.418 310 HE3 LYS 540 HE3 LYS 540 -1.216 -15.226 18.427 311 HZ1 LYS 540 HZ1 LYS 540 -0.076 -13.553 19.697 312 HZ2 LYS 540 HZ2 LYS 540 1.427 -14.156 19.234 313 HZ3 LYS 540 HZ3 LYS 540 0.395 -15.093 20.211 314 H THR 541 H THR 541 -1.349 -20.777 16.648 315 HA THR 541 HA THR 541 -4.079 -19.963 16.268 316 HB THR 541 HB THR 541 -4.404 -22.053 17.767 317 HG1 THR 541 HG1 THR 541 -2.306 -22.578 18.385 318 HG21 THR 541 HG21 THR 541 -3.343 -22.268 14.958 319 HG22 THR 541 HG22 THR 541 -5.025 -21.983 15.419 320 HG23 THR 541 HG23 THR 541 -4.259 -23.528 15.781 321 H ILE 542 H ILE 542 -5.363 -19.173 17.814 322 HA ILE 542 HA ILE 542 -4.174 -18.449 20.394 323 HB ILE 542 HB ILE 542 -6.509 -17.362 18.853 324 HG12 ILE 542 HG12 ILE 542 -3.897 -16.006 19.484 325 HG13 ILE 542 HG13 ILE 542 -4.264 -16.778 17.944 326 HG21 ILE 542 HG21 ILE 542 -6.914 -17.180 21.263 327 HG22 ILE 542 HG22 ILE 542 -6.621 -15.579 20.584 328 HG23 ILE 542 HG23 ILE 542 -5.347 -16.399 21.486 329 HD11 ILE 542 HD11 ILE 542 -4.503 -14.328 17.954 330 HD12 ILE 542 HD12 ILE 542 -5.833 -14.495 19.115 331 HD13 ILE 542 HD13 ILE 542 -5.962 -15.195 17.494 332 H GLU 543 H GLU 543 -4.967 -19.588 22.060 333 HA GLU 543 HA GLU 543 -7.124 -21.434 21.650 334 HB2 GLU 543 HB2 GLU 543 -5.603 -20.757 24.171 335 HB3 GLU 543 HB3 GLU 543 -6.667 -22.131 23.936 336 HG2 GLU 543 HG2 GLU 543 -5.146 -23.029 22.251 337 HG3 GLU 543 HG3 GLU 543 -4.071 -21.651 22.490 338 H GLY 544 H GLY 544 -9.166 -20.885 21.880 339 HA2 GLY 544 HA2 GLY 544 -9.852 -18.522 23.490 340 HA3 GLY 544 HA3 GLY 544 -10.830 -19.216 22.193 341 H THR 545 H THR 545 -12.512 -20.398 22.822 342 HA THR 545 HA THR 545 -12.652 -21.352 25.509 343 HB THR 545 HB THR 545 -14.842 -22.385 24.704 344 HG1 THR 545 HG1 THR 545 -15.486 -21.321 22.626 345 HG21 THR 545 HG21 THR 545 -14.775 -20.165 25.738 346 HG22 THR 545 HG22 THR 545 -16.000 -20.235 24.470 347 HG23 THR 545 HG23 THR 545 -14.453 -19.441 24.164 348 H ALA 546 H ALA 546 -11.924 -22.549 22.372 349 HA ALA 546 HA ALA 546 -11.663 -25.305 23.195 350 HB1 ALA 546 HB1 ALA 546 -10.901 -25.668 20.883 351 HB2 ALA 546 HB2 ALA 546 -10.894 -23.926 20.616 352 HB3 ALA 546 HB3 ALA 546 -12.415 -24.763 20.913 353 H ARG 547 H ARG 547 -9.721 -26.359 23.542 354 HA ARG 547 HA ARG 547 -7.431 -24.602 24.038 355 HB2 ARG 547 HB2 ARG 547 -8.037 -27.362 25.055 356 HB3 ARG 547 HB3 ARG 547 -6.598 -26.436 25.452 357 HG2 ARG 547 HG2 ARG 547 -7.988 -24.728 26.455 358 HG3 ARG 547 HG3 ARG 547 -9.432 -25.681 26.100 359 HD2 ARG 547 HD2 ARG 547 -8.423 -27.542 27.406 360 HD3 ARG 547 HD3 ARG 547 -7.139 -26.441 27.890 361 HE ARG 547 HE ARG 547 -8.995 -25.038 28.813 362 HH11 ARG 547 HH11 ARG 547 -9.249 -28.573 28.556 363 HH12 ARG 547 HH12 ARG 547 -10.285 -28.716 29.901 364 HH21 ARG 547 HH21 ARG 547 -10.469 -25.276 30.616 365 HH22 ARG 547 HH22 ARG 547 -11.017 -26.841 31.051 366 H GLY 548 H GLY 548 -5.430 -25.145 23.397 367 HA2 GLY 548 HA2 GLY 548 -5.392 -26.675 20.902 368 HA3 GLY 548 HA3 GLY 548 -4.197 -25.490 21.410 369 H GLY 549 H GLY 549 -2.679 -27.133 20.765 370 HA2 GLY 549 HA2 GLY 549 -0.982 -28.508 21.442 371 HA3 GLY 549 HA3 GLY 549 -1.706 -28.562 23.040 372 H GLY 550 H GLY 550 -3.950 -29.343 20.703 373 HA2 GLY 550 HA2 GLY 550 -4.313 -31.441 19.647 374 HA3 GLY 550 HA3 GLY 550 -3.263 -32.173 20.842 375 H GLU 551 H GLU 551 -5.361 -29.973 22.360 376 HA GLU 551 HA GLU 551 -6.837 -32.236 23.364 377 HB2 GLU 551 HB2 GLU 551 -6.091 -30.424 24.929 378 HB3 GLU 551 HB3 GLU 551 -7.233 -29.338 24.146 379 HG2 GLU 551 HG2 GLU 551 -9.092 -30.592 24.892 380 HG3 GLU 551 HG3 GLU 551 -8.076 -31.937 25.395 381 H ASP 552 H ASP 552 -7.989 -29.077 22.160 382 HA ASP 552 HA ASP 552 -10.297 -30.508 21.023 383 HB2 ASP 552 HB2 ASP 552 -9.833 -27.536 21.381 384 HB3 ASP 552 HB3 ASP 552 -11.277 -28.248 20.674 385 H PHE 553 H PHE 553 -7.723 -28.298 20.298 386 HA PHE 553 HA PHE 553 -7.772 -29.272 17.568 387 HB2 PHE 553 HB2 PHE 553 -7.416 -27.045 16.645 388 HB3 PHE 553 HB3 PHE 553 -8.912 -27.044 17.562 389 HD1 PHE 553 HD2 PHE 553 -9.038 -25.821 19.693 390 HD2 PHE 553 HD1 PHE 553 -5.538 -25.728 17.299 391 HE1 PHE 553 HE2 PHE 553 -8.227 -23.865 20.944 392 HE2 PHE 553 HE1 PHE 553 -4.721 -23.792 18.538 393 HZ PHE 553 HZ PHE 553 -6.064 -22.845 20.364 394 H GLU 554 H GLU 554 -5.724 -29.027 16.568 395 HA GLU 554 HA GLU 554 -3.571 -29.305 18.447 396 HB2 GLU 554 HB2 GLU 554 -4.146 -30.401 16.040 397 HB3 GLU 554 HB3 GLU 554 -3.039 -29.133 15.542 398 HG2 GLU 554 HG2 GLU 554 -2.541 -31.323 17.509 399 HG3 GLU 554 HG3 GLU 554 -1.888 -31.212 15.889 400 H ASP 555 H ASP 555 -1.939 -27.843 18.676 401 HA ASP 555 HA ASP 555 -2.685 -25.095 18.025 402 HB2 ASP 555 HB2 ASP 555 -2.071 -25.554 20.350 403 HB3 ASP 555 HB3 ASP 555 -0.516 -26.196 19.839 404 H THR 556 H THR 556 -2.061 -24.449 16.112 405 HA THR 556 HA THR 556 0.452 -25.508 15.091 406 HB THR 556 HB THR 556 -1.478 -26.337 13.815 407 HG1 THR 556 HG1 THR 556 -0.719 -24.985 11.722 408 HG21 THR 556 HG21 THR 556 -2.722 -24.740 12.367 409 HG22 THR 556 HG22 THR 556 -2.029 -23.417 13.326 410 HG23 THR 556 HG23 THR 556 -3.078 -24.607 14.087 411 H CYS 557 H CYS 557 1.807 -24.234 14.066 412 HA CYS 557 HA CYS 557 1.246 -21.456 13.610 413 HB2 CYS 557 HB2 CYS 557 3.409 -20.798 14.691 414 HB3 CYS 557 HB3 CYS 557 2.234 -21.401 15.851 415 HG CYS 557 HG CYS 557 3.437 -23.619 16.511 416 H GLY 558 H GLY 558 2.639 -20.686 11.923 417 HA2 GLY 558 HA2 GLY 558 4.644 -22.335 10.825 418 HA3 GLY 558 HA3 GLY 558 3.123 -22.513 9.947 419 H GLU 559 H GLU 559 4.875 -21.595 8.405 420 HA GLU 559 HA GLU 559 4.426 -18.722 8.320 421 HB2 GLU 559 HB2 GLU 559 7.011 -20.202 7.930 422 HB3 GLU 559 HB3 GLU 559 6.765 -18.580 7.293 423 HG2 GLU 559 HG2 GLU 559 6.370 -17.740 9.529 424 HG3 GLU 559 HG3 GLU 559 6.512 -19.365 10.191 425 H LEU 560 H LEU 560 3.289 -18.256 6.657 426 HA LEU 560 HA LEU 560 3.079 -20.051 4.401 427 HB2 LEU 560 HB2 LEU 560 1.725 -17.440 5.029 428 HB3 LEU 560 HB3 LEU 560 1.331 -18.468 3.673 429 HG LEU 560 HG LEU 560 0.942 -19.118 6.588 430 HD11 LEU 560 HD11 LEU 560 -1.423 -19.038 6.034 431 HD12 LEU 560 HD12 LEU 560 -1.025 -18.556 4.385 432 HD13 LEU 560 HD13 LEU 560 -0.638 -17.490 5.735 433 HD21 LEU 560 HD21 LEU 560 -0.249 -21.123 5.719 434 HD22 LEU 560 HD22 LEU 560 1.489 -21.139 5.430 435 HD23 LEU 560 HD23 LEU 560 0.391 -20.748 4.111 436 H GLU 561 H GLU 561 3.783 -19.601 2.399 437 HA GLU 561 HA GLU 561 5.671 -17.394 2.203 438 HB2 GLU 561 HB2 GLU 561 6.431 -19.763 1.972 439 HB3 GLU 561 HB3 GLU 561 5.451 -19.880 0.520 440 HG2 GLU 561 HG2 GLU 561 6.847 -17.955 -0.396 441 HG3 GLU 561 HG3 GLU 561 7.817 -18.147 1.021 442 H PHE 562 H PHE 562 4.980 -15.683 1.058 443 HA PHE 562 HA PHE 562 3.209 -16.174 -1.236 444 HB2 PHE 562 HB2 PHE 562 3.210 -13.806 0.655 445 HB3 PHE 562 HB3 PHE 562 2.270 -13.905 -0.819 446 HD1 PHE 562 HD2 PHE 562 0.233 -15.351 -0.913 447 HD2 PHE 562 HD1 PHE 562 2.573 -14.963 2.639 448 HE1 PHE 562 HE2 PHE 562 -1.600 -16.256 0.396 449 HE2 PHE 562 HE1 PHE 562 0.704 -15.873 3.945 450 HZ PHE 562 HZ PHE 562 -1.380 -16.518 2.827 451 H GLN 563 H GLN 563 4.564 -15.947 -2.950 452 HA GLN 563 HA GLN 563 6.395 -13.630 -2.966 453 HB2 GLN 563 HB2 GLN 563 6.319 -15.803 -4.935 454 HB3 GLN 563 HB3 GLN 563 7.678 -14.734 -4.593 455 HG2 GLN 563 HG2 GLN 563 7.712 -15.819 -2.263 456 HG3 GLN 563 HG3 GLN 563 6.704 -17.073 -2.973 457 HE21 GLN 563 HE21 GLN 563 9.374 -15.372 -4.557 458 HE22 GLN 563 HE22 GLN 563 10.355 -16.780 -4.659 459 H ASN 564 H ASN 564 6.706 -12.954 -5.434 460 HA ASN 564 HA ASN 564 4.422 -11.574 -6.208 461 HB2 ASN 564 HB2 ASN 564 6.749 -11.061 -6.977 462 HB3 ASN 564 HB3 ASN 564 6.673 -12.451 -8.041 463 HD21 ASN 564 HD21 ASN 564 7.132 -9.658 -8.678 464 HD22 ASN 564 HD22 ASN 564 5.931 -9.231 -9.834 465 H ASP 565 H ASP 565 5.613 -14.656 -7.422 466 HA ASP 565 HA ASP 565 3.468 -14.953 -9.308 467 HB2 ASP 565 HB2 ASP 565 5.555 -16.138 -9.730 468 HB3 ASP 565 HB3 ASP 565 5.337 -17.085 -8.257 469 H GLU 566 H GLU 566 4.093 -16.497 -6.140 470 HA GLU 566 HA GLU 566 1.907 -18.132 -5.978 471 HB2 GLU 566 HB2 GLU 566 3.487 -16.636 -3.945 472 HB3 GLU 566 HB3 GLU 566 2.153 -17.660 -3.467 473 HG2 GLU 566 HG2 GLU 566 4.328 -18.752 -3.216 474 HG3 GLU 566 HG3 GLU 566 3.286 -19.608 -4.345 475 H ILE 567 H ILE 567 -0.125 -17.930 -5.239 476 HA ILE 567 HA ILE 567 -1.119 -15.210 -5.104 477 HB ILE 567 HB ILE 567 -3.416 -16.385 -5.479 478 HG12 ILE 567 HG12 ILE 567 -1.602 -18.430 -6.785 479 HG13 ILE 567 HG13 ILE 567 -2.396 -18.732 -5.254 480 HG21 ILE 567 HG21 ILE 567 -1.361 -16.101 -7.666 481 HG22 ILE 567 HG22 ILE 567 -2.416 -14.832 -7.039 482 HG23 ILE 567 HG23 ILE 567 -3.104 -16.199 -7.913 483 HD11 ILE 567 HD11 ILE 567 -4.537 -18.509 -6.313 484 HD12 ILE 567 HD12 ILE 567 -3.569 -19.754 -7.109 485 HD13 ILE 567 HD13 ILE 567 -3.771 -18.165 -7.865 486 H VAL 568 H VAL 568 -2.789 -18.040 -3.808 487 HA VAL 568 HA VAL 568 -2.888 -16.593 -1.265 488 HB VAL 568 HB VAL 568 -5.035 -16.730 -2.542 489 HG11 VAL 568 HG11 VAL 568 -4.882 -19.659 -1.964 490 HG12 VAL 568 HG12 VAL 568 -4.761 -18.927 -3.573 491 HG13 VAL 568 HG13 VAL 568 -6.268 -18.816 -2.640 492 HG21 VAL 568 HG21 VAL 568 -5.016 -18.196 0.074 493 HG22 VAL 568 HG22 VAL 568 -6.432 -17.516 -0.728 494 HG23 VAL 568 HG23 VAL 568 -5.145 -16.447 -0.163 495 H LYS 569 H LYS 569 -2.823 -17.861 0.632 496 HA LYS 569 HA LYS 569 -2.104 -20.667 0.304 497 HB2 LYS 569 HB2 LYS 569 -0.794 -18.668 2.086 498 HB3 LYS 569 HB3 LYS 569 -0.740 -20.389 2.426 499 HG2 LYS 569 HG2 LYS 569 0.044 -20.313 -0.190 500 HG3 LYS 569 HG3 LYS 569 0.678 -18.796 0.429 501 HD2 LYS 569 HD2 LYS 569 2.307 -20.504 0.678 502 HD3 LYS 569 HD3 LYS 569 1.749 -19.992 2.278 503 HE2 LYS 569 HE2 LYS 569 1.979 -22.400 2.266 504 HE3 LYS 569 HE3 LYS 569 0.265 -22.036 2.296 505 HZ1 LYS 569 HZ1 LYS 569 0.671 -23.772 0.747 506 HZ2 LYS 569 HZ2 LYS 569 1.880 -22.905 -0.026 507 HZ3 LYS 569 HZ3 LYS 569 0.276 -22.415 -0.170 508 H THR 570 H THR 570 -2.441 -21.907 2.361 509 HA THR 570 HA THR 570 -4.783 -20.878 3.743 510 HB THR 570 HB THR 570 -5.256 -23.451 3.875 511 HG1 THR 570 HG1 THR 570 -4.558 -24.041 1.461 512 HG21 THR 570 HG21 THR 570 -6.751 -21.846 2.841 513 HG22 THR 570 HG22 THR 570 -6.639 -23.289 1.845 514 HG23 THR 570 HG23 THR 570 -5.771 -21.820 1.375 515 H ILE 571 H ILE 571 -4.993 -21.415 5.871 516 HA ILE 571 HA ILE 571 -2.644 -22.460 7.275 517 HB ILE 571 HB ILE 571 -5.230 -21.207 8.295 518 HG12 ILE 571 HG12 ILE 571 -3.662 -19.584 9.424 519 HG13 ILE 571 HG13 ILE 571 -2.355 -20.320 8.511 520 HG21 ILE 571 HG21 ILE 571 -3.053 -22.375 10.002 521 HG22 ILE 571 HG22 ILE 571 -4.675 -23.017 9.772 522 HG23 ILE 571 HG23 ILE 571 -4.454 -21.462 10.581 523 HD11 ILE 571 HD11 ILE 571 -3.436 -19.653 6.461 524 HD12 ILE 571 HD12 ILE 571 -3.079 -18.283 7.515 525 HD13 ILE 571 HD13 ILE 571 -4.734 -18.901 7.392 526 H SER 572 H SER 572 -2.580 -24.538 7.844 527 HA SER 572 HA SER 572 -5.037 -26.102 7.664 528 HB2 SER 572 HB2 SER 572 -2.129 -26.939 7.568 529 HB3 SER 572 HB3 SER 572 -3.509 -28.027 7.415 530 HG SER 572 HG SER 572 -4.070 -27.113 5.549 531 H VAL 573 H VAL 573 -5.970 -26.493 9.531 532 HA VAL 573 HA VAL 573 -4.297 -26.831 11.946 533 HB VAL 573 HB VAL 573 -7.152 -25.812 11.779 534 HG11 VAL 573 HG11 VAL 573 -6.853 -27.197 13.767 535 HG12 VAL 573 HG12 VAL 573 -7.065 -25.500 14.186 536 HG13 VAL 573 HG13 VAL 573 -5.456 -26.222 14.250 537 HG21 VAL 573 HG21 VAL 573 -4.615 -24.467 12.647 538 HG22 VAL 573 HG22 VAL 573 -6.219 -23.752 12.742 539 HG23 VAL 573 HG23 VAL 573 -5.514 -24.142 11.165 540 H LYS 574 H LYS 574 -4.336 -28.797 12.869 541 HA LYS 574 HA LYS 574 -6.213 -30.760 11.997 542 HB2 LYS 574 HB2 LYS 574 -3.980 -31.530 12.409 543 HB3 LYS 574 HB3 LYS 574 -3.930 -30.764 13.982 544 HG2 LYS 574 HG2 LYS 574 -4.121 -33.174 14.226 545 HG3 LYS 574 HG3 LYS 574 -5.578 -32.383 14.814 546 HD2 LYS 574 HD2 LYS 574 -6.725 -32.951 12.714 547 HD3 LYS 574 HD3 LYS 574 -5.259 -33.749 12.138 548 HE2 LYS 574 HE2 LYS 574 -5.377 -35.336 13.989 549 HE3 LYS 574 HE3 LYS 574 -6.805 -34.515 14.616 550 HZ1 LYS 574 HZ1 LYS 574 -7.405 -36.506 13.367 551 HZ2 LYS 574 HZ2 LYS 574 -6.645 -35.919 11.992 552 HZ3 LYS 574 HZ3 LYS 574 -7.992 -35.137 12.612 553 H VAL 575 H VAL 575 -8.150 -30.711 12.724 554 HA VAL 575 HA VAL 575 -8.726 -29.643 15.354 555 HB VAL 575 HB VAL 575 -10.615 -30.857 13.293 556 HG11 VAL 575 HG11 VAL 575 -11.206 -29.197 15.748 557 HG12 VAL 575 HG12 VAL 575 -11.511 -30.922 15.574 558 HG13 VAL 575 HG13 VAL 575 -12.398 -29.763 14.585 559 HG21 VAL 575 HG21 VAL 575 -9.551 -28.841 12.417 560 HG22 VAL 575 HG22 VAL 575 -10.024 -27.949 13.862 561 HG23 VAL 575 HG23 VAL 575 -11.257 -28.546 12.754 562 H ILE 576 H ILE 576 -8.879 -30.945 17.081 563 HA ILE 576 HA ILE 576 -8.231 -33.707 16.667 564 HB ILE 576 HB ILE 576 -8.842 -32.269 19.229 565 HG12 ILE 576 HG12 ILE 576 -6.960 -31.195 18.104 566 HG13 ILE 576 HG13 ILE 576 -6.405 -32.069 19.524 567 HG21 ILE 576 HG21 ILE 576 -9.014 -34.680 19.466 568 HG22 ILE 576 HG22 ILE 576 -7.563 -34.104 20.294 569 HG23 ILE 576 HG23 ILE 576 -7.429 -34.883 18.720 570 HD11 ILE 576 HD11 ILE 576 -4.885 -32.299 17.615 571 HD12 ILE 576 HD12 ILE 576 -6.182 -33.044 16.680 572 HD13 ILE 576 HD13 ILE 576 -5.555 -33.852 18.116 573 H ASP 577 H ASP 577 -9.523 -35.228 16.639 574 HA ASP 577 HA ASP 577 -12.371 -34.687 17.041 575 HB2 ASP 577 HB2 ASP 577 -12.005 -35.189 14.775 576 HB3 ASP 577 HB3 ASP 577 -10.945 -36.538 15.164 577 H ASP 578 H ASP 578 -12.466 -35.188 19.207 578 HA ASP 578 HA ASP 578 -13.602 -37.595 19.745 579 HB2 ASP 578 HB2 ASP 578 -11.312 -38.627 19.534 580 HB3 ASP 578 HB3 ASP 578 -10.828 -37.694 20.951 581 H GLU 579 H GLU 579 -15.004 -36.580 20.892 582 HA GLU 579 HA GLU 579 -16.051 -35.892 22.720 583 HB2 GLU 579 HB2 GLU 579 -13.547 -36.785 24.092 584 HB3 GLU 579 HB3 GLU 579 -14.993 -36.260 24.941 585 HG2 GLU 579 HG2 GLU 579 -14.859 -38.541 22.997 586 HG3 GLU 579 HG3 GLU 579 -14.795 -38.704 24.749 587 H GLU 580 H GLU 580 -16.116 -33.724 21.972 588 HA GLU 580 HA GLU 580 -14.559 -31.967 23.679 589 HB2 GLU 580 HB2 GLU 580 -16.320 -30.278 22.327 590 HB3 GLU 580 HB3 GLU 580 -14.670 -30.596 21.843 591 HG2 GLU 580 HG2 GLU 580 -16.191 -30.760 19.947 592 HG3 GLU 580 HG3 GLU 580 -15.444 -32.315 20.282 593 H TYR 581 H TYR 581 -17.931 -32.560 22.843 594 HA TYR 581 HA TYR 581 -19.789 -32.970 24.047 595 HB2 TYR 581 HB2 TYR 581 -18.131 -34.752 24.699 596 HB3 TYR 581 HB3 TYR 581 -17.869 -33.860 26.184 597 HD1 TYR 581 HD1 TYR 581 -20.682 -35.218 24.180 598 HD2 TYR 581 HD2 TYR 581 -19.057 -34.582 28.047 599 HE1 TYR 581 HE1 TYR 581 -22.537 -36.462 25.155 600 HE2 TYR 581 HE2 TYR 581 -20.935 -35.830 29.038 601 HH TYR 581 HH TYR 581 -23.217 -36.461 28.472 602 H GLU 582 H GLU 582 -18.653 -30.190 24.544 603 HA GLU 582 HA GLU 582 -20.067 -29.793 27.079 604 HB2 GLU 582 HB2 GLU 582 -18.378 -28.201 27.912 605 HB3 GLU 582 HB3 GLU 582 -17.751 -29.830 27.725 606 HG2 GLU 582 HG2 GLU 582 -16.638 -29.239 25.720 607 HG3 GLU 582 HG3 GLU 582 -17.403 -27.653 25.716 608 H LYS 583 H LYS 583 -18.725 -28.065 24.285 609 HA LYS 583 HA LYS 583 -20.884 -26.122 24.327 610 HB2 LYS 583 HB2 LYS 583 -19.227 -25.328 25.954 611 HB3 LYS 583 HB3 LYS 583 -17.961 -25.475 24.769 612 HG2 LYS 583 HG2 LYS 583 -18.387 -23.196 24.753 613 HG3 LYS 583 HG3 LYS 583 -19.328 -23.775 23.385 614 HD2 LYS 583 HD2 LYS 583 -20.685 -22.226 24.587 615 HD3 LYS 583 HD3 LYS 583 -21.318 -23.842 24.909 616 HE2 LYS 583 HE2 LYS 583 -20.241 -23.902 27.067 617 HE3 LYS 583 HE3 LYS 583 -19.399 -22.394 26.728 618 HZ1 LYS 583 HZ1 LYS 583 -21.520 -21.258 26.727 619 HZ2 LYS 583 HZ2 LYS 583 -21.281 -22.057 28.177 620 HZ3 LYS 583 HZ3 LYS 583 -22.330 -22.707 27.030 621 H ASN 584 H ASN 584 -20.953 -25.132 22.244 622 HA ASN 584 HA ASN 584 -19.418 -26.231 20.094 623 HB2 ASN 584 HB2 ASN 584 -21.713 -25.170 19.837 624 HB3 ASN 584 HB3 ASN 584 -20.971 -23.613 20.191 625 HD21 ASN 584 HD21 ASN 584 -21.428 -22.709 18.219 626 HD22 ASN 584 HD22 ASN 584 -20.693 -23.214 16.739 627 H LYS 585 H LYS 585 -17.252 -25.917 20.504 628 HA LYS 585 HA LYS 585 -16.468 -23.369 21.591 629 HB2 LYS 585 HB2 LYS 585 -14.943 -25.937 21.403 630 HB3 LYS 585 HB3 LYS 585 -14.248 -24.429 21.993 631 HG2 LYS 585 HG2 LYS 585 -16.026 -24.319 23.703 632 HG3 LYS 585 HG3 LYS 585 -16.601 -25.888 23.148 633 HD2 LYS 585 HD2 LYS 585 -13.853 -25.332 24.239 634 HD3 LYS 585 HD3 LYS 585 -15.195 -25.994 25.162 635 HE2 LYS 585 HE2 LYS 585 -15.269 -27.911 23.600 636 HE3 LYS 585 HE3 LYS 585 -13.869 -27.250 22.760 637 HZ1 LYS 585 HZ1 LYS 585 -13.943 -28.287 25.565 638 HZ2 LYS 585 HZ2 LYS 585 -12.699 -27.356 24.934 639 HZ3 LYS 585 HZ3 LYS 585 -13.012 -28.822 24.228 640 H THR 586 H THR 586 -14.495 -22.368 21.019 641 HA THR 586 HA THR 586 -13.891 -22.486 18.204 642 HB THR 586 HB THR 586 -15.836 -21.041 18.220 643 HG1 THR 586 HG1 THR 586 -13.859 -20.380 17.055 644 HG21 THR 586 HG21 THR 586 -14.426 -19.409 20.306 645 HG22 THR 586 HG22 THR 586 -15.844 -20.426 20.568 646 HG23 THR 586 HG23 THR 586 -15.961 -18.988 19.543 647 H PHE 587 H PHE 587 -12.039 -21.151 17.684 648 HA PHE 587 HA PHE 587 -10.522 -20.080 19.888 649 HB2 PHE 587 HB2 PHE 587 -8.482 -21.225 19.194 650 HB3 PHE 587 HB3 PHE 587 -9.707 -22.414 19.585 651 HD1 PHE 587 HD1 PHE 587 -10.808 -23.692 17.721 652 HD2 PHE 587 HD2 PHE 587 -7.515 -21.084 17.061 653 HE1 PHE 587 HE1 PHE 587 -10.358 -24.791 15.551 654 HE2 PHE 587 HE2 PHE 587 -7.076 -22.177 14.904 655 HZ PHE 587 HZ PHE 587 -8.500 -24.030 14.157 656 H PHE 588 H PHE 588 -8.409 -19.058 18.614 657 HA PHE 588 HA PHE 588 -9.645 -17.736 16.321 658 HB2 PHE 588 HB2 PHE 588 -7.975 -16.319 18.450 659 HB3 PHE 588 HB3 PHE 588 -8.618 -15.603 16.987 660 HD1 PHE 588 HD1 PHE 588 -10.996 -15.120 16.791 661 HD2 PHE 588 HD2 PHE 588 -9.344 -16.752 20.359 662 HE1 PHE 588 HE1 PHE 588 -13.028 -14.486 18.022 663 HE2 PHE 588 HE2 PHE 588 -11.375 -16.124 21.593 664 HZ PHE 588 HZ PHE 588 -13.221 -14.990 20.425 665 H LEU 589 H LEU 589 -8.187 -16.951 14.793 666 HA LEU 589 HA LEU 589 -5.525 -18.228 14.889 667 HB2 LEU 589 HB2 LEU 589 -7.529 -18.791 13.096 668 HB3 LEU 589 HB3 LEU 589 -6.710 -17.472 12.289 669 HG LEU 589 HG LEU 589 -5.900 -19.520 11.395 670 HD11 LEU 589 HD11 LEU 589 -3.815 -18.403 13.234 671 HD12 LEU 589 HD12 LEU 589 -4.210 -17.804 11.629 672 HD13 LEU 589 HD13 LEU 589 -3.519 -19.417 11.825 673 HD21 LEU 589 HD21 LEU 589 -5.318 -20.304 14.228 674 HD22 LEU 589 HD22 LEU 589 -4.819 -21.220 12.802 675 HD23 LEU 589 HD23 LEU 589 -6.535 -21.001 13.163 676 H GLU 590 H GLU 590 -3.895 -16.755 14.698 677 HA GLU 590 HA GLU 590 -4.609 -14.144 13.608 678 HB2 GLU 590 HB2 GLU 590 -4.368 -13.976 16.024 679 HB3 GLU 590 HB3 GLU 590 -2.753 -14.675 15.939 680 HG2 GLU 590 HG2 GLU 590 -2.023 -12.731 14.618 681 HG3 GLU 590 HG3 GLU 590 -3.639 -12.046 14.759 682 H ILE 591 H ILE 591 -3.303 -13.415 12.112 683 HA ILE 591 HA ILE 591 -0.964 -15.006 11.501 684 HB ILE 591 HB ILE 591 -0.967 -13.749 9.312 685 HG12 ILE 591 HG12 ILE 591 -3.725 -12.897 10.255 686 HG13 ILE 591 HG13 ILE 591 -2.355 -11.831 9.975 687 HG21 ILE 591 HG21 ILE 591 -2.731 -15.144 8.321 688 HG22 ILE 591 HG22 ILE 591 -3.351 -15.460 9.946 689 HG23 ILE 591 HG23 ILE 591 -1.749 -16.028 9.499 690 HD11 ILE 591 HD11 ILE 591 -2.447 -12.390 7.576 691 HD12 ILE 591 HD12 ILE 591 -3.954 -11.690 8.170 692 HD13 ILE 591 HD13 ILE 591 -3.845 -13.425 7.891 693 H GLY 592 H GLY 592 0.997 -14.062 11.241 694 HA2 GLY 592 HA2 GLY 592 1.299 -11.776 12.957 695 HA3 GLY 592 HA3 GLY 592 2.592 -12.808 12.361 696 H GLU 593 H GLU 593 3.098 -10.275 12.286 697 HA GLU 593 HA GLU 593 2.183 -8.984 9.962 698 HB2 GLU 593 HB2 GLU 593 4.476 -8.383 11.814 699 HB3 GLU 593 HB3 GLU 593 4.031 -7.350 10.457 700 HG2 GLU 593 HG2 GLU 593 1.829 -7.035 11.378 701 HG3 GLU 593 HG3 GLU 593 2.205 -8.107 12.721 702 HA PRO 594 HA PRO 594 4.416 -11.108 6.949 703 HB2 PRO 594 HB2 PRO 594 4.517 -9.088 5.069 704 HB3 PRO 594 HB3 PRO 594 3.138 -10.159 5.317 705 HG2 PRO 594 HG2 PRO 594 3.602 -7.397 6.316 706 HG3 PRO 594 HG3 PRO 594 2.101 -8.119 5.735 707 HD2 PRO 594 HD2 PRO 594 2.605 -7.757 8.323 708 HD3 PRO 594 HD3 PRO 594 1.689 -9.167 7.770 709 H ARG 595 H ARG 595 6.461 -11.517 6.783 710 HA ARG 595 HA ARG 595 8.377 -9.384 7.299 711 HB2 ARG 595 HB2 ARG 595 9.973 -11.202 7.947 712 HB3 ARG 595 HB3 ARG 595 8.559 -11.113 8.978 713 HG2 ARG 595 HG2 ARG 595 7.585 -13.022 7.677 714 HG3 ARG 595 HG3 ARG 595 9.120 -13.123 6.815 715 HD2 ARG 595 HD2 ARG 595 8.998 -14.765 8.635 716 HD3 ARG 595 HD3 ARG 595 10.288 -13.593 8.909 717 HE ARG 595 HE ARG 595 8.448 -12.453 10.332 718 HH11 ARG 595 HH11 ARG 595 8.836 -16.035 10.142 719 HH12 ARG 595 HH12 ARG 595 8.366 -16.227 11.756 720 HH21 ARG 595 HH21 ARG 595 7.788 -12.848 12.480 721 HH22 ARG 595 HH22 ARG 595 7.744 -14.440 13.111 722 H LEU 596 H LEU 596 9.432 -8.649 5.659 723 HA LEU 596 HA LEU 596 9.280 -9.711 3.079 724 HB2 LEU 596 HB2 LEU 596 9.630 -7.282 3.931 725 HB3 LEU 596 HB3 LEU 596 11.304 -7.756 4.108 726 HG LEU 596 HG LEU 596 10.742 -6.415 2.035 727 HD11 LEU 596 HD11 LEU 596 12.131 -7.716 0.524 728 HD12 LEU 596 HD12 LEU 596 11.960 -9.123 1.571 729 HD13 LEU 596 HD13 LEU 596 12.811 -7.688 2.152 730 HD21 LEU 596 HD21 LEU 596 8.623 -7.511 1.604 731 HD22 LEU 596 HD22 LEU 596 9.478 -8.999 1.197 732 HD23 LEU 596 HD23 LEU 596 9.682 -7.558 0.188 733 H VAL 597 H VAL 597 10.585 -11.126 2.101 734 HA VAL 597 HA VAL 597 12.728 -12.287 3.649 735 HB VAL 597 HB VAL 597 11.633 -13.093 0.941 736 HG11 VAL 597 HG11 VAL 597 12.780 -15.219 1.340 737 HG12 VAL 597 HG12 VAL 597 13.436 -14.581 2.848 738 HG13 VAL 597 HG13 VAL 597 13.924 -13.873 1.303 739 HG21 VAL 597 HG21 VAL 597 10.511 -14.879 2.157 740 HG22 VAL 597 HG22 VAL 597 9.952 -13.282 2.656 741 HG23 VAL 597 HG23 VAL 597 11.067 -14.191 3.685 742 H GLU 598 H GLU 598 14.641 -11.680 3.437 743 HA GLU 598 HA GLU 598 15.479 -9.474 2.026 744 HB2 GLU 598 HB2 GLU 598 16.422 -10.449 4.115 745 HB3 GLU 598 HB3 GLU 598 17.180 -11.690 3.138 746 HG2 GLU 598 HG2 GLU 598 18.527 -10.012 2.025 747 HG3 GLU 598 HG3 GLU 598 17.700 -8.749 2.926 748 H MET 599 H MET 599 15.536 -9.324 -0.050 749 HA MET 599 HA MET 599 15.965 -11.491 -1.857 750 HB2 MET 599 HB2 MET 599 14.436 -9.683 -2.446 751 HB3 MET 599 HB3 MET 599 15.719 -8.505 -2.289 752 HG2 MET 599 HG2 MET 599 15.828 -10.702 -4.344 753 HG3 MET 599 HG3 MET 599 14.980 -9.189 -4.628 754 HE1 MET 599 HE1 MET 599 17.864 -6.561 -4.573 755 HE2 MET 599 HE2 MET 599 16.815 -7.014 -3.238 756 HE3 MET 599 HE3 MET 599 16.148 -6.838 -4.864 757 H SER 600 H SER 600 17.762 -8.611 -0.925 758 HA SER 600 HA SER 600 20.113 -9.661 -2.258 759 HB2 SER 600 HB2 SER 600 19.494 -7.175 -2.347 760 HB3 SER 600 HB3 SER 600 19.846 -7.106 -0.623 761 HG SER 600 HG SER 600 21.555 -6.490 -2.120 762 H GLU 601 H GLU 601 19.834 -11.487 -0.876 763 HA GLU 601 HA GLU 601 19.897 -11.402 1.906 764 HB2 GLU 601 HB2 GLU 601 18.982 -13.225 0.555 765 HB3 GLU 601 HB3 GLU 601 20.596 -13.614 -0.001 766 HG2 GLU 601 HG2 GLU 601 21.247 -14.297 2.195 767 HG3 GLU 601 HG3 GLU 601 19.712 -13.729 2.862 768 H LYS 602 H LYS 602 21.412 -10.962 3.185 769 HA LYS 602 HA LYS 602 24.096 -10.696 2.262 770 HB2 LYS 602 HB2 LYS 602 24.625 -10.066 4.660 771 HB3 LYS 602 HB3 LYS 602 23.483 -9.037 3.827 772 HG2 LYS 602 HG2 LYS 602 22.705 -9.269 6.026 773 HG3 LYS 602 HG3 LYS 602 21.660 -10.284 5.044 774 HD2 LYS 602 HD2 LYS 602 22.924 -12.267 5.784 775 HD3 LYS 602 HD3 LYS 602 23.965 -11.226 6.762 776 HE2 LYS 602 HE2 LYS 602 22.025 -10.469 8.037 777 HE3 LYS 602 HE3 LYS 602 20.975 -11.506 7.076 778 HZ1 LYS 602 HZ1 LYS 602 21.490 -12.457 9.190 779 HZ2 LYS 602 HZ2 LYS 602 23.144 -12.410 8.901 780 HZ3 LYS 602 HZ3 LYS 602 22.158 -13.433 7.994 781 H LYS 603 H LYS 603 25.909 -11.629 3.631 782 HA LYS 603 HA LYS 603 25.213 -14.400 4.173 783 HB2 LYS 603 HB2 LYS 603 26.335 -14.331 2.030 784 HB3 LYS 603 HB3 LYS 603 27.653 -13.392 2.700 785 HG2 LYS 603 HG2 LYS 603 28.301 -15.716 2.389 786 HG3 LYS 603 HG3 LYS 603 28.305 -15.291 4.099 787 HD2 LYS 603 HD2 LYS 603 26.118 -16.355 4.364 788 HD3 LYS 603 HD3 LYS 603 26.106 -16.777 2.651 789 HE2 LYS 603 HE2 LYS 603 28.139 -18.113 3.004 790 HE3 LYS 603 HE3 LYS 603 28.087 -17.705 4.719 791 HZ1 LYS 603 HZ1 LYS 603 26.006 -19.217 3.238 792 HZ2 LYS 603 HZ2 LYS 603 25.949 -18.830 4.877 793 HZ3 LYS 603 HZ3 LYS 603 27.138 -19.873 4.303 794 H GLY 604 H GLY 604 25.589 -14.892 6.174 795 HA2 GLY 604 HA2 GLY 604 27.583 -13.426 7.717 796 HA3 GLY 604 HA3 GLY 604 26.429 -14.610 8.349 797 H GLY 605 H GLY 605 29.351 -14.214 6.461 798 HA2 GLY 605 HA2 GLY 605 29.766 -16.946 5.984 799 HA3 GLY 605 HA3 GLY 605 30.965 -15.679 5.822 800 H PHE 606 H PHE 606 31.227 -18.345 6.805 801 HA PHE 606 HA PHE 606 31.588 -18.292 9.623 802 HB2 PHE 606 HB2 PHE 606 31.143 -20.390 8.482 803 HB3 PHE 606 HB3 PHE 606 32.555 -20.185 7.463 804 HD1 PHE 606 HD1 PHE 606 31.879 -20.154 11.148 805 HD2 PHE 606 HD2 PHE 606 34.226 -21.648 7.935 806 HE1 PHE 606 HE1 PHE 606 33.207 -21.477 12.737 807 HE2 PHE 606 HE2 PHE 606 35.561 -22.967 9.519 808 HZ PHE 606 HZ PHE 606 35.058 -22.886 11.913 809 H THR 607 H THR 607 33.435 -17.974 10.800 810 HA THR 607 HA THR 607 35.532 -16.438 9.598 811 HB THR 607 HB THR 607 36.202 -16.471 12.141 812 HG1 THR 607 HG1 THR 607 34.933 -17.784 13.205 813 HG21 THR 607 HG21 THR 607 34.571 -14.682 12.577 814 HG22 THR 607 HG22 THR 607 33.638 -15.188 11.165 815 HG23 THR 607 HG23 THR 607 35.259 -14.523 10.961 816 H ILE 608 H ILE 608 37.683 -17.168 11.309 817 HA ILE 608 HA ILE 608 38.838 -19.312 9.925 818 HB ILE 608 HB ILE 608 40.621 -19.290 11.656 819 HG12 ILE 608 HG12 ILE 608 38.967 -17.096 12.944 820 HG13 ILE 608 HG13 ILE 608 39.179 -18.713 13.596 821 HG21 ILE 608 HG21 ILE 608 40.771 -17.832 9.731 822 HG22 ILE 608 HG22 ILE 608 41.453 -17.049 11.157 823 HG23 ILE 608 HG23 ILE 608 39.851 -16.588 10.582 824 HD11 ILE 608 HD11 ILE 608 41.570 -18.289 13.858 825 HD12 ILE 608 HD12 ILE 608 40.602 -17.093 14.723 826 HD13 ILE 608 HD13 ILE 608 41.356 -16.674 13.186 827 H THR 609 H THR 609 39.556 -21.365 10.702 828 HA THR 609 HA THR 609 37.534 -22.753 12.134 829 HB THR 609 HB THR 609 39.214 -24.671 11.727 830 HG1 THR 609 HG1 THR 609 41.052 -23.595 11.344 831 HG21 THR 609 HG21 THR 609 37.219 -24.324 10.336 832 HG22 THR 609 HG22 THR 609 38.593 -24.808 9.340 833 HG23 THR 609 HG23 THR 609 38.088 -23.120 9.386 834 H GLU 610 H GLU 610 37.555 -23.319 14.236 835 HA GLU 610 HA GLU 610 39.960 -23.536 15.780 836 HB2 GLU 610 HB2 GLU 610 39.331 -21.859 17.437 837 HB3 GLU 610 HB3 GLU 610 39.421 -21.070 15.867 838 HG2 GLU 610 HG2 GLU 610 36.971 -21.226 15.674 839 HG3 GLU 610 HG3 GLU 610 36.908 -21.962 17.269 840 H GLU 611 H GLU 611 39.109 -24.172 18.121 841 HA GLU 611 HA GLU 611 36.797 -25.834 17.688 842 HB2 GLU 611 HB2 GLU 611 37.234 -26.782 19.932 843 HB3 GLU 611 HB3 GLU 611 38.627 -26.897 18.878 844 HG2 GLU 611 HG2 GLU 611 39.732 -25.116 20.035 845 HG3 GLU 611 HG3 GLU 611 38.283 -24.771 20.974 846 H TYR 612 H TYR 612 34.926 -24.938 17.832 847 HA TYR 612 HA TYR 612 34.479 -22.929 19.917 848 HB2 TYR 612 HB2 TYR 612 32.707 -21.980 18.349 849 HB3 TYR 612 HB3 TYR 612 34.376 -21.736 17.849 850 HD1 TYR 612 HD2 TYR 612 31.282 -23.656 17.177 851 HD2 TYR 612 HD1 TYR 612 35.204 -22.702 15.855 852 HE1 TYR 612 HE2 TYR 612 30.811 -24.720 15.012 853 HE2 TYR 612 HE1 TYR 612 34.751 -23.759 13.705 854 HH TYR 612 HH TYR 612 31.656 -24.641 12.689 855 H ASP 613 H ASP 613 32.185 -22.764 20.549 856 HA ASP 613 HA ASP 613 31.109 -25.455 20.895 857 HB2 ASP 613 HB2 ASP 613 31.519 -24.038 22.920 858 HB3 ASP 613 HB3 ASP 613 30.375 -22.860 22.294 859 H ASP 614 H ASP 614 28.848 -25.793 20.521 860 HA ASP 614 HA ASP 614 27.872 -24.628 18.137 861 HB2 ASP 614 HB2 ASP 614 27.283 -26.915 18.868 862 HB3 ASP 614 HB3 ASP 614 26.402 -26.242 20.234 863 H LYS 615 H LYS 615 27.407 -22.518 18.121 864 HA LYS 615 HA LYS 615 25.705 -21.459 20.268 865 HB2 LYS 615 HB2 LYS 615 28.097 -20.109 19.018 866 HB3 LYS 615 HB3 LYS 615 26.957 -19.319 20.085 867 HG2 LYS 615 HG2 LYS 615 28.654 -21.694 20.851 868 HG3 LYS 615 HG3 LYS 615 29.071 -20.012 21.176 869 HD2 LYS 615 HD2 LYS 615 26.548 -21.350 22.171 870 HD3 LYS 615 HD3 LYS 615 28.035 -21.229 23.105 871 HE2 LYS 615 HE2 LYS 615 26.469 -18.874 22.028 872 HE3 LYS 615 HE3 LYS 615 26.392 -19.466 23.679 873 HZ1 LYS 615 HZ1 LYS 615 28.832 -18.431 22.347 874 HZ2 LYS 615 HZ2 LYS 615 28.743 -18.959 23.938 875 HZ3 LYS 615 HZ3 LYS 615 27.893 -17.588 23.445 876 H GLN 616 H GLN 616 23.888 -20.948 19.417 877 HA GLN 616 HA GLN 616 23.626 -19.866 16.747 878 HB2 GLN 616 HB2 GLN 616 21.218 -19.852 17.213 879 HB3 GLN 616 HB3 GLN 616 21.867 -21.400 17.700 880 HG2 GLN 616 HG2 GLN 616 21.248 -19.118 19.574 881 HG3 GLN 616 HG3 GLN 616 20.180 -20.479 19.257 882 HE21 GLN 616 HE21 GLN 616 21.395 -19.561 21.731 883 HE22 GLN 616 HE22 GLN 616 22.285 -20.897 22.365 884 HA PRO 617 HA PRO 617 23.801 -15.602 17.964 885 HB2 PRO 617 HB2 PRO 617 21.134 -14.960 16.874 886 HB3 PRO 617 HB3 PRO 617 22.715 -14.327 16.408 887 HG2 PRO 617 HG2 PRO 617 21.388 -16.041 14.833 888 HG3 PRO 617 HG3 PRO 617 23.153 -16.092 14.976 889 HD2 PRO 617 HD2 PRO 617 21.096 -17.848 16.258 890 HD3 PRO 617 HD3 PRO 617 22.665 -18.285 15.545 891 H LEU 618 H LEU 618 23.621 -16.079 20.164 892 HA LEU 618 HA LEU 618 21.080 -15.588 21.487 893 HB2 LEU 618 HB2 LEU 618 22.838 -17.332 22.219 894 HB3 LEU 618 HB3 LEU 618 23.836 -15.989 22.702 895 HG LEU 618 HG LEU 618 21.139 -16.642 23.926 896 HD11 LEU 618 HD11 LEU 618 22.752 -18.400 24.355 897 HD12 LEU 618 HD12 LEU 618 22.421 -17.481 25.825 898 HD13 LEU 618 HD13 LEU 618 23.919 -17.211 24.934 899 HD21 LEU 618 HD21 LEU 618 21.784 -14.274 24.176 900 HD22 LEU 618 HD22 LEU 618 23.328 -14.778 24.868 901 HD23 LEU 618 HD23 LEU 618 21.823 -15.126 25.721 902 H THR 619 H THR 619 24.355 -14.310 21.350 903 HA THR 619 HA THR 619 23.547 -11.761 22.409 904 HB THR 619 HB THR 619 26.227 -12.657 21.306 905 HG1 THR 619 HG1 THR 619 26.160 -13.898 23.024 906 HG21 THR 619 HG21 THR 619 25.929 -10.208 21.522 907 HG22 THR 619 HG22 THR 619 27.121 -10.828 22.661 908 HG23 THR 619 HG23 THR 619 25.496 -10.424 23.220 909 H SER 620 H SER 620 22.257 -10.794 20.886 910 HA SER 620 HA SER 620 23.391 -10.605 18.217 911 HB2 SER 620 HB2 SER 620 20.489 -10.484 19.017 912 HB3 SER 620 HB3 SER 620 21.110 -10.252 17.381 913 HG SER 620 HG SER 620 21.588 -12.293 17.216 914 H LYS 621 H LYS 621 24.667 -8.865 18.693 915 HA LYS 621 HA LYS 621 23.383 -6.279 19.136 916 HB2 LYS 621 HB2 LYS 621 26.286 -7.114 18.841 917 HB3 LYS 621 HB3 LYS 621 25.759 -5.469 19.148 918 HG2 LYS 621 HG2 LYS 621 24.857 -6.114 21.303 919 HG3 LYS 621 HG3 LYS 621 25.265 -7.801 20.991 920 HD2 LYS 621 HD2 LYS 621 27.277 -5.552 21.168 921 HD3 LYS 621 HD3 LYS 621 26.876 -6.642 22.495 922 HE2 LYS 621 HE2 LYS 621 27.603 -8.550 21.110 923 HE3 LYS 621 HE3 LYS 621 28.041 -7.431 19.825 924 HZ1 LYS 621 HZ1 LYS 621 29.234 -7.451 22.538 925 HZ2 LYS 621 HZ2 LYS 621 29.721 -6.468 21.251 926 HZ3 LYS 621 HZ3 LYS 621 29.934 -8.128 21.182 927 H GLU 622 H GLU 622 22.812 -7.830 16.893 928 HA GLU 622 HA GLU 622 24.303 -6.973 14.582 929 HB2 GLU 622 HB2 GLU 622 23.286 -9.248 14.843 930 HB3 GLU 622 HB3 GLU 622 21.701 -8.493 14.802 931 HG2 GLU 622 HG2 GLU 622 22.120 -9.359 12.643 932 HG3 GLU 622 HG3 GLU 622 22.289 -7.606 12.533 933 H GLU 623 H GLU 623 23.827 -5.114 13.576 934 HA GLU 623 HA GLU 623 21.262 -3.862 14.112 935 HB2 GLU 623 HB2 GLU 623 23.667 -2.834 12.599 936 HB3 GLU 623 HB3 GLU 623 22.211 -1.920 12.953 937 HG2 GLU 623 HG2 GLU 623 22.677 -2.129 15.338 938 HG3 GLU 623 HG3 GLU 623 24.169 -2.992 14.957 939 H GLU 624 H GLU 624 19.849 -4.979 12.910 940 HA GLU 624 HA GLU 624 20.506 -5.720 10.222 941 HB2 GLU 624 HB2 GLU 624 17.872 -5.894 11.699 942 HB3 GLU 624 HB3 GLU 624 18.209 -6.597 10.123 943 HG2 GLU 624 HG2 GLU 624 19.923 -8.030 11.154 944 HG3 GLU 624 HG3 GLU 624 19.511 -7.361 12.729 945 H GLU 625 H GLU 625 18.949 -5.141 8.496 946 HA GLU 625 HA GLU 625 18.577 -2.256 8.555 947 HB2 GLU 625 HB2 GLU 625 18.455 -2.459 6.062 948 HB3 GLU 625 HB3 GLU 625 19.986 -2.956 6.745 949 HG2 GLU 625 HG2 GLU 625 17.815 -4.887 5.944 950 HG3 GLU 625 HG3 GLU 625 19.106 -4.368 4.864 951 H ARG 626 H ARG 626 16.696 -4.150 9.790 952 HA ARG 626 HA ARG 626 14.441 -4.371 8.014 953 HB2 ARG 626 HB2 ARG 626 14.308 -4.564 11.028 954 HB3 ARG 626 HB3 ARG 626 13.218 -5.275 9.857 955 HG2 ARG 626 HG2 ARG 626 16.053 -6.104 10.420 956 HG3 ARG 626 HG3 ARG 626 14.588 -6.977 10.845 957 HD2 ARG 626 HD2 ARG 626 14.113 -7.372 8.487 958 HD3 ARG 626 HD3 ARG 626 15.523 -6.409 8.024 959 HE ARG 626 HE ARG 626 15.858 -8.710 9.767 960 HH11 ARG 626 HH11 ARG 626 16.332 -7.478 6.444 961 HH12 ARG 626 HH12 ARG 626 17.698 -8.451 6.147 962 HH21 ARG 626 HH21 ARG 626 17.711 -10.003 9.340 963 HH22 ARG 626 HH22 ARG 626 18.515 -9.905 7.841 964 H ARG 627 H ARG 627 15.628 -2.125 10.363 965 HA ARG 627 HA ARG 627 13.323 -0.463 10.575 966 HB2 ARG 627 HB2 ARG 627 15.409 -0.646 12.162 967 HB3 ARG 627 HB3 ARG 627 16.211 0.340 10.962 968 HG2 ARG 627 HG2 ARG 627 13.760 1.223 12.462 969 HG3 ARG 627 HG3 ARG 627 15.405 1.571 12.972 970 HD2 ARG 627 HD2 ARG 627 14.205 2.295 10.351 971 HD3 ARG 627 HD3 ARG 627 14.316 3.445 11.709 972 HE ARG 627 HE ARG 627 16.868 2.717 11.326 973 HH11 ARG 627 HH11 ARG 627 14.415 3.683 8.932 974 HH12 ARG 627 HH12 ARG 627 15.532 4.384 7.860 975 HH21 ARG 627 HH21 ARG 627 18.400 3.678 9.806 976 HH22 ARG 627 HH22 ARG 627 17.824 4.371 8.355 977 H ILE 628 H ILE 628 16.108 -0.691 8.514 978 HA ILE 628 HA ILE 628 15.744 1.840 7.230 979 HB ILE 628 HB ILE 628 17.332 -0.573 6.279 980 HG12 ILE 628 HG12 ILE 628 18.247 1.831 7.887 981 HG13 ILE 628 HG13 ILE 628 18.029 0.207 8.524 982 HG21 ILE 628 HG21 ILE 628 18.586 1.051 4.950 983 HG22 ILE 628 HG22 ILE 628 17.536 2.342 5.531 984 HG23 ILE 628 HG23 ILE 628 16.875 1.061 4.516 985 HD11 ILE 628 HD11 ILE 628 20.030 1.037 6.427 986 HD12 ILE 628 HD12 ILE 628 19.821 -0.595 7.056 987 HD13 ILE 628 HD13 ILE 628 20.376 0.695 8.121 988 H ALA 629 H ALA 629 14.903 -1.477 6.571 989 HA ALA 629 HA ALA 629 13.660 -0.933 4.056 990 HB1 ALA 629 HB1 ALA 629 14.770 -3.068 4.518 991 HB2 ALA 629 HB2 ALA 629 13.081 -3.285 4.062 992 HB3 ALA 629 HB3 ALA 629 13.562 -3.419 5.754 993 H GLU 630 H GLU 630 12.627 -0.611 7.301 994 HA GLU 630 HA GLU 630 9.976 -1.524 6.948 995 HB2 GLU 630 HB2 GLU 630 9.426 -0.731 9.104 996 HB3 GLU 630 HB3 GLU 630 11.079 -1.299 9.191 997 HG2 GLU 630 HG2 GLU 630 11.903 0.944 9.194 998 HG3 GLU 630 HG3 GLU 630 10.273 1.575 8.944 999 H MET 631 H MET 631 11.435 1.208 5.832 1000 HA MET 631 HA MET 631 9.119 2.862 5.846 1001 HB2 MET 631 HB2 MET 631 10.376 4.302 4.219 1002 HB3 MET 631 HB3 MET 631 11.181 4.027 5.750 1003 HG2 MET 631 HG2 MET 631 12.784 3.978 4.047 1004 HG3 MET 631 HG3 MET 631 12.602 2.330 4.624 1005 HE1 MET 631 HE1 MET 631 14.152 3.033 1.993 1006 HE2 MET 631 HE2 MET 631 13.536 1.812 0.879 1007 HE3 MET 631 HE3 MET 631 13.895 1.381 2.552 1008 H GLY 632 H GLY 632 9.997 0.169 4.085 1009 HA2 GLY 632 HA2 GLY 632 7.716 0.528 2.339 1010 HA3 GLY 632 HA3 GLY 632 9.287 0.284 1.578 1011 H ARG 633 H ARG 633 7.670 -1.085 4.403 1012 HA ARG 633 HA ARG 633 8.585 -3.723 3.518 1013 HB2 ARG 633 HB2 ARG 633 8.183 -4.479 5.843 1014 HB3 ARG 633 HB3 ARG 633 9.339 -3.164 5.781 1015 HG2 ARG 633 HG2 ARG 633 7.814 -1.646 6.720 1016 HG3 ARG 633 HG3 ARG 633 6.436 -2.676 6.346 1017 HD2 ARG 633 HD2 ARG 633 7.074 -2.656 8.766 1018 HD3 ARG 633 HD3 ARG 633 7.055 -4.253 8.027 1019 HE ARG 633 HE ARG 633 9.610 -3.669 7.788 1020 HH11 ARG 633 HH11 ARG 633 7.520 -3.123 10.593 1021 HH12 ARG 633 HH12 ARG 633 8.741 -3.405 11.739 1022 HH21 ARG 633 HH21 ARG 633 11.272 -4.045 9.346 1023 HH22 ARG 633 HH22 ARG 633 10.939 -3.961 11.024 1024 HA PRO 634 HA PRO 634 4.384 -4.878 2.860 1025 HB2 PRO 634 HB2 PRO 634 4.362 -7.484 3.613 1026 HB3 PRO 634 HB3 PRO 634 5.090 -6.929 2.101 1027 HG2 PRO 634 HG2 PRO 634 6.418 -7.613 4.695 1028 HG3 PRO 634 HG3 PRO 634 6.937 -7.979 3.046 1029 HD2 PRO 634 HD2 PRO 634 7.982 -5.932 4.475 1030 HD3 PRO 634 HD3 PRO 634 7.834 -5.888 2.713 1031 H ILE 635 H ILE 635 2.564 -4.741 3.905 1032 HA ILE 635 HA ILE 635 2.625 -5.170 6.765 1033 HB ILE 635 HB ILE 635 1.058 -3.194 6.998 1034 HG12 ILE 635 HG12 ILE 635 1.353 -1.382 5.192 1035 HG13 ILE 635 HG13 ILE 635 1.958 -2.659 4.153 1036 HG21 ILE 635 HG21 ILE 635 3.350 -3.024 7.697 1037 HG22 ILE 635 HG22 ILE 635 2.893 -1.510 6.902 1038 HG23 ILE 635 HG23 ILE 635 3.850 -2.715 6.036 1039 HD11 ILE 635 HD11 ILE 635 -0.208 -3.778 4.291 1040 HD12 ILE 635 HD12 ILE 635 -0.348 -2.135 3.668 1041 HD13 ILE 635 HD13 ILE 635 -0.798 -2.488 5.339 1042 H LEU 636 H LEU 636 0.272 -5.181 7.608 1043 HA LEU 636 HA LEU 636 -1.198 -6.841 5.743 1044 HB2 LEU 636 HB2 LEU 636 -2.223 -7.898 7.843 1045 HB3 LEU 636 HB3 LEU 636 -0.613 -8.360 7.370 1046 HG LEU 636 HG LEU 636 0.298 -6.874 9.155 1047 HD11 LEU 636 HD11 LEU 636 -2.576 -6.579 9.995 1048 HD12 LEU 636 HD12 LEU 636 -1.546 -5.307 9.342 1049 HD13 LEU 636 HD13 LEU 636 -1.158 -6.039 10.902 1050 HD21 LEU 636 HD21 LEU 636 -0.293 -8.338 10.997 1051 HD22 LEU 636 HD22 LEU 636 -0.033 -9.259 9.512 1052 HD23 LEU 636 HD23 LEU 636 -1.672 -8.939 10.081 1053 H GLY 637 H GLY 637 -3.625 -7.089 6.782 1054 HA2 GLY 637 HA2 GLY 637 -4.765 -4.620 5.986 1055 HA3 GLY 637 HA3 GLY 637 -5.598 -6.085 6.473 1056 H GLU 638 H GLU 638 -6.983 -4.308 7.301 1057 HA GLU 638 HA GLU 638 -6.250 -2.719 9.513 1058 HB2 GLU 638 HB2 GLU 638 -8.076 -2.221 7.893 1059 HB3 GLU 638 HB3 GLU 638 -8.994 -3.553 8.566 1060 HG2 GLU 638 HG2 GLU 638 -9.094 -2.395 10.719 1061 HG3 GLU 638 HG3 GLU 638 -8.170 -1.060 10.034 1062 H HIS 639 H HIS 639 -8.300 -5.647 9.281 1063 HA HIS 639 HA HIS 639 -7.614 -6.208 12.091 1064 HB2 HIS 639 HB2 HIS 639 -10.202 -6.857 10.634 1065 HB3 HIS 639 HB3 HIS 639 -9.755 -7.555 12.175 1066 HD1 HIS 639 HD1 HIS 639 -10.443 -6.249 14.232 1067 HD2 HIS 639 HD2 HIS 639 -10.653 -4.010 10.739 1068 HE1 HIS 639 HE1 HIS 639 -11.599 -4.094 14.845 1069 H THR 640 H THR 640 -6.373 -7.943 12.254 1070 HA THR 640 HA THR 640 -6.722 -9.994 10.226 1071 HB THR 640 HB THR 640 -4.296 -10.579 10.676 1072 HG1 THR 640 HG1 THR 640 -4.446 -8.846 12.509 1073 HG21 THR 640 HG21 THR 640 -4.896 -7.931 9.353 1074 HG22 THR 640 HG22 THR 640 -5.095 -9.521 8.624 1075 HG23 THR 640 HG23 THR 640 -3.481 -8.947 9.047 1076 H LYS 641 H LYS 641 -8.042 -11.326 11.266 1077 HA LYS 641 HA LYS 641 -7.011 -12.959 13.333 1078 HB2 LYS 641 HB2 LYS 641 -7.779 -10.891 14.614 1079 HB3 LYS 641 HB3 LYS 641 -9.399 -11.223 14.020 1080 HG2 LYS 641 HG2 LYS 641 -9.229 -13.485 15.127 1081 HG3 LYS 641 HG3 LYS 641 -7.739 -12.921 15.878 1082 HD2 LYS 641 HD2 LYS 641 -9.530 -12.631 17.442 1083 HD3 LYS 641 HD3 LYS 641 -9.048 -11.031 16.876 1084 HE2 LYS 641 HE2 LYS 641 -10.939 -10.991 15.327 1085 HE3 LYS 641 HE3 LYS 641 -11.386 -12.625 15.813 1086 HZ1 LYS 641 HZ1 LYS 641 -11.835 -11.758 18.051 1087 HZ2 LYS 641 HZ2 LYS 641 -12.749 -10.970 16.878 1088 HZ3 LYS 641 HZ3 LYS 641 -11.409 -10.214 17.527 1089 H LEU 642 H LEU 642 -8.363 -14.726 13.554 1090 HA LEU 642 HA LEU 642 -10.745 -14.836 11.850 1091 HB2 LEU 642 HB2 LEU 642 -8.816 -15.881 10.747 1092 HB3 LEU 642 HB3 LEU 642 -8.564 -16.856 12.176 1093 HG LEU 642 HG LEU 642 -10.791 -17.923 11.754 1094 HD11 LEU 642 HD11 LEU 642 -11.782 -16.195 10.394 1095 HD12 LEU 642 HD12 LEU 642 -11.726 -17.741 9.545 1096 HD13 LEU 642 HD13 LEU 642 -10.570 -16.477 9.144 1097 HD21 LEU 642 HD21 LEU 642 -9.952 -19.297 9.926 1098 HD22 LEU 642 HD22 LEU 642 -8.749 -19.022 11.185 1099 HD23 LEU 642 HD23 LEU 642 -8.647 -18.133 9.662 1100 H GLU 643 H GLU 643 -12.400 -15.655 12.977 1101 HA GLU 643 HA GLU 643 -11.888 -16.967 15.546 1102 HB2 GLU 643 HB2 GLU 643 -13.491 -15.062 15.430 1103 HB3 GLU 643 HB3 GLU 643 -14.451 -15.978 14.287 1104 HG2 GLU 643 HG2 GLU 643 -14.917 -17.643 16.007 1105 HG3 GLU 643 HG3 GLU 643 -13.922 -16.741 17.149 1106 H VAL 644 H VAL 644 -11.676 -19.128 15.322 1107 HA VAL 644 HA VAL 644 -13.082 -20.433 13.105 1108 HB VAL 644 HB VAL 644 -10.872 -21.564 14.828 1109 HG11 VAL 644 HG11 VAL 644 -10.748 -23.324 13.207 1110 HG12 VAL 644 HG12 VAL 644 -11.963 -22.539 12.198 1111 HG13 VAL 644 HG13 VAL 644 -12.410 -23.187 13.780 1112 HG21 VAL 644 HG21 VAL 644 -9.382 -21.208 12.916 1113 HG22 VAL 644 HG22 VAL 644 -10.031 -19.675 13.511 1114 HG23 VAL 644 HG23 VAL 644 -10.689 -20.405 12.050 1115 H ILE 645 H ILE 645 -14.927 -21.200 13.716 1116 HA ILE 645 HA ILE 645 -15.301 -22.173 16.460 1117 HB ILE 645 HB ILE 645 -17.392 -21.814 14.295 1118 HG12 ILE 645 HG12 ILE 645 -16.641 -19.822 16.444 1119 HG13 ILE 645 HG13 ILE 645 -16.106 -19.701 14.775 1120 HG21 ILE 645 HG21 ILE 645 -18.926 -21.709 16.220 1121 HG22 ILE 645 HG22 ILE 645 -17.566 -21.892 17.327 1122 HG23 ILE 645 HG23 ILE 645 -18.002 -23.211 16.245 1123 HD11 ILE 645 HD11 ILE 645 -18.413 -19.545 14.058 1124 HD12 ILE 645 HD12 ILE 645 -17.965 -18.261 15.175 1125 HD13 ILE 645 HD13 ILE 645 -18.949 -19.623 15.743 1126 H ILE 646 H ILE 646 -15.400 -24.305 16.842 1127 HA ILE 646 HA ILE 646 -15.233 -26.120 14.542 1128 HB ILE 646 HB ILE 646 -14.726 -26.710 17.493 1129 HG12 ILE 646 HG12 ILE 646 -12.680 -26.319 15.293 1130 HG13 ILE 646 HG13 ILE 646 -13.099 -25.081 16.469 1131 HG21 ILE 646 HG21 ILE 646 -13.690 -28.762 16.679 1132 HG22 ILE 646 HG22 ILE 646 -14.143 -28.335 15.029 1133 HG23 ILE 646 HG23 ILE 646 -15.394 -28.666 16.228 1134 HD11 ILE 646 HD11 ILE 646 -11.910 -27.778 17.111 1135 HD12 ILE 646 HD12 ILE 646 -12.295 -26.505 18.271 1136 HD13 ILE 646 HD13 ILE 646 -11.040 -26.243 17.065 1137 H GLU 647 H GLU 647 -17.258 -26.678 13.924 1138 HA GLU 647 HA GLU 647 -19.204 -27.104 16.072 1139 HB2 GLU 647 HB2 GLU 647 -19.803 -26.330 13.240 1140 HB3 GLU 647 HB3 GLU 647 -20.922 -26.374 14.588 1141 HG2 GLU 647 HG2 GLU 647 -19.591 -24.590 15.678 1142 HG3 GLU 647 HG3 GLU 647 -18.622 -24.479 14.207 1143 H GLU 648 H GLU 648 -20.267 -28.972 16.133 1144 HA GLU 648 HA GLU 648 -19.436 -31.127 14.509 1145 HB2 GLU 648 HB2 GLU 648 -19.957 -31.614 16.670 1146 HB3 GLU 648 HB3 GLU 648 -21.541 -30.814 16.647 1147 HG2 GLU 648 HG2 GLU 648 -22.315 -32.602 15.110 1148 HG3 GLU 648 HG3 GLU 648 -20.744 -33.384 15.257 1149 H SER 649 H SER 649 -20.170 -31.594 12.592 1150 HA SER 649 HA SER 649 -22.769 -30.530 11.710 1151 HB2 SER 649 HB2 SER 649 -20.133 -30.200 10.299 1152 HB3 SER 649 HB3 SER 649 -21.695 -29.578 9.755 1153 HG SER 649 HG SER 649 -20.224 -28.881 12.062 1154 H TYR 650 H TYR 650 -21.884 -33.345 12.268 1155 HA TYR 650 HA TYR 650 -21.121 -34.836 10.006 1156 HB2 TYR 650 HB2 TYR 650 -23.103 -35.681 12.119 1157 HB3 TYR 650 HB3 TYR 650 -22.356 -36.752 10.953 1158 HD1 TYR 650 HD1 TYR 650 -19.878 -37.068 11.068 1159 HD2 TYR 650 HD2 TYR 650 -22.130 -35.187 14.084 1160 HE1 TYR 650 HE1 TYR 650 -18.045 -37.503 12.673 1161 HE2 TYR 650 HE2 TYR 650 -20.331 -35.589 15.717 1162 HH TYR 650 HH TYR 650 -17.261 -36.467 14.744 1163 H GLU 651 H GLU 651 -24.269 -33.785 11.063 1164 HA GLU 651 HA GLU 651 -25.815 -35.175 9.226 1165 HB2 GLU 651 HB2 GLU 651 -26.404 -32.528 10.533 1166 HB3 GLU 651 HB3 GLU 651 -27.584 -33.535 9.715 1167 HG2 GLU 651 HG2 GLU 651 -27.236 -35.280 11.376 1168 HG3 GLU 651 HG3 GLU 651 -26.048 -34.270 12.192 1169 H PHE 652 H PHE 652 -24.270 -32.071 9.130 1170 HA PHE 652 HA PHE 652 -25.621 -31.192 6.734 1171 HB2 PHE 652 HB2 PHE 652 -23.468 -29.859 8.384 1172 HB3 PHE 652 HB3 PHE 652 -24.361 -29.112 7.065 1173 HD1 PHE 652 HD2 PHE 652 -24.564 -30.339 10.525 1174 HD2 PHE 652 HD1 PHE 652 -26.611 -28.346 7.378 1175 HE1 PHE 652 HE2 PHE 652 -26.288 -29.615 12.118 1176 HE2 PHE 652 HE1 PHE 652 -28.344 -27.615 8.966 1177 HZ PHE 652 HZ PHE 652 -28.184 -28.250 11.338 1178 H LYS 653 H LYS 653 -22.175 -31.412 7.672 1179 HA LYS 653 HA LYS 653 -21.383 -32.726 5.330 1180 HB2 LYS 653 HB2 LYS 653 -21.895 -30.446 4.382 1181 HB3 LYS 653 HB3 LYS 653 -20.691 -29.779 5.467 1182 HG2 LYS 653 HG2 LYS 653 -19.796 -30.035 3.222 1183 HG3 LYS 653 HG3 LYS 653 -18.946 -31.071 4.363 1184 HD2 LYS 653 HD2 LYS 653 -19.391 -32.252 2.264 1185 HD3 LYS 653 HD3 LYS 653 -20.253 -32.996 3.603 1186 HE2 LYS 653 HE2 LYS 653 -22.318 -31.883 2.919 1187 HE3 LYS 653 HE3 LYS 653 -21.464 -31.077 1.605 1188 HZ1 LYS 653 HZ1 LYS 653 -22.701 -33.017 0.873 1189 HZ2 LYS 653 HZ2 LYS 653 -21.808 -34.017 1.885 1190 HZ3 LYS 653 HZ3 LYS 653 -21.055 -33.213 0.591 1191 H SER 654 H SER 654 -19.556 -33.722 5.880 1192 HA SER 654 HA SER 654 -18.365 -33.073 8.388 1193 HB2 SER 654 HB2 SER 654 -17.823 -35.284 6.415 1194 HB3 SER 654 HB3 SER 654 -17.145 -35.196 8.028 1195 HG SER 654 HG SER 654 -19.063 -35.516 8.902 1196 H THR 655 H THR 655 -16.953 -33.709 5.129 1197 HA THR 655 HA THR 655 -15.205 -31.473 5.574 1198 HB THR 655 HB THR 655 -14.031 -33.372 6.673 1199 HG1 THR 655 HG1 THR 655 -12.183 -32.735 5.959 1200 HG21 THR 655 HG21 THR 655 -13.104 -35.188 5.289 1201 HG22 THR 655 HG22 THR 655 -14.046 -34.597 3.917 1202 HG23 THR 655 HG23 THR 655 -14.867 -35.219 5.351 1203 H VAL 656 H VAL 656 -13.972 -30.992 3.644 1204 HA VAL 656 HA VAL 656 -15.041 -32.146 1.188 1205 HB VAL 656 HB VAL 656 -14.626 -29.182 1.713 1206 HG11 VAL 656 HG11 VAL 656 -15.714 -30.585 -0.719 1207 HG12 VAL 656 HG12 VAL 656 -14.117 -29.862 -0.567 1208 HG13 VAL 656 HG13 VAL 656 -15.554 -28.837 -0.510 1209 HG21 VAL 656 HG21 VAL 656 -17.217 -30.688 1.317 1210 HG22 VAL 656 HG22 VAL 656 -17.060 -28.938 1.460 1211 HG23 VAL 656 HG23 VAL 656 -16.655 -29.976 2.827 1212 H ASP 657 H ASP 657 -13.278 -32.958 0.211 1213 HA ASP 657 HA ASP 657 -10.637 -31.915 0.839 1214 HB2 ASP 657 HB2 ASP 657 -9.726 -33.786 -0.308 1215 HB3 ASP 657 HB3 ASP 657 -11.159 -34.406 0.497 Start of MODEL 6 1 H HIS 501 H HIS 501 1.390 -0.199 0.365 2 HA HIS 501 HA HIS 501 3.568 0.883 -0.740 3 HB2 HIS 501 HB2 HIS 501 4.692 0.818 1.468 4 HB3 HIS 501 HB3 HIS 501 4.470 -0.922 1.524 5 HD1 HIS 501 HD1 HIS 501 6.621 1.736 -0.029 6 HD2 HIS 501 HD2 HIS 501 6.237 -2.404 -0.061 7 HE1 HIS 501 HE1 HIS 501 8.714 0.849 -1.100 8 H ALA 502 H ALA 502 2.351 -2.106 0.563 9 HA ALA 502 HA ALA 502 3.058 -3.439 -1.966 10 HB1 ALA 502 HB1 ALA 502 3.226 -5.511 -0.773 11 HB2 ALA 502 HB2 ALA 502 2.641 -4.737 0.693 12 HB3 ALA 502 HB3 ALA 502 4.226 -4.299 0.044 13 H GLY 503 H GLY 503 0.663 -3.709 0.700 14 HA2 GLY 503 HA2 GLY 503 -1.608 -3.485 -0.633 15 HA3 GLY 503 HA3 GLY 503 -1.095 -5.126 -1.033 16 H ILE 504 H ILE 504 -2.766 -6.123 0.165 17 HA ILE 504 HA ILE 504 -2.692 -5.577 3.033 18 HB ILE 504 HB ILE 504 -5.107 -6.047 1.274 19 HG12 ILE 504 HG12 ILE 504 -5.928 -3.905 2.471 20 HG13 ILE 504 HG13 ILE 504 -4.252 -3.684 2.941 21 HG21 ILE 504 HG21 ILE 504 -5.052 -6.000 4.263 22 HG22 ILE 504 HG22 ILE 504 -5.434 -7.365 3.212 23 HG23 ILE 504 HG23 ILE 504 -6.510 -5.969 3.268 24 HD11 ILE 504 HD11 ILE 504 -4.812 -2.368 0.984 25 HD12 ILE 504 HD12 ILE 504 -5.289 -3.838 0.121 26 HD13 ILE 504 HD13 ILE 504 -3.611 -3.602 0.591 27 H PHE 505 H PHE 505 -2.146 -7.298 4.142 28 HA PHE 505 HA PHE 505 -2.948 -9.960 3.194 29 HB2 PHE 505 HB2 PHE 505 -0.828 -9.075 5.146 30 HB3 PHE 505 HB3 PHE 505 -1.426 -10.726 5.133 31 HD1 PHE 505 HD2 PHE 505 -1.232 -12.036 3.023 32 HD2 PHE 505 HD1 PHE 505 0.838 -8.390 3.667 33 HE1 PHE 505 HE2 PHE 505 0.353 -12.647 1.267 34 HE2 PHE 505 HE1 PHE 505 2.446 -8.993 1.892 35 HZ PHE 505 HZ PHE 505 2.184 -11.148 0.685 36 H THR 506 H THR 506 -4.652 -10.884 4.173 37 HA THR 506 HA THR 506 -5.102 -10.658 6.946 38 HB THR 506 HB THR 506 -5.936 -8.402 6.259 39 HG1 THR 506 HG1 THR 506 -7.308 -8.668 7.850 40 HG21 THR 506 HG21 THR 506 -8.013 -9.950 4.685 41 HG22 THR 506 HG22 THR 506 -6.690 -9.034 3.983 42 HG23 THR 506 HG23 THR 506 -7.950 -8.194 4.882 43 H PHE 507 H PHE 507 -7.371 -11.617 7.414 44 HA PHE 507 HA PHE 507 -7.459 -14.111 6.024 45 HB2 PHE 507 HB2 PHE 507 -8.997 -12.944 8.312 46 HB3 PHE 507 HB3 PHE 507 -9.431 -14.507 7.610 47 HD1 PHE 507 HD1 PHE 507 -7.697 -16.296 7.600 48 HD2 PHE 507 HD2 PHE 507 -7.282 -12.727 9.854 49 HE1 PHE 507 HE1 PHE 507 -6.067 -17.412 9.016 50 HE2 PHE 507 HE2 PHE 507 -5.620 -13.825 11.297 51 HZ PHE 507 HZ PHE 507 -5.004 -16.169 10.887 52 H GLU 508 H GLU 508 -9.098 -14.939 4.742 53 HA GLU 508 HA GLU 508 -10.434 -13.152 3.034 54 HB2 GLU 508 HB2 GLU 508 -9.653 -15.459 2.502 55 HB3 GLU 508 HB3 GLU 508 -10.936 -16.081 3.523 56 HG2 GLU 508 HG2 GLU 508 -12.579 -15.006 2.050 57 HG3 GLU 508 HG3 GLU 508 -11.226 -14.491 1.028 58 H GLU 509 H GLU 509 -11.309 -14.775 5.957 59 HA GLU 509 HA GLU 509 -13.827 -13.372 6.005 60 HB2 GLU 509 HB2 GLU 509 -14.901 -15.445 6.934 61 HB3 GLU 509 HB3 GLU 509 -14.452 -15.583 5.245 62 HG2 GLU 509 HG2 GLU 509 -12.316 -16.711 6.138 63 HG3 GLU 509 HG3 GLU 509 -13.223 -16.840 7.648 64 HA PRO 510 HA PRO 510 -12.146 -12.419 10.013 65 HB2 PRO 510 HB2 PRO 510 -14.386 -11.517 11.254 66 HB3 PRO 510 HB3 PRO 510 -13.564 -10.588 9.996 67 HG2 PRO 510 HG2 PRO 510 -16.005 -12.312 9.781 68 HG3 PRO 510 HG3 PRO 510 -15.696 -10.722 9.063 69 HD2 PRO 510 HD2 PRO 510 -15.437 -13.070 7.658 70 HD3 PRO 510 HD3 PRO 510 -14.471 -11.615 7.316 71 H VAL 511 H VAL 511 -14.828 -14.534 9.618 72 HA VAL 511 HA VAL 511 -14.113 -16.039 12.017 73 HB VAL 511 HB VAL 511 -16.954 -15.498 11.075 74 HG11 VAL 511 HG11 VAL 511 -16.677 -17.686 12.090 75 HG12 VAL 511 HG12 VAL 511 -17.646 -16.629 13.119 76 HG13 VAL 511 HG13 VAL 511 -15.958 -16.938 13.518 77 HG21 VAL 511 HG21 VAL 511 -15.546 -14.403 13.510 78 HG22 VAL 511 HG22 VAL 511 -17.263 -14.240 13.162 79 HG23 VAL 511 HG23 VAL 511 -16.071 -13.492 12.095 80 H THR 512 H THR 512 -13.984 -18.181 11.520 81 HA THR 512 HA THR 512 -15.122 -18.998 8.979 82 HB THR 512 HB THR 512 -12.580 -18.752 8.824 83 HG1 THR 512 HG1 THR 512 -13.749 -20.094 7.502 84 HG21 THR 512 HG21 THR 512 -11.209 -20.522 9.861 85 HG22 THR 512 HG22 THR 512 -12.642 -21.124 10.691 86 HG23 THR 512 HG23 THR 512 -12.010 -19.524 11.076 87 H HIS 513 H HIS 513 -16.033 -21.003 9.012 88 HA HIS 513 HA HIS 513 -16.355 -22.078 11.712 89 HB2 HIS 513 HB2 HIS 513 -18.375 -21.082 10.518 90 HB3 HIS 513 HB3 HIS 513 -18.137 -22.407 9.366 91 HD1 HIS 513 HD1 HIS 513 -18.822 -24.777 10.099 92 HD2 HIS 513 HD2 HIS 513 -19.474 -21.811 12.914 93 HE1 HIS 513 HE1 HIS 513 -20.374 -25.773 11.809 94 H VAL 514 H VAL 514 -15.974 -24.196 11.951 95 HA VAL 514 HA VAL 514 -15.270 -25.709 9.579 96 HB VAL 514 HB VAL 514 -13.298 -26.654 10.600 97 HG11 VAL 514 HG11 VAL 514 -11.825 -24.671 10.797 98 HG12 VAL 514 HG12 VAL 514 -13.265 -23.652 10.760 99 HG13 VAL 514 HG13 VAL 514 -12.864 -24.672 9.378 100 HG21 VAL 514 HG21 VAL 514 -13.977 -26.676 12.933 101 HG22 VAL 514 HG22 VAL 514 -13.862 -24.917 12.999 102 HG23 VAL 514 HG23 VAL 514 -12.408 -25.887 12.759 103 H SER 515 H SER 515 -15.358 -27.984 9.925 104 HA SER 515 HA SER 515 -17.504 -28.751 11.610 105 HB2 SER 515 HB2 SER 515 -15.764 -30.059 9.577 106 HB3 SER 515 HB3 SER 515 -17.217 -30.791 10.261 107 HG SER 515 HG SER 515 -18.316 -28.895 9.456 108 H GLU 516 H GLU 516 -17.066 -31.076 12.678 109 HA GLU 516 HA GLU 516 -14.694 -30.656 14.291 110 HB2 GLU 516 HB2 GLU 516 -16.870 -30.913 15.416 111 HB3 GLU 516 HB3 GLU 516 -17.035 -32.510 14.708 112 HG2 GLU 516 HG2 GLU 516 -15.111 -33.281 15.967 113 HG3 GLU 516 HG3 GLU 516 -14.896 -31.666 16.643 114 H SER 517 H SER 517 -16.347 -33.443 12.790 115 HA SER 517 HA SER 517 -13.881 -34.945 12.742 116 HB2 SER 517 HB2 SER 517 -16.586 -35.565 11.551 117 HB3 SER 517 HB3 SER 517 -15.290 -36.735 11.869 118 HG SER 517 HG SER 517 -17.017 -35.384 13.561 119 H ILE 518 H ILE 518 -13.315 -32.800 11.394 120 HA ILE 518 HA ILE 518 -13.692 -33.285 8.523 121 HB ILE 518 HB ILE 518 -14.296 -31.098 9.257 122 HG12 ILE 518 HG12 ILE 518 -11.704 -30.959 7.702 123 HG13 ILE 518 HG13 ILE 518 -13.311 -31.208 7.024 124 HG21 ILE 518 HG21 ILE 518 -12.671 -29.493 10.196 125 HG22 ILE 518 HG22 ILE 518 -11.494 -30.810 10.311 126 HG23 ILE 518 HG23 ILE 518 -12.998 -30.871 11.248 127 HD11 ILE 518 HD11 ILE 518 -13.957 -28.977 7.767 128 HD12 ILE 518 HD12 ILE 518 -12.532 -28.925 6.711 129 HD13 ILE 518 HD13 ILE 518 -12.351 -28.753 8.459 130 H GLY 519 H GLY 519 -11.225 -33.132 10.997 131 HA2 GLY 519 HA2 GLY 519 -9.099 -34.105 10.822 132 HA3 GLY 519 HA3 GLY 519 -9.300 -34.118 9.074 133 H ILE 520 H ILE 520 -9.251 -32.041 8.007 134 HA ILE 520 HA ILE 520 -7.424 -30.197 9.394 135 HB ILE 520 HB ILE 520 -7.164 -31.162 6.540 136 HG12 ILE 520 HG12 ILE 520 -6.265 -32.756 8.197 137 HG13 ILE 520 HG13 ILE 520 -5.006 -32.079 7.174 138 HG21 ILE 520 HG21 ILE 520 -6.638 -28.811 6.623 139 HG22 ILE 520 HG22 ILE 520 -5.146 -29.727 6.395 140 HG23 ILE 520 HG23 ILE 520 -5.546 -29.064 7.980 141 HD11 ILE 520 HD11 ILE 520 -5.632 -31.295 10.005 142 HD12 ILE 520 HD12 ILE 520 -4.413 -30.533 8.990 143 HD13 ILE 520 HD13 ILE 520 -4.240 -32.228 9.449 144 H MET 521 H MET 521 -8.204 -28.273 9.376 145 HA MET 521 HA MET 521 -10.127 -27.557 7.290 146 HB2 MET 521 HB2 MET 521 -10.951 -25.851 8.753 147 HB3 MET 521 HB3 MET 521 -10.847 -27.330 9.690 148 HG2 MET 521 HG2 MET 521 -10.057 -25.733 11.171 149 HG3 MET 521 HG3 MET 521 -8.567 -26.307 10.438 150 HE1 MET 521 HE1 MET 521 -8.219 -22.350 11.043 151 HE2 MET 521 HE2 MET 521 -7.520 -23.904 11.467 152 HE3 MET 521 HE3 MET 521 -9.168 -23.510 11.980 153 H GLU 522 H GLU 522 -9.805 -25.601 6.160 154 HA GLU 522 HA GLU 522 -7.154 -24.444 6.441 155 HB2 GLU 522 HB2 GLU 522 -8.467 -25.480 3.967 156 HB3 GLU 522 HB3 GLU 522 -7.266 -24.207 3.891 157 HG2 GLU 522 HG2 GLU 522 -5.605 -25.609 4.807 158 HG3 GLU 522 HG3 GLU 522 -6.776 -26.867 5.196 159 H VAL 523 H VAL 523 -7.115 -22.381 6.446 160 HA VAL 523 HA VAL 523 -9.533 -20.871 5.700 161 HB VAL 523 HB VAL 523 -7.267 -19.994 7.512 162 HG11 VAL 523 HG11 VAL 523 -10.002 -18.804 7.085 163 HG12 VAL 523 HG12 VAL 523 -8.486 -18.172 6.429 164 HG13 VAL 523 HG13 VAL 523 -8.741 -18.212 8.172 165 HG21 VAL 523 HG21 VAL 523 -9.995 -21.002 8.273 166 HG22 VAL 523 HG22 VAL 523 -8.717 -20.450 9.383 167 HG23 VAL 523 HG23 VAL 523 -8.495 -21.904 8.427 168 H LYS 524 H LYS 524 -9.340 -19.549 4.015 169 HA LYS 524 HA LYS 524 -6.850 -19.458 2.561 170 HB2 LYS 524 HB2 LYS 524 -9.548 -18.216 1.963 171 HB3 LYS 524 HB3 LYS 524 -8.199 -18.378 0.844 172 HG2 LYS 524 HG2 LYS 524 -9.449 -20.789 2.110 173 HG3 LYS 524 HG3 LYS 524 -10.154 -20.044 0.678 174 HD2 LYS 524 HD2 LYS 524 -7.249 -20.609 0.589 175 HD3 LYS 524 HD3 LYS 524 -8.325 -22.012 0.558 176 HE2 LYS 524 HE2 LYS 524 -8.490 -19.640 -1.308 177 HE3 LYS 524 HE3 LYS 524 -7.686 -21.164 -1.681 178 HZ1 LYS 524 HZ1 LYS 524 -10.583 -20.875 -1.061 179 HZ2 LYS 524 HZ2 LYS 524 -9.777 -22.308 -1.448 180 HZ3 LYS 524 HZ3 LYS 524 -9.913 -21.088 -2.599 181 H VAL 525 H VAL 525 -5.477 -17.783 2.626 182 HA VAL 525 HA VAL 525 -6.316 -15.379 4.085 183 HB VAL 525 HB VAL 525 -3.510 -16.356 3.503 184 HG11 VAL 525 HG11 VAL 525 -3.631 -13.914 3.784 185 HG12 VAL 525 HG12 VAL 525 -2.793 -14.669 5.142 186 HG13 VAL 525 HG13 VAL 525 -4.465 -14.143 5.322 187 HG21 VAL 525 HG21 VAL 525 -4.657 -17.842 5.031 188 HG22 VAL 525 HG22 VAL 525 -5.103 -16.475 6.053 189 HG23 VAL 525 HG23 VAL 525 -3.408 -16.930 5.876 190 H LEU 526 H LEU 526 -6.408 -13.490 3.089 191 HA LEU 526 HA LEU 526 -6.184 -13.355 0.247 192 HB2 LEU 526 HB2 LEU 526 -6.696 -11.231 2.337 193 HB3 LEU 526 HB3 LEU 526 -6.769 -10.951 0.613 194 HG LEU 526 HG LEU 526 -8.596 -12.865 2.093 195 HD11 LEU 526 HD11 LEU 526 -8.994 -10.577 2.803 196 HD12 LEU 526 HD12 LEU 526 -10.308 -11.156 1.783 197 HD13 LEU 526 HD13 LEU 526 -9.094 -10.057 1.121 198 HD21 LEU 526 HD21 LEU 526 -8.255 -13.407 -0.277 199 HD22 LEU 526 HD22 LEU 526 -8.695 -11.756 -0.712 200 HD23 LEU 526 HD23 LEU 526 -9.889 -12.821 0.030 201 H ARG 527 H ARG 527 -4.493 -12.755 -0.890 202 HA ARG 527 HA ARG 527 -2.041 -12.090 0.494 203 HB2 ARG 527 HB2 ARG 527 -2.151 -13.836 -1.308 204 HB3 ARG 527 HB3 ARG 527 -2.540 -12.568 -2.455 205 HG2 ARG 527 HG2 ARG 527 -0.372 -11.526 -2.071 206 HG3 ARG 527 HG3 ARG 527 0.024 -12.749 -0.863 207 HD2 ARG 527 HD2 ARG 527 -0.416 -13.131 -3.804 208 HD3 ARG 527 HD3 ARG 527 1.098 -13.366 -2.924 209 HE ARG 527 HE ARG 527 -1.320 -14.980 -2.557 210 HH11 ARG 527 HH11 ARG 527 2.163 -14.896 -3.157 211 HH12 ARG 527 HH12 ARG 527 2.404 -16.521 -2.700 212 HH21 ARG 527 HH21 ARG 527 -0.971 -17.199 -1.971 213 HH22 ARG 527 HH22 ARG 527 0.586 -17.884 -2.015 214 H THR 528 H THR 528 -0.750 -10.356 -0.283 215 HA THR 528 HA THR 528 -1.907 -7.879 -0.260 216 HB THR 528 HB THR 528 0.374 -8.143 0.371 217 HG1 THR 528 HG1 THR 528 1.274 -6.854 -1.717 218 HG21 THR 528 HG21 THR 528 2.129 -8.786 -1.196 219 HG22 THR 528 HG22 THR 528 0.880 -9.080 -2.423 220 HG23 THR 528 HG23 THR 528 0.933 -10.067 -0.957 221 H SER 529 H SER 529 -2.528 -6.439 -1.768 222 HA SER 529 HA SER 529 -3.465 -7.048 -4.257 223 HB2 SER 529 HB2 SER 529 -4.050 -5.035 -2.907 224 HB3 SER 529 HB3 SER 529 -2.451 -4.395 -3.206 225 HG SER 529 HG SER 529 -4.497 -4.878 -5.101 226 H GLY 530 H GLY 530 -0.322 -5.896 -3.210 227 HA2 GLY 530 HA2 GLY 530 0.757 -6.239 -5.934 228 HA3 GLY 530 HA3 GLY 530 1.326 -5.035 -4.782 229 H ALA 531 H ALA 531 1.350 -8.367 -5.649 230 HA ALA 531 HA ALA 531 2.903 -9.066 -3.317 231 HB1 ALA 531 HB1 ALA 531 2.186 -10.697 -5.769 232 HB2 ALA 531 HB2 ALA 531 1.297 -10.690 -4.249 233 HB3 ALA 531 HB3 ALA 531 2.944 -11.319 -4.300 234 H ARG 532 H ARG 532 4.803 -8.139 -3.340 235 HA ARG 532 HA ARG 532 6.285 -8.118 -5.855 236 HB2 ARG 532 HB2 ARG 532 6.817 -6.468 -3.392 237 HB3 ARG 532 HB3 ARG 532 7.564 -6.294 -4.971 238 HG2 ARG 532 HG2 ARG 532 4.654 -5.803 -4.342 239 HG3 ARG 532 HG3 ARG 532 5.851 -4.541 -4.567 240 HD2 ARG 532 HD2 ARG 532 6.186 -5.325 -6.886 241 HD3 ARG 532 HD3 ARG 532 4.949 -6.558 -6.612 242 HE ARG 532 HE ARG 532 4.145 -3.851 -6.074 243 HH11 ARG 532 HH11 ARG 532 4.219 -6.453 -8.493 244 HH12 ARG 532 HH12 ARG 532 2.952 -5.810 -9.420 245 HH21 ARG 532 HH21 ARG 532 2.427 -2.979 -7.349 246 HH22 ARG 532 HH22 ARG 532 1.881 -3.783 -8.744 247 H GLY 533 H GLY 533 7.103 -10.228 -5.689 248 HA2 GLY 533 HA2 GLY 533 9.133 -11.301 -5.381 249 HA3 GLY 533 HA3 GLY 533 9.494 -10.199 -4.063 250 H ASN 534 H ASN 534 9.919 -11.544 -2.434 251 HA ASN 534 HA ASN 534 7.876 -13.549 -1.828 252 HB2 ASN 534 HB2 ASN 534 10.013 -14.590 -2.423 253 HB3 ASN 534 HB3 ASN 534 10.835 -13.669 -1.170 254 HD21 ASN 534 HD21 ASN 534 7.674 -15.150 -0.805 255 HD22 ASN 534 HD22 ASN 534 8.145 -16.284 0.401 256 H VAL 535 H VAL 535 6.711 -13.167 -0.143 257 HA VAL 535 HA VAL 535 7.810 -11.658 2.113 258 HB VAL 535 HB VAL 535 4.957 -11.751 1.077 259 HG11 VAL 535 HG11 VAL 535 4.992 -11.470 3.480 260 HG12 VAL 535 HG12 VAL 535 4.516 -9.953 2.712 261 HG13 VAL 535 HG13 VAL 535 6.147 -10.150 3.335 262 HG21 VAL 535 HG21 VAL 535 6.343 -10.482 -0.415 263 HG22 VAL 535 HG22 VAL 535 7.011 -9.566 0.927 264 HG23 VAL 535 HG23 VAL 535 5.303 -9.368 0.487 265 H ILE 536 H ILE 536 7.346 -12.581 4.121 266 HA ILE 536 HA ILE 536 5.895 -15.137 4.038 267 HB ILE 536 HB ILE 536 8.186 -14.334 5.853 268 HG12 ILE 536 HG12 ILE 536 8.976 -15.065 3.661 269 HG13 ILE 536 HG13 ILE 536 9.364 -16.282 4.874 270 HG21 ILE 536 HG21 ILE 536 6.564 -15.548 7.120 271 HG22 ILE 536 HG22 ILE 536 7.985 -16.565 6.855 272 HG23 ILE 536 HG23 ILE 536 6.510 -16.814 5.902 273 HD11 ILE 536 HD11 ILE 536 7.325 -17.523 4.093 274 HD12 ILE 536 HD12 ILE 536 8.632 -17.393 2.919 275 HD13 ILE 536 HD13 ILE 536 7.226 -16.348 2.778 276 H VAL 537 H VAL 537 4.243 -15.410 5.452 277 HA VAL 537 HA VAL 537 3.897 -13.306 7.425 278 HB VAL 537 HB VAL 537 1.650 -14.726 5.947 279 HG11 VAL 537 HG11 VAL 537 1.561 -12.433 7.896 280 HG12 VAL 537 HG12 VAL 537 1.046 -14.087 8.242 281 HG13 VAL 537 HG13 VAL 537 0.170 -13.116 7.053 282 HG21 VAL 537 HG21 VAL 537 2.601 -11.897 5.771 283 HG22 VAL 537 HG22 VAL 537 1.249 -12.583 4.851 284 HG23 VAL 537 HG23 VAL 537 2.911 -13.135 4.564 285 HA PRO 538 HA PRO 538 4.056 -17.043 10.024 286 HB2 PRO 538 HB2 PRO 538 4.277 -15.722 12.373 287 HB3 PRO 538 HB3 PRO 538 5.649 -15.973 11.291 288 HG2 PRO 538 HG2 PRO 538 3.957 -13.542 11.688 289 HG3 PRO 538 HG3 PRO 538 5.704 -13.656 11.432 290 HD2 PRO 538 HD2 PRO 538 3.930 -12.978 9.472 291 HD3 PRO 538 HD3 PRO 538 5.484 -13.767 9.156 292 H TYR 539 H TYR 539 2.664 -18.003 11.571 293 HA TYR 539 HA TYR 539 0.352 -16.508 12.467 294 HB2 TYR 539 HB2 TYR 539 -1.316 -18.021 11.551 295 HB3 TYR 539 HB3 TYR 539 -0.315 -17.364 10.266 296 HD1 TYR 539 HD2 TYR 539 -1.002 -20.433 12.233 297 HD2 TYR 539 HD1 TYR 539 0.929 -18.755 8.845 298 HE1 TYR 539 HE2 TYR 539 -0.602 -22.693 11.358 299 HE2 TYR 539 HE1 TYR 539 1.319 -21.003 7.949 300 HH TYR 539 HH TYR 539 1.523 -23.292 8.800 301 H LYS 540 H LYS 540 -0.985 -17.763 13.956 302 HA LYS 540 HA LYS 540 0.076 -20.199 15.093 303 HB2 LYS 540 HB2 LYS 540 0.438 -19.316 17.334 304 HB3 LYS 540 HB3 LYS 540 1.521 -18.533 16.188 305 HG2 LYS 540 HG2 LYS 540 0.156 -16.580 16.148 306 HG3 LYS 540 HG3 LYS 540 -1.075 -17.370 17.124 307 HD2 LYS 540 HD2 LYS 540 0.516 -17.531 18.975 308 HD3 LYS 540 HD3 LYS 540 1.729 -16.698 17.995 309 HE2 LYS 540 HE2 LYS 540 -0.976 -15.628 18.608 310 HE3 LYS 540 HE3 LYS 540 0.454 -15.222 19.578 311 HZ1 LYS 540 HZ1 LYS 540 -0.118 -13.533 17.789 312 HZ2 LYS 540 HZ2 LYS 540 0.233 -14.712 16.645 313 HZ3 LYS 540 HZ3 LYS 540 1.432 -14.178 17.674 314 H THR 541 H THR 541 -1.365 -21.137 16.632 315 HA THR 541 HA THR 541 -4.079 -20.207 16.404 316 HB THR 541 HB THR 541 -4.425 -22.370 17.782 317 HG1 THR 541 HG1 THR 541 -2.315 -22.924 18.399 318 HG21 THR 541 HG21 THR 541 -4.994 -22.164 15.419 319 HG22 THR 541 HG22 THR 541 -4.289 -23.748 15.750 320 HG23 THR 541 HG23 THR 541 -3.319 -22.489 14.981 321 H ILE 542 H ILE 542 -5.286 -19.402 18.052 322 HA ILE 542 HA ILE 542 -3.986 -18.894 20.647 323 HB ILE 542 HB ILE 542 -6.377 -17.534 19.390 324 HG12 ILE 542 HG12 ILE 542 -3.545 -16.472 19.530 325 HG13 ILE 542 HG13 ILE 542 -4.262 -17.177 18.086 326 HG21 ILE 542 HG21 ILE 542 -5.976 -15.792 21.095 327 HG22 ILE 542 HG22 ILE 542 -4.664 -16.765 21.762 328 HG23 ILE 542 HG23 ILE 542 -6.321 -17.364 21.817 329 HD11 ILE 542 HD11 ILE 542 -5.935 -15.406 18.044 330 HD12 ILE 542 HD12 ILE 542 -4.303 -14.738 18.017 331 HD13 ILE 542 HD13 ILE 542 -5.248 -14.718 19.512 332 H GLU 543 H GLU 543 -4.720 -20.313 22.182 333 HA GLU 543 HA GLU 543 -7.193 -21.752 21.877 334 HB2 GLU 543 HB2 GLU 543 -5.902 -21.669 24.559 335 HB3 GLU 543 HB3 GLU 543 -6.579 -23.031 23.695 336 HG2 GLU 543 HG2 GLU 543 -4.331 -23.539 23.815 337 HG3 GLU 543 HG3 GLU 543 -4.472 -22.818 22.210 338 H GLY 544 H GLY 544 -8.921 -20.468 21.975 339 HA2 GLY 544 HA2 GLY 544 -9.175 -18.651 24.288 340 HA3 GLY 544 HA3 GLY 544 -10.146 -18.567 22.816 341 H THR 545 H THR 545 -11.733 -19.960 22.440 342 HA THR 545 HA THR 545 -12.991 -20.972 24.847 343 HB THR 545 HB THR 545 -14.130 -20.431 22.113 344 HG1 THR 545 HG1 THR 545 -14.215 -18.263 22.654 345 HG21 THR 545 HG21 THR 545 -16.126 -19.894 23.365 346 HG22 THR 545 HG22 THR 545 -15.250 -20.132 24.879 347 HG23 THR 545 HG23 THR 545 -15.574 -21.522 23.813 348 H ALA 546 H ALA 546 -10.857 -22.341 23.350 349 HA ALA 546 HA ALA 546 -12.027 -24.905 22.977 350 HB1 ALA 546 HB1 ALA 546 -12.306 -23.968 20.711 351 HB2 ALA 546 HB2 ALA 546 -11.079 -25.235 20.731 352 HB3 ALA 546 HB3 ALA 546 -10.596 -23.540 20.689 353 H ARG 547 H ARG 547 -10.420 -26.467 23.264 354 HA ARG 547 HA ARG 547 -8.078 -25.405 24.556 355 HB2 ARG 547 HB2 ARG 547 -9.317 -28.109 24.440 356 HB3 ARG 547 HB3 ARG 547 -7.875 -27.712 25.371 357 HG2 ARG 547 HG2 ARG 547 -8.993 -26.244 26.713 358 HG3 ARG 547 HG3 ARG 547 -10.432 -26.194 25.687 359 HD2 ARG 547 HD2 ARG 547 -9.437 -28.531 27.288 360 HD3 ARG 547 HD3 ARG 547 -10.901 -27.585 27.622 361 HE ARG 547 HE ARG 547 -11.099 -28.518 25.023 362 HH11 ARG 547 HH11 ARG 547 -11.131 -29.943 28.282 363 HH12 ARG 547 HH12 ARG 547 -11.911 -31.373 27.798 364 HH21 ARG 547 HH21 ARG 547 -12.104 -30.475 24.349 365 HH22 ARG 547 HH22 ARG 547 -12.502 -31.687 25.479 366 H GLY 548 H GLY 548 -6.137 -25.670 23.886 367 HA2 GLY 548 HA2 GLY 548 -5.741 -26.738 21.174 368 HA3 GLY 548 HA3 GLY 548 -4.682 -25.594 21.982 369 H GLY 549 H GLY 549 -3.103 -27.115 21.107 370 HA2 GLY 549 HA2 GLY 549 -1.355 -28.501 21.678 371 HA3 GLY 549 HA3 GLY 549 -2.151 -28.807 23.212 372 H GLY 550 H GLY 550 -4.252 -29.400 20.615 373 HA2 GLY 550 HA2 GLY 550 -4.557 -31.342 19.366 374 HA3 GLY 550 HA3 GLY 550 -3.410 -32.179 20.409 375 H GLU 551 H GLU 551 -5.826 -30.165 21.823 376 HA GLU 551 HA GLU 551 -7.017 -32.602 22.864 377 HB2 GLU 551 HB2 GLU 551 -6.093 -30.922 24.449 378 HB3 GLU 551 HB3 GLU 551 -7.302 -29.781 23.886 379 HG2 GLU 551 HG2 GLU 551 -9.048 -30.992 24.840 380 HG3 GLU 551 HG3 GLU 551 -8.054 -32.429 25.034 381 H ASP 552 H ASP 552 -8.306 -29.348 21.978 382 HA ASP 552 HA ASP 552 -10.567 -30.779 20.740 383 HB2 ASP 552 HB2 ASP 552 -10.233 -27.795 21.243 384 HB3 ASP 552 HB3 ASP 552 -11.623 -28.532 20.471 385 H PHE 553 H PHE 553 -8.056 -28.440 20.170 386 HA PHE 553 HA PHE 553 -8.050 -29.251 17.366 387 HB2 PHE 553 HB2 PHE 553 -7.610 -26.979 16.623 388 HB3 PHE 553 HB3 PHE 553 -9.108 -26.985 17.536 389 HD1 PHE 553 HD1 PHE 553 -9.208 -25.901 19.740 390 HD2 PHE 553 HD2 PHE 553 -5.670 -25.812 17.394 391 HE1 PHE 553 HE1 PHE 553 -8.329 -24.062 21.121 392 HE2 PHE 553 HE2 PHE 553 -4.785 -23.997 18.774 393 HZ PHE 553 HZ PHE 553 -6.113 -23.108 20.635 394 H GLU 554 H GLU 554 -5.996 -29.121 16.420 395 HA GLU 554 HA GLU 554 -3.856 -29.600 18.273 396 HB2 GLU 554 HB2 GLU 554 -4.512 -30.472 15.770 397 HB3 GLU 554 HB3 GLU 554 -3.276 -29.280 15.405 398 HG2 GLU 554 HG2 GLU 554 -2.994 -31.665 17.222 399 HG3 GLU 554 HG3 GLU 554 -2.344 -31.515 15.596 400 H ASP 555 H ASP 555 -2.157 -28.212 18.609 401 HA ASP 555 HA ASP 555 -2.745 -25.412 17.964 402 HB2 ASP 555 HB2 ASP 555 -2.206 -25.899 20.307 403 HB3 ASP 555 HB3 ASP 555 -0.647 -26.568 19.829 404 H THR 556 H THR 556 -1.721 -24.386 16.402 405 HA THR 556 HA THR 556 0.695 -25.626 15.401 406 HB THR 556 HB THR 556 -1.238 -26.456 14.043 407 HG1 THR 556 HG1 THR 556 0.234 -26.532 12.597 408 HG21 THR 556 HG21 THR 556 -1.538 -23.542 13.268 409 HG22 THR 556 HG22 THR 556 -2.724 -24.521 14.134 410 HG23 THR 556 HG23 THR 556 -2.332 -24.889 12.459 411 H CYS 557 H CYS 557 1.745 -24.225 13.807 412 HA CYS 557 HA CYS 557 1.348 -21.441 13.845 413 HB2 CYS 557 HB2 CYS 557 3.547 -20.939 14.942 414 HB3 CYS 557 HB3 CYS 557 2.368 -21.613 16.061 415 HG CYS 557 HG CYS 557 3.549 -23.901 16.539 416 H GLY 558 H GLY 558 3.137 -20.486 12.478 417 HA2 GLY 558 HA2 GLY 558 5.069 -21.919 11.212 418 HA3 GLY 558 HA3 GLY 558 3.595 -22.258 10.307 419 H GLU 559 H GLU 559 4.957 -21.197 8.656 420 HA GLU 559 HA GLU 559 4.372 -18.358 8.624 421 HB2 GLU 559 HB2 GLU 559 7.022 -19.674 8.065 422 HB3 GLU 559 HB3 GLU 559 6.625 -18.055 7.511 423 HG2 GLU 559 HG2 GLU 559 6.342 -17.309 9.796 424 HG3 GLU 559 HG3 GLU 559 6.631 -18.944 10.384 425 H LEU 560 H LEU 560 3.237 -17.912 6.930 426 HA LEU 560 HA LEU 560 3.017 -19.802 4.718 427 HB2 LEU 560 HB2 LEU 560 1.551 -17.267 5.357 428 HB3 LEU 560 HB3 LEU 560 1.252 -18.263 3.948 429 HG LEU 560 HG LEU 560 0.805 -19.039 6.820 430 HD11 LEU 560 HD11 LEU 560 -1.107 -18.504 4.563 431 HD12 LEU 560 HD12 LEU 560 -0.828 -17.475 5.969 432 HD13 LEU 560 HD13 LEU 560 -1.535 -19.078 6.172 433 HD21 LEU 560 HD21 LEU 560 0.420 -20.615 4.275 434 HD22 LEU 560 HD22 LEU 560 -0.231 -21.078 5.845 435 HD23 LEU 560 HD23 LEU 560 1.512 -20.996 5.607 436 H GLU 561 H GLU 561 3.944 -19.597 2.905 437 HA GLU 561 HA GLU 561 5.614 -17.309 2.484 438 HB2 GLU 561 HB2 GLU 561 6.422 -19.596 2.093 439 HB3 GLU 561 HB3 GLU 561 5.252 -19.772 0.779 440 HG2 GLU 561 HG2 GLU 561 6.418 -17.644 -0.158 441 HG3 GLU 561 HG3 GLU 561 7.662 -18.054 0.983 442 H PHE 562 H PHE 562 4.965 -15.625 1.345 443 HA PHE 562 HA PHE 562 2.972 -16.106 -0.709 444 HB2 PHE 562 HB2 PHE 562 3.201 -13.749 1.154 445 HB3 PHE 562 HB3 PHE 562 2.230 -13.732 -0.307 446 HD1 PHE 562 HD2 PHE 562 0.398 -15.493 -0.513 447 HD2 PHE 562 HD1 PHE 562 2.299 -14.563 3.158 448 HE1 PHE 562 HE2 PHE 562 -1.509 -16.395 0.650 449 HE2 PHE 562 HE1 PHE 562 0.366 -15.491 4.382 450 HZ PHE 562 HZ PHE 562 -1.542 -16.409 3.142 451 H GLN 563 H GLN 563 4.337 -16.268 -2.373 452 HA GLN 563 HA GLN 563 6.140 -14.050 -2.926 453 HB2 GLN 563 HB2 GLN 563 5.646 -16.586 -4.470 454 HB3 GLN 563 HB3 GLN 563 6.866 -15.387 -4.858 455 HG2 GLN 563 HG2 GLN 563 7.824 -15.774 -2.572 456 HG3 GLN 563 HG3 GLN 563 6.767 -17.171 -2.447 457 HE21 GLN 563 HE21 GLN 563 9.536 -15.796 -3.949 458 HE22 GLN 563 HE22 GLN 563 10.124 -17.263 -4.619 459 H ASN 564 H ASN 564 6.165 -13.662 -5.450 460 HA ASN 564 HA ASN 564 3.667 -12.457 -6.100 461 HB2 ASN 564 HB2 ASN 564 4.793 -11.653 -8.134 462 HB3 ASN 564 HB3 ASN 564 5.795 -11.374 -6.721 463 HD21 ASN 564 HD21 ASN 564 6.579 -11.493 -9.501 464 HD22 ASN 564 HD22 ASN 564 7.754 -12.742 -9.610 465 H ASP 565 H ASP 565 5.235 -15.369 -6.681 466 HA ASP 565 HA ASP 565 3.954 -16.219 -9.100 467 HB2 ASP 565 HB2 ASP 565 6.065 -17.231 -8.471 468 HB3 ASP 565 HB3 ASP 565 5.361 -17.846 -6.982 469 H GLU 566 H GLU 566 3.396 -17.169 -5.709 470 HA GLU 566 HA GLU 566 1.243 -18.885 -6.330 471 HB2 GLU 566 HB2 GLU 566 2.416 -17.784 -3.888 472 HB3 GLU 566 HB3 GLU 566 0.807 -18.452 -3.773 473 HG2 GLU 566 HG2 GLU 566 3.347 -19.801 -4.578 474 HG3 GLU 566 HG3 GLU 566 2.347 -20.033 -3.133 475 H ILE 567 H ILE 567 -0.849 -18.715 -5.269 476 HA ILE 567 HA ILE 567 -2.075 -16.090 -5.740 477 HB ILE 567 HB ILE 567 -4.241 -17.544 -5.701 478 HG12 ILE 567 HG12 ILE 567 -2.360 -19.665 -6.685 479 HG13 ILE 567 HG13 ILE 567 -2.770 -19.610 -4.987 480 HG21 ILE 567 HG21 ILE 567 -2.288 -17.610 -7.995 481 HG22 ILE 567 HG22 ILE 567 -3.456 -16.336 -7.650 482 HG23 ILE 567 HG23 ILE 567 -4.014 -17.942 -8.120 483 HD11 ILE 567 HD11 ILE 567 -5.070 -19.827 -5.526 484 HD12 ILE 567 HD12 ILE 567 -4.128 -21.174 -6.176 485 HD13 ILE 567 HD13 ILE 567 -4.711 -19.888 -7.257 486 H VAL 568 H VAL 568 -2.756 -18.882 -3.557 487 HA VAL 568 HA VAL 568 -3.184 -16.975 -1.372 488 HB VAL 568 HB VAL 568 -5.363 -17.551 -2.503 489 HG11 VAL 568 HG11 VAL 568 -4.827 -19.743 -3.283 490 HG12 VAL 568 HG12 VAL 568 -6.286 -19.778 -2.278 491 HG13 VAL 568 HG13 VAL 568 -4.737 -20.325 -1.618 492 HG21 VAL 568 HG21 VAL 568 -5.094 -18.636 0.296 493 HG22 VAL 568 HG22 VAL 568 -6.606 -18.208 -0.502 494 HG23 VAL 568 HG23 VAL 568 -5.413 -16.956 -0.146 495 H LYS 569 H LYS 569 -3.082 -18.132 0.751 496 HA LYS 569 HA LYS 569 -2.077 -20.858 0.625 497 HB2 LYS 569 HB2 LYS 569 -0.985 -18.645 2.365 498 HB3 LYS 569 HB3 LYS 569 -0.726 -20.351 2.691 499 HG2 LYS 569 HG2 LYS 569 0.018 -19.963 0.033 500 HG3 LYS 569 HG3 LYS 569 0.672 -18.592 0.925 501 HD2 LYS 569 HD2 LYS 569 2.265 -20.415 0.828 502 HD3 LYS 569 HD3 LYS 569 1.745 -20.182 2.497 503 HE2 LYS 569 HE2 LYS 569 0.332 -22.130 2.362 504 HE3 LYS 569 HE3 LYS 569 0.585 -22.258 0.626 505 HZ1 LYS 569 HZ1 LYS 569 2.898 -22.765 1.032 506 HZ2 LYS 569 HZ2 LYS 569 1.926 -23.860 1.838 507 HZ3 LYS 569 HZ3 LYS 569 2.700 -22.631 2.696 508 H THR 570 H THR 570 -2.392 -21.943 2.763 509 HA THR 570 HA THR 570 -4.747 -20.877 4.112 510 HB THR 570 HB THR 570 -5.393 -23.358 4.333 511 HG1 THR 570 HG1 THR 570 -4.649 -24.667 2.627 512 HG21 THR 570 HG21 THR 570 -6.564 -23.368 2.183 513 HG22 THR 570 HG22 THR 570 -5.567 -22.018 1.622 514 HG23 THR 570 HG23 THR 570 -6.687 -21.802 2.971 515 H ILE 571 H ILE 571 -4.920 -21.416 6.249 516 HA ILE 571 HA ILE 571 -2.549 -22.564 7.510 517 HB ILE 571 HB ILE 571 -5.034 -21.276 8.741 518 HG12 ILE 571 HG12 ILE 571 -3.325 -19.712 9.781 519 HG13 ILE 571 HG13 ILE 571 -2.145 -20.431 8.700 520 HG21 ILE 571 HG21 ILE 571 -4.327 -23.147 10.096 521 HG22 ILE 571 HG22 ILE 571 -4.074 -21.615 10.935 522 HG23 ILE 571 HG23 ILE 571 -2.703 -22.469 10.220 523 HD11 ILE 571 HD11 ILE 571 -2.918 -18.340 7.860 524 HD12 ILE 571 HD12 ILE 571 -4.596 -18.905 7.903 525 HD13 ILE 571 HD13 ILE 571 -3.430 -19.655 6.803 526 H SER 572 H SER 572 -2.539 -24.651 7.916 527 HA SER 572 HA SER 572 -5.037 -26.168 7.622 528 HB2 SER 572 HB2 SER 572 -2.214 -27.202 7.819 529 HB3 SER 572 HB3 SER 572 -3.634 -28.012 7.148 530 HG SER 572 HG SER 572 -3.588 -26.014 5.696 531 H VAL 573 H VAL 573 -6.024 -26.534 9.507 532 HA VAL 573 HA VAL 573 -4.332 -27.104 11.843 533 HB VAL 573 HB VAL 573 -7.077 -25.802 11.838 534 HG11 VAL 573 HG11 VAL 573 -6.871 -25.637 14.265 535 HG12 VAL 573 HG12 VAL 573 -5.369 -26.564 14.212 536 HG13 VAL 573 HG13 VAL 573 -6.894 -27.322 13.745 537 HG21 VAL 573 HG21 VAL 573 -5.908 -23.915 12.887 538 HG22 VAL 573 HG22 VAL 573 -5.306 -24.290 11.269 539 HG23 VAL 573 HG23 VAL 573 -4.383 -24.785 12.689 540 H LYS 574 H LYS 574 -4.495 -29.014 12.633 541 HA LYS 574 HA LYS 574 -6.454 -30.882 11.716 542 HB2 LYS 574 HB2 LYS 574 -4.182 -31.667 12.196 543 HB3 LYS 574 HB3 LYS 574 -4.294 -31.086 13.845 544 HG2 LYS 574 HG2 LYS 574 -4.607 -33.406 13.992 545 HG3 LYS 574 HG3 LYS 574 -6.222 -32.725 14.137 546 HD2 LYS 574 HD2 LYS 574 -6.462 -34.572 12.686 547 HD3 LYS 574 HD3 LYS 574 -6.449 -33.168 11.623 548 HE2 LYS 574 HE2 LYS 574 -4.099 -33.542 11.104 549 HE3 LYS 574 HE3 LYS 574 -4.045 -34.883 12.242 550 HZ1 LYS 574 HZ1 LYS 574 -5.629 -34.811 9.709 551 HZ2 LYS 574 HZ2 LYS 574 -5.624 -36.090 10.807 552 HZ3 LYS 574 HZ3 LYS 574 -4.214 -35.659 9.995 553 H VAL 575 H VAL 575 -8.382 -30.619 12.386 554 HA VAL 575 HA VAL 575 -8.973 -29.728 15.069 555 HB VAL 575 HB VAL 575 -10.858 -30.836 12.940 556 HG11 VAL 575 HG11 VAL 575 -11.791 -30.999 15.182 557 HG12 VAL 575 HG12 VAL 575 -12.633 -29.741 14.274 558 HG13 VAL 575 HG13 VAL 575 -11.435 -29.300 15.477 559 HG21 VAL 575 HG21 VAL 575 -10.250 -27.958 13.630 560 HG22 VAL 575 HG22 VAL 575 -11.478 -28.503 12.486 561 HG23 VAL 575 HG23 VAL 575 -9.770 -28.792 12.153 562 H ILE 576 H ILE 576 -9.100 -31.118 16.691 563 HA ILE 576 HA ILE 576 -8.232 -33.764 16.222 564 HB ILE 576 HB ILE 576 -9.326 -32.552 18.750 565 HG12 ILE 576 HG12 ILE 576 -7.485 -31.215 17.980 566 HG13 ILE 576 HG13 ILE 576 -6.945 -32.168 19.353 567 HG21 ILE 576 HG21 ILE 576 -9.234 -34.985 18.913 568 HG22 ILE 576 HG22 ILE 576 -7.998 -34.219 19.927 569 HG23 ILE 576 HG23 ILE 576 -7.537 -34.952 18.392 570 HD11 ILE 576 HD11 ILE 576 -5.242 -32.089 17.615 571 HD12 ILE 576 HD12 ILE 576 -6.379 -32.753 16.453 572 HD13 ILE 576 HD13 ILE 576 -5.849 -33.734 17.818 573 H ASP 577 H ASP 577 -9.272 -35.473 16.012 574 HA ASP 577 HA ASP 577 -12.125 -35.348 15.487 575 HB2 ASP 577 HB2 ASP 577 -10.424 -36.611 14.031 576 HB3 ASP 577 HB3 ASP 577 -10.353 -37.800 15.313 577 H ASP 578 H ASP 578 -12.824 -34.957 17.533 578 HA ASP 578 HA ASP 578 -12.752 -37.208 19.406 579 HB2 ASP 578 HB2 ASP 578 -11.297 -35.527 20.314 580 HB3 ASP 578 HB3 ASP 578 -12.468 -34.259 19.988 581 H GLU 579 H GLU 579 -14.679 -38.008 19.273 582 HA GLU 579 HA GLU 579 -16.997 -36.489 18.642 583 HB2 GLU 579 HB2 GLU 579 -16.664 -38.867 18.018 584 HB3 GLU 579 HB3 GLU 579 -16.741 -39.295 19.718 585 HG2 GLU 579 HG2 GLU 579 -19.047 -38.351 19.765 586 HG3 GLU 579 HG3 GLU 579 -18.940 -38.178 18.012 587 H GLU 580 H GLU 580 -17.031 -34.925 20.286 588 HA GLU 580 HA GLU 580 -18.464 -35.778 22.638 589 HB2 GLU 580 HB2 GLU 580 -16.159 -35.921 23.418 590 HB3 GLU 580 HB3 GLU 580 -15.818 -34.316 22.810 591 HG2 GLU 580 HG2 GLU 580 -16.078 -34.297 25.231 592 HG3 GLU 580 HG3 GLU 580 -17.336 -33.367 24.427 593 H TYR 581 H TYR 581 -19.847 -34.225 23.314 594 HA TYR 581 HA TYR 581 -19.841 -31.741 21.758 595 HB2 TYR 581 HB2 TYR 581 -21.574 -33.550 21.130 596 HB3 TYR 581 HB3 TYR 581 -22.308 -33.230 22.690 597 HD1 TYR 581 HD1 TYR 581 -21.293 -31.548 19.539 598 HD2 TYR 581 HD2 TYR 581 -23.948 -31.549 22.862 599 HE1 TYR 581 HE1 TYR 581 -22.586 -29.750 18.490 600 HE2 TYR 581 HE2 TYR 581 -25.250 -29.735 21.822 601 HH TYR 581 HH TYR 581 -24.720 -28.804 18.542 602 H GLU 582 H GLU 582 -19.146 -30.338 23.254 603 HA GLU 582 HA GLU 582 -20.359 -30.425 25.968 604 HB2 GLU 582 HB2 GLU 582 -17.701 -29.179 25.256 605 HB3 GLU 582 HB3 GLU 582 -18.365 -29.429 26.858 606 HG2 GLU 582 HG2 GLU 582 -18.140 -31.864 26.524 607 HG3 GLU 582 HG3 GLU 582 -17.437 -31.518 24.941 608 H LYS 583 H LYS 583 -18.730 -28.242 23.713 609 HA LYS 583 HA LYS 583 -20.698 -26.181 23.909 610 HB2 LYS 583 HB2 LYS 583 -19.298 -25.939 25.940 611 HB3 LYS 583 HB3 LYS 583 -17.877 -25.968 24.927 612 HG2 LYS 583 HG2 LYS 583 -18.513 -23.839 23.899 613 HG3 LYS 583 HG3 LYS 583 -19.972 -23.788 24.893 614 HD2 LYS 583 HD2 LYS 583 -18.197 -22.381 25.845 615 HD3 LYS 583 HD3 LYS 583 -18.597 -23.716 26.924 616 HE2 LYS 583 HE2 LYS 583 -16.635 -24.967 26.010 617 HE3 LYS 583 HE3 LYS 583 -16.218 -23.544 25.057 618 HZ1 LYS 583 HZ1 LYS 583 -15.882 -22.334 27.143 619 HZ2 LYS 583 HZ2 LYS 583 -14.938 -23.731 27.100 620 HZ3 LYS 583 HZ3 LYS 583 -16.326 -23.697 28.026 621 H ASN 584 H ASN 584 -20.314 -24.822 22.067 622 HA ASN 584 HA ASN 584 -18.812 -25.841 19.921 623 HB2 ASN 584 HB2 ASN 584 -19.934 -23.088 20.446 624 HB3 ASN 584 HB3 ASN 584 -18.959 -23.414 19.024 625 HD21 ASN 584 HD21 ASN 584 -20.585 -22.967 17.636 626 HD22 ASN 584 HD22 ASN 584 -21.924 -24.010 17.368 627 H LYS 585 H LYS 585 -16.750 -25.919 19.684 628 HA LYS 585 HA LYS 585 -15.062 -24.486 21.554 629 HB2 LYS 585 HB2 LYS 585 -14.372 -26.534 19.419 630 HB3 LYS 585 HB3 LYS 585 -13.299 -25.959 20.681 631 HG2 LYS 585 HG2 LYS 585 -15.847 -27.501 21.167 632 HG3 LYS 585 HG3 LYS 585 -14.235 -28.212 21.124 633 HD2 LYS 585 HD2 LYS 585 -13.556 -26.903 23.034 634 HD3 LYS 585 HD3 LYS 585 -15.087 -26.027 23.023 635 HE2 LYS 585 HE2 LYS 585 -15.012 -27.761 24.768 636 HE3 LYS 585 HE3 LYS 585 -16.291 -28.037 23.599 637 HZ1 LYS 585 HZ1 LYS 585 -13.661 -29.425 23.374 638 HZ2 LYS 585 HZ2 LYS 585 -15.134 -29.887 22.697 639 HZ3 LYS 585 HZ3 LYS 585 -14.896 -29.983 24.358 640 H THR 586 H THR 586 -14.241 -22.591 20.955 641 HA THR 586 HA THR 586 -13.675 -22.251 18.157 642 HB THR 586 HB THR 586 -15.808 -21.230 18.204 643 HG1 THR 586 HG1 THR 586 -14.086 -20.013 17.219 644 HG21 THR 586 HG21 THR 586 -14.965 -19.533 20.542 645 HG22 THR 586 HG22 THR 586 -16.022 -20.952 20.638 646 HG23 THR 586 HG23 THR 586 -16.533 -19.527 19.726 647 H PHE 587 H PHE 587 -11.894 -21.417 17.697 648 HA PHE 587 HA PHE 587 -10.412 -20.108 19.849 649 HB2 PHE 587 HB2 PHE 587 -8.341 -21.154 19.092 650 HB3 PHE 587 HB3 PHE 587 -9.508 -22.373 19.540 651 HD1 PHE 587 HD1 PHE 587 -10.667 -23.667 17.699 652 HD2 PHE 587 HD2 PHE 587 -7.393 -21.061 16.980 653 HE1 PHE 587 HE1 PHE 587 -10.221 -24.803 15.550 654 HE2 PHE 587 HE2 PHE 587 -6.958 -22.194 14.835 655 HZ PHE 587 HZ PHE 587 -8.372 -24.063 14.133 656 H PHE 588 H PHE 588 -8.317 -19.088 18.677 657 HA PHE 588 HA PHE 588 -9.454 -17.576 16.461 658 HB2 PHE 588 HB2 PHE 588 -7.902 -16.478 18.835 659 HB3 PHE 588 HB3 PHE 588 -8.309 -15.556 17.392 660 HD1 PHE 588 HD2 PHE 588 -9.740 -17.331 20.311 661 HD2 PHE 588 HD1 PHE 588 -10.413 -14.590 17.138 662 HE1 PHE 588 HE2 PHE 588 -11.935 -16.745 21.302 663 HE2 PHE 588 HE1 PHE 588 -12.594 -13.990 18.110 664 HZ PHE 588 HZ PHE 588 -13.355 -15.067 20.193 665 H LEU 589 H LEU 589 -7.985 -16.841 14.979 666 HA LEU 589 HA LEU 589 -5.338 -18.150 15.076 667 HB2 LEU 589 HB2 LEU 589 -7.337 -18.684 13.290 668 HB3 LEU 589 HB3 LEU 589 -6.533 -17.356 12.493 669 HG LEU 589 HG LEU 589 -5.729 -19.401 11.572 670 HD11 LEU 589 HD11 LEU 589 -3.630 -18.215 13.352 671 HD12 LEU 589 HD12 LEU 589 -4.043 -17.699 11.714 672 HD13 LEU 589 HD13 LEU 589 -3.327 -19.288 11.990 673 HD21 LEU 589 HD21 LEU 589 -5.053 -20.194 14.383 674 HD22 LEU 589 HD22 LEU 589 -4.560 -21.077 12.940 675 HD23 LEU 589 HD23 LEU 589 -6.273 -20.908 13.332 676 H GLU 590 H GLU 590 -3.686 -16.702 14.882 677 HA GLU 590 HA GLU 590 -4.407 -14.085 13.823 678 HB2 GLU 590 HB2 GLU 590 -4.114 -13.832 16.210 679 HB3 GLU 590 HB3 GLU 590 -2.524 -14.596 16.131 680 HG2 GLU 590 HG2 GLU 590 -1.741 -12.754 14.701 681 HG3 GLU 590 HG3 GLU 590 -3.321 -11.996 14.839 682 H ILE 591 H ILE 591 -3.232 -13.448 12.198 683 HA ILE 591 HA ILE 591 -0.738 -14.832 11.673 684 HB ILE 591 HB ILE 591 -0.857 -13.794 9.398 685 HG12 ILE 591 HG12 ILE 591 -3.657 -12.981 10.243 686 HG13 ILE 591 HG13 ILE 591 -2.317 -11.881 9.955 687 HG21 ILE 591 HG21 ILE 591 -2.621 -15.296 8.539 688 HG22 ILE 591 HG22 ILE 591 -3.158 -15.542 10.209 689 HG23 ILE 591 HG23 ILE 591 -1.556 -16.059 9.722 690 HD11 ILE 591 HD11 ILE 591 -3.868 -11.918 8.087 691 HD12 ILE 591 HD12 ILE 591 -3.617 -13.655 7.898 692 HD13 ILE 591 HD13 ILE 591 -2.286 -12.533 7.604 693 H GLY 592 H GLY 592 1.102 -13.718 11.461 694 HA2 GLY 592 HA2 GLY 592 1.119 -11.266 13.001 695 HA3 GLY 592 HA3 GLY 592 2.526 -12.213 12.537 696 H GLU 593 H GLU 593 3.068 -9.826 12.232 697 HA GLU 593 HA GLU 593 2.062 -8.619 9.895 698 HB2 GLU 593 HB2 GLU 593 4.387 -7.931 11.680 699 HB3 GLU 593 HB3 GLU 593 3.867 -6.935 10.319 700 HG2 GLU 593 HG2 GLU 593 1.717 -6.629 11.279 701 HG3 GLU 593 HG3 GLU 593 2.086 -7.746 12.588 702 HA PRO 594 HA PRO 594 4.298 -10.851 6.955 703 HB2 PRO 594 HB2 PRO 594 4.219 -8.908 4.958 704 HB3 PRO 594 HB3 PRO 594 2.970 -10.111 5.258 705 HG2 PRO 594 HG2 PRO 594 3.091 -7.272 6.015 706 HG3 PRO 594 HG3 PRO 594 1.678 -8.258 5.633 707 HD2 PRO 594 HD2 PRO 594 2.362 -7.510 8.145 708 HD3 PRO 594 HD3 PRO 594 1.476 -9.005 7.806 709 H ARG 595 H ARG 595 6.331 -11.148 6.653 710 HA ARG 595 HA ARG 595 8.173 -8.921 7.063 711 HB2 ARG 595 HB2 ARG 595 9.844 -10.649 7.705 712 HB3 ARG 595 HB3 ARG 595 8.417 -10.725 8.720 713 HG2 ARG 595 HG2 ARG 595 7.615 -12.601 7.194 714 HG3 ARG 595 HG3 ARG 595 9.240 -12.597 6.521 715 HD2 ARG 595 HD2 ARG 595 8.522 -13.097 9.416 716 HD3 ARG 595 HD3 ARG 595 8.950 -14.333 8.242 717 HE ARG 595 HE ARG 595 10.902 -12.241 8.756 718 HH11 ARG 595 HH11 ARG 595 9.950 -15.692 9.329 719 HH12 ARG 595 HH12 ARG 595 11.465 -16.067 9.979 720 HH21 ARG 595 HH21 ARG 595 12.925 -12.882 9.673 721 HH22 ARG 595 HH22 ARG 595 13.175 -14.491 10.180 722 H LEU 596 H LEU 596 9.055 -8.129 5.274 723 HA LEU 596 HA LEU 596 8.989 -9.357 2.763 724 HB2 LEU 596 HB2 LEU 596 9.253 -6.837 3.467 725 HB3 LEU 596 HB3 LEU 596 10.936 -7.258 3.667 726 HG LEU 596 HG LEU 596 10.381 -6.088 1.513 727 HD11 LEU 596 HD11 LEU 596 11.601 -8.824 1.223 728 HD12 LEU 596 HD12 LEU 596 12.451 -7.350 1.683 729 HD13 LEU 596 HD13 LEU 596 11.753 -7.499 0.071 730 HD21 LEU 596 HD21 LEU 596 8.257 -7.192 1.178 731 HD22 LEU 596 HD22 LEU 596 9.091 -8.708 0.838 732 HD23 LEU 596 HD23 LEU 596 9.292 -7.322 -0.249 733 H VAL 597 H VAL 597 10.400 -10.794 1.926 734 HA VAL 597 HA VAL 597 12.419 -11.792 3.714 735 HB VAL 597 HB VAL 597 11.639 -12.840 0.979 736 HG11 VAL 597 HG11 VAL 597 13.308 -14.112 3.157 737 HG12 VAL 597 HG12 VAL 597 13.909 -13.521 1.606 738 HG13 VAL 597 HG13 VAL 597 12.801 -14.895 1.662 739 HG21 VAL 597 HG21 VAL 597 10.456 -14.576 2.217 740 HG22 VAL 597 HG22 VAL 597 9.808 -12.971 2.557 741 HG23 VAL 597 HG23 VAL 597 10.856 -13.768 3.735 742 H GLU 598 H GLU 598 13.952 -10.357 3.801 743 HA GLU 598 HA GLU 598 15.380 -9.258 1.612 744 HB2 GLU 598 HB2 GLU 598 15.312 -8.501 4.093 745 HB3 GLU 598 HB3 GLU 598 16.348 -9.864 4.440 746 HG2 GLU 598 HG2 GLU 598 17.110 -7.599 2.602 747 HG3 GLU 598 HG3 GLU 598 17.474 -7.632 4.320 748 H MET 599 H MET 599 17.040 -10.285 0.471 749 HA MET 599 HA MET 599 16.897 -13.091 0.430 750 HB2 MET 599 HB2 MET 599 18.620 -13.079 -1.316 751 HB3 MET 599 HB3 MET 599 17.365 -11.894 -1.618 752 HG2 MET 599 HG2 MET 599 18.856 -10.169 -0.732 753 HG3 MET 599 HG3 MET 599 20.111 -11.402 -0.568 754 HE1 MET 599 HE1 MET 599 21.755 -9.875 -2.094 755 HE2 MET 599 HE2 MET 599 20.485 -8.668 -2.308 756 HE3 MET 599 HE3 MET 599 21.334 -9.314 -3.711 757 H SER 600 H SER 600 19.098 -10.986 2.021 758 HA SER 600 HA SER 600 20.731 -11.283 3.466 759 HB2 SER 600 HB2 SER 600 19.091 -13.718 4.165 760 HB3 SER 600 HB3 SER 600 20.353 -13.025 5.183 761 HG SER 600 HG SER 600 18.882 -11.013 4.571 762 H GLU 601 H GLU 601 21.839 -11.863 1.229 763 HA GLU 601 HA GLU 601 22.973 -14.476 1.434 764 HB2 GLU 601 HB2 GLU 601 24.353 -13.757 -0.619 765 HB3 GLU 601 HB3 GLU 601 22.627 -13.964 -0.823 766 HG2 GLU 601 HG2 GLU 601 23.087 -12.050 -2.025 767 HG3 GLU 601 HG3 GLU 601 22.506 -11.417 -0.494 768 H LYS 602 H LYS 602 25.085 -15.007 1.901 769 HA LYS 602 HA LYS 602 25.946 -13.228 3.987 770 HB2 LYS 602 HB2 LYS 602 26.798 -16.028 3.362 771 HB3 LYS 602 HB3 LYS 602 27.400 -15.071 4.704 772 HG2 LYS 602 HG2 LYS 602 24.525 -15.911 4.301 773 HG3 LYS 602 HG3 LYS 602 25.667 -16.687 5.390 774 HD2 LYS 602 HD2 LYS 602 24.506 -15.323 6.861 775 HD3 LYS 602 HD3 LYS 602 25.844 -14.268 6.431 776 HE2 LYS 602 HE2 LYS 602 24.301 -13.138 4.741 777 HE3 LYS 602 HE3 LYS 602 23.033 -14.197 5.311 778 HZ1 LYS 602 HZ1 LYS 602 23.218 -13.229 7.494 779 HZ2 LYS 602 HZ2 LYS 602 22.908 -12.026 6.362 780 HZ3 LYS 602 HZ3 LYS 602 24.458 -12.208 6.996 781 H LYS 603 H LYS 603 27.116 -11.759 3.749 782 HA LYS 603 HA LYS 603 29.388 -11.871 1.947 783 HB2 LYS 603 HB2 LYS 603 29.615 -9.430 2.605 784 HB3 LYS 603 HB3 LYS 603 28.158 -9.854 1.721 785 HG2 LYS 603 HG2 LYS 603 26.926 -9.910 3.890 786 HG3 LYS 603 HG3 LYS 603 28.398 -9.337 4.679 787 HD2 LYS 603 HD2 LYS 603 27.094 -7.874 2.402 788 HD3 LYS 603 HD3 LYS 603 26.653 -7.588 4.081 789 HE2 LYS 603 HE2 LYS 603 29.490 -7.364 3.091 790 HE3 LYS 603 HE3 LYS 603 28.369 -6.010 3.034 791 HZ1 LYS 603 HZ1 LYS 603 29.187 -7.451 5.522 792 HZ2 LYS 603 HZ2 LYS 603 28.125 -6.153 5.430 793 HZ3 LYS 603 HZ3 LYS 603 29.722 -5.932 5.035 794 H GLY 604 H GLY 604 28.532 -12.233 5.191 795 HA2 GLY 604 HA2 GLY 604 31.366 -12.288 5.941 796 HA3 GLY 604 HA3 GLY 604 30.118 -11.694 7.039 797 H GLY 605 H GLY 605 29.511 -13.120 8.515 798 HA2 GLY 605 HA2 GLY 605 29.042 -15.869 7.734 799 HA3 GLY 605 HA3 GLY 605 30.346 -15.621 8.885 800 H PHE 606 H PHE 606 27.340 -13.814 8.699 801 HA PHE 606 HA PHE 606 26.512 -15.138 11.163 802 HB2 PHE 606 HB2 PHE 606 27.329 -12.883 11.738 803 HB3 PHE 606 HB3 PHE 606 26.228 -12.177 10.561 804 HD1 PHE 606 HD2 PHE 606 26.386 -14.061 13.728 805 HD2 PHE 606 HD1 PHE 606 23.971 -11.725 11.132 806 HE1 PHE 606 HE2 PHE 606 24.642 -13.951 15.460 807 HE2 PHE 606 HE1 PHE 606 22.218 -11.610 12.854 808 HZ PHE 606 HZ PHE 606 22.553 -12.723 15.023 809 H THR 607 H THR 607 24.974 -16.371 10.431 810 HA THR 607 HA THR 607 23.029 -15.284 8.585 811 HB THR 607 HB THR 607 23.964 -17.539 8.088 812 HG1 THR 607 HG1 THR 607 22.077 -17.552 7.207 813 HG21 THR 607 HG21 THR 607 24.346 -18.329 10.381 814 HG22 THR 607 HG22 THR 607 23.331 -19.471 9.500 815 HG23 THR 607 HG23 THR 607 22.608 -18.366 10.666 816 H ILE 608 H ILE 608 20.715 -16.227 9.197 817 HA ILE 608 HA ILE 608 20.053 -15.097 11.768 818 HB ILE 608 HB ILE 608 18.302 -16.404 9.662 819 HG12 ILE 608 HG12 ILE 608 19.270 -14.336 8.829 820 HG13 ILE 608 HG13 ILE 608 17.558 -14.106 9.135 821 HG21 ILE 608 HG21 ILE 608 17.475 -14.863 12.116 822 HG22 ILE 608 HG22 ILE 608 17.256 -16.591 11.840 823 HG23 ILE 608 HG23 ILE 608 16.384 -15.421 10.846 824 HD11 ILE 608 HD11 ILE 608 19.823 -13.162 10.886 825 HD12 ILE 608 HD12 ILE 608 18.110 -12.964 11.247 826 HD13 ILE 608 HD13 ILE 608 18.813 -12.163 9.841 827 H THR 609 H THR 609 20.212 -16.291 13.515 828 HA THR 609 HA THR 609 19.869 -19.143 13.195 829 HB THR 609 HB THR 609 22.075 -18.735 14.009 830 HG1 THR 609 HG1 THR 609 21.762 -19.607 16.311 831 HG21 THR 609 HG21 THR 609 21.823 -16.473 14.921 832 HG22 THR 609 HG22 THR 609 22.560 -17.533 16.125 833 HG23 THR 609 HG23 THR 609 20.855 -17.103 16.254 834 H GLU 610 H GLU 610 17.741 -19.273 13.294 835 HA GLU 610 HA GLU 610 16.400 -18.223 15.648 836 HB2 GLU 610 HB2 GLU 610 15.463 -17.776 13.373 837 HB3 GLU 610 HB3 GLU 610 15.255 -19.506 13.158 838 HG2 GLU 610 HG2 GLU 610 13.159 -18.426 13.768 839 HG3 GLU 610 HG3 GLU 610 13.683 -19.560 15.015 840 H GLU 611 H GLU 611 15.140 -19.634 16.922 841 HA GLU 611 HA GLU 611 15.687 -22.471 16.533 842 HB2 GLU 611 HB2 GLU 611 17.312 -21.617 18.182 843 HB3 GLU 611 HB3 GLU 611 15.985 -21.057 19.188 844 HG2 GLU 611 HG2 GLU 611 15.225 -23.322 19.509 845 HG3 GLU 611 HG3 GLU 611 16.467 -23.918 18.416 846 H TYR 612 H TYR 612 13.954 -20.342 18.795 847 HA TYR 612 HA TYR 612 11.594 -21.978 18.287 848 HB2 TYR 612 HB2 TYR 612 11.021 -21.882 20.697 849 HB3 TYR 612 HB3 TYR 612 12.507 -22.760 20.390 850 HD1 TYR 612 HD1 TYR 612 14.712 -21.650 20.964 851 HD2 TYR 612 HD2 TYR 612 10.969 -19.990 22.111 852 HE1 TYR 612 HE1 TYR 612 15.849 -20.270 22.649 853 HE2 TYR 612 HE2 TYR 612 12.095 -18.607 23.793 854 HH TYR 612 HH TYR 612 15.521 -18.286 23.915 855 H ASP 613 H ASP 613 9.868 -20.839 17.742 856 HA ASP 613 HA ASP 613 9.910 -18.019 18.441 857 HB2 ASP 613 HB2 ASP 613 9.645 -18.422 16.035 858 HB3 ASP 613 HB3 ASP 613 8.205 -19.390 16.348 859 H ASP 614 H ASP 614 9.477 -18.471 20.495 860 HA ASP 614 HA ASP 614 6.634 -18.779 21.050 861 HB2 ASP 614 HB2 ASP 614 7.659 -20.885 21.747 862 HB3 ASP 614 HB3 ASP 614 8.915 -20.018 22.621 863 H LYS 615 H LYS 615 6.378 -16.697 21.165 864 HA LYS 615 HA LYS 615 6.247 -14.639 21.995 865 HB2 LYS 615 HB2 LYS 615 7.418 -15.830 24.519 866 HB3 LYS 615 HB3 LYS 615 6.672 -14.243 24.395 867 HG2 LYS 615 HG2 LYS 615 5.302 -16.895 23.972 868 HG3 LYS 615 HG3 LYS 615 5.127 -15.828 25.368 869 HD2 LYS 615 HD2 LYS 615 4.205 -14.096 23.938 870 HD3 LYS 615 HD3 LYS 615 4.406 -15.141 22.530 871 HE2 LYS 615 HE2 LYS 615 2.863 -16.760 23.588 872 HE3 LYS 615 HE3 LYS 615 2.600 -15.594 24.888 873 HZ1 LYS 615 HZ1 LYS 615 2.072 -15.093 22.023 874 HZ2 LYS 615 HZ2 LYS 615 1.755 -14.019 23.290 875 HZ3 LYS 615 HZ3 LYS 615 0.899 -15.471 23.174 876 H GLN 616 H GLN 616 7.714 -14.021 20.413 877 HA GLN 616 HA GLN 616 10.314 -13.233 21.515 878 HB2 GLN 616 HB2 GLN 616 9.451 -13.470 18.630 879 HB3 GLN 616 HB3 GLN 616 10.986 -12.808 19.147 880 HG2 GLN 616 HG2 GLN 616 11.433 -15.037 20.227 881 HG3 GLN 616 HG3 GLN 616 10.017 -15.639 19.354 882 HE21 GLN 616 HE21 GLN 616 11.311 -17.043 18.129 883 HE22 GLN 616 HE22 GLN 616 12.330 -16.463 16.864 884 HA PRO 617 HA PRO 617 8.747 -9.063 21.309 885 HB2 PRO 617 HB2 PRO 617 11.128 -7.770 21.643 886 HB3 PRO 617 HB3 PRO 617 10.246 -8.499 22.989 887 HG2 PRO 617 HG2 PRO 617 12.594 -9.555 21.470 888 HG3 PRO 617 HG3 PRO 617 12.262 -9.629 23.209 889 HD2 PRO 617 HD2 PRO 617 11.850 -11.725 21.534 890 HD3 PRO 617 HD3 PRO 617 10.879 -11.448 22.995 891 H LEU 618 H LEU 618 8.503 -7.695 19.619 892 HA LEU 618 HA LEU 618 9.930 -8.336 17.189 893 HB2 LEU 618 HB2 LEU 618 7.577 -6.520 17.741 894 HB3 LEU 618 HB3 LEU 618 8.333 -6.629 16.173 895 HG LEU 618 HG LEU 618 6.358 -7.916 16.093 896 HD11 LEU 618 HD11 LEU 618 7.127 -10.150 15.561 897 HD12 LEU 618 HD12 LEU 618 8.658 -9.815 16.361 898 HD13 LEU 618 HD13 LEU 618 8.199 -8.903 14.923 899 HD21 LEU 618 HD21 LEU 618 5.947 -8.249 18.472 900 HD22 LEU 618 HD22 LEU 618 7.290 -9.390 18.558 901 HD23 LEU 618 HD23 LEU 618 5.856 -9.786 17.608 902 H THR 619 H THR 619 10.134 -6.039 15.825 903 HA THR 619 HA THR 619 12.369 -4.892 17.086 904 HB THR 619 HB THR 619 12.321 -3.365 15.042 905 HG1 THR 619 HG1 THR 619 10.223 -3.430 14.490 906 HG21 THR 619 HG21 THR 619 13.000 -5.164 13.528 907 HG22 THR 619 HG22 THR 619 12.285 -6.354 14.620 908 HG23 THR 619 HG23 THR 619 13.677 -5.404 15.139 909 H SER 620 H SER 620 12.441 -3.268 18.408 910 HA SER 620 HA SER 620 10.108 -1.996 19.320 911 HB2 SER 620 HB2 SER 620 13.001 -1.307 19.841 912 HB3 SER 620 HB3 SER 620 11.615 -0.916 20.867 913 HG SER 620 HG SER 620 11.606 -3.529 20.332 914 H LYS 621 H LYS 621 9.454 0.122 19.027 915 HA LYS 621 HA LYS 621 10.116 1.235 16.487 916 HB2 LYS 621 HB2 LYS 621 8.193 2.150 18.610 917 HB3 LYS 621 HB3 LYS 621 8.371 2.912 17.037 918 HG2 LYS 621 HG2 LYS 621 7.657 0.885 15.933 919 HG3 LYS 621 HG3 LYS 621 7.562 0.049 17.485 920 HD2 LYS 621 HD2 LYS 621 5.823 1.583 18.223 921 HD3 LYS 621 HD3 LYS 621 5.971 2.480 16.711 922 HE2 LYS 621 HE2 LYS 621 5.214 0.569 15.453 923 HE3 LYS 621 HE3 LYS 621 5.169 -0.415 16.915 924 HZ1 LYS 621 HZ1 LYS 621 3.428 0.943 17.781 925 HZ2 LYS 621 HZ2 LYS 621 2.983 0.427 16.224 926 HZ3 LYS 621 HZ3 LYS 621 3.526 2.010 16.472 927 H GLU 622 H GLU 622 12.166 1.867 16.654 928 HA GLU 622 HA GLU 622 12.605 4.415 18.065 929 HB2 GLU 622 HB2 GLU 622 14.633 2.254 17.431 930 HB3 GLU 622 HB3 GLU 622 15.013 3.821 18.128 931 HG2 GLU 622 HG2 GLU 622 13.705 3.263 20.105 932 HG3 GLU 622 HG3 GLU 622 13.303 1.700 19.398 933 H GLU 623 H GLU 623 14.020 5.886 16.834 934 HA GLU 623 HA GLU 623 13.374 5.682 14.046 935 HB2 GLU 623 HB2 GLU 623 14.714 7.876 15.611 936 HB3 GLU 623 HB3 GLU 623 14.424 7.946 13.887 937 HG2 GLU 623 HG2 GLU 623 12.276 7.644 15.967 938 HG3 GLU 623 HG3 GLU 623 12.737 9.163 15.197 939 H GLU 624 H GLU 624 14.739 3.770 14.023 940 HA GLU 624 HA GLU 624 17.553 4.299 13.441 941 HB2 GLU 624 HB2 GLU 624 15.938 1.730 13.218 942 HB3 GLU 624 HB3 GLU 624 17.683 1.864 13.103 943 HG2 GLU 624 HG2 GLU 624 17.848 2.444 15.433 944 HG3 GLU 624 HG3 GLU 624 16.093 2.527 15.572 945 H GLU 625 H GLU 625 18.217 3.286 11.140 946 HA GLU 625 HA GLU 625 16.608 4.560 9.197 947 HB2 GLU 625 HB2 GLU 625 17.963 3.482 7.446 948 HB3 GLU 625 HB3 GLU 625 18.970 4.172 8.704 949 HG2 GLU 625 HG2 GLU 625 19.540 2.063 9.542 950 HG3 GLU 625 HG3 GLU 625 18.230 1.269 8.667 951 H ARG 626 H ARG 626 16.310 1.608 10.683 952 HA ARG 626 HA ARG 626 14.832 0.044 8.923 953 HB2 ARG 626 HB2 ARG 626 14.586 0.373 11.876 954 HB3 ARG 626 HB3 ARG 626 13.658 -0.791 10.966 955 HG2 ARG 626 HG2 ARG 626 15.909 -1.736 10.227 956 HG3 ARG 626 HG3 ARG 626 16.592 -0.752 11.535 957 HD2 ARG 626 HD2 ARG 626 16.047 -3.009 12.338 958 HD3 ARG 626 HD3 ARG 626 15.041 -1.791 13.134 959 HE ARG 626 HE ARG 626 14.206 -3.683 11.060 960 HH11 ARG 626 HH11 ARG 626 13.235 -1.296 13.550 961 HH12 ARG 626 HH12 ARG 626 11.580 -1.525 13.326 962 HH21 ARG 626 HH21 ARG 626 11.928 -3.963 10.752 963 HH22 ARG 626 HH22 ARG 626 10.799 -3.002 11.577 964 H ARG 627 H ARG 627 13.918 2.973 10.626 965 HA ARG 627 HA ARG 627 11.155 2.613 10.607 966 HB2 ARG 627 HB2 ARG 627 12.222 4.291 12.003 967 HB3 ARG 627 HB3 ARG 627 12.835 5.126 10.595 968 HG2 ARG 627 HG2 ARG 627 9.895 4.872 10.742 969 HG3 ARG 627 HG3 ARG 627 10.671 5.880 11.969 970 HD2 ARG 627 HD2 ARG 627 11.139 6.134 9.021 971 HD3 ARG 627 HD3 ARG 627 9.989 7.141 9.917 972 HE ARG 627 HE ARG 627 11.999 7.747 11.303 973 HH11 ARG 627 HH11 ARG 627 12.159 7.152 7.811 974 HH12 ARG 627 HH12 ARG 627 13.667 7.935 7.623 975 HH21 ARG 627 HH21 ARG 627 14.040 8.859 10.982 976 HH22 ARG 627 HH22 ARG 627 14.747 8.901 9.431 977 H ILE 628 H ILE 628 13.349 3.465 8.067 978 HA ILE 628 HA ILE 628 11.345 4.376 6.234 979 HB ILE 628 HB ILE 628 14.127 3.269 5.698 980 HG12 ILE 628 HG12 ILE 628 13.159 6.130 5.898 981 HG13 ILE 628 HG13 ILE 628 14.119 5.288 7.104 982 HG21 ILE 628 HG21 ILE 628 12.293 4.840 3.869 983 HG22 ILE 628 HG22 ILE 628 12.698 3.133 3.707 984 HG23 ILE 628 HG23 ILE 628 13.950 4.356 3.500 985 HD11 ILE 628 HD11 ILE 628 14.975 5.945 4.301 986 HD12 ILE 628 HD12 ILE 628 15.954 5.109 5.509 987 HD13 ILE 628 HD13 ILE 628 15.474 6.787 5.768 988 H ALA 629 H ALA 629 12.908 1.338 6.981 989 HA ALA 629 HA ALA 629 11.685 -0.145 4.892 990 HB1 ALA 629 HB1 ALA 629 12.910 -1.159 7.461 991 HB2 ALA 629 HB2 ALA 629 13.782 -0.880 5.953 992 HB3 ALA 629 HB3 ALA 629 12.538 -2.127 6.036 993 H GLU 630 H GLU 630 10.779 0.634 8.145 994 HA GLU 630 HA GLU 630 8.672 -1.128 8.562 995 HB2 GLU 630 HB2 GLU 630 9.079 1.701 9.484 996 HB3 GLU 630 HB3 GLU 630 7.710 0.728 10.008 997 HG2 GLU 630 HG2 GLU 630 10.577 -0.061 10.363 998 HG3 GLU 630 HG3 GLU 630 9.635 0.792 11.592 999 H MET 631 H MET 631 8.731 1.839 6.679 1000 HA MET 631 HA MET 631 5.845 1.589 6.206 1001 HB2 MET 631 HB2 MET 631 5.915 3.738 5.114 1002 HB3 MET 631 HB3 MET 631 6.801 3.878 6.621 1003 HG2 MET 631 HG2 MET 631 8.898 3.729 5.414 1004 HG3 MET 631 HG3 MET 631 8.029 3.506 3.900 1005 HE1 MET 631 HE1 MET 631 9.289 5.419 2.726 1006 HE2 MET 631 HE2 MET 631 10.263 5.627 4.182 1007 HE3 MET 631 HE3 MET 631 9.519 7.029 3.413 1008 H GLY 632 H GLY 632 8.733 0.582 4.932 1009 HA2 GLY 632 HA2 GLY 632 7.691 0.332 2.211 1010 HA3 GLY 632 HA3 GLY 632 9.386 0.225 2.676 1011 H ARG 633 H ARG 633 6.957 -1.280 4.564 1012 HA ARG 633 HA ARG 633 8.017 -3.946 3.909 1013 HB2 ARG 633 HB2 ARG 633 5.934 -3.109 5.918 1014 HB3 ARG 633 HB3 ARG 633 6.478 -4.725 5.659 1015 HG2 ARG 633 HG2 ARG 633 8.687 -4.063 6.592 1016 HG3 ARG 633 HG3 ARG 633 7.985 -2.474 6.969 1017 HD2 ARG 633 HD2 ARG 633 6.151 -3.559 8.174 1018 HD3 ARG 633 HD3 ARG 633 6.852 -5.129 7.827 1019 HE ARG 633 HE ARG 633 8.363 -3.197 9.444 1020 HH11 ARG 633 HH11 ARG 633 6.722 -6.351 9.171 1021 HH12 ARG 633 HH12 ARG 633 7.085 -6.814 10.753 1022 HH21 ARG 633 HH21 ARG 633 8.756 -3.763 11.526 1023 HH22 ARG 633 HH22 ARG 633 8.293 -5.295 12.200 1024 HA PRO 634 HA PRO 634 3.985 -4.904 2.081 1025 HB2 PRO 634 HB2 PRO 634 3.899 -7.548 2.826 1026 HB3 PRO 634 HB3 PRO 634 4.781 -6.993 1.394 1027 HG2 PRO 634 HG2 PRO 634 5.818 -7.644 4.127 1028 HG3 PRO 634 HG3 PRO 634 6.546 -8.017 2.560 1029 HD2 PRO 634 HD2 PRO 634 7.363 -5.980 4.103 1030 HD3 PRO 634 HD3 PRO 634 7.418 -5.892 2.334 1031 H ILE 635 H ILE 635 1.955 -4.810 3.238 1032 HA ILE 635 HA ILE 635 2.331 -5.201 6.072 1033 HB ILE 635 HB ILE 635 0.906 -3.211 6.564 1034 HG12 ILE 635 HG12 ILE 635 1.018 -1.359 4.742 1035 HG13 ILE 635 HG13 ILE 635 1.266 -2.680 3.611 1036 HG21 ILE 635 HG21 ILE 635 2.712 -1.562 6.266 1037 HG22 ILE 635 HG22 ILE 635 3.526 -2.710 5.198 1038 HG23 ILE 635 HG23 ILE 635 3.273 -3.116 6.894 1039 HD11 ILE 635 HD11 ILE 635 -1.044 -1.993 3.637 1040 HD12 ILE 635 HD12 ILE 635 -1.134 -2.254 5.377 1041 HD13 ILE 635 HD13 ILE 635 -0.899 -3.623 4.290 1042 H LEU 636 H LEU 636 0.218 -5.075 7.270 1043 HA LEU 636 HA LEU 636 -1.456 -6.943 5.847 1044 HB2 LEU 636 HB2 LEU 636 -2.332 -7.516 8.172 1045 HB3 LEU 636 HB3 LEU 636 -0.757 -8.095 7.697 1046 HG LEU 636 HG LEU 636 0.290 -6.337 9.113 1047 HD11 LEU 636 HD11 LEU 636 -2.528 -5.743 10.018 1048 HD12 LEU 636 HD12 LEU 636 -1.502 -4.664 9.076 1049 HD13 LEU 636 HD13 LEU 636 -1.045 -5.097 10.723 1050 HD21 LEU 636 HD21 LEU 636 -1.725 -8.072 10.476 1051 HD22 LEU 636 HD22 LEU 636 -0.287 -7.377 11.238 1052 HD23 LEU 636 HD23 LEU 636 -0.124 -8.574 9.939 1053 H GLY 637 H GLY 637 -3.742 -6.997 6.722 1054 HA2 GLY 637 HA2 GLY 637 -4.923 -4.579 5.828 1055 HA3 GLY 637 HA3 GLY 637 -5.744 -6.006 6.436 1056 H GLU 638 H GLU 638 -7.076 -4.137 7.238 1057 HA GLU 638 HA GLU 638 -6.190 -2.476 9.304 1058 HB2 GLU 638 HB2 GLU 638 -8.233 -2.070 7.983 1059 HB3 GLU 638 HB3 GLU 638 -8.986 -3.465 8.736 1060 HG2 GLU 638 HG2 GLU 638 -9.773 -1.391 9.724 1061 HG3 GLU 638 HG3 GLU 638 -8.897 -2.371 10.898 1062 H HIS 639 H HIS 639 -7.681 -5.678 9.337 1063 HA HIS 639 HA HIS 639 -6.665 -5.995 12.019 1064 HB2 HIS 639 HB2 HIS 639 -8.771 -7.011 12.858 1065 HB3 HIS 639 HB3 HIS 639 -8.969 -5.316 12.454 1066 HD1 HIS 639 HD1 HIS 639 -10.639 -8.502 12.045 1067 HD2 HIS 639 HD2 HIS 639 -10.240 -5.039 9.765 1068 HE1 HIS 639 HE1 HIS 639 -12.504 -8.545 10.380 1069 H THR 640 H THR 640 -5.780 -7.920 12.350 1070 HA THR 640 HA THR 640 -6.373 -9.967 10.397 1071 HB THR 640 HB THR 640 -3.994 -10.744 10.880 1072 HG1 THR 640 HG1 THR 640 -2.783 -9.494 12.113 1073 HG21 THR 640 HG21 THR 640 -4.377 -8.104 9.458 1074 HG22 THR 640 HG22 THR 640 -4.710 -9.692 8.778 1075 HG23 THR 640 HG23 THR 640 -3.054 -9.245 9.189 1076 H LYS 641 H LYS 641 -7.784 -11.137 11.479 1077 HA LYS 641 HA LYS 641 -6.923 -12.683 13.693 1078 HB2 LYS 641 HB2 LYS 641 -7.554 -10.633 14.910 1079 HB3 LYS 641 HB3 LYS 641 -9.114 -10.617 14.106 1080 HG2 LYS 641 HG2 LYS 641 -9.633 -12.776 15.204 1081 HG3 LYS 641 HG3 LYS 641 -8.104 -12.665 16.064 1082 HD2 LYS 641 HD2 LYS 641 -10.212 -10.520 16.229 1083 HD3 LYS 641 HD3 LYS 641 -10.200 -11.926 17.284 1084 HE2 LYS 641 HE2 LYS 641 -9.166 -10.060 18.444 1085 HE3 LYS 641 HE3 LYS 641 -7.964 -11.289 18.079 1086 HZ1 LYS 641 HZ1 LYS 641 -7.069 -9.912 16.352 1087 HZ2 LYS 641 HZ2 LYS 641 -7.185 -9.015 17.748 1088 HZ3 LYS 641 HZ3 LYS 641 -8.308 -8.773 16.517 1089 H LEU 642 H LEU 642 -8.181 -14.477 13.795 1090 HA LEU 642 HA LEU 642 -10.538 -14.569 12.055 1091 HB2 LEU 642 HB2 LEU 642 -8.609 -15.573 10.990 1092 HB3 LEU 642 HB3 LEU 642 -8.342 -16.555 12.415 1093 HG LEU 642 HG LEU 642 -10.596 -17.577 11.992 1094 HD11 LEU 642 HD11 LEU 642 -11.498 -15.886 10.517 1095 HD12 LEU 642 HD12 LEU 642 -11.444 -17.468 9.737 1096 HD13 LEU 642 HD13 LEU 642 -10.242 -16.249 9.328 1097 HD21 LEU 642 HD21 LEU 642 -8.599 -18.771 11.565 1098 HD22 LEU 642 HD22 LEU 642 -8.336 -17.888 10.071 1099 HD23 LEU 642 HD23 LEU 642 -9.707 -19.007 10.209 1100 H GLU 643 H GLU 643 -12.221 -15.402 13.101 1101 HA GLU 643 HA GLU 643 -11.813 -16.785 15.645 1102 HB2 GLU 643 HB2 GLU 643 -13.504 -14.923 15.471 1103 HB3 GLU 643 HB3 GLU 643 -14.337 -15.875 14.262 1104 HG2 GLU 643 HG2 GLU 643 -14.746 -17.627 15.899 1105 HG3 GLU 643 HG3 GLU 643 -13.920 -16.664 17.124 1106 H VAL 644 H VAL 644 -11.725 -18.981 15.502 1107 HA VAL 644 HA VAL 644 -12.938 -20.253 13.143 1108 HB VAL 644 HB VAL 644 -10.882 -21.411 15.038 1109 HG11 VAL 644 HG11 VAL 644 -12.287 -23.053 13.911 1110 HG12 VAL 644 HG12 VAL 644 -10.613 -23.144 13.382 1111 HG13 VAL 644 HG13 VAL 644 -11.824 -22.380 12.344 1112 HG21 VAL 644 HG21 VAL 644 -10.468 -20.238 12.288 1113 HG22 VAL 644 HG22 VAL 644 -9.250 -21.092 13.232 1114 HG23 VAL 644 HG23 VAL 644 -9.898 -19.548 13.808 1115 H ILE 645 H ILE 645 -14.811 -21.181 13.557 1116 HA ILE 645 HA ILE 645 -15.428 -22.021 16.310 1117 HB ILE 645 HB ILE 645 -17.262 -21.682 13.948 1118 HG12 ILE 645 HG12 ILE 645 -17.075 -19.913 16.381 1119 HG13 ILE 645 HG13 ILE 645 -16.158 -19.589 14.911 1120 HG21 ILE 645 HG21 ILE 645 -18.068 -23.345 15.540 1121 HG22 ILE 645 HG22 ILE 645 -19.065 -21.891 15.621 1122 HG23 ILE 645 HG23 ILE 645 -17.828 -22.205 16.860 1123 HD11 ILE 645 HD11 ILE 645 -18.183 -19.414 13.654 1124 HD12 ILE 645 HD12 ILE 645 -18.197 -18.281 15.005 1125 HD13 ILE 645 HD13 ILE 645 -19.160 -19.771 15.084 1126 H ILE 646 H ILE 646 -15.324 -24.135 16.763 1127 HA ILE 646 HA ILE 646 -15.568 -26.078 14.591 1128 HB ILE 646 HB ILE 646 -14.603 -26.583 17.419 1129 HG12 ILE 646 HG12 ILE 646 -12.841 -26.210 14.981 1130 HG13 ILE 646 HG13 ILE 646 -13.058 -24.987 16.231 1131 HG21 ILE 646 HG21 ILE 646 -13.688 -28.635 16.469 1132 HG22 ILE 646 HG22 ILE 646 -14.392 -28.212 14.908 1133 HG23 ILE 646 HG23 ILE 646 -15.440 -28.526 16.291 1134 HD11 ILE 646 HD11 ILE 646 -10.982 -26.285 16.536 1135 HD12 ILE 646 HD12 ILE 646 -11.950 -27.750 16.690 1136 HD13 ILE 646 HD13 ILE 646 -12.100 -26.468 17.883 1137 H GLU 647 H GLU 647 -17.758 -26.527 14.497 1138 HA GLU 647 HA GLU 647 -18.597 -27.919 16.839 1139 HB2 GLU 647 HB2 GLU 647 -20.985 -27.328 16.621 1140 HB3 GLU 647 HB3 GLU 647 -20.038 -25.871 16.825 1141 HG2 GLU 647 HG2 GLU 647 -20.327 -25.262 14.569 1142 HG3 GLU 647 HG3 GLU 647 -20.931 -26.860 14.141 1143 H GLU 648 H GLU 648 -19.903 -29.865 16.194 1144 HA GLU 648 HA GLU 648 -18.924 -30.848 13.749 1145 HB2 GLU 648 HB2 GLU 648 -19.529 -32.329 15.660 1146 HB3 GLU 648 HB3 GLU 648 -21.230 -32.033 15.289 1147 HG2 GLU 648 HG2 GLU 648 -20.423 -34.135 14.311 1148 HG3 GLU 648 HG3 GLU 648 -20.952 -32.984 13.082 1149 H SER 649 H SER 649 -19.622 -30.932 11.837 1150 HA SER 649 HA SER 649 -22.260 -30.059 11.196 1151 HB2 SER 649 HB2 SER 649 -21.236 -28.190 9.698 1152 HB3 SER 649 HB3 SER 649 -21.426 -27.890 11.427 1153 HG SER 649 HG SER 649 -19.311 -28.111 11.735 1154 H TYR 650 H TYR 650 -22.788 -31.621 9.837 1155 HA TYR 650 HA TYR 650 -20.835 -32.640 7.937 1156 HB2 TYR 650 HB2 TYR 650 -23.591 -33.601 8.693 1157 HB3 TYR 650 HB3 TYR 650 -22.646 -34.291 7.389 1158 HD1 TYR 650 HD1 TYR 650 -22.860 -33.871 11.022 1159 HD2 TYR 650 HD2 TYR 650 -20.821 -35.657 7.798 1160 HE1 TYR 650 HE1 TYR 650 -21.733 -35.395 12.605 1161 HE2 TYR 650 HE2 TYR 650 -19.664 -37.197 9.353 1162 HH TYR 650 HH TYR 650 -20.638 -37.610 12.565 1163 H GLU 651 H GLU 651 -24.111 -31.391 7.987 1164 HA GLU 651 HA GLU 651 -24.253 -31.346 5.176 1165 HB2 GLU 651 HB2 GLU 651 -26.058 -30.061 7.216 1166 HB3 GLU 651 HB3 GLU 651 -26.413 -30.167 5.501 1167 HG2 GLU 651 HG2 GLU 651 -26.450 -32.582 5.626 1168 HG3 GLU 651 HG3 GLU 651 -26.008 -32.516 7.333 1169 H PHE 652 H PHE 652 -23.697 -28.973 7.687 1170 HA PHE 652 HA PHE 652 -23.198 -26.931 5.653 1171 HB2 PHE 652 HB2 PHE 652 -23.902 -26.656 8.584 1172 HB3 PHE 652 HB3 PHE 652 -23.402 -25.315 7.570 1173 HD1 PHE 652 HD1 PHE 652 -26.097 -27.668 8.342 1174 HD2 PHE 652 HD2 PHE 652 -24.883 -24.404 5.899 1175 HE1 PHE 652 HE1 PHE 652 -28.430 -27.299 7.681 1176 HE2 PHE 652 HE2 PHE 652 -27.216 -24.029 5.229 1177 HZ PHE 652 HZ PHE 652 -28.994 -25.475 6.119 1178 H LYS 653 H LYS 653 -21.391 -25.552 6.089 1179 HA LYS 653 HA LYS 653 -19.476 -26.557 8.042 1180 HB2 LYS 653 HB2 LYS 653 -17.602 -26.213 6.495 1181 HB3 LYS 653 HB3 LYS 653 -18.704 -27.423 5.877 1182 HG2 LYS 653 HG2 LYS 653 -19.626 -25.824 4.306 1183 HG3 LYS 653 HG3 LYS 653 -18.620 -24.547 4.981 1184 HD2 LYS 653 HD2 LYS 653 -17.483 -25.205 3.035 1185 HD3 LYS 653 HD3 LYS 653 -16.621 -26.018 4.332 1186 HE2 LYS 653 HE2 LYS 653 -18.707 -27.283 2.542 1187 HE3 LYS 653 HE3 LYS 653 -16.974 -27.434 2.328 1188 HZ1 LYS 653 HZ1 LYS 653 -16.900 -28.611 4.500 1189 HZ2 LYS 653 HZ2 LYS 653 -17.855 -29.375 3.355 1190 HZ3 LYS 653 HZ3 LYS 653 -18.589 -28.546 4.588 1191 H SER 654 H SER 654 -21.450 -24.249 7.329 1192 HA SER 654 HA SER 654 -19.771 -22.136 8.386 1193 HB2 SER 654 HB2 SER 654 -21.663 -21.828 6.030 1194 HB3 SER 654 HB3 SER 654 -20.685 -20.555 6.764 1195 HG SER 654 HG SER 654 -18.856 -22.034 6.213 1196 H THR 655 H THR 655 -21.233 -20.414 9.305 1197 HA THR 655 HA THR 655 -23.796 -21.581 10.077 1198 HB THR 655 HB THR 655 -22.173 -21.780 11.961 1199 HG1 THR 655 HG1 THR 655 -23.644 -19.900 13.179 1200 HG21 THR 655 HG21 THR 655 -20.732 -19.857 11.479 1201 HG22 THR 655 HG22 THR 655 -21.359 -19.749 13.124 1202 HG23 THR 655 HG23 THR 655 -22.057 -18.754 11.846 1203 H VAL 656 H VAL 656 -25.493 -20.114 10.218 1204 HA VAL 656 HA VAL 656 -25.073 -17.662 8.770 1205 HB VAL 656 HB VAL 656 -27.616 -18.733 10.036 1206 HG11 VAL 656 HG11 VAL 656 -27.724 -16.329 9.674 1207 HG12 VAL 656 HG12 VAL 656 -28.764 -17.160 8.513 1208 HG13 VAL 656 HG13 VAL 656 -27.198 -16.538 8.005 1209 HG21 VAL 656 HG21 VAL 656 -26.648 -18.915 7.181 1210 HG22 VAL 656 HG22 VAL 656 -28.232 -19.431 7.757 1211 HG23 VAL 656 HG23 VAL 656 -26.777 -20.251 8.323 1212 H ASP 657 H ASP 657 -24.466 -15.897 9.718 1213 HA ASP 657 HA ASP 657 -24.741 -15.635 12.623 1214 HB2 ASP 657 HB2 ASP 657 -22.501 -15.350 11.675 1215 HB3 ASP 657 HB3 ASP 657 -23.088 -14.046 10.653 Start of MODEL 7 1 H HIS 501 H HIS 501 -0.055 -0.373 0.955 2 HA HIS 501 HA HIS 501 1.707 0.665 -0.061 3 HB2 HIS 501 HB2 HIS 501 3.411 -0.456 2.189 4 HB3 HIS 501 HB3 HIS 501 3.929 0.722 0.988 5 HD1 HIS 501 HD1 HIS 501 3.082 3.189 1.318 6 HD2 HIS 501 HD2 HIS 501 1.840 0.518 4.230 7 HE1 HIS 501 HE1 HIS 501 2.176 4.594 3.202 8 H ALA 502 H ALA 502 1.712 -2.451 1.089 9 HA ALA 502 HA ALA 502 2.896 -3.453 -1.435 10 HB1 ALA 502 HB1 ALA 502 3.609 -5.438 -0.211 11 HB2 ALA 502 HB2 ALA 502 2.887 -4.787 1.254 12 HB3 ALA 502 HB3 ALA 502 4.294 -3.988 0.541 13 H GLY 503 H GLY 503 0.162 -2.884 0.151 14 HA2 GLY 503 HA2 GLY 503 -1.853 -3.735 -0.923 15 HA3 GLY 503 HA3 GLY 503 -1.095 -5.319 -0.881 16 H ILE 504 H ILE 504 -3.013 -6.020 0.208 17 HA ILE 504 HA ILE 504 -3.058 -5.260 3.025 18 HB ILE 504 HB ILE 504 -5.346 -5.904 1.147 19 HG12 ILE 504 HG12 ILE 504 -6.269 -3.682 2.104 20 HG13 ILE 504 HG13 ILE 504 -4.630 -3.394 2.656 21 HG21 ILE 504 HG21 ILE 504 -6.878 -5.672 2.994 22 HG22 ILE 504 HG22 ILE 504 -5.502 -5.613 4.112 23 HG23 ILE 504 HG23 ILE 504 -5.798 -7.060 3.132 24 HD11 ILE 504 HD11 ILE 504 -3.850 -3.516 0.332 25 HD12 ILE 504 HD12 ILE 504 -5.056 -2.249 0.562 26 HD13 ILE 504 HD13 ILE 504 -5.507 -3.775 -0.202 27 H PHE 505 H PHE 505 -2.159 -7.010 4.080 28 HA PHE 505 HA PHE 505 -2.958 -9.709 3.281 29 HB2 PHE 505 HB2 PHE 505 -0.864 -8.656 5.135 30 HB3 PHE 505 HB3 PHE 505 -1.592 -10.197 5.555 31 HD1 PHE 505 HD1 PHE 505 -1.785 -11.806 3.377 32 HD2 PHE 505 HD2 PHE 505 1.123 -8.782 4.023 33 HE1 PHE 505 HE1 PHE 505 -0.235 -12.979 1.872 34 HE2 PHE 505 HE2 PHE 505 2.666 -9.939 2.502 35 HZ PHE 505 HZ PHE 505 1.977 -12.047 1.419 36 H THR 506 H THR 506 -4.632 -10.718 4.176 37 HA THR 506 HA THR 506 -5.272 -10.454 6.894 38 HB THR 506 HB THR 506 -6.249 -8.275 6.040 39 HG1 THR 506 HG1 THR 506 -7.627 -8.544 7.598 40 HG21 THR 506 HG21 THR 506 -8.324 -8.371 4.679 41 HG22 THR 506 HG22 THR 506 -8.102 -10.114 4.494 42 HG23 THR 506 HG23 THR 506 -6.930 -9.000 3.798 43 H PHE 507 H PHE 507 -7.573 -11.542 7.164 44 HA PHE 507 HA PHE 507 -7.329 -14.074 5.822 45 HB2 PHE 507 HB2 PHE 507 -9.075 -13.025 8.031 46 HB3 PHE 507 HB3 PHE 507 -9.327 -14.625 7.328 47 HD1 PHE 507 HD2 PHE 507 -7.660 -16.345 7.623 48 HD2 PHE 507 HD1 PHE 507 -7.247 -12.557 9.495 49 HE1 PHE 507 HE2 PHE 507 -6.023 -17.301 9.143 50 HE2 PHE 507 HE1 PHE 507 -5.585 -13.489 11.036 51 HZ PHE 507 HZ PHE 507 -4.960 -15.854 10.879 52 H GLU 508 H GLU 508 -8.911 -15.020 4.475 53 HA GLU 508 HA GLU 508 -10.270 -13.295 2.732 54 HB2 GLU 508 HB2 GLU 508 -9.443 -15.595 2.215 55 HB3 GLU 508 HB3 GLU 508 -10.727 -16.236 3.227 56 HG2 GLU 508 HG2 GLU 508 -12.369 -15.160 1.739 57 HG3 GLU 508 HG3 GLU 508 -11.009 -14.659 0.722 58 H GLU 509 H GLU 509 -11.216 -14.996 5.610 59 HA GLU 509 HA GLU 509 -13.677 -13.501 5.651 60 HB2 GLU 509 HB2 GLU 509 -14.870 -15.501 6.538 61 HB3 GLU 509 HB3 GLU 509 -14.392 -15.684 4.868 62 HG2 GLU 509 HG2 GLU 509 -12.342 -16.935 5.840 63 HG3 GLU 509 HG3 GLU 509 -13.305 -17.006 7.317 64 HA PRO 510 HA PRO 510 -12.001 -12.656 9.632 65 HB2 PRO 510 HB2 PRO 510 -14.179 -11.613 10.849 66 HB3 PRO 510 HB3 PRO 510 -13.309 -10.753 9.575 67 HG2 PRO 510 HG2 PRO 510 -15.841 -12.341 9.394 68 HG3 PRO 510 HG3 PRO 510 -15.441 -10.785 8.643 69 HD2 PRO 510 HD2 PRO 510 -15.327 -13.166 7.293 70 HD3 PRO 510 HD3 PRO 510 -14.289 -11.773 6.919 71 H VAL 511 H VAL 511 -14.797 -14.657 9.289 72 HA VAL 511 HA VAL 511 -14.134 -16.060 11.772 73 HB VAL 511 HB VAL 511 -16.994 -15.410 10.905 74 HG11 VAL 511 HG11 VAL 511 -16.006 -16.808 13.371 75 HG12 VAL 511 HG12 VAL 511 -16.807 -17.561 11.992 76 HG13 VAL 511 HG13 VAL 511 -17.686 -16.412 13.002 77 HG21 VAL 511 HG21 VAL 511 -15.457 -14.312 13.264 78 HG22 VAL 511 HG22 VAL 511 -17.162 -14.025 12.927 79 HG23 VAL 511 HG23 VAL 511 -15.928 -13.402 11.828 80 H THR 512 H THR 512 -14.191 -18.259 11.445 81 HA THR 512 HA THR 512 -15.463 -19.128 8.991 82 HB THR 512 HB THR 512 -12.986 -19.015 8.644 83 HG1 THR 512 HG1 THR 512 -14.235 -20.587 7.597 84 HG21 THR 512 HG21 THR 512 -12.885 -21.115 10.797 85 HG22 THR 512 HG22 THR 512 -12.233 -19.477 10.906 86 HG23 THR 512 HG23 THR 512 -11.526 -20.640 9.776 87 H HIS 513 H HIS 513 -16.654 -20.958 9.211 88 HA HIS 513 HA HIS 513 -16.623 -22.135 11.868 89 HB2 HIS 513 HB2 HIS 513 -18.994 -22.803 11.554 90 HB3 HIS 513 HB3 HIS 513 -18.793 -21.065 11.454 91 HD1 HIS 513 HD1 HIS 513 -19.496 -19.942 9.201 92 HD2 HIS 513 HD2 HIS 513 -19.788 -24.088 9.201 93 HE1 HIS 513 HE1 HIS 513 -20.849 -20.552 7.171 94 H VAL 514 H VAL 514 -15.931 -24.047 12.051 95 HA VAL 514 HA VAL 514 -15.678 -25.633 9.611 96 HB VAL 514 HB VAL 514 -13.608 -26.575 10.442 97 HG11 VAL 514 HG11 VAL 514 -12.138 -24.566 10.474 98 HG12 VAL 514 HG12 VAL 514 -13.580 -23.568 10.608 99 HG13 VAL 514 HG13 VAL 514 -13.333 -24.569 9.176 100 HG21 VAL 514 HG21 VAL 514 -12.528 -25.793 12.518 101 HG22 VAL 514 HG22 VAL 514 -14.068 -26.590 12.838 102 HG23 VAL 514 HG23 VAL 514 -13.959 -24.830 12.889 103 H SER 515 H SER 515 -15.667 -27.949 9.999 104 HA SER 515 HA SER 515 -17.705 -28.705 11.844 105 HB2 SER 515 HB2 SER 515 -16.139 -29.896 9.639 106 HB3 SER 515 HB3 SER 515 -17.328 -30.850 10.488 107 HG SER 515 HG SER 515 -18.474 -28.543 9.792 108 H GLU 516 H GLU 516 -17.349 -30.556 13.299 109 HA GLU 516 HA GLU 516 -14.742 -30.596 14.453 110 HB2 GLU 516 HB2 GLU 516 -16.610 -30.799 15.979 111 HB3 GLU 516 HB3 GLU 516 -17.237 -32.192 15.132 112 HG2 GLU 516 HG2 GLU 516 -14.518 -32.551 16.195 113 HG3 GLU 516 HG3 GLU 516 -15.750 -32.276 17.420 114 H SER 517 H SER 517 -16.636 -32.972 12.643 115 HA SER 517 HA SER 517 -14.480 -34.907 12.666 116 HB2 SER 517 HB2 SER 517 -17.094 -34.946 11.169 117 HB3 SER 517 HB3 SER 517 -16.083 -36.323 11.618 118 HG SER 517 HG SER 517 -16.492 -35.201 13.864 119 H ILE 518 H ILE 518 -13.721 -32.518 11.357 120 HA ILE 518 HA ILE 518 -13.984 -33.068 8.490 121 HB ILE 518 HB ILE 518 -14.542 -30.820 9.286 122 HG12 ILE 518 HG12 ILE 518 -12.090 -30.856 7.528 123 HG13 ILE 518 HG13 ILE 518 -13.751 -31.095 6.985 124 HG21 ILE 518 HG21 ILE 518 -13.069 -30.621 11.146 125 HG22 ILE 518 HG22 ILE 518 -12.833 -29.272 10.044 126 HG23 ILE 518 HG23 ILE 518 -11.651 -30.595 10.088 127 HD11 ILE 518 HD11 ILE 518 -13.045 -28.846 6.503 128 HD12 ILE 518 HD12 ILE 518 -12.558 -28.640 8.188 129 HD13 ILE 518 HD13 ILE 518 -14.275 -28.825 7.792 130 H GLY 519 H GLY 519 -11.652 -33.176 11.046 131 HA2 GLY 519 HA2 GLY 519 -9.557 -34.179 10.956 132 HA3 GLY 519 HA3 GLY 519 -9.675 -34.190 9.202 133 H ILE 520 H ILE 520 -9.624 -32.027 8.175 134 HA ILE 520 HA ILE 520 -7.711 -30.288 9.551 135 HB ILE 520 HB ILE 520 -7.540 -31.252 6.692 136 HG12 ILE 520 HG12 ILE 520 -6.688 -32.953 8.268 137 HG13 ILE 520 HG13 ILE 520 -5.403 -32.303 7.262 138 HG21 ILE 520 HG21 ILE 520 -5.792 -29.265 8.123 139 HG22 ILE 520 HG22 ILE 520 -6.880 -28.959 6.775 140 HG23 ILE 520 HG23 ILE 520 -5.442 -29.951 6.535 141 HD11 ILE 520 HD11 ILE 520 -4.653 -32.601 9.541 142 HD12 ILE 520 HD12 ILE 520 -5.968 -31.589 10.122 143 HD13 ILE 520 HD13 ILE 520 -4.688 -30.883 9.135 144 H MET 521 H MET 521 -8.312 -28.249 9.339 145 HA MET 521 HA MET 521 -10.259 -27.601 7.240 146 HB2 MET 521 HB2 MET 521 -11.162 -25.894 8.661 147 HB3 MET 521 HB3 MET 521 -11.065 -27.357 9.625 148 HG2 MET 521 HG2 MET 521 -10.283 -25.766 11.129 149 HG3 MET 521 HG3 MET 521 -8.796 -26.289 10.371 150 HE1 MET 521 HE1 MET 521 -9.471 -23.538 11.906 151 HE2 MET 521 HE2 MET 521 -8.555 -22.341 10.986 152 HE3 MET 521 HE3 MET 521 -7.802 -23.876 11.424 153 H GLU 522 H GLU 522 -9.881 -25.631 6.133 154 HA GLU 522 HA GLU 522 -7.254 -24.492 6.595 155 HB2 GLU 522 HB2 GLU 522 -8.275 -25.583 4.010 156 HB3 GLU 522 HB3 GLU 522 -7.157 -24.225 4.006 157 HG2 GLU 522 HG2 GLU 522 -5.514 -25.447 5.116 158 HG3 GLU 522 HG3 GLU 522 -6.589 -26.814 5.433 159 H VAL 523 H VAL 523 -6.997 -22.429 6.245 160 HA VAL 523 HA VAL 523 -9.399 -20.860 5.590 161 HB VAL 523 HB VAL 523 -7.161 -20.063 7.476 162 HG11 VAL 523 HG11 VAL 523 -9.832 -18.770 6.987 163 HG12 VAL 523 HG12 VAL 523 -8.284 -18.201 6.351 164 HG13 VAL 523 HG13 VAL 523 -8.563 -18.228 8.092 165 HG21 VAL 523 HG21 VAL 523 -9.955 -20.951 8.163 166 HG22 VAL 523 HG22 VAL 523 -8.670 -20.479 9.295 167 HG23 VAL 523 HG23 VAL 523 -8.508 -21.937 8.331 168 H LYS 524 H LYS 524 -9.131 -19.491 3.920 169 HA LYS 524 HA LYS 524 -6.593 -19.421 2.541 170 HB2 LYS 524 HB2 LYS 524 -9.190 -18.011 1.906 171 HB3 LYS 524 HB3 LYS 524 -7.827 -18.263 0.818 172 HG2 LYS 524 HG2 LYS 524 -9.347 -20.560 2.005 173 HG3 LYS 524 HG3 LYS 524 -9.908 -19.729 0.559 174 HD2 LYS 524 HD2 LYS 524 -7.094 -20.573 0.549 175 HD3 LYS 524 HD3 LYS 524 -8.286 -21.895 0.491 176 HE2 LYS 524 HE2 LYS 524 -9.317 -20.568 -1.429 177 HE3 LYS 524 HE3 LYS 524 -7.857 -19.586 -1.391 178 HZ1 LYS 524 HZ1 LYS 524 -6.559 -21.641 -1.766 179 HZ2 LYS 524 HZ2 LYS 524 -7.655 -21.342 -3.020 180 HZ3 LYS 524 HZ3 LYS 524 -8.004 -22.508 -1.866 181 H VAL 525 H VAL 525 -5.186 -17.815 2.767 182 HA VAL 525 HA VAL 525 -6.066 -15.410 4.184 183 HB VAL 525 HB VAL 525 -3.248 -16.423 3.739 184 HG11 VAL 525 HG11 VAL 525 -2.587 -14.716 5.392 185 HG12 VAL 525 HG12 VAL 525 -4.258 -14.163 5.474 186 HG13 VAL 525 HG13 VAL 525 -3.343 -13.976 3.977 187 HG21 VAL 525 HG21 VAL 525 -4.967 -16.488 6.206 188 HG22 VAL 525 HG22 VAL 525 -3.263 -16.943 6.128 189 HG23 VAL 525 HG23 VAL 525 -4.464 -17.869 5.229 190 H LEU 526 H LEU 526 -6.227 -13.606 3.120 191 HA LEU 526 HA LEU 526 -5.834 -13.559 0.311 192 HB2 LEU 526 HB2 LEU 526 -6.622 -11.405 2.267 193 HB3 LEU 526 HB3 LEU 526 -6.575 -11.185 0.531 194 HG LEU 526 HG LEU 526 -8.400 -13.120 1.979 195 HD11 LEU 526 HD11 LEU 526 -10.170 -11.554 1.351 196 HD12 LEU 526 HD12 LEU 526 -8.953 -10.431 0.740 197 HD13 LEU 526 HD13 LEU 526 -9.004 -10.837 2.457 198 HD21 LEU 526 HD21 LEU 526 -7.842 -13.881 -0.273 199 HD22 LEU 526 HD22 LEU 526 -8.247 -12.293 -0.921 200 HD23 LEU 526 HD23 LEU 526 -9.507 -13.301 -0.211 201 H ARG 527 H ARG 527 -4.025 -13.290 -0.571 202 HA ARG 527 HA ARG 527 -1.657 -12.343 0.639 203 HB2 ARG 527 HB2 ARG 527 -1.832 -13.895 -1.341 204 HB3 ARG 527 HB3 ARG 527 -2.303 -12.507 -2.305 205 HG2 ARG 527 HG2 ARG 527 -0.106 -11.457 -1.595 206 HG3 ARG 527 HG3 ARG 527 0.348 -13.060 -1.010 207 HD2 ARG 527 HD2 ARG 527 1.194 -12.876 -3.212 208 HD3 ARG 527 HD3 ARG 527 -0.223 -13.923 -3.291 209 HE ARG 527 HE ARG 527 -0.697 -11.105 -3.794 210 HH11 ARG 527 HH11 ARG 527 -0.132 -14.272 -5.255 211 HH12 ARG 527 HH12 ARG 527 -0.695 -13.813 -6.799 212 HH21 ARG 527 HH21 ARG 527 -1.401 -10.467 -5.985 213 HH22 ARG 527 HH22 ARG 527 -1.430 -11.617 -7.207 214 H THR 528 H THR 528 -0.511 -10.360 0.131 215 HA THR 528 HA THR 528 -1.940 -8.053 0.116 216 HB THR 528 HB THR 528 0.419 -7.313 -0.875 217 HG1 THR 528 HG1 THR 528 1.895 -8.798 -0.713 218 HG21 THR 528 HG21 THR 528 -0.468 -6.676 1.312 219 HG22 THR 528 HG22 THR 528 1.219 -7.178 1.450 220 HG23 THR 528 HG23 THR 528 -0.072 -8.272 1.946 221 H SER 529 H SER 529 -2.526 -6.656 -1.376 222 HA SER 529 HA SER 529 -3.318 -7.357 -3.873 223 HB2 SER 529 HB2 SER 529 -2.788 -4.585 -2.826 224 HB3 SER 529 HB3 SER 529 -4.185 -5.175 -3.756 225 HG SER 529 HG SER 529 -4.878 -6.276 -1.965 226 H GLY 530 H GLY 530 -0.207 -6.306 -2.707 227 HA2 GLY 530 HA2 GLY 530 0.836 -6.279 -5.433 228 HA3 GLY 530 HA3 GLY 530 1.244 -4.999 -4.298 229 H ALA 531 H ALA 531 1.410 -8.492 -4.770 230 HA ALA 531 HA ALA 531 3.294 -8.727 -2.572 231 HB1 ALA 531 HB1 ALA 531 2.374 -10.794 -4.580 232 HB2 ALA 531 HB2 ALA 531 1.713 -10.565 -2.964 233 HB3 ALA 531 HB3 ALA 531 3.373 -11.123 -3.168 234 H ARG 532 H ARG 532 5.128 -7.835 -2.980 235 HA ARG 532 HA ARG 532 6.256 -7.996 -5.652 236 HB2 ARG 532 HB2 ARG 532 7.113 -6.251 -3.349 237 HB3 ARG 532 HB3 ARG 532 7.585 -6.097 -5.040 238 HG2 ARG 532 HG2 ARG 532 4.829 -5.668 -3.887 239 HG3 ARG 532 HG3 ARG 532 5.925 -4.392 -4.388 240 HD2 ARG 532 HD2 ARG 532 5.772 -5.158 -6.695 241 HD3 ARG 532 HD3 ARG 532 4.765 -6.513 -6.190 242 HE ARG 532 HE ARG 532 3.747 -3.923 -5.450 243 HH11 ARG 532 HH11 ARG 532 3.772 -6.377 -7.986 244 HH12 ARG 532 HH12 ARG 532 2.251 -5.953 -8.609 245 HH21 ARG 532 HH21 ARG 532 1.659 -3.327 -6.293 246 HH22 ARG 532 HH22 ARG 532 1.018 -4.193 -7.617 247 H GLY 533 H GLY 533 7.185 -10.073 -5.576 248 HA2 GLY 533 HA2 GLY 533 9.318 -11.063 -5.409 249 HA3 GLY 533 HA3 GLY 533 9.612 -10.127 -3.956 250 H ASN 534 H ASN 534 9.633 -11.279 -2.198 251 HA ASN 534 HA ASN 534 7.611 -13.341 -1.895 252 HB2 ASN 534 HB2 ASN 534 9.674 -14.493 -2.482 253 HB3 ASN 534 HB3 ASN 534 10.550 -13.693 -1.189 254 HD21 ASN 534 HD21 ASN 534 7.256 -15.028 -1.034 255 HD22 ASN 534 HD22 ASN 534 7.656 -16.301 0.054 256 H VAL 535 H VAL 535 6.633 -13.298 0.020 257 HA VAL 535 HA VAL 535 7.807 -11.679 2.143 258 HB VAL 535 HB VAL 535 4.884 -11.715 1.318 259 HG11 VAL 535 HG11 VAL 535 4.650 -9.882 2.943 260 HG12 VAL 535 HG12 VAL 535 6.317 -10.169 3.448 261 HG13 VAL 535 HG13 VAL 535 5.099 -11.426 3.667 262 HG21 VAL 535 HG21 VAL 535 5.175 -9.362 0.659 263 HG22 VAL 535 HG22 VAL 535 6.179 -10.445 -0.307 264 HG23 VAL 535 HG23 VAL 535 6.904 -9.495 0.989 265 H ILE 536 H ILE 536 7.559 -12.655 4.131 266 HA ILE 536 HA ILE 536 6.108 -15.200 4.162 267 HB ILE 536 HB ILE 536 8.342 -14.201 5.938 268 HG12 ILE 536 HG12 ILE 536 9.184 -14.934 3.764 269 HG13 ILE 536 HG13 ILE 536 9.615 -16.116 4.997 270 HG21 ILE 536 HG21 ILE 536 6.843 -16.800 6.046 271 HG22 ILE 536 HG22 ILE 536 6.759 -15.493 7.216 272 HG23 ILE 536 HG23 ILE 536 8.267 -16.403 7.020 273 HD11 ILE 536 HD11 ILE 536 7.474 -16.282 2.919 274 HD12 ILE 536 HD12 ILE 536 7.646 -17.434 4.232 275 HD13 ILE 536 HD13 ILE 536 8.939 -17.257 3.036 276 H VAL 537 H VAL 537 4.468 -15.480 5.578 277 HA VAL 537 HA VAL 537 4.021 -13.291 7.447 278 HB VAL 537 HB VAL 537 1.834 -14.894 6.086 279 HG11 VAL 537 HG11 VAL 537 1.191 -14.108 8.301 280 HG12 VAL 537 HG12 VAL 537 0.311 -13.221 7.050 281 HG13 VAL 537 HG13 VAL 537 1.682 -12.469 7.870 282 HG21 VAL 537 HG21 VAL 537 2.720 -12.061 5.608 283 HG22 VAL 537 HG22 VAL 537 1.348 -12.858 4.825 284 HG23 VAL 537 HG23 VAL 537 2.998 -13.425 4.534 285 HA PRO 538 HA PRO 538 4.217 -16.870 10.234 286 HB2 PRO 538 HB2 PRO 538 4.364 -15.402 12.509 287 HB3 PRO 538 HB3 PRO 538 5.769 -15.766 11.504 288 HG2 PRO 538 HG2 PRO 538 4.169 -13.254 11.713 289 HG3 PRO 538 HG3 PRO 538 5.908 -13.453 11.445 290 HD2 PRO 538 HD2 PRO 538 4.095 -12.852 9.467 291 HD3 PRO 538 HD3 PRO 538 5.651 -13.642 9.184 292 H TYR 539 H TYR 539 2.735 -17.765 11.641 293 HA TYR 539 HA TYR 539 0.390 -16.234 12.414 294 HB2 TYR 539 HB2 TYR 539 -1.222 -17.745 11.380 295 HB3 TYR 539 HB3 TYR 539 -0.155 -17.047 10.163 296 HD1 TYR 539 HD2 TYR 539 -1.052 -20.133 11.954 297 HD2 TYR 539 HD1 TYR 539 1.363 -18.413 8.913 298 HE1 TYR 539 HE2 TYR 539 -0.520 -22.370 11.135 299 HE2 TYR 539 HE1 TYR 539 1.906 -20.651 8.078 300 HH TYR 539 HH TYR 539 1.992 -22.916 8.915 301 H LYS 540 H LYS 540 -1.053 -17.493 13.811 302 HA LYS 540 HA LYS 540 -0.074 -19.951 14.966 303 HB2 LYS 540 HB2 LYS 540 0.126 -19.093 17.227 304 HB3 LYS 540 HB3 LYS 540 1.263 -18.257 16.172 305 HG2 LYS 540 HG2 LYS 540 -0.157 -16.351 16.050 306 HG3 LYS 540 HG3 LYS 540 -1.430 -17.190 16.921 307 HD2 LYS 540 HD2 LYS 540 -0.000 -17.287 18.898 308 HD3 LYS 540 HD3 LYS 540 1.263 -16.415 18.016 309 HE2 LYS 540 HE2 LYS 540 -1.518 -15.436 18.372 310 HE3 LYS 540 HE3 LYS 540 -0.207 -14.959 19.457 311 HZ1 LYS 540 HZ1 LYS 540 0.937 -13.979 17.538 312 HZ2 LYS 540 HZ2 LYS 540 -0.624 -13.319 17.664 313 HZ3 LYS 540 HZ3 LYS 540 -0.294 -14.480 16.512 314 H THR 541 H THR 541 -1.626 -20.870 16.376 315 HA THR 541 HA THR 541 -4.312 -19.913 16.067 316 HB THR 541 HB THR 541 -4.718 -21.987 17.522 317 HG1 THR 541 HG1 THR 541 -2.630 -22.274 18.323 318 HG21 THR 541 HG21 THR 541 -5.086 -21.994 15.107 319 HG22 THR 541 HG22 THR 541 -4.393 -23.532 15.625 320 HG23 THR 541 HG23 THR 541 -3.377 -22.317 14.845 321 H ILE 542 H ILE 542 -5.630 -19.419 17.899 322 HA ILE 542 HA ILE 542 -4.199 -18.736 20.389 323 HB ILE 542 HB ILE 542 -6.510 -17.287 19.117 324 HG12 ILE 542 HG12 ILE 542 -3.667 -16.281 19.343 325 HG13 ILE 542 HG13 ILE 542 -4.347 -16.986 17.880 326 HG21 ILE 542 HG21 ILE 542 -6.519 -17.120 21.546 327 HG22 ILE 542 HG22 ILE 542 -6.088 -15.554 20.857 328 HG23 ILE 542 HG23 ILE 542 -4.837 -16.587 21.543 329 HD11 ILE 542 HD11 ILE 542 -5.970 -15.209 17.747 330 HD12 ILE 542 HD12 ILE 542 -4.334 -14.554 17.819 331 HD13 ILE 542 HD13 ILE 542 -5.368 -14.516 19.255 332 H GLU 543 H GLU 543 -5.024 -19.998 21.932 333 HA GLU 543 HA GLU 543 -7.335 -21.569 21.618 334 HB2 GLU 543 HB2 GLU 543 -6.132 -20.902 24.306 335 HB3 GLU 543 HB3 GLU 543 -6.982 -22.361 23.832 336 HG2 GLU 543 HG2 GLU 543 -4.783 -23.099 23.910 337 HG3 GLU 543 HG3 GLU 543 -4.960 -22.672 22.214 338 H GLY 544 H GLY 544 -9.346 -21.008 21.775 339 HA2 GLY 544 HA2 GLY 544 -10.112 -18.625 23.318 340 HA3 GLY 544 HA3 GLY 544 -11.083 -19.382 22.053 341 H THR 545 H THR 545 -12.580 -20.840 22.622 342 HA THR 545 HA THR 545 -12.666 -21.683 25.392 343 HB THR 545 HB THR 545 -14.856 -22.745 24.678 344 HG1 THR 545 HG1 THR 545 -15.630 -21.886 22.643 345 HG21 THR 545 HG21 THR 545 -16.067 -20.616 24.426 346 HG22 THR 545 HG22 THR 545 -14.549 -19.802 24.063 347 HG23 THR 545 HG23 THR 545 -14.816 -20.499 25.661 348 H ALA 546 H ALA 546 -11.724 -22.702 22.317 349 HA ALA 546 HA ALA 546 -11.729 -25.538 22.805 350 HB1 ALA 546 HB1 ALA 546 -10.363 -24.026 20.596 351 HB2 ALA 546 HB2 ALA 546 -12.058 -24.426 20.561 352 HB3 ALA 546 HB3 ALA 546 -10.854 -25.724 20.590 353 H ARG 547 H ARG 547 -10.030 -26.743 23.454 354 HA ARG 547 HA ARG 547 -7.724 -25.356 24.507 355 HB2 ARG 547 HB2 ARG 547 -8.611 -28.210 24.640 356 HB3 ARG 547 HB3 ARG 547 -7.150 -27.586 25.376 357 HG2 ARG 547 HG2 ARG 547 -8.433 -26.179 26.805 358 HG3 ARG 547 HG3 ARG 547 -9.951 -26.734 26.063 359 HD2 ARG 547 HD2 ARG 547 -9.429 -29.025 26.701 360 HD3 ARG 547 HD3 ARG 547 -7.912 -28.496 27.409 361 HE ARG 547 HE ARG 547 -10.124 -27.192 28.569 362 HH11 ARG 547 HH11 ARG 547 -8.365 -30.277 28.486 363 HH12 ARG 547 HH12 ARG 547 -8.736 -30.709 30.092 364 HH21 ARG 547 HH21 ARG 547 -10.673 -27.813 30.800 365 HH22 ARG 547 HH22 ARG 547 -10.064 -29.279 31.433 366 H GLY 548 H GLY 548 -5.703 -25.709 23.911 367 HA2 GLY 548 HA2 GLY 548 -5.207 -26.943 21.314 368 HA3 GLY 548 HA3 GLY 548 -4.061 -25.976 22.243 369 H GLY 549 H GLY 549 -2.486 -27.671 21.849 370 HA2 GLY 549 HA2 GLY 549 -1.215 -29.383 22.698 371 HA3 GLY 549 HA3 GLY 549 -2.341 -29.473 24.044 372 H GLY 550 H GLY 550 -3.425 -29.775 20.779 373 HA2 GLY 550 HA2 GLY 550 -4.309 -31.509 19.598 374 HA3 GLY 550 HA3 GLY 550 -3.285 -32.578 20.548 375 H GLU 551 H GLU 551 -5.718 -30.434 21.867 376 HA GLU 551 HA GLU 551 -7.109 -32.824 22.805 377 HB2 GLU 551 HB2 GLU 551 -6.232 -31.319 24.541 378 HB3 GLU 551 HB3 GLU 551 -7.243 -30.035 23.872 379 HG2 GLU 551 HG2 GLU 551 -9.069 -30.768 24.915 380 HG3 GLU 551 HG3 GLU 551 -8.735 -32.440 24.494 381 H ASP 552 H ASP 552 -8.091 -29.478 21.970 382 HA ASP 552 HA ASP 552 -10.497 -30.672 20.778 383 HB2 ASP 552 HB2 ASP 552 -9.901 -27.784 21.483 384 HB3 ASP 552 HB3 ASP 552 -11.365 -28.330 20.680 385 H PHE 553 H PHE 553 -7.912 -28.421 20.211 386 HA PHE 553 HA PHE 553 -8.075 -29.182 17.421 387 HB2 PHE 553 HB2 PHE 553 -7.724 -26.934 16.624 388 HB3 PHE 553 HB3 PHE 553 -9.111 -26.893 17.694 389 HD1 PHE 553 HD1 PHE 553 -8.845 -25.903 19.980 390 HD2 PHE 553 HD2 PHE 553 -5.797 -25.661 17.038 391 HE1 PHE 553 HE1 PHE 553 -7.799 -24.052 21.215 392 HE2 PHE 553 HE2 PHE 553 -4.742 -23.826 18.272 393 HZ PHE 553 HZ PHE 553 -5.740 -23.011 20.356 394 H GLU 554 H GLU 554 -6.102 -29.127 16.399 395 HA GLU 554 HA GLU 554 -3.857 -29.503 18.160 396 HB2 GLU 554 HB2 GLU 554 -4.498 -30.809 16.001 397 HB3 GLU 554 HB3 GLU 554 -3.851 -29.411 15.166 398 HG2 GLU 554 HG2 GLU 554 -1.769 -29.881 16.715 399 HG3 GLU 554 HG3 GLU 554 -2.548 -31.470 16.757 400 H ASP 555 H ASP 555 -2.839 -27.665 18.785 401 HA ASP 555 HA ASP 555 -3.274 -25.187 17.465 402 HB2 ASP 555 HB2 ASP 555 -1.695 -24.193 19.075 403 HB3 ASP 555 HB3 ASP 555 -2.910 -25.166 19.884 404 H THR 556 H THR 556 -1.897 -23.929 16.274 405 HA THR 556 HA THR 556 0.466 -25.251 15.326 406 HB THR 556 HB THR 556 -1.304 -26.145 13.865 407 HG1 THR 556 HG1 THR 556 0.799 -25.742 13.021 408 HG21 THR 556 HG21 THR 556 -1.777 -23.261 13.065 409 HG22 THR 556 HG22 THR 556 -2.928 -24.315 13.886 410 HG23 THR 556 HG23 THR 556 -2.448 -24.658 12.234 411 H CYS 557 H CYS 557 1.906 -23.939 14.323 412 HA CYS 557 HA CYS 557 1.333 -21.170 13.904 413 HB2 CYS 557 HB2 CYS 557 3.379 -20.528 15.245 414 HB3 CYS 557 HB3 CYS 557 2.028 -21.096 16.221 415 HG CYS 557 HG CYS 557 3.197 -23.063 17.335 416 H GLY 558 H GLY 558 3.120 -20.222 12.585 417 HA2 GLY 558 HA2 GLY 558 5.339 -21.545 11.745 418 HA3 GLY 558 HA3 GLY 558 4.033 -22.139 10.722 419 H GLU 559 H GLU 559 5.250 -21.135 9.032 420 HA GLU 559 HA GLU 559 4.625 -18.301 8.801 421 HB2 GLU 559 HB2 GLU 559 7.253 -19.670 8.294 422 HB3 GLU 559 HB3 GLU 559 6.880 -18.085 7.623 423 HG2 GLU 559 HG2 GLU 559 6.665 -17.173 9.875 424 HG3 GLU 559 HG3 GLU 559 6.912 -18.771 10.559 425 H LEU 560 H LEU 560 3.537 -17.888 7.033 426 HA LEU 560 HA LEU 560 3.301 -19.852 4.846 427 HB2 LEU 560 HB2 LEU 560 1.856 -17.289 5.454 428 HB3 LEU 560 HB3 LEU 560 1.583 -18.260 4.025 429 HG LEU 560 HG LEU 560 1.039 -19.085 6.869 430 HD11 LEU 560 HD11 LEU 560 -1.296 -19.034 6.164 431 HD12 LEU 560 HD12 LEU 560 -0.804 -18.386 4.598 432 HD13 LEU 560 HD13 LEU 560 -0.535 -17.450 6.066 433 HD21 LEU 560 HD21 LEU 560 -0.074 -21.056 5.764 434 HD22 LEU 560 HD22 LEU 560 1.681 -21.035 5.672 435 HD23 LEU 560 HD23 LEU 560 0.739 -20.584 4.261 436 H GLU 561 H GLU 561 4.092 -19.582 2.932 437 HA GLU 561 HA GLU 561 5.852 -17.300 2.594 438 HB2 GLU 561 HB2 GLU 561 6.745 -19.600 2.486 439 HB3 GLU 561 HB3 GLU 561 5.690 -19.877 1.101 440 HG2 GLU 561 HG2 GLU 561 6.910 -17.902 0.013 441 HG3 GLU 561 HG3 GLU 561 8.028 -18.041 1.332 442 H PHE 562 H PHE 562 4.888 -15.684 1.518 443 HA PHE 562 HA PHE 562 3.140 -16.383 -0.701 444 HB2 PHE 562 HB2 PHE 562 3.328 -13.886 0.963 445 HB3 PHE 562 HB3 PHE 562 2.429 -13.965 -0.545 446 HD1 PHE 562 HD1 PHE 562 0.378 -15.219 -0.701 447 HD2 PHE 562 HD2 PHE 562 2.538 -15.006 2.954 448 HE1 PHE 562 HE1 PHE 562 -1.600 -16.022 0.504 449 HE2 PHE 562 HE2 PHE 562 0.560 -15.813 4.169 450 HZ PHE 562 HZ PHE 562 -1.504 -16.319 2.945 451 H GLN 563 H GLN 563 4.340 -16.556 -2.377 452 HA GLN 563 HA GLN 563 6.468 -14.678 -3.024 453 HB2 GLN 563 HB2 GLN 563 5.197 -16.859 -4.674 454 HB3 GLN 563 HB3 GLN 563 6.627 -15.972 -5.076 455 HG2 GLN 563 HG2 GLN 563 6.516 -17.629 -2.594 456 HG3 GLN 563 HG3 GLN 563 6.870 -18.385 -4.131 457 HE21 GLN 563 HE21 GLN 563 8.319 -15.934 -5.040 458 HE22 GLN 563 HE22 GLN 563 9.799 -16.003 -4.185 459 H ASN 564 H ASN 564 6.278 -13.675 -5.282 460 HA ASN 564 HA ASN 564 3.803 -12.364 -5.683 461 HB2 ASN 564 HB2 ASN 564 4.857 -11.421 -7.718 462 HB3 ASN 564 HB3 ASN 564 5.928 -11.311 -6.332 463 HD21 ASN 564 HD21 ASN 564 6.606 -11.173 -9.106 464 HD22 ASN 564 HD22 ASN 564 7.687 -12.481 -9.430 465 H ASP 565 H ASP 565 5.294 -15.177 -6.808 466 HA ASP 565 HA ASP 565 3.484 -15.884 -8.926 467 HB2 ASP 565 HB2 ASP 565 5.728 -16.887 -8.764 468 HB3 ASP 565 HB3 ASP 565 5.266 -17.680 -7.264 469 H GLU 566 H GLU 566 3.712 -16.818 -5.506 470 HA GLU 566 HA GLU 566 1.643 -18.675 -5.406 471 HB2 GLU 566 HB2 GLU 566 2.905 -16.911 -3.343 472 HB3 GLU 566 HB3 GLU 566 1.640 -18.068 -2.970 473 HG2 GLU 566 HG2 GLU 566 4.295 -18.768 -4.203 474 HG3 GLU 566 HG3 GLU 566 3.906 -18.909 -2.485 475 H ILE 567 H ILE 567 -0.438 -18.483 -5.262 476 HA ILE 567 HA ILE 567 -1.584 -15.836 -5.438 477 HB ILE 567 HB ILE 567 -3.780 -17.178 -5.714 478 HG12 ILE 567 HG12 ILE 567 -1.979 -19.380 -6.639 479 HG13 ILE 567 HG13 ILE 567 -2.440 -19.345 -4.948 480 HG21 ILE 567 HG21 ILE 567 -3.312 -17.505 -8.110 481 HG22 ILE 567 HG22 ILE 567 -1.590 -17.305 -7.784 482 HG23 ILE 567 HG23 ILE 567 -2.699 -15.961 -7.516 483 HD11 ILE 567 HD11 ILE 567 -3.847 -20.791 -6.265 484 HD12 ILE 567 HD12 ILE 567 -4.357 -19.401 -7.259 485 HD13 ILE 567 HD13 ILE 567 -4.695 -19.452 -5.509 486 H VAL 568 H VAL 568 -2.309 -18.736 -3.464 487 HA VAL 568 HA VAL 568 -2.865 -16.945 -1.236 488 HB VAL 568 HB VAL 568 -5.027 -17.429 -2.400 489 HG11 VAL 568 HG11 VAL 568 -4.436 -20.282 -1.773 490 HG12 VAL 568 HG12 VAL 568 -4.541 -19.539 -3.371 491 HG13 VAL 568 HG13 VAL 568 -5.980 -19.658 -2.352 492 HG21 VAL 568 HG21 VAL 568 -4.803 -18.730 0.307 493 HG22 VAL 568 HG22 VAL 568 -6.299 -18.221 -0.477 494 HG23 VAL 568 HG23 VAL 568 -5.097 -17.018 -0.009 495 H LYS 569 H LYS 569 -2.638 -18.003 0.797 496 HA LYS 569 HA LYS 569 -1.679 -20.754 0.709 497 HB2 LYS 569 HB2 LYS 569 -0.861 -18.509 2.528 498 HB3 LYS 569 HB3 LYS 569 -0.502 -20.210 2.815 499 HG2 LYS 569 HG2 LYS 569 0.250 -19.212 0.210 500 HG3 LYS 569 HG3 LYS 569 1.126 -18.449 1.537 501 HD2 LYS 569 HD2 LYS 569 2.404 -20.340 0.738 502 HD3 LYS 569 HD3 LYS 569 1.680 -20.811 2.258 503 HE2 LYS 569 HE2 LYS 569 1.536 -22.617 0.605 504 HE3 LYS 569 HE3 LYS 569 -0.052 -22.061 1.107 505 HZ1 LYS 569 HZ1 LYS 569 -0.269 -20.853 -1.001 506 HZ2 LYS 569 HZ2 LYS 569 0.099 -22.451 -1.280 507 HZ3 LYS 569 HZ3 LYS 569 1.296 -21.304 -1.471 508 H THR 570 H THR 570 -2.213 -21.937 2.535 509 HA THR 570 HA THR 570 -4.580 -20.969 3.984 510 HB THR 570 HB THR 570 -5.022 -23.570 4.059 511 HG1 THR 570 HG1 THR 570 -4.206 -24.689 2.516 512 HG21 THR 570 HG21 THR 570 -5.738 -21.864 1.660 513 HG22 THR 570 HG22 THR 570 -6.596 -21.917 3.203 514 HG23 THR 570 HG23 THR 570 -6.545 -23.349 2.192 515 H ILE 571 H ILE 571 -4.760 -21.548 6.087 516 HA ILE 571 HA ILE 571 -2.477 -22.911 7.299 517 HB ILE 571 HB ILE 571 -4.813 -21.459 8.621 518 HG12 ILE 571 HG12 ILE 571 -2.888 -20.061 9.608 519 HG13 ILE 571 HG13 ILE 571 -1.909 -20.798 8.348 520 HG21 ILE 571 HG21 ILE 571 -4.124 -23.390 9.945 521 HG22 ILE 571 HG22 ILE 571 -3.734 -21.882 10.773 522 HG23 ILE 571 HG23 ILE 571 -2.464 -22.799 9.960 523 HD11 ILE 571 HD11 ILE 571 -4.347 -19.113 7.912 524 HD12 ILE 571 HD12 ILE 571 -3.312 -19.821 6.663 525 HD13 ILE 571 HD13 ILE 571 -2.668 -18.592 7.756 526 H SER 572 H SER 572 -2.663 -25.010 7.605 527 HA SER 572 HA SER 572 -5.295 -26.247 7.529 528 HB2 SER 572 HB2 SER 572 -3.771 -28.323 7.409 529 HB3 SER 572 HB3 SER 572 -3.810 -27.256 6.005 530 HG SER 572 HG SER 572 -1.684 -28.014 7.093 531 H VAL 573 H VAL 573 -6.247 -26.542 9.406 532 HA VAL 573 HA VAL 573 -4.521 -27.062 11.714 533 HB VAL 573 HB VAL 573 -7.261 -25.755 11.745 534 HG11 VAL 573 HG11 VAL 573 -7.014 -27.177 13.704 535 HG12 VAL 573 HG12 VAL 573 -6.922 -25.476 14.171 536 HG13 VAL 573 HG13 VAL 573 -5.452 -26.440 14.068 537 HG21 VAL 573 HG21 VAL 573 -4.527 -24.694 12.415 538 HG22 VAL 573 HG22 VAL 573 -6.036 -23.831 12.693 539 HG23 VAL 573 HG23 VAL 573 -5.540 -24.230 11.044 540 H LYS 574 H LYS 574 -4.702 -28.863 12.656 541 HA LYS 574 HA LYS 574 -6.613 -30.820 11.808 542 HB2 LYS 574 HB2 LYS 574 -4.374 -31.578 12.222 543 HB3 LYS 574 HB3 LYS 574 -4.342 -30.851 13.811 544 HG2 LYS 574 HG2 LYS 574 -4.558 -33.229 14.044 545 HG3 LYS 574 HG3 LYS 574 -6.073 -32.474 14.534 546 HD2 LYS 574 HD2 LYS 574 -6.936 -32.917 12.243 547 HD3 LYS 574 HD3 LYS 574 -5.434 -33.806 11.937 548 HE2 LYS 574 HE2 LYS 574 -7.435 -34.479 14.097 549 HE3 LYS 574 HE3 LYS 574 -7.350 -35.282 12.534 550 HZ1 LYS 574 HZ1 LYS 574 -6.243 -36.551 14.204 551 HZ2 LYS 574 HZ2 LYS 574 -5.225 -35.276 14.613 552 HZ3 LYS 574 HZ3 LYS 574 -5.112 -36.005 13.081 553 H VAL 575 H VAL 575 -8.569 -30.792 12.594 554 HA VAL 575 HA VAL 575 -9.069 -29.752 15.262 555 HB VAL 575 HB VAL 575 -11.022 -31.064 13.317 556 HG11 VAL 575 HG11 VAL 575 -11.825 -31.119 15.610 557 HG12 VAL 575 HG12 VAL 575 -12.758 -29.933 14.686 558 HG13 VAL 575 HG13 VAL 575 -11.504 -29.398 15.789 559 HG21 VAL 575 HG21 VAL 575 -10.498 -28.124 13.778 560 HG22 VAL 575 HG22 VAL 575 -11.774 -28.792 12.759 561 HG23 VAL 575 HG23 VAL 575 -10.083 -29.040 12.329 562 H ILE 576 H ILE 576 -9.175 -31.099 17.005 563 HA ILE 576 HA ILE 576 -8.187 -33.726 16.509 564 HB ILE 576 HB ILE 576 -8.995 -32.450 19.094 565 HG12 ILE 576 HG12 ILE 576 -7.221 -31.190 18.015 566 HG13 ILE 576 HG13 ILE 576 -6.588 -32.024 19.424 567 HG21 ILE 576 HG21 ILE 576 -7.590 -34.147 20.175 568 HG22 ILE 576 HG22 ILE 576 -7.302 -34.901 18.606 569 HG23 ILE 576 HG23 ILE 576 -8.932 -34.884 19.291 570 HD11 ILE 576 HD11 ILE 576 -6.237 -32.866 16.546 571 HD12 ILE 576 HD12 ILE 576 -5.609 -33.731 17.943 572 HD13 ILE 576 HD13 ILE 576 -5.016 -32.114 17.570 573 H ASP 577 H ASP 577 -9.171 -35.394 16.372 574 HA ASP 577 HA ASP 577 -12.100 -35.439 16.583 575 HB2 ASP 577 HB2 ASP 577 -11.034 -36.021 14.383 576 HB3 ASP 577 HB3 ASP 577 -10.254 -37.381 15.163 577 H ASP 578 H ASP 578 -11.887 -35.642 18.904 578 HA ASP 578 HA ASP 578 -12.430 -38.212 19.822 579 HB2 ASP 578 HB2 ASP 578 -9.971 -38.622 19.531 580 HB3 ASP 578 HB3 ASP 578 -9.658 -37.325 20.678 581 H GLU 579 H GLU 579 -13.484 -38.070 21.639 582 HA GLU 579 HA GLU 579 -14.313 -37.408 23.575 583 HB2 GLU 579 HB2 GLU 579 -11.675 -36.003 23.839 584 HB3 GLU 579 HB3 GLU 579 -12.889 -36.007 25.111 585 HG2 GLU 579 HG2 GLU 579 -11.582 -38.437 23.908 586 HG3 GLU 579 HG3 GLU 579 -11.218 -37.722 25.479 587 H GLU 580 H GLU 580 -14.763 -35.639 21.139 588 HA GLU 580 HA GLU 580 -15.383 -33.220 22.546 589 HB2 GLU 580 HB2 GLU 580 -14.876 -32.967 20.169 590 HB3 GLU 580 HB3 GLU 580 -16.200 -34.046 19.745 591 HG2 GLU 580 HG2 GLU 580 -16.710 -31.614 19.436 592 HG3 GLU 580 HG3 GLU 580 -17.834 -32.475 20.484 593 H TYR 581 H TYR 581 -16.583 -33.579 24.101 594 HA TYR 581 HA TYR 581 -19.358 -34.436 23.730 595 HB2 TYR 581 HB2 TYR 581 -17.647 -36.304 24.487 596 HB3 TYR 581 HB3 TYR 581 -17.632 -35.434 26.006 597 HD1 TYR 581 HD2 TYR 581 -19.667 -35.433 27.445 598 HD2 TYR 581 HD1 TYR 581 -19.483 -37.635 23.825 599 HE1 TYR 581 HE2 TYR 581 -21.621 -36.754 28.152 600 HE2 TYR 581 HE1 TYR 581 -21.422 -38.958 24.517 601 HH TYR 581 HH TYR 581 -23.414 -38.052 27.041 602 H GLU 582 H GLU 582 -17.843 -31.891 24.081 603 HA GLU 582 HA GLU 582 -18.456 -31.259 26.883 604 HB2 GLU 582 HB2 GLU 582 -16.063 -31.224 26.417 605 HB3 GLU 582 HB3 GLU 582 -16.321 -30.103 25.094 606 HG2 GLU 582 HG2 GLU 582 -15.440 -28.905 26.976 607 HG3 GLU 582 HG3 GLU 582 -17.111 -28.417 26.726 608 H LYS 583 H LYS 583 -17.968 -29.369 23.829 609 HA LYS 583 HA LYS 583 -20.462 -28.020 23.982 610 HB2 LYS 583 HB2 LYS 583 -19.141 -27.268 26.035 611 HB3 LYS 583 HB3 LYS 583 -18.043 -26.487 24.933 612 HG2 LYS 583 HG2 LYS 583 -19.537 -24.812 25.766 613 HG3 LYS 583 HG3 LYS 583 -19.922 -25.097 24.073 614 HD2 LYS 583 HD2 LYS 583 -22.003 -24.930 25.187 615 HD3 LYS 583 HD3 LYS 583 -21.763 -26.643 24.890 616 HE2 LYS 583 HE2 LYS 583 -21.243 -25.234 27.514 617 HE3 LYS 583 HE3 LYS 583 -22.695 -26.136 27.141 618 HZ1 LYS 583 HZ1 LYS 583 -21.296 -27.532 28.420 619 HZ2 LYS 583 HZ2 LYS 583 -19.957 -27.133 27.557 620 HZ3 LYS 583 HZ3 LYS 583 -21.114 -28.141 26.855 621 H ASN 584 H ASN 584 -20.321 -26.110 22.408 622 HA ASN 584 HA ASN 584 -18.792 -26.582 20.111 623 HB2 ASN 584 HB2 ASN 584 -20.838 -25.215 20.056 624 HB3 ASN 584 HB3 ASN 584 -20.074 -24.008 21.083 625 HD21 ASN 584 HD21 ASN 584 -20.231 -25.359 17.894 626 HD22 ASN 584 HD22 ASN 584 -19.347 -24.113 17.107 627 H LYS 585 H LYS 585 -16.780 -26.052 19.599 628 HA LYS 585 HA LYS 585 -15.197 -24.619 21.621 629 HB2 LYS 585 HB2 LYS 585 -14.338 -26.620 19.525 630 HB3 LYS 585 HB3 LYS 585 -13.301 -25.893 20.740 631 HG2 LYS 585 HG2 LYS 585 -15.672 -27.611 21.382 632 HG3 LYS 585 HG3 LYS 585 -14.024 -28.216 21.229 633 HD2 LYS 585 HD2 LYS 585 -13.312 -26.901 23.095 634 HD3 LYS 585 HD3 LYS 585 -14.863 -26.054 23.158 635 HE2 LYS 585 HE2 LYS 585 -14.589 -27.847 24.877 636 HE3 LYS 585 HE3 LYS 585 -15.997 -28.039 23.837 637 HZ1 LYS 585 HZ1 LYS 585 -14.709 -30.133 24.223 638 HZ2 LYS 585 HZ2 LYS 585 -13.423 -29.468 23.354 639 HZ3 LYS 585 HZ3 LYS 585 -14.894 -29.722 22.605 640 H THR 586 H THR 586 -14.146 -22.776 20.982 641 HA THR 586 HA THR 586 -13.724 -22.442 18.157 642 HB THR 586 HB THR 586 -15.836 -21.266 18.536 643 HG1 THR 586 HG1 THR 586 -14.076 -20.309 17.219 644 HG21 THR 586 HG21 THR 586 -15.995 -19.330 19.981 645 HG22 THR 586 HG22 THR 586 -14.362 -19.633 20.595 646 HG23 THR 586 HG23 THR 586 -15.665 -20.794 20.908 647 H PHE 587 H PHE 587 -11.997 -21.131 17.626 648 HA PHE 587 HA PHE 587 -10.398 -20.046 19.758 649 HB2 PHE 587 HB2 PHE 587 -8.356 -21.177 19.006 650 HB3 PHE 587 HB3 PHE 587 -9.548 -22.364 19.488 651 HD1 PHE 587 HD1 PHE 587 -10.675 -23.744 17.745 652 HD2 PHE 587 HD2 PHE 587 -7.511 -21.064 16.805 653 HE1 PHE 587 HE1 PHE 587 -10.314 -24.908 15.599 654 HE2 PHE 587 HE2 PHE 587 -7.159 -22.226 14.666 655 HZ PHE 587 HZ PHE 587 -8.562 -24.147 14.071 656 H PHE 588 H PHE 588 -8.362 -19.018 18.472 657 HA PHE 588 HA PHE 588 -9.573 -17.621 16.181 658 HB2 PHE 588 HB2 PHE 588 -7.928 -16.379 18.421 659 HB3 PHE 588 HB3 PHE 588 -8.442 -15.566 16.953 660 HD1 PHE 588 HD1 PHE 588 -9.642 -17.183 20.047 661 HD2 PHE 588 HD2 PHE 588 -10.546 -14.620 16.790 662 HE1 PHE 588 HE1 PHE 588 -11.754 -16.533 21.157 663 HE2 PHE 588 HE2 PHE 588 -12.639 -13.966 17.874 664 HZ PHE 588 HZ PHE 588 -13.251 -14.915 20.062 665 H LEU 589 H LEU 589 -8.049 -16.685 14.779 666 HA LEU 589 HA LEU 589 -5.423 -18.021 14.806 667 HB2 LEU 589 HB2 LEU 589 -7.421 -18.634 13.046 668 HB3 LEU 589 HB3 LEU 589 -6.671 -17.290 12.219 669 HG LEU 589 HG LEU 589 -5.829 -19.329 11.310 670 HD11 LEU 589 HD11 LEU 589 -3.741 -18.046 13.029 671 HD12 LEU 589 HD12 LEU 589 -4.183 -17.604 11.370 672 HD13 LEU 589 HD13 LEU 589 -3.424 -19.159 11.704 673 HD21 LEU 589 HD21 LEU 589 -4.588 -20.951 12.679 674 HD22 LEU 589 HD22 LEU 589 -6.300 -20.826 13.100 675 HD23 LEU 589 HD23 LEU 589 -5.089 -20.060 14.119 676 H GLU 590 H GLU 590 -3.824 -16.558 14.582 677 HA GLU 590 HA GLU 590 -4.554 -13.920 13.580 678 HB2 GLU 590 HB2 GLU 590 -4.459 -13.778 15.975 679 HB3 GLU 590 HB3 GLU 590 -2.872 -14.536 16.009 680 HG2 GLU 590 HG2 GLU 590 -1.906 -12.593 14.932 681 HG3 GLU 590 HG3 GLU 590 -3.503 -11.862 14.767 682 H ILE 591 H ILE 591 -3.113 -13.017 12.247 683 HA ILE 591 HA ILE 591 -0.693 -14.530 11.696 684 HB ILE 591 HB ILE 591 -0.716 -13.396 9.458 685 HG12 ILE 591 HG12 ILE 591 -3.524 -12.576 10.264 686 HG13 ILE 591 HG13 ILE 591 -2.167 -11.483 10.021 687 HG21 ILE 591 HG21 ILE 591 -1.464 -15.677 9.668 688 HG22 ILE 591 HG22 ILE 591 -2.448 -14.841 8.467 689 HG23 ILE 591 HG23 ILE 591 -3.085 -15.138 10.087 690 HD11 ILE 591 HD11 ILE 591 -3.475 -13.187 7.910 691 HD12 ILE 591 HD12 ILE 591 -2.124 -12.080 7.646 692 HD13 ILE 591 HD13 ILE 591 -3.702 -11.454 8.134 693 H GLY 592 H GLY 592 1.182 -13.425 11.549 694 HA2 GLY 592 HA2 GLY 592 1.176 -10.951 13.083 695 HA3 GLY 592 HA3 GLY 592 2.583 -11.938 12.701 696 H GLU 593 H GLU 593 3.195 -9.542 12.308 697 HA GLU 593 HA GLU 593 2.290 -8.442 9.889 698 HB2 GLU 593 HB2 GLU 593 4.615 -7.775 11.662 699 HB3 GLU 593 HB3 GLU 593 4.287 -6.896 10.172 700 HG2 GLU 593 HG2 GLU 593 2.073 -6.307 11.012 701 HG3 GLU 593 HG3 GLU 593 2.411 -7.172 12.504 702 HA PRO 594 HA PRO 594 4.450 -10.880 7.022 703 HB2 PRO 594 HB2 PRO 594 4.426 -9.085 4.938 704 HB3 PRO 594 HB3 PRO 594 3.045 -10.083 5.395 705 HG2 PRO 594 HG2 PRO 594 3.645 -7.245 6.072 706 HG3 PRO 594 HG3 PRO 594 2.100 -7.962 5.611 707 HD2 PRO 594 HD2 PRO 594 2.698 -7.378 8.131 708 HD3 PRO 594 HD3 PRO 594 1.729 -8.809 7.732 709 H ARG 595 H ARG 595 6.526 -11.240 6.712 710 HA ARG 595 HA ARG 595 8.396 -9.013 6.965 711 HB2 ARG 595 HB2 ARG 595 10.067 -10.832 7.634 712 HB3 ARG 595 HB3 ARG 595 8.798 -10.480 8.788 713 HG2 ARG 595 HG2 ARG 595 7.690 -12.491 7.290 714 HG3 ARG 595 HG3 ARG 595 9.390 -12.941 7.345 715 HD2 ARG 595 HD2 ARG 595 7.726 -12.245 9.764 716 HD3 ARG 595 HD3 ARG 595 8.000 -13.879 9.191 717 HE ARG 595 HE ARG 595 10.295 -13.644 9.737 718 HH11 ARG 595 HH11 ARG 595 8.383 -10.876 10.970 719 HH12 ARG 595 HH12 ARG 595 9.297 -10.743 12.389 720 HH21 ARG 595 HH21 ARG 595 11.495 -13.414 11.720 721 HH22 ARG 595 HH22 ARG 595 11.080 -12.185 12.845 722 H LEU 596 H LEU 596 9.402 -8.393 5.266 723 HA LEU 596 HA LEU 596 9.052 -9.499 2.741 724 HB2 LEU 596 HB2 LEU 596 9.481 -7.087 3.538 725 HB3 LEU 596 HB3 LEU 596 11.163 -7.529 3.576 726 HG LEU 596 HG LEU 596 10.403 -6.209 1.554 727 HD11 LEU 596 HD11 LEU 596 12.492 -7.453 1.496 728 HD12 LEU 596 HD12 LEU 596 11.677 -7.484 -0.072 729 HD13 LEU 596 HD13 LEU 596 11.610 -8.893 0.990 730 HD21 LEU 596 HD21 LEU 596 8.270 -7.348 1.286 731 HD22 LEU 596 HD22 LEU 596 9.121 -8.815 0.808 732 HD23 LEU 596 HD23 LEU 596 9.219 -7.367 -0.206 733 H VAL 597 H VAL 597 10.307 -10.797 1.518 734 HA VAL 597 HA VAL 597 12.887 -11.697 2.569 735 HB VAL 597 HB VAL 597 11.136 -13.044 0.514 736 HG11 VAL 597 HG11 VAL 597 12.461 -15.042 1.032 737 HG12 VAL 597 HG12 VAL 597 13.446 -14.081 2.135 738 HG13 VAL 597 HG13 VAL 597 13.453 -13.722 0.402 739 HG21 VAL 597 HG21 VAL 597 11.252 -13.658 3.455 740 HG22 VAL 597 HG22 VAL 597 10.442 -14.631 2.225 741 HG23 VAL 597 HG23 VAL 597 9.876 -12.992 2.563 742 H GLU 598 H GLU 598 14.451 -10.735 1.481 743 HA GLU 598 HA GLU 598 14.047 -9.028 -0.699 744 HB2 GLU 598 HB2 GLU 598 15.897 -8.902 1.002 745 HB3 GLU 598 HB3 GLU 598 16.663 -10.257 0.195 746 HG2 GLU 598 HG2 GLU 598 16.918 -8.922 -1.828 747 HG3 GLU 598 HG3 GLU 598 16.097 -7.573 -1.050 748 H MET 599 H MET 599 14.969 -9.180 -2.829 749 HA MET 599 HA MET 599 14.262 -11.581 -4.213 750 HB2 MET 599 HB2 MET 599 14.891 -10.351 -6.237 751 HB3 MET 599 HB3 MET 599 13.856 -9.399 -5.178 752 HG2 MET 599 HG2 MET 599 15.858 -8.269 -4.317 753 HG3 MET 599 HG3 MET 599 16.821 -9.170 -5.486 754 HE1 MET 599 HE1 MET 599 13.657 -5.995 -6.651 755 HE2 MET 599 HE2 MET 599 14.050 -6.420 -4.985 756 HE3 MET 599 HE3 MET 599 13.205 -7.575 -6.018 757 H SER 600 H SER 600 16.711 -11.344 -2.435 758 HA SER 600 HA SER 600 18.810 -12.447 -4.142 759 HB2 SER 600 HB2 SER 600 19.313 -10.463 -2.696 760 HB3 SER 600 HB3 SER 600 18.771 -11.372 -1.297 761 HG SER 600 HG SER 600 21.023 -11.908 -2.935 762 H GLU 601 H GLU 601 19.984 -13.960 -2.024 763 HA GLU 601 HA GLU 601 17.989 -15.985 -1.714 764 HB2 GLU 601 HB2 GLU 601 19.959 -17.195 -0.448 765 HB3 GLU 601 HB3 GLU 601 19.935 -17.124 -2.189 766 HG2 GLU 601 HG2 GLU 601 22.166 -16.736 -1.477 767 HG3 GLU 601 HG3 GLU 601 21.535 -15.212 -2.066 768 H LYS 602 H LYS 602 17.476 -16.965 0.377 769 HA LYS 602 HA LYS 602 16.476 -14.907 2.050 770 HB2 LYS 602 HB2 LYS 602 15.585 -17.330 1.607 771 HB3 LYS 602 HB3 LYS 602 16.693 -17.804 2.875 772 HG2 LYS 602 HG2 LYS 602 14.377 -15.878 3.179 773 HG3 LYS 602 HG3 LYS 602 14.377 -17.567 3.657 774 HD2 LYS 602 HD2 LYS 602 16.189 -17.058 5.273 775 HD3 LYS 602 HD3 LYS 602 16.076 -15.361 4.819 776 HE2 LYS 602 HE2 LYS 602 14.818 -15.744 6.860 777 HE3 LYS 602 HE3 LYS 602 13.717 -15.335 5.547 778 HZ1 LYS 602 HZ1 LYS 602 13.197 -17.716 5.321 779 HZ2 LYS 602 HZ2 LYS 602 12.862 -17.153 6.858 780 HZ3 LYS 602 HZ3 LYS 602 14.238 -18.069 6.608 781 H LYS 603 H LYS 603 17.760 -13.738 3.262 782 HA LYS 603 HA LYS 603 19.886 -15.011 4.834 783 HB2 LYS 603 HB2 LYS 603 21.366 -13.129 4.227 784 HB3 LYS 603 HB3 LYS 603 20.900 -14.075 2.816 785 HG2 LYS 603 HG2 LYS 603 19.110 -12.391 2.382 786 HG3 LYS 603 HG3 LYS 603 19.807 -11.410 3.665 787 HD2 LYS 603 HD2 LYS 603 21.884 -11.242 2.437 788 HD3 LYS 603 HD3 LYS 603 21.251 -12.312 1.176 789 HE2 LYS 603 HE2 LYS 603 19.403 -10.688 0.820 790 HE3 LYS 603 HE3 LYS 603 20.196 -9.605 1.955 791 HZ1 LYS 603 HZ1 LYS 603 21.405 -10.584 -0.568 792 HZ2 LYS 603 HZ2 LYS 603 22.054 -9.406 0.466 793 HZ3 LYS 603 HZ3 LYS 603 20.605 -9.118 -0.365 794 H GLY 604 H GLY 604 20.468 -13.730 6.677 795 HA2 GLY 604 HA2 GLY 604 20.175 -11.614 7.874 796 HA3 GLY 604 HA3 GLY 604 18.489 -11.667 7.363 797 H GLY 605 H GLY 605 19.622 -11.535 10.019 798 HA2 GLY 605 HA2 GLY 605 19.085 -14.130 11.183 799 HA3 GLY 605 HA3 GLY 605 19.569 -12.670 12.043 800 H PHE 606 H PHE 606 16.898 -14.311 10.511 801 HA PHE 606 HA PHE 606 15.023 -12.386 11.525 802 HB2 PHE 606 HB2 PHE 606 14.613 -14.908 9.923 803 HB3 PHE 606 HB3 PHE 606 13.270 -13.986 10.589 804 HD1 PHE 606 HD1 PHE 606 15.965 -14.012 8.110 805 HD2 PHE 606 HD2 PHE 606 12.668 -11.847 9.696 806 HE1 PHE 606 HE1 PHE 606 15.998 -12.527 6.154 807 HE2 PHE 606 HE2 PHE 606 12.698 -10.357 7.744 808 HZ PHE 606 HZ PHE 606 14.365 -10.696 5.968 809 H THR 607 H THR 607 15.850 -12.727 13.618 810 HA THR 607 HA THR 607 15.025 -15.018 15.116 811 HB THR 607 HB THR 607 15.868 -12.265 16.074 812 HG1 THR 607 HG1 THR 607 17.281 -14.461 15.061 813 HG21 THR 607 HG21 THR 607 16.096 -15.012 17.335 814 HG22 THR 607 HG22 THR 607 14.952 -13.761 17.822 815 HG23 THR 607 HG23 THR 607 16.684 -13.511 18.046 816 H ILE 608 H ILE 608 13.196 -15.079 16.452 817 HA ILE 608 HA ILE 608 11.085 -13.346 15.739 818 HB ILE 608 HB ILE 608 10.547 -15.628 16.358 819 HG12 ILE 608 HG12 ILE 608 8.798 -15.297 18.107 820 HG13 ILE 608 HG13 ILE 608 9.451 -13.691 18.401 821 HG21 ILE 608 HG21 ILE 608 11.658 -15.083 19.092 822 HG22 ILE 608 HG22 ILE 608 12.317 -16.168 17.871 823 HG23 ILE 608 HG23 ILE 608 10.766 -16.531 18.624 824 HD11 ILE 608 HD11 ILE 608 8.282 -14.669 15.804 825 HD12 ILE 608 HD12 ILE 608 8.905 -13.048 16.112 826 HD13 ILE 608 HD13 ILE 608 7.479 -13.627 16.975 827 H THR 609 H THR 609 11.386 -11.283 16.198 828 HA THR 609 HA THR 609 12.690 -10.348 18.524 829 HB THR 609 HB THR 609 11.774 -8.099 17.538 830 HG1 THR 609 HG1 THR 609 10.251 -8.885 16.110 831 HG21 THR 609 HG21 THR 609 13.722 -9.853 16.016 832 HG22 THR 609 HG22 THR 609 14.120 -8.841 17.405 833 HG23 THR 609 HG23 THR 609 13.610 -8.097 15.891 834 H GLU 610 H GLU 610 9.440 -11.030 17.736 835 HA GLU 610 HA GLU 610 8.296 -9.373 19.789 836 HB2 GLU 610 HB2 GLU 610 7.077 -11.574 18.098 837 HB3 GLU 610 HB3 GLU 610 6.177 -10.552 19.198 838 HG2 GLU 610 HG2 GLU 610 5.833 -9.782 16.943 839 HG3 GLU 610 HG3 GLU 610 6.802 -8.587 17.802 840 H GLU 611 H GLU 611 8.422 -9.963 21.880 841 HA GLU 611 HA GLU 611 8.758 -12.805 22.459 842 HB2 GLU 611 HB2 GLU 611 9.425 -12.125 24.728 843 HB3 GLU 611 HB3 GLU 611 10.417 -11.371 23.494 844 HG2 GLU 611 HG2 GLU 611 9.133 -9.302 23.760 845 HG3 GLU 611 HG3 GLU 611 8.174 -10.080 25.017 846 H TYR 612 H TYR 612 6.339 -10.581 22.289 847 HA TYR 612 HA TYR 612 4.645 -12.219 24.024 848 HB2 TYR 612 HB2 TYR 612 4.351 -9.303 23.272 849 HB3 TYR 612 HB3 TYR 612 3.145 -10.225 24.164 850 HD1 TYR 612 HD2 TYR 612 3.814 -11.152 26.421 851 HD2 TYR 612 HD1 TYR 612 6.119 -8.242 24.359 852 HE1 TYR 612 HE2 TYR 612 4.931 -10.562 28.517 853 HE2 TYR 612 HE1 TYR 612 7.247 -7.639 26.457 854 HH TYR 612 HH TYR 612 6.965 -9.550 29.263 855 H ASP 613 H ASP 613 3.393 -13.450 22.845 856 HA ASP 613 HA ASP 613 3.259 -13.092 20.026 857 HB2 ASP 613 HB2 ASP 613 1.864 -15.089 21.818 858 HB3 ASP 613 HB3 ASP 613 1.695 -15.079 20.065 859 H ASP 614 H ASP 614 1.329 -12.079 22.645 860 HA ASP 614 HA ASP 614 -1.008 -11.496 21.048 861 HB2 ASP 614 HB2 ASP 614 -1.956 -10.535 23.089 862 HB3 ASP 614 HB3 ASP 614 -1.284 -12.120 23.428 863 H LYS 615 H LYS 615 1.939 -10.097 21.342 864 HA LYS 615 HA LYS 615 0.918 -7.507 20.388 865 HB2 LYS 615 HB2 LYS 615 3.213 -7.992 22.304 866 HB3 LYS 615 HB3 LYS 615 2.931 -6.466 21.481 867 HG2 LYS 615 HG2 LYS 615 0.857 -6.155 22.626 868 HG3 LYS 615 HG3 LYS 615 0.947 -7.772 23.320 869 HD2 LYS 615 HD2 LYS 615 1.578 -6.083 24.955 870 HD3 LYS 615 HD3 LYS 615 2.934 -7.136 24.564 871 HE2 LYS 615 HE2 LYS 615 3.844 -5.407 23.094 872 HE3 LYS 615 HE3 LYS 615 2.470 -4.364 23.469 873 HZ1 LYS 615 HZ1 LYS 615 4.383 -3.784 24.824 874 HZ2 LYS 615 HZ2 LYS 615 4.486 -5.355 25.410 875 HZ3 LYS 615 HZ3 LYS 615 3.166 -4.412 25.800 876 H GLN 616 H GLN 616 1.719 -9.941 19.185 877 HA GLN 616 HA GLN 616 4.318 -9.622 18.165 878 HB2 GLN 616 HB2 GLN 616 3.446 -11.796 18.519 879 HB3 GLN 616 HB3 GLN 616 2.063 -11.499 17.501 880 HG2 GLN 616 HG2 GLN 616 3.397 -11.662 15.554 881 HG3 GLN 616 HG3 GLN 616 4.892 -11.641 16.510 882 HE21 GLN 616 HE21 GLN 616 5.489 -13.428 17.659 883 HE22 GLN 616 HE22 GLN 616 4.734 -14.960 17.463 884 HA PRO 617 HA PRO 617 2.316 -7.460 14.555 885 HB2 PRO 617 HB2 PRO 617 -0.374 -7.230 14.277 886 HB3 PRO 617 HB3 PRO 617 0.497 -8.611 13.610 887 HG2 PRO 617 HG2 PRO 617 -1.202 -8.439 16.043 888 HG3 PRO 617 HG3 PRO 617 -0.953 -9.803 14.944 889 HD2 PRO 617 HD2 PRO 617 0.267 -9.457 17.443 890 HD3 PRO 617 HD3 PRO 617 0.779 -10.588 16.174 891 H LEU 618 H LEU 618 2.282 -5.196 14.835 892 HA LEU 618 HA LEU 618 1.800 -4.309 17.485 893 HB2 LEU 618 HB2 LEU 618 2.346 -2.688 15.003 894 HB3 LEU 618 HB3 LEU 618 2.266 -2.021 16.618 895 HG LEU 618 HG LEU 618 4.332 -3.920 15.519 896 HD11 LEU 618 HD11 LEU 618 4.518 -1.109 16.578 897 HD12 LEU 618 HD12 LEU 618 4.629 -1.598 14.889 898 HD13 LEU 618 HD13 LEU 618 5.872 -2.099 16.037 899 HD21 LEU 618 HD21 LEU 618 5.418 -3.792 17.724 900 HD22 LEU 618 HD22 LEU 618 3.854 -4.589 17.811 901 HD23 LEU 618 HD23 LEU 618 4.023 -2.918 18.357 902 H THR 619 H THR 619 0.138 -3.553 18.394 903 HA THR 619 HA THR 619 -2.350 -3.474 16.912 904 HB THR 619 HB THR 619 -2.333 -4.783 18.972 905 HG1 THR 619 HG1 THR 619 -3.849 -2.415 18.995 906 HG21 THR 619 HG21 THR 619 -1.631 -2.202 20.389 907 HG22 THR 619 HG22 THR 619 -0.581 -3.608 20.207 908 HG23 THR 619 HG23 THR 619 -2.043 -3.721 21.182 909 H SER 620 H SER 620 -0.028 -1.339 17.410 910 HA SER 620 HA SER 620 -1.367 0.952 18.331 911 HB2 SER 620 HB2 SER 620 1.056 0.758 16.547 912 HB3 SER 620 HB3 SER 620 0.599 2.121 17.575 913 HG SER 620 HG SER 620 1.086 0.979 19.345 914 H LYS 621 H LYS 621 -3.140 1.565 17.271 915 HA LYS 621 HA LYS 621 -3.007 1.812 14.382 916 HB2 LYS 621 HB2 LYS 621 -5.524 2.264 14.454 917 HB3 LYS 621 HB3 LYS 621 -5.047 0.647 14.905 918 HG2 LYS 621 HG2 LYS 621 -5.671 2.760 16.968 919 HG3 LYS 621 HG3 LYS 621 -6.923 1.756 16.243 920 HD2 LYS 621 HD2 LYS 621 -5.797 -0.251 17.055 921 HD3 LYS 621 HD3 LYS 621 -4.507 0.714 17.747 922 HE2 LYS 621 HE2 LYS 621 -6.006 0.078 19.496 923 HE3 LYS 621 HE3 LYS 621 -6.197 1.804 19.208 924 HZ1 LYS 621 HZ1 LYS 621 -7.988 -0.293 18.119 925 HZ2 LYS 621 HZ2 LYS 621 -8.232 1.377 18.014 926 HZ3 LYS 621 HZ3 LYS 621 -8.294 0.597 19.501 927 H GLU 622 H GLU 622 -1.536 3.416 14.570 928 HA GLU 622 HA GLU 622 -2.524 6.077 14.696 929 HB2 GLU 622 HB2 GLU 622 -1.015 6.744 16.574 930 HB3 GLU 622 HB3 GLU 622 -2.326 5.695 17.091 931 HG2 GLU 622 HG2 GLU 622 -0.699 3.773 16.888 932 HG3 GLU 622 HG3 GLU 622 0.567 4.987 16.715 933 H GLU 623 H GLU 623 -0.762 7.542 13.992 934 HA GLU 623 HA GLU 623 0.942 6.038 12.232 935 HB2 GLU 623 HB2 GLU 623 1.519 8.215 11.195 936 HB3 GLU 623 HB3 GLU 623 -0.203 7.877 11.195 937 HG2 GLU 623 HG2 GLU 623 -0.539 9.402 13.016 938 HG3 GLU 623 HG3 GLU 623 1.200 9.668 13.153 939 H GLU 624 H GLU 624 3.164 6.681 11.874 940 HA GLU 624 HA GLU 624 4.710 7.787 14.005 941 HB2 GLU 624 HB2 GLU 624 4.106 5.484 14.865 942 HB3 GLU 624 HB3 GLU 624 4.857 4.798 13.442 943 HG2 GLU 624 HG2 GLU 624 7.015 5.664 14.144 944 HG3 GLU 624 HG3 GLU 624 6.259 6.403 15.554 945 H GLU 625 H GLU 625 6.968 7.930 13.205 946 HA GLU 625 HA GLU 625 7.022 8.193 10.392 947 HB2 GLU 625 HB2 GLU 625 9.217 8.420 12.426 948 HB3 GLU 625 HB3 GLU 625 9.488 8.672 10.703 949 HG2 GLU 625 HG2 GLU 625 7.785 10.423 10.722 950 HG3 GLU 625 HG3 GLU 625 7.592 10.204 12.457 951 H ARG 626 H ARG 626 8.123 5.689 12.496 952 HA ARG 626 HA ARG 626 9.460 4.134 10.583 953 HB2 ARG 626 HB2 ARG 626 9.710 3.583 12.910 954 HB3 ARG 626 HB3 ARG 626 7.986 3.448 13.129 955 HG2 ARG 626 HG2 ARG 626 9.469 1.492 11.381 956 HG3 ARG 626 HG3 ARG 626 9.425 1.299 13.131 957 HD2 ARG 626 HD2 ARG 626 7.050 1.361 11.248 958 HD3 ARG 626 HD3 ARG 626 7.650 -0.039 12.138 959 HE ARG 626 HE ARG 626 7.113 1.920 14.012 960 HH11 ARG 626 HH11 ARG 626 5.002 0.257 11.604 961 HH12 ARG 626 HH12 ARG 626 3.701 0.250 12.673 962 HH21 ARG 626 HH21 ARG 626 5.307 1.887 15.336 963 HH22 ARG 626 HH22 ARG 626 3.832 1.203 14.804 964 H ARG 627 H ARG 627 6.104 4.533 11.366 965 HA ARG 627 HA ARG 627 5.046 2.346 9.838 966 HB2 ARG 627 HB2 ARG 627 4.091 4.019 11.753 967 HB3 ARG 627 HB3 ARG 627 3.440 4.798 10.331 968 HG2 ARG 627 HG2 ARG 627 2.916 1.983 11.266 969 HG3 ARG 627 HG3 ARG 627 1.812 3.348 11.340 970 HD2 ARG 627 HD2 ARG 627 1.857 3.412 8.841 971 HD3 ARG 627 HD3 ARG 627 2.831 1.944 8.877 972 HE ARG 627 HE ARG 627 0.026 2.217 9.531 973 HH11 ARG 627 HH11 ARG 627 2.897 0.098 9.605 974 HH12 ARG 627 HH12 ARG 627 2.009 -1.325 9.656 975 HH21 ARG 627 HH21 ARG 627 -1.195 0.243 9.633 976 HH22 ARG 627 HH22 ARG 627 -0.420 -1.261 9.697 977 H ILE 628 H ILE 628 5.846 5.680 9.211 978 HA ILE 628 HA ILE 628 4.656 5.780 6.607 979 HB ILE 628 HB ILE 628 6.839 7.550 7.779 980 HG12 ILE 628 HG12 ILE 628 3.837 7.986 7.703 981 HG13 ILE 628 HG13 ILE 628 4.744 7.498 9.124 982 HG21 ILE 628 HG21 ILE 628 6.690 7.702 5.335 983 HG22 ILE 628 HG22 ILE 628 6.118 9.188 6.089 984 HG23 ILE 628 HG23 ILE 628 4.958 8.021 5.449 985 HD11 ILE 628 HD11 ILE 628 4.226 9.863 9.181 986 HD12 ILE 628 HD12 ILE 628 5.043 10.092 7.636 987 HD13 ILE 628 HD13 ILE 628 5.970 9.616 9.058 988 H ALA 629 H ALA 629 7.877 5.157 7.897 989 HA ALA 629 HA ALA 629 9.189 4.844 5.405 990 HB1 ALA 629 HB1 ALA 629 11.013 3.877 6.708 991 HB2 ALA 629 HB2 ALA 629 9.950 3.754 8.110 992 HB3 ALA 629 HB3 ALA 629 10.396 5.340 7.478 993 H GLU 630 H GLU 630 7.073 2.864 7.154 994 HA GLU 630 HA GLU 630 7.882 0.363 6.265 995 HB2 GLU 630 HB2 GLU 630 5.222 1.333 7.242 996 HB3 GLU 630 HB3 GLU 630 5.464 -0.335 6.715 997 HG2 GLU 630 HG2 GLU 630 7.299 -0.471 8.396 998 HG3 GLU 630 HG3 GLU 630 6.815 1.128 8.950 999 H MET 631 H MET 631 6.702 2.833 4.426 1000 HA MET 631 HA MET 631 5.108 1.611 2.539 1001 HB2 MET 631 HB2 MET 631 5.776 3.358 0.952 1002 HB3 MET 631 HB3 MET 631 5.392 3.999 2.535 1003 HG2 MET 631 HG2 MET 631 7.220 5.202 1.775 1004 HG3 MET 631 HG3 MET 631 7.881 4.084 2.962 1005 HE1 MET 631 HE1 MET 631 10.339 4.542 2.082 1006 HE2 MET 631 HE2 MET 631 9.679 5.699 0.927 1007 HE3 MET 631 HE3 MET 631 10.807 4.453 0.383 1008 H GLY 632 H GLY 632 8.483 1.092 3.009 1009 HA2 GLY 632 HA2 GLY 632 8.826 -0.099 0.374 1010 HA3 GLY 632 HA3 GLY 632 10.073 0.109 1.595 1011 H ARG 633 H ARG 633 7.689 -1.162 3.368 1012 HA ARG 633 HA ARG 633 8.642 -3.900 2.859 1013 HB2 ARG 633 HB2 ARG 633 8.425 -4.382 5.225 1014 HB3 ARG 633 HB3 ARG 633 9.312 -2.879 5.099 1015 HG2 ARG 633 HG2 ARG 633 7.454 -1.600 5.773 1016 HG3 ARG 633 HG3 ARG 633 6.350 -2.948 5.536 1017 HD2 ARG 633 HD2 ARG 633 8.537 -2.867 7.614 1018 HD3 ARG 633 HD3 ARG 633 6.848 -2.470 7.915 1019 HE ARG 633 HE ARG 633 7.498 -5.107 6.838 1020 HH11 ARG 633 HH11 ARG 633 6.135 -3.158 9.508 1021 HH12 ARG 633 HH12 ARG 633 5.710 -4.510 10.437 1022 HH21 ARG 633 HH21 ARG 633 6.826 -6.943 8.149 1023 HH22 ARG 633 HH22 ARG 633 6.186 -6.641 9.713 1024 HA PRO 634 HA PRO 634 4.301 -4.809 2.561 1025 HB2 PRO 634 HB2 PRO 634 4.123 -7.373 3.322 1026 HB3 PRO 634 HB3 PRO 634 4.919 -6.893 1.817 1027 HG2 PRO 634 HG2 PRO 634 6.120 -7.722 4.413 1028 HG3 PRO 634 HG3 PRO 634 6.718 -8.002 2.774 1029 HD2 PRO 634 HD2 PRO 634 7.577 -6.030 4.543 1030 HD3 PRO 634 HD3 PRO 634 7.902 -6.062 2.800 1031 H ILE 635 H ILE 635 2.475 -4.712 3.716 1032 HA ILE 635 HA ILE 635 2.695 -5.058 6.572 1033 HB ILE 635 HB ILE 635 1.249 -2.999 6.884 1034 HG12 ILE 635 HG12 ILE 635 1.522 -1.210 5.111 1035 HG13 ILE 635 HG13 ILE 635 2.073 -2.459 4.009 1036 HG21 ILE 635 HG21 ILE 635 3.608 -2.999 7.436 1037 HG22 ILE 635 HG22 ILE 635 3.154 -1.434 6.744 1038 HG23 ILE 635 HG23 ILE 635 3.996 -2.636 5.754 1039 HD11 ILE 635 HD11 ILE 635 -0.128 -3.530 4.189 1040 HD12 ILE 635 HD12 ILE 635 -0.229 -1.871 3.599 1041 HD13 ILE 635 HD13 ILE 635 -0.647 -2.240 5.274 1042 H LEU 636 H LEU 636 0.430 -4.971 7.579 1043 HA LEU 636 HA LEU 636 -1.172 -6.705 5.913 1044 HB2 LEU 636 HB2 LEU 636 -2.296 -7.336 8.133 1045 HB3 LEU 636 HB3 LEU 636 -0.708 -7.965 7.778 1046 HG LEU 636 HG LEU 636 0.266 -6.267 9.321 1047 HD11 LEU 636 HD11 LEU 636 -1.473 -4.576 9.196 1048 HD12 LEU 636 HD12 LEU 636 -1.169 -5.071 10.862 1049 HD13 LEU 636 HD13 LEU 636 -2.600 -5.663 10.011 1050 HD21 LEU 636 HD21 LEU 636 -0.489 -7.358 11.369 1051 HD22 LEU 636 HD22 LEU 636 -0.217 -8.522 10.064 1052 HD23 LEU 636 HD23 LEU 636 -1.859 -8.026 10.481 1053 H GLY 637 H GLY 637 -3.608 -6.677 6.831 1054 HA2 GLY 637 HA2 GLY 637 -4.605 -4.267 5.661 1055 HA3 GLY 637 HA3 GLY 637 -5.503 -5.665 6.240 1056 H GLU 638 H GLU 638 -7.055 -4.223 6.990 1057 HA GLU 638 HA GLU 638 -6.531 -2.206 8.924 1058 HB2 GLU 638 HB2 GLU 638 -8.472 -2.121 7.419 1059 HB3 GLU 638 HB3 GLU 638 -9.107 -3.589 8.143 1060 HG2 GLU 638 HG2 GLU 638 -9.317 -2.410 10.286 1061 HG3 GLU 638 HG3 GLU 638 -8.740 -0.939 9.505 1062 H HIS 639 H HIS 639 -7.923 -5.451 9.053 1063 HA HIS 639 HA HIS 639 -6.937 -5.742 11.758 1064 HB2 HIS 639 HB2 HIS 639 -9.818 -6.276 10.951 1065 HB3 HIS 639 HB3 HIS 639 -9.086 -6.967 12.387 1066 HD1 HIS 639 HD1 HIS 639 -8.292 -5.088 14.250 1067 HD2 HIS 639 HD2 HIS 639 -10.888 -3.813 11.262 1068 HE1 HIS 639 HE1 HIS 639 -9.288 -2.944 15.064 1069 H THR 640 H THR 640 -6.375 -7.809 12.231 1070 HA THR 640 HA THR 640 -6.703 -9.771 10.124 1071 HB THR 640 HB THR 640 -4.313 -10.480 10.682 1072 HG1 THR 640 HG1 THR 640 -4.079 -9.123 12.513 1073 HG21 THR 640 HG21 THR 640 -4.705 -7.822 9.304 1074 HG22 THR 640 HG22 THR 640 -5.009 -9.394 8.587 1075 HG23 THR 640 HG23 THR 640 -3.360 -8.944 9.045 1076 H LYS 641 H LYS 641 -8.096 -11.035 11.187 1077 HA LYS 641 HA LYS 641 -7.198 -12.574 13.414 1078 HB2 LYS 641 HB2 LYS 641 -7.911 -10.485 14.608 1079 HB3 LYS 641 HB3 LYS 641 -9.511 -10.674 13.910 1080 HG2 LYS 641 HG2 LYS 641 -9.730 -12.852 15.074 1081 HG3 LYS 641 HG3 LYS 641 -8.163 -12.575 15.828 1082 HD2 LYS 641 HD2 LYS 641 -9.913 -12.014 17.371 1083 HD3 LYS 641 HD3 LYS 641 -9.081 -10.531 16.896 1084 HE2 LYS 641 HE2 LYS 641 -10.903 -10.024 15.320 1085 HE3 LYS 641 HE3 LYS 641 -11.707 -11.525 15.764 1086 HZ1 LYS 641 HZ1 LYS 641 -11.929 -10.651 18.034 1087 HZ2 LYS 641 HZ2 LYS 641 -12.694 -9.677 16.894 1088 HZ3 LYS 641 HZ3 LYS 641 -11.232 -9.186 17.544 1089 H LEU 642 H LEU 642 -8.326 -14.440 13.466 1090 HA LEU 642 HA LEU 642 -10.727 -14.607 11.797 1091 HB2 LEU 642 HB2 LEU 642 -8.777 -15.623 10.745 1092 HB3 LEU 642 HB3 LEU 642 -8.497 -16.552 12.203 1093 HG LEU 642 HG LEU 642 -10.776 -17.606 11.800 1094 HD11 LEU 642 HD11 LEU 642 -10.354 -16.423 9.089 1095 HD12 LEU 642 HD12 LEU 642 -11.656 -16.023 10.215 1096 HD13 LEU 642 HD13 LEU 642 -11.546 -17.642 9.515 1097 HD21 LEU 642 HD21 LEU 642 -8.791 -18.832 11.502 1098 HD22 LEU 642 HD22 LEU 642 -8.439 -18.008 9.999 1099 HD23 LEU 642 HD23 LEU 642 -9.826 -19.115 10.097 1100 H GLU 643 H GLU 643 -12.364 -15.495 12.856 1101 HA GLU 643 HA GLU 643 -11.843 -16.765 15.447 1102 HB2 GLU 643 HB2 GLU 643 -13.483 -14.812 15.248 1103 HB3 GLU 643 HB3 GLU 643 -14.485 -15.877 14.291 1104 HG2 GLU 643 HG2 GLU 643 -14.812 -17.357 16.128 1105 HG3 GLU 643 HG3 GLU 643 -13.648 -16.463 17.109 1106 H VAL 644 H VAL 644 -11.731 -18.923 15.323 1107 HA VAL 644 HA VAL 644 -13.074 -20.274 13.096 1108 HB VAL 644 HB VAL 644 -10.946 -21.376 14.938 1109 HG11 VAL 644 HG11 VAL 644 -12.434 -23.033 13.911 1110 HG12 VAL 644 HG12 VAL 644 -10.778 -23.181 13.354 1111 HG13 VAL 644 HG13 VAL 644 -11.991 -22.434 12.308 1112 HG21 VAL 644 HG21 VAL 644 -10.022 -19.552 13.601 1113 HG22 VAL 644 HG22 VAL 644 -10.659 -20.293 12.136 1114 HG23 VAL 644 HG23 VAL 644 -9.391 -21.106 13.050 1115 H ILE 645 H ILE 645 -14.966 -20.965 13.674 1116 HA ILE 645 HA ILE 645 -15.418 -21.886 16.420 1117 HB ILE 645 HB ILE 645 -17.393 -21.265 14.208 1118 HG12 ILE 645 HG12 ILE 645 -16.739 -19.587 16.627 1119 HG13 ILE 645 HG13 ILE 645 -16.013 -19.330 15.050 1120 HG21 ILE 645 HG21 ILE 645 -19.071 -21.274 15.998 1121 HG22 ILE 645 HG22 ILE 645 -17.826 -21.745 17.155 1122 HG23 ILE 645 HG23 ILE 645 -18.276 -22.843 15.849 1123 HD11 ILE 645 HD11 ILE 645 -18.156 -18.884 14.093 1124 HD12 ILE 645 HD12 ILE 645 -17.862 -17.813 15.462 1125 HD13 ILE 645 HD13 ILE 645 -18.960 -19.195 15.634 1126 H ILE 646 H ILE 646 -15.386 -24.058 16.726 1127 HA ILE 646 HA ILE 646 -15.563 -25.831 14.421 1128 HB ILE 646 HB ILE 646 -14.901 -26.557 17.309 1129 HG12 ILE 646 HG12 ILE 646 -12.921 -26.061 15.068 1130 HG13 ILE 646 HG13 ILE 646 -13.248 -24.907 16.358 1131 HG21 ILE 646 HG21 ILE 646 -13.949 -28.561 16.328 1132 HG22 ILE 646 HG22 ILE 646 -14.447 -28.022 14.726 1133 HG23 ILE 646 HG23 ILE 646 -15.663 -28.398 15.945 1134 HD11 ILE 646 HD11 ILE 646 -12.462 -26.520 18.008 1135 HD12 ILE 646 HD12 ILE 646 -11.217 -26.204 16.803 1136 HD13 ILE 646 HD13 ILE 646 -12.162 -27.691 16.731 1137 H GLU 647 H GLU 647 -17.641 -26.297 14.005 1138 HA GLU 647 HA GLU 647 -19.319 -26.932 16.297 1139 HB2 GLU 647 HB2 GLU 647 -21.282 -26.439 14.789 1140 HB3 GLU 647 HB3 GLU 647 -20.308 -25.058 15.247 1141 HG2 GLU 647 HG2 GLU 647 -19.242 -25.061 13.065 1142 HG3 GLU 647 HG3 GLU 647 -20.149 -26.504 12.612 1143 H GLU 648 H GLU 648 -20.137 -28.861 16.479 1144 HA GLU 648 HA GLU 648 -19.139 -30.891 14.852 1145 HB2 GLU 648 HB2 GLU 648 -20.575 -32.393 16.220 1146 HB3 GLU 648 HB3 GLU 648 -19.505 -31.362 17.154 1147 HG2 GLU 648 HG2 GLU 648 -21.536 -29.829 17.425 1148 HG3 GLU 648 HG3 GLU 648 -22.468 -31.188 16.809 1149 H SER 649 H SER 649 -19.765 -31.653 13.111 1150 HA SER 649 HA SER 649 -22.440 -31.220 12.129 1151 HB2 SER 649 HB2 SER 649 -19.863 -30.444 10.754 1152 HB3 SER 649 HB3 SER 649 -21.485 -30.270 10.051 1153 HG SER 649 HG SER 649 -20.296 -28.893 12.225 1154 H TYR 650 H TYR 650 -23.034 -33.221 11.771 1155 HA TYR 650 HA TYR 650 -21.085 -35.369 11.290 1156 HB2 TYR 650 HB2 TYR 650 -24.024 -35.822 11.594 1157 HB3 TYR 650 HB3 TYR 650 -22.686 -36.807 12.152 1158 HD1 TYR 650 HD2 TYR 650 -21.446 -36.057 14.259 1159 HD2 TYR 650 HD1 TYR 650 -25.097 -34.299 12.989 1160 HE1 TYR 650 HE2 TYR 650 -21.823 -35.176 16.535 1161 HE2 TYR 650 HE1 TYR 650 -25.483 -33.429 15.242 1162 HH TYR 650 HH TYR 650 -23.136 -33.370 17.699 1163 H GLU 651 H GLU 651 -22.362 -33.267 9.485 1164 HA GLU 651 HA GLU 651 -24.328 -34.344 7.831 1165 HB2 GLU 651 HB2 GLU 651 -22.418 -32.317 6.782 1166 HB3 GLU 651 HB3 GLU 651 -24.161 -32.398 6.612 1167 HG2 GLU 651 HG2 GLU 651 -22.598 -31.527 9.031 1168 HG3 GLU 651 HG3 GLU 651 -23.594 -30.523 7.987 1169 H PHE 652 H PHE 652 -20.820 -34.066 7.363 1170 HA PHE 652 HA PHE 652 -21.174 -35.673 5.011 1171 HB2 PHE 652 HB2 PHE 652 -18.854 -35.011 4.337 1172 HB3 PHE 652 HB3 PHE 652 -19.983 -33.677 4.460 1173 HD1 PHE 652 HD1 PHE 652 -19.840 -32.186 6.499 1174 HD2 PHE 652 HD2 PHE 652 -16.847 -35.033 5.490 1175 HE1 PHE 652 HE1 PHE 652 -18.225 -30.978 7.892 1176 HE2 PHE 652 HE2 PHE 652 -15.229 -33.834 6.889 1177 HZ PHE 652 HZ PHE 652 -15.918 -31.803 8.093 1178 H LYS 653 H LYS 653 -21.316 -37.543 5.421 1179 HA LYS 653 HA LYS 653 -19.108 -39.169 5.911 1180 HB2 LYS 653 HB2 LYS 653 -19.982 -40.421 7.914 1181 HB3 LYS 653 HB3 LYS 653 -19.504 -38.781 8.309 1182 HG2 LYS 653 HG2 LYS 653 -21.867 -38.117 8.313 1183 HG3 LYS 653 HG3 LYS 653 -22.324 -39.771 7.912 1184 HD2 LYS 653 HD2 LYS 653 -21.301 -40.551 10.002 1185 HD3 LYS 653 HD3 LYS 653 -20.861 -38.889 10.402 1186 HE2 LYS 653 HE2 LYS 653 -23.223 -38.268 10.416 1187 HE3 LYS 653 HE3 LYS 653 -23.662 -39.919 9.995 1188 HZ1 LYS 653 HZ1 LYS 653 -22.729 -40.665 12.089 1189 HZ2 LYS 653 HZ2 LYS 653 -23.908 -39.491 12.344 1190 HZ3 LYS 653 HZ3 LYS 653 -22.285 -39.088 12.493 1191 H SER 654 H SER 654 -22.645 -38.987 6.100 1192 HA SER 654 HA SER 654 -22.919 -41.275 4.414 1193 HB2 SER 654 HB2 SER 654 -25.360 -40.540 4.661 1194 HB3 SER 654 HB3 SER 654 -24.533 -41.008 6.150 1195 HG SER 654 HG SER 654 -25.792 -38.881 5.886 1196 H THR 655 H THR 655 -23.718 -37.802 4.339 1197 HA THR 655 HA THR 655 -23.482 -37.898 1.436 1198 HB THR 655 HB THR 655 -24.818 -35.744 3.091 1199 HG1 THR 655 HG1 THR 655 -25.627 -38.250 2.415 1200 HG21 THR 655 HG21 THR 655 -24.951 -36.448 0.150 1201 HG22 THR 655 HG22 THR 655 -24.108 -35.061 0.838 1202 HG23 THR 655 HG23 THR 655 -25.864 -35.165 0.935 1203 H VAL 656 H VAL 656 -21.311 -37.556 1.171 1204 HA VAL 656 HA VAL 656 -20.124 -35.176 2.413 1205 HB VAL 656 HB VAL 656 -18.774 -37.296 0.693 1206 HG11 VAL 656 HG11 VAL 656 -16.672 -36.385 1.574 1207 HG12 VAL 656 HG12 VAL 656 -17.577 -35.142 2.437 1208 HG13 VAL 656 HG13 VAL 656 -17.583 -35.172 0.675 1209 HG21 VAL 656 HG21 VAL 656 -19.613 -38.268 2.770 1210 HG22 VAL 656 HG22 VAL 656 -18.787 -37.022 3.701 1211 HG23 VAL 656 HG23 VAL 656 -17.852 -38.195 2.779 1212 H ASP 657 H ASP 657 -21.072 -36.608 -0.598 1213 HA ASP 657 HA ASP 657 -21.019 -34.002 -1.893 1214 HB2 ASP 657 HB2 ASP 657 -18.939 -34.958 -2.650 1215 HB3 ASP 657 HB3 ASP 657 -19.720 -36.501 -2.988 Start of MODEL 8 1 H HIS 501 H HIS 501 4.410 0.918 -0.244 2 HA HIS 501 HA HIS 501 2.710 0.104 1.619 3 HB2 HIS 501 HB2 HIS 501 1.208 1.978 1.115 4 HB3 HIS 501 HB3 HIS 501 1.123 1.479 -0.564 5 HD1 HIS 501 HD1 HIS 501 -0.250 0.613 2.855 6 HD2 HIS 501 HD2 HIS 501 -0.620 -0.594 -1.107 7 HE1 HIS 501 HE1 HIS 501 -2.253 -0.894 2.766 8 H ALA 502 H ALA 502 2.639 -1.970 1.331 9 HA ALA 502 HA ALA 502 3.197 -3.188 -1.258 10 HB1 ALA 502 HB1 ALA 502 4.307 -4.017 0.764 11 HB2 ALA 502 HB2 ALA 502 3.306 -5.265 0.015 12 HB3 ALA 502 HB3 ALA 502 2.734 -4.419 1.453 13 H GLY 503 H GLY 503 0.669 -3.635 1.269 14 HA2 GLY 503 HA2 GLY 503 -1.517 -3.381 -0.280 15 HA3 GLY 503 HA3 GLY 503 -0.983 -5.035 -0.570 16 H ILE 504 H ILE 504 -2.735 -5.999 0.463 17 HA ILE 504 HA ILE 504 -2.906 -5.465 3.336 18 HB ILE 504 HB ILE 504 -5.264 -5.998 1.484 19 HG12 ILE 504 HG12 ILE 504 -6.063 -3.720 2.417 20 HG13 ILE 504 HG13 ILE 504 -4.382 -3.463 2.860 21 HG21 ILE 504 HG21 ILE 504 -5.635 -7.067 3.575 22 HG22 ILE 504 HG22 ILE 504 -6.699 -5.668 3.413 23 HG23 ILE 504 HG23 ILE 504 -5.264 -5.574 4.436 24 HD11 ILE 504 HD11 ILE 504 -4.913 -2.388 0.750 25 HD12 ILE 504 HD12 ILE 504 -5.432 -3.937 0.072 26 HD13 ILE 504 HD13 ILE 504 -3.749 -3.690 0.507 27 H PHE 505 H PHE 505 -2.162 -7.268 4.262 28 HA PHE 505 HA PHE 505 -3.061 -9.849 3.233 29 HB2 PHE 505 HB2 PHE 505 -0.941 -9.072 5.224 30 HB3 PHE 505 HB3 PHE 505 -1.632 -10.689 5.270 31 HD1 PHE 505 HD1 PHE 505 -1.571 -12.033 3.116 32 HD2 PHE 505 HD2 PHE 505 0.847 -8.603 3.797 33 HE1 PHE 505 HE1 PHE 505 -0.013 -12.805 1.393 34 HE2 PHE 505 HE2 PHE 505 2.418 -9.373 2.061 35 HZ PHE 505 HZ PHE 505 1.966 -11.496 0.848 36 H THR 506 H THR 506 -4.676 -10.952 4.177 37 HA THR 506 HA THR 506 -5.372 -10.634 6.890 38 HB THR 506 HB THR 506 -6.300 -8.500 6.006 39 HG1 THR 506 HG1 THR 506 -7.630 -8.917 7.557 40 HG21 THR 506 HG21 THR 506 -8.055 -10.271 4.291 41 HG22 THR 506 HG22 THR 506 -6.776 -9.211 3.703 42 HG23 THR 506 HG23 THR 506 -8.214 -8.520 4.457 43 H PHE 507 H PHE 507 -7.670 -11.752 7.137 44 HA PHE 507 HA PHE 507 -7.366 -14.303 5.788 45 HB2 PHE 507 HB2 PHE 507 -9.109 -13.401 8.077 46 HB3 PHE 507 HB3 PHE 507 -9.269 -14.985 7.328 47 HD1 PHE 507 HD2 PHE 507 -7.408 -16.585 7.464 48 HD2 PHE 507 HD1 PHE 507 -7.367 -12.924 9.605 49 HE1 PHE 507 HE2 PHE 507 -5.694 -17.491 8.970 50 HE2 PHE 507 HE1 PHE 507 -5.654 -13.814 11.109 51 HZ PHE 507 HZ PHE 507 -4.819 -16.098 10.802 52 H GLU 508 H GLU 508 -9.096 -15.360 4.690 53 HA GLU 508 HA GLU 508 -10.403 -13.682 2.874 54 HB2 GLU 508 HB2 GLU 508 -9.622 -16.044 2.507 55 HB3 GLU 508 HB3 GLU 508 -10.994 -16.577 3.467 56 HG2 GLU 508 HG2 GLU 508 -12.514 -15.590 1.859 57 HG3 GLU 508 HG3 GLU 508 -11.120 -15.003 0.939 58 H GLU 509 H GLU 509 -11.491 -15.327 5.798 59 HA GLU 509 HA GLU 509 -13.787 -13.556 5.758 60 HB2 GLU 509 HB2 GLU 509 -15.210 -15.304 6.811 61 HB3 GLU 509 HB3 GLU 509 -14.740 -15.721 5.177 62 HG2 GLU 509 HG2 GLU 509 -13.220 -16.792 7.515 63 HG3 GLU 509 HG3 GLU 509 -14.747 -17.520 7.031 64 HA PRO 510 HA PRO 510 -12.330 -12.629 9.814 65 HB2 PRO 510 HB2 PRO 510 -14.603 -11.703 10.994 66 HB3 PRO 510 HB3 PRO 510 -13.715 -10.777 9.781 67 HG2 PRO 510 HG2 PRO 510 -16.182 -12.434 9.470 68 HG3 PRO 510 HG3 PRO 510 -15.797 -10.857 8.761 69 HD2 PRO 510 HD2 PRO 510 -15.590 -13.196 7.388 70 HD3 PRO 510 HD3 PRO 510 -14.561 -11.790 7.060 71 H VAL 511 H VAL 511 -15.111 -14.728 9.447 72 HA VAL 511 HA VAL 511 -14.374 -16.181 11.873 73 HB VAL 511 HB VAL 511 -17.249 -15.515 11.121 74 HG11 VAL 511 HG11 VAL 511 -16.140 -16.882 13.556 75 HG12 VAL 511 HG12 VAL 511 -17.018 -17.651 12.236 76 HG13 VAL 511 HG13 VAL 511 -17.837 -16.488 13.285 77 HG21 VAL 511 HG21 VAL 511 -16.183 -13.491 11.967 78 HG22 VAL 511 HG22 VAL 511 -15.619 -14.359 13.392 79 HG23 VAL 511 HG23 VAL 511 -17.344 -14.105 13.143 80 H THR 512 H THR 512 -14.390 -18.363 11.475 81 HA THR 512 HA THR 512 -15.772 -19.237 9.070 82 HB THR 512 HB THR 512 -13.305 -19.004 8.619 83 HG1 THR 512 HG1 THR 512 -14.751 -20.725 7.681 84 HG21 THR 512 HG21 THR 512 -11.763 -20.649 9.589 85 HG22 THR 512 HG22 THR 512 -13.059 -21.231 10.637 86 HG23 THR 512 HG23 THR 512 -12.447 -19.587 10.821 87 H HIS 513 H HIS 513 -16.748 -21.228 9.227 88 HA HIS 513 HA HIS 513 -16.755 -22.433 11.893 89 HB2 HIS 513 HB2 HIS 513 -18.881 -22.375 9.742 90 HB3 HIS 513 HB3 HIS 513 -18.962 -23.406 11.159 91 HD1 HIS 513 HD1 HIS 513 -20.611 -22.458 12.704 92 HD2 HIS 513 HD2 HIS 513 -18.357 -19.509 10.854 93 HE1 HIS 513 HE1 HIS 513 -21.426 -20.240 13.641 94 H VAL 514 H VAL 514 -16.042 -24.419 12.081 95 HA VAL 514 HA VAL 514 -15.693 -26.023 9.655 96 HB VAL 514 HB VAL 514 -13.610 -26.957 10.541 97 HG11 VAL 514 HG11 VAL 514 -13.583 -23.947 10.555 98 HG12 VAL 514 HG12 VAL 514 -13.361 -24.999 9.157 99 HG13 VAL 514 HG13 VAL 514 -12.153 -24.965 10.443 100 HG21 VAL 514 HG21 VAL 514 -13.980 -25.069 12.879 101 HG22 VAL 514 HG22 VAL 514 -12.543 -26.044 12.575 102 HG23 VAL 514 HG23 VAL 514 -14.080 -26.830 12.936 103 H SER 515 H SER 515 -15.201 -28.412 10.490 104 HA SER 515 HA SER 515 -17.437 -29.053 12.263 105 HB2 SER 515 HB2 SER 515 -17.435 -30.011 9.942 106 HB3 SER 515 HB3 SER 515 -15.948 -30.830 10.364 107 HG SER 515 HG SER 515 -17.667 -32.189 10.628 108 H GLU 516 H GLU 516 -17.195 -30.716 13.712 109 HA GLU 516 HA GLU 516 -14.802 -30.816 15.154 110 HB2 GLU 516 HB2 GLU 516 -16.934 -30.966 16.295 111 HB3 GLU 516 HB3 GLU 516 -17.404 -32.350 15.352 112 HG2 GLU 516 HG2 GLU 516 -15.079 -32.510 17.244 113 HG3 GLU 516 HG3 GLU 516 -16.738 -32.679 17.816 114 H SER 517 H SER 517 -16.338 -32.976 12.828 115 HA SER 517 HA SER 517 -14.067 -34.805 13.041 116 HB2 SER 517 HB2 SER 517 -16.826 -35.219 11.883 117 HB3 SER 517 HB3 SER 517 -15.520 -36.387 11.717 118 HG SER 517 HG SER 517 -16.367 -35.412 14.258 119 H ILE 518 H ILE 518 -14.182 -32.157 11.436 120 HA ILE 518 HA ILE 518 -14.093 -33.010 8.716 121 HB ILE 518 HB ILE 518 -14.545 -30.626 9.158 122 HG12 ILE 518 HG12 ILE 518 -11.920 -30.983 7.714 123 HG13 ILE 518 HG13 ILE 518 -13.522 -31.205 7.011 124 HG21 ILE 518 HG21 ILE 518 -12.824 -29.095 9.939 125 HG22 ILE 518 HG22 ILE 518 -11.726 -30.445 10.224 126 HG23 ILE 518 HG23 ILE 518 -13.233 -30.301 11.156 127 HD11 ILE 518 HD11 ILE 518 -13.989 -28.850 7.318 128 HD12 ILE 518 HD12 ILE 518 -12.465 -29.063 6.424 129 HD13 ILE 518 HD13 ILE 518 -12.446 -28.655 8.144 130 H GLY 519 H GLY 519 -11.728 -32.701 11.246 131 HA2 GLY 519 HA2 GLY 519 -9.705 -33.928 11.307 132 HA3 GLY 519 HA3 GLY 519 -9.820 -34.117 9.562 133 H ILE 520 H ILE 520 -9.513 -32.170 8.290 134 HA ILE 520 HA ILE 520 -7.645 -30.342 9.608 135 HB ILE 520 HB ILE 520 -7.358 -31.518 6.850 136 HG12 ILE 520 HG12 ILE 520 -6.805 -33.220 8.571 137 HG13 ILE 520 HG13 ILE 520 -5.402 -32.779 7.611 138 HG21 ILE 520 HG21 ILE 520 -5.536 -29.680 8.409 139 HG22 ILE 520 HG22 ILE 520 -6.463 -29.276 6.970 140 HG23 ILE 520 HG23 ILE 520 -5.118 -30.413 6.861 141 HD11 ILE 520 HD11 ILE 520 -6.038 -31.849 10.396 142 HD12 ILE 520 HD12 ILE 520 -4.644 -31.334 9.446 143 HD13 ILE 520 HD13 ILE 520 -4.803 -33.022 9.937 144 H MET 521 H MET 521 -8.126 -28.315 9.114 145 HA MET 521 HA MET 521 -9.961 -27.825 6.871 146 HB2 MET 521 HB2 MET 521 -10.881 -25.947 8.139 147 HB3 MET 521 HB3 MET 521 -11.024 -27.441 9.051 148 HG2 MET 521 HG2 MET 521 -10.275 -26.049 10.750 149 HG3 MET 521 HG3 MET 521 -8.740 -26.505 10.049 150 HE1 MET 521 HE1 MET 521 -9.552 -23.893 11.780 151 HE2 MET 521 HE2 MET 521 -8.640 -22.603 10.994 152 HE3 MET 521 HE3 MET 521 -7.845 -24.123 11.367 153 H GLU 522 H GLU 522 -9.514 -26.078 5.515 154 HA GLU 522 HA GLU 522 -6.857 -24.871 5.842 155 HB2 GLU 522 HB2 GLU 522 -8.396 -25.570 3.359 156 HB3 GLU 522 HB3 GLU 522 -7.143 -24.352 3.337 157 HG2 GLU 522 HG2 GLU 522 -6.125 -26.286 2.546 158 HG3 GLU 522 HG3 GLU 522 -5.610 -26.149 4.222 159 H VAL 523 H VAL 523 -6.830 -22.816 6.236 160 HA VAL 523 HA VAL 523 -9.182 -21.147 5.577 161 HB VAL 523 HB VAL 523 -6.831 -20.389 7.340 162 HG11 VAL 523 HG11 VAL 523 -8.163 -18.550 8.046 163 HG12 VAL 523 HG12 VAL 523 -9.513 -19.081 7.060 164 HG13 VAL 523 HG13 VAL 523 -8.025 -18.522 6.287 165 HG21 VAL 523 HG21 VAL 523 -8.306 -20.779 9.228 166 HG22 VAL 523 HG22 VAL 523 -8.085 -22.259 8.298 167 HG23 VAL 523 HG23 VAL 523 -9.574 -21.331 8.138 168 H LYS 524 H LYS 524 -9.039 -19.745 3.937 169 HA LYS 524 HA LYS 524 -6.588 -19.501 2.423 170 HB2 LYS 524 HB2 LYS 524 -9.252 -18.114 2.065 171 HB3 LYS 524 HB3 LYS 524 -7.922 -18.172 0.919 172 HG2 LYS 524 HG2 LYS 524 -9.066 -20.775 1.779 173 HG3 LYS 524 HG3 LYS 524 -10.016 -19.713 0.727 174 HD2 LYS 524 HD2 LYS 524 -7.194 -20.368 0.084 175 HD3 LYS 524 HD3 LYS 524 -8.524 -21.433 -0.413 176 HE2 LYS 524 HE2 LYS 524 -8.154 -18.522 -1.053 177 HE3 LYS 524 HE3 LYS 524 -8.005 -19.876 -2.197 178 HZ1 LYS 524 HZ1 LYS 524 -10.413 -18.710 -0.935 179 HZ2 LYS 524 HZ2 LYS 524 -10.430 -20.278 -1.579 180 HZ3 LYS 524 HZ3 LYS 524 -10.112 -18.985 -2.582 181 H VAL 525 H VAL 525 -5.162 -17.901 2.695 182 HA VAL 525 HA VAL 525 -5.998 -15.530 4.196 183 HB VAL 525 HB VAL 525 -3.209 -16.560 3.631 184 HG11 VAL 525 HG11 VAL 525 -3.255 -14.120 3.843 185 HG12 VAL 525 HG12 VAL 525 -2.481 -14.849 5.257 186 HG13 VAL 525 HG13 VAL 525 -4.146 -14.274 5.356 187 HG21 VAL 525 HG21 VAL 525 -4.822 -16.578 6.170 188 HG22 VAL 525 HG22 VAL 525 -3.132 -17.066 6.017 189 HG23 VAL 525 HG23 VAL 525 -4.391 -17.975 5.183 190 H LEU 526 H LEU 526 -6.430 -13.844 3.033 191 HA LEU 526 HA LEU 526 -6.055 -13.717 0.242 192 HB2 LEU 526 HB2 LEU 526 -6.799 -11.576 2.232 193 HB3 LEU 526 HB3 LEU 526 -6.856 -11.368 0.496 194 HG LEU 526 HG LEU 526 -8.543 -13.348 2.050 195 HD11 LEU 526 HD11 LEU 526 -10.394 -11.847 1.523 196 HD12 LEU 526 HD12 LEU 526 -9.259 -10.695 0.819 197 HD13 LEU 526 HD13 LEU 526 -9.186 -11.069 2.544 198 HD21 LEU 526 HD21 LEU 526 -8.098 -14.096 -0.221 199 HD22 LEU 526 HD22 LEU 526 -8.579 -12.523 -0.849 200 HD23 LEU 526 HD23 LEU 526 -9.770 -13.557 -0.064 201 H ARG 527 H ARG 527 -4.420 -13.130 -0.863 202 HA ARG 527 HA ARG 527 -1.960 -12.367 0.348 203 HB2 ARG 527 HB2 ARG 527 -2.207 -13.828 -1.690 204 HB3 ARG 527 HB3 ARG 527 -2.676 -12.396 -2.591 205 HG2 ARG 527 HG2 ARG 527 -0.470 -11.388 -2.008 206 HG3 ARG 527 HG3 ARG 527 -0.009 -12.927 -1.288 207 HD2 ARG 527 HD2 ARG 527 0.890 -12.838 -3.491 208 HD3 ARG 527 HD3 ARG 527 -0.436 -13.998 -3.482 209 HE ARG 527 HE ARG 527 -1.620 -11.677 -4.264 210 HH11 ARG 527 HH11 ARG 527 1.082 -13.572 -5.517 211 HH12 ARG 527 HH12 ARG 527 1.016 -12.945 -7.089 212 HH21 ARG 527 HH21 ARG 527 -1.771 -10.824 -6.427 213 HH22 ARG 527 HH22 ARG 527 -0.660 -11.311 -7.624 214 H THR 528 H THR 528 -0.758 -10.473 -0.215 215 HA THR 528 HA THR 528 -2.075 -8.039 -0.049 216 HB THR 528 HB THR 528 0.209 -8.249 0.710 217 HG1 THR 528 HG1 THR 528 1.121 -6.676 -1.124 218 HG21 THR 528 HG21 THR 528 0.922 -8.848 -2.145 219 HG22 THR 528 HG22 THR 528 0.978 -9.992 -0.797 220 HG23 THR 528 HG23 THR 528 2.076 -8.604 -0.833 221 H SER 529 H SER 529 -2.728 -6.607 -1.574 222 HA SER 529 HA SER 529 -3.299 -7.272 -4.161 223 HB2 SER 529 HB2 SER 529 -4.381 -5.450 -2.907 224 HB3 SER 529 HB3 SER 529 -2.884 -4.535 -2.929 225 HG SER 529 HG SER 529 -4.017 -3.740 -4.550 226 H GLY 530 H GLY 530 -0.481 -5.747 -2.742 227 HA2 GLY 530 HA2 GLY 530 0.787 -5.662 -5.389 228 HA3 GLY 530 HA3 GLY 530 1.216 -4.631 -4.023 229 H ALA 531 H ALA 531 1.354 -7.857 -5.310 230 HA ALA 531 HA ALA 531 3.111 -8.676 -3.150 231 HB1 ALA 531 HB1 ALA 531 1.449 -10.286 -3.971 232 HB2 ALA 531 HB2 ALA 531 3.091 -10.871 -4.240 233 HB3 ALA 531 HB3 ALA 531 2.163 -10.197 -5.580 234 H ARG 532 H ARG 532 4.975 -7.642 -3.358 235 HA ARG 532 HA ARG 532 6.296 -7.773 -5.964 236 HB2 ARG 532 HB2 ARG 532 6.898 -5.966 -3.623 237 HB3 ARG 532 HB3 ARG 532 7.704 -5.942 -5.183 238 HG2 ARG 532 HG2 ARG 532 4.795 -5.316 -4.692 239 HG3 ARG 532 HG3 ARG 532 6.064 -4.134 -5.000 240 HD2 ARG 532 HD2 ARG 532 6.440 -5.130 -7.215 241 HD3 ARG 532 HD3 ARG 532 5.172 -6.308 -6.890 242 HE ARG 532 HE ARG 532 4.023 -3.861 -6.511 243 HH11 ARG 532 HH11 ARG 532 5.570 -5.567 -9.194 244 HH12 ARG 532 HH12 ARG 532 4.708 -4.742 -10.414 245 HH21 ARG 532 HH21 ARG 532 2.827 -2.733 -8.174 246 HH22 ARG 532 HH22 ARG 532 3.106 -3.111 -9.815 247 H GLY 533 H GLY 533 7.098 -9.828 -5.817 248 HA2 GLY 533 HA2 GLY 533 9.209 -10.885 -5.625 249 HA3 GLY 533 HA3 GLY 533 9.530 -9.919 -4.199 250 H ASN 534 H ASN 534 9.609 -11.058 -2.434 251 HA ASN 534 HA ASN 534 7.757 -13.297 -2.040 252 HB2 ASN 534 HB2 ASN 534 9.877 -14.238 -2.747 253 HB3 ASN 534 HB3 ASN 534 10.743 -13.275 -1.563 254 HD21 ASN 534 HD21 ASN 534 7.707 -15.044 -0.932 255 HD22 ASN 534 HD22 ASN 534 8.439 -16.137 0.167 256 H VAL 535 H VAL 535 6.819 -13.301 -0.076 257 HA VAL 535 HA VAL 535 7.861 -11.577 2.053 258 HB VAL 535 HB VAL 535 4.971 -11.750 1.128 259 HG11 VAL 535 HG11 VAL 535 5.125 -11.420 3.512 260 HG12 VAL 535 HG12 VAL 535 4.556 -9.941 2.725 261 HG13 VAL 535 HG13 VAL 535 6.224 -10.062 3.272 262 HG21 VAL 535 HG21 VAL 535 6.924 -9.489 0.888 263 HG22 VAL 535 HG22 VAL 535 5.208 -9.399 0.453 264 HG23 VAL 535 HG23 VAL 535 6.306 -10.470 -0.435 265 H ILE 536 H ILE 536 7.640 -12.537 4.045 266 HA ILE 536 HA ILE 536 6.198 -15.109 4.144 267 HB ILE 536 HB ILE 536 8.340 -14.083 6.033 268 HG12 ILE 536 HG12 ILE 536 9.276 -14.824 3.905 269 HG13 ILE 536 HG13 ILE 536 9.702 -15.958 5.185 270 HG21 ILE 536 HG21 ILE 536 6.843 -16.702 6.067 271 HG22 ILE 536 HG22 ILE 536 6.674 -15.404 7.228 272 HG23 ILE 536 HG23 ILE 536 8.187 -16.301 7.139 273 HD11 ILE 536 HD11 ILE 536 7.643 -16.283 3.025 274 HD12 ILE 536 HD12 ILE 536 7.794 -17.350 4.412 275 HD13 ILE 536 HD13 ILE 536 9.132 -17.209 3.258 276 H VAL 537 H VAL 537 4.489 -15.322 5.425 277 HA VAL 537 HA VAL 537 3.972 -13.157 7.305 278 HB VAL 537 HB VAL 537 1.835 -14.762 5.871 279 HG11 VAL 537 HG11 VAL 537 0.301 -13.032 6.703 280 HG12 VAL 537 HG12 VAL 537 1.655 -12.264 7.534 281 HG13 VAL 537 HG13 VAL 537 1.126 -13.875 8.019 282 HG21 VAL 537 HG21 VAL 537 2.819 -11.986 5.291 283 HG22 VAL 537 HG22 VAL 537 1.425 -12.749 4.512 284 HG23 VAL 537 HG23 VAL 537 3.053 -13.399 4.274 285 HA PRO 538 HA PRO 538 4.129 -16.840 9.975 286 HB2 PRO 538 HB2 PRO 538 4.142 -15.485 12.316 287 HB3 PRO 538 HB3 PRO 538 5.592 -15.697 11.335 288 HG2 PRO 538 HG2 PRO 538 3.786 -13.327 11.567 289 HG3 PRO 538 HG3 PRO 538 5.552 -13.376 11.445 290 HD2 PRO 538 HD2 PRO 538 3.913 -12.793 9.349 291 HD3 PRO 538 HD3 PRO 538 5.507 -13.548 9.158 292 H TYR 539 H TYR 539 2.659 -17.817 11.451 293 HA TYR 539 HA TYR 539 0.234 -16.383 12.136 294 HB2 TYR 539 HB2 TYR 539 -1.295 -17.994 11.153 295 HB3 TYR 539 HB3 TYR 539 -0.219 -17.365 9.908 296 HD1 TYR 539 HD2 TYR 539 -0.998 -20.339 11.968 297 HD2 TYR 539 HD1 TYR 539 1.231 -18.780 8.714 298 HE1 TYR 539 HE2 TYR 539 -0.448 -22.623 11.270 299 HE2 TYR 539 HE1 TYR 539 1.779 -21.067 7.991 300 HH TYR 539 HH TYR 539 1.929 -23.282 8.934 301 H LYS 540 H LYS 540 -1.074 -17.585 13.644 302 HA LYS 540 HA LYS 540 -0.043 -20.030 14.776 303 HB2 LYS 540 HB2 LYS 540 0.503 -19.270 16.965 304 HB3 LYS 540 HB3 LYS 540 1.412 -18.305 15.833 305 HG2 LYS 540 HG2 LYS 540 0.007 -16.409 16.136 306 HG3 LYS 540 HG3 LYS 540 -1.162 -17.354 17.061 307 HD2 LYS 540 HD2 LYS 540 0.676 -17.793 18.723 308 HD3 LYS 540 HD3 LYS 540 1.642 -16.608 17.847 309 HE2 LYS 540 HE2 LYS 540 -1.082 -16.018 18.895 310 HE3 LYS 540 HE3 LYS 540 0.354 -15.798 19.902 311 HZ1 LYS 540 HZ1 LYS 540 -0.257 -14.293 17.340 312 HZ2 LYS 540 HZ2 LYS 540 1.141 -14.169 18.279 313 HZ3 LYS 540 HZ3 LYS 540 -0.313 -13.758 18.926 314 H THR 541 H THR 541 -1.437 -21.033 16.265 315 HA THR 541 HA THR 541 -4.165 -20.160 16.104 316 HB THR 541 HB THR 541 -4.452 -22.291 17.534 317 HG1 THR 541 HG1 THR 541 -2.444 -22.927 18.176 318 HG21 THR 541 HG21 THR 541 -5.053 -22.205 15.185 319 HG22 THR 541 HG22 THR 541 -4.268 -23.745 15.547 320 HG23 THR 541 HG23 THR 541 -3.367 -22.458 14.737 321 H ILE 542 H ILE 542 -5.380 -19.459 17.791 322 HA ILE 542 HA ILE 542 -3.969 -18.836 20.305 323 HB ILE 542 HB ILE 542 -6.397 -17.494 19.117 324 HG12 ILE 542 HG12 ILE 542 -3.564 -16.453 19.135 325 HG13 ILE 542 HG13 ILE 542 -4.321 -17.202 17.736 326 HG21 ILE 542 HG21 ILE 542 -4.562 -16.683 21.388 327 HG22 ILE 542 HG22 ILE 542 -6.209 -17.289 21.552 328 HG23 ILE 542 HG23 ILE 542 -5.918 -15.726 20.788 329 HD11 ILE 542 HD11 ILE 542 -4.325 -14.765 17.632 330 HD12 ILE 542 HD12 ILE 542 -5.305 -14.708 19.103 331 HD13 ILE 542 HD13 ILE 542 -5.950 -15.441 17.631 332 H GLU 543 H GLU 543 -4.766 -19.887 22.077 333 HA GLU 543 HA GLU 543 -7.344 -21.144 21.753 334 HB2 GLU 543 HB2 GLU 543 -6.394 -22.464 23.878 335 HB3 GLU 543 HB3 GLU 543 -6.124 -23.003 22.240 336 HG2 GLU 543 HG2 GLU 543 -4.082 -23.167 23.489 337 HG3 GLU 543 HG3 GLU 543 -3.918 -21.905 22.281 338 H GLY 544 H GLY 544 -8.709 -21.325 23.522 339 HA2 GLY 544 HA2 GLY 544 -8.558 -19.877 25.915 340 HA3 GLY 544 HA3 GLY 544 -9.278 -18.816 24.705 341 H THR 545 H THR 545 -11.176 -19.674 23.502 342 HA THR 545 HA THR 545 -13.020 -20.929 25.274 343 HB THR 545 HB THR 545 -14.381 -20.620 22.996 344 HG1 THR 545 HG1 THR 545 -12.753 -19.979 21.689 345 HG21 THR 545 HG21 THR 545 -13.502 -18.354 24.795 346 HG22 THR 545 HG22 THR 545 -14.817 -19.482 25.124 347 HG23 THR 545 HG23 THR 545 -14.942 -18.354 23.769 348 H ALA 546 H ALA 546 -10.692 -22.164 23.557 349 HA ALA 546 HA ALA 546 -11.839 -24.765 23.473 350 HB1 ALA 546 HB1 ALA 546 -10.544 -23.523 21.023 351 HB2 ALA 546 HB2 ALA 546 -12.236 -23.978 21.158 352 HB3 ALA 546 HB3 ALA 546 -10.982 -25.224 21.176 353 H ARG 547 H ARG 547 -10.134 -26.247 23.862 354 HA ARG 547 HA ARG 547 -7.665 -24.927 24.622 355 HB2 ARG 547 HB2 ARG 547 -9.027 -27.402 25.521 356 HB3 ARG 547 HB3 ARG 547 -7.283 -27.287 25.706 357 HG2 ARG 547 HG2 ARG 547 -7.460 -25.332 27.049 358 HG3 ARG 547 HG3 ARG 547 -9.181 -25.179 26.703 359 HD2 ARG 547 HD2 ARG 547 -8.528 -26.094 28.964 360 HD3 ARG 547 HD3 ARG 547 -9.717 -27.012 28.034 361 HE ARG 547 HE ARG 547 -8.170 -28.657 27.638 362 HH11 ARG 547 HH11 ARG 547 -6.753 -26.181 29.781 363 HH12 ARG 547 HH12 ARG 547 -5.453 -27.172 30.262 364 HH21 ARG 547 HH21 ARG 547 -6.450 -29.942 28.315 365 HH22 ARG 547 HH22 ARG 547 -5.268 -29.396 29.438 366 H GLY 548 H GLY 548 -5.775 -25.305 23.687 367 HA2 GLY 548 HA2 GLY 548 -5.896 -26.832 21.231 368 HA3 GLY 548 HA3 GLY 548 -4.637 -25.700 21.683 369 H GLY 549 H GLY 549 -2.938 -26.984 21.339 370 HA2 GLY 549 HA2 GLY 549 -1.332 -28.558 21.752 371 HA3 GLY 549 HA3 GLY 549 -2.102 -28.794 23.309 372 H GLY 550 H GLY 550 -4.271 -29.428 20.720 373 HA2 GLY 550 HA2 GLY 550 -4.579 -31.434 19.546 374 HA3 GLY 550 HA3 GLY 550 -3.504 -32.238 20.684 375 H GLU 551 H GLU 551 -5.741 -30.117 22.167 376 HA GLU 551 HA GLU 551 -7.190 -32.454 23.062 377 HB2 GLU 551 HB2 GLU 551 -6.343 -30.788 24.723 378 HB3 GLU 551 HB3 GLU 551 -7.489 -29.621 24.076 379 HG2 GLU 551 HG2 GLU 551 -9.334 -31.016 24.699 380 HG3 GLU 551 HG3 GLU 551 -8.234 -32.280 25.245 381 H ASP 552 H ASP 552 -8.403 -29.149 22.321 382 HA ASP 552 HA ASP 552 -10.718 -30.393 21.045 383 HB2 ASP 552 HB2 ASP 552 -10.049 -27.471 21.508 384 HB3 ASP 552 HB3 ASP 552 -11.492 -28.022 20.673 385 H PHE 553 H PHE 553 -7.949 -28.465 20.326 386 HA PHE 553 HA PHE 553 -8.160 -29.299 17.565 387 HB2 PHE 553 HB2 PHE 553 -7.756 -27.083 16.669 388 HB3 PHE 553 HB3 PHE 553 -9.165 -27.001 17.713 389 HD1 PHE 553 HD1 PHE 553 -9.045 -25.813 19.866 390 HD2 PHE 553 HD2 PHE 553 -5.743 -25.913 17.189 391 HE1 PHE 553 HE1 PHE 553 -8.014 -23.920 21.056 392 HE2 PHE 553 HE2 PHE 553 -4.710 -24.046 18.371 393 HZ PHE 553 HZ PHE 553 -5.833 -23.030 20.293 394 H GLU 554 H GLU 554 -6.142 -29.238 16.500 395 HA GLU 554 HA GLU 554 -3.915 -29.668 18.279 396 HB2 GLU 554 HB2 GLU 554 -4.737 -30.764 15.914 397 HB3 GLU 554 HB3 GLU 554 -3.526 -29.622 15.359 398 HG2 GLU 554 HG2 GLU 554 -3.157 -31.835 17.326 399 HG3 GLU 554 HG3 GLU 554 -2.591 -31.802 15.668 400 H ASP 555 H ASP 555 -2.155 -28.300 18.340 401 HA ASP 555 HA ASP 555 -2.851 -25.537 17.663 402 HB2 ASP 555 HB2 ASP 555 -2.073 -26.174 19.953 403 HB3 ASP 555 HB3 ASP 555 -0.497 -26.531 19.264 404 H THR 556 H THR 556 -1.790 -24.325 16.155 405 HA THR 556 HA THR 556 0.573 -25.499 14.992 406 HB THR 556 HB THR 556 -1.312 -26.325 13.607 407 HG1 THR 556 HG1 THR 556 -0.326 -25.924 11.719 408 HG21 THR 556 HG21 THR 556 -1.831 -23.397 13.044 409 HG22 THR 556 HG22 THR 556 -2.940 -24.530 13.826 410 HG23 THR 556 HG23 THR 556 -2.520 -24.730 12.131 411 H CYS 557 H CYS 557 1.915 -24.090 14.037 412 HA CYS 557 HA CYS 557 1.331 -21.307 13.779 413 HB2 CYS 557 HB2 CYS 557 1.943 -21.476 16.187 414 HB3 CYS 557 HB3 CYS 557 3.443 -22.280 15.748 415 HG CYS 557 HG CYS 557 2.798 -19.232 14.494 416 H GLY 558 H GLY 558 2.966 -20.368 12.416 417 HA2 GLY 558 HA2 GLY 558 5.274 -21.625 11.596 418 HA3 GLY 558 HA3 GLY 558 3.967 -22.218 10.571 419 H GLU 559 H GLU 559 5.221 -21.105 8.874 420 HA GLU 559 HA GLU 559 4.399 -18.318 8.749 421 HB2 GLU 559 HB2 GLU 559 7.161 -19.371 8.159 422 HB3 GLU 559 HB3 GLU 559 6.611 -17.732 7.801 423 HG2 GLU 559 HG2 GLU 559 6.283 -17.331 10.174 424 HG3 GLU 559 HG3 GLU 559 6.797 -18.978 10.527 425 H LEU 560 H LEU 560 3.483 -17.814 6.910 426 HA LEU 560 HA LEU 560 3.361 -19.791 4.763 427 HB2 LEU 560 HB2 LEU 560 1.834 -17.248 5.249 428 HB3 LEU 560 HB3 LEU 560 1.594 -18.312 3.884 429 HG LEU 560 HG LEU 560 1.070 -18.981 6.770 430 HD11 LEU 560 HD11 LEU 560 -1.266 -19.020 6.069 431 HD12 LEU 560 HD12 LEU 560 -0.793 -18.452 4.470 432 HD13 LEU 560 HD13 LEU 560 -0.541 -17.426 5.883 433 HD21 LEU 560 HD21 LEU 560 0.682 -20.626 4.265 434 HD22 LEU 560 HD22 LEU 560 0.007 -21.026 5.838 435 HD23 LEU 560 HD23 LEU 560 1.757 -20.988 5.617 436 H GLU 561 H GLU 561 4.257 -19.485 2.883 437 HA GLU 561 HA GLU 561 5.873 -17.101 2.543 438 HB2 GLU 561 HB2 GLU 561 6.893 -19.382 2.355 439 HB3 GLU 561 HB3 GLU 561 5.883 -19.646 0.931 440 HG2 GLU 561 HG2 GLU 561 6.980 -17.517 0.008 441 HG3 GLU 561 HG3 GLU 561 8.068 -17.680 1.338 442 H PHE 562 H PHE 562 4.990 -15.540 1.389 443 HA PHE 562 HA PHE 562 3.213 -16.278 -0.811 444 HB2 PHE 562 HB2 PHE 562 3.315 -13.779 0.868 445 HB3 PHE 562 HB3 PHE 562 2.454 -13.862 -0.659 446 HD1 PHE 562 HD1 PHE 562 0.441 -15.164 -0.880 447 HD2 PHE 562 HD2 PHE 562 2.498 -14.916 2.825 448 HE1 PHE 562 HE1 PHE 562 -1.551 -16.023 0.278 449 HE2 PHE 562 HE2 PHE 562 0.513 -15.778 3.991 450 HZ PHE 562 HZ PHE 562 -1.509 -16.332 2.713 451 H GLN 563 H GLN 563 3.552 -15.325 -2.766 452 HA GLN 563 HA GLN 563 5.911 -13.668 -3.100 453 HB2 GLN 563 HB2 GLN 563 5.444 -16.229 -4.634 454 HB3 GLN 563 HB3 GLN 563 6.688 -15.041 -4.977 455 HG2 GLN 563 HG2 GLN 563 7.655 -15.470 -2.763 456 HG3 GLN 563 HG3 GLN 563 6.454 -16.730 -2.518 457 HE21 GLN 563 HE21 GLN 563 9.294 -15.800 -4.300 458 HE22 GLN 563 HE22 GLN 563 9.631 -17.367 -4.892 459 H ASN 564 H ASN 564 6.036 -13.206 -5.534 460 HA ASN 564 HA ASN 564 3.626 -11.947 -6.340 461 HB2 ASN 564 HB2 ASN 564 5.821 -11.075 -6.982 462 HB3 ASN 564 HB3 ASN 564 6.152 -12.549 -7.884 463 HD21 ASN 564 HD21 ASN 564 6.439 -11.538 -9.809 464 HD22 ASN 564 HD22 ASN 564 5.162 -10.803 -10.701 465 H ASP 565 H ASP 565 5.349 -14.860 -7.188 466 HA ASP 565 HA ASP 565 3.541 -15.706 -9.263 467 HB2 ASP 565 HB2 ASP 565 5.915 -16.273 -9.396 468 HB3 ASP 565 HB3 ASP 565 5.801 -17.184 -7.898 469 H GLU 566 H GLU 566 3.798 -16.271 -5.816 470 HA GLU 566 HA GLU 566 2.090 -18.557 -5.827 471 HB2 GLU 566 HB2 GLU 566 3.097 -16.732 -3.654 472 HB3 GLU 566 HB3 GLU 566 2.097 -18.136 -3.355 473 HG2 GLU 566 HG2 GLU 566 4.820 -18.208 -4.651 474 HG3 GLU 566 HG3 GLU 566 4.506 -18.506 -2.943 475 H ILE 567 H ILE 567 -0.049 -18.557 -5.099 476 HA ILE 567 HA ILE 567 -1.418 -16.050 -5.605 477 HB ILE 567 HB ILE 567 -3.502 -17.643 -5.602 478 HG12 ILE 567 HG12 ILE 567 -1.383 -19.631 -6.439 479 HG13 ILE 567 HG13 ILE 567 -2.064 -19.656 -4.827 480 HG21 ILE 567 HG21 ILE 567 -3.219 -18.014 -8.000 481 HG22 ILE 567 HG22 ILE 567 -1.510 -17.619 -7.855 482 HG23 ILE 567 HG23 ILE 567 -2.731 -16.386 -7.524 483 HD11 ILE 567 HD11 ILE 567 -3.568 -20.026 -7.399 484 HD12 ILE 567 HD12 ILE 567 -4.245 -20.026 -5.758 485 HD13 ILE 567 HD13 ILE 567 -3.110 -21.284 -6.237 486 H VAL 568 H VAL 568 -2.432 -18.761 -3.542 487 HA VAL 568 HA VAL 568 -2.680 -16.903 -1.321 488 HB VAL 568 HB VAL 568 -4.893 -17.051 -2.439 489 HG11 VAL 568 HG11 VAL 568 -4.740 -19.994 -1.919 490 HG12 VAL 568 HG12 VAL 568 -4.705 -19.201 -3.497 491 HG13 VAL 568 HG13 VAL 568 -6.157 -19.115 -2.491 492 HG21 VAL 568 HG21 VAL 568 -4.855 -18.519 0.188 493 HG22 VAL 568 HG22 VAL 568 -6.259 -17.734 -0.535 494 HG23 VAL 568 HG23 VAL 568 -4.876 -16.770 -0.022 495 H LYS 569 H LYS 569 -2.503 -17.953 0.682 496 HA LYS 569 HA LYS 569 -1.682 -20.760 0.525 497 HB2 LYS 569 HB2 LYS 569 -0.688 -18.619 2.395 498 HB3 LYS 569 HB3 LYS 569 -0.426 -20.336 2.668 499 HG2 LYS 569 HG2 LYS 569 0.446 -19.755 0.037 500 HG3 LYS 569 HG3 LYS 569 1.090 -18.504 1.096 501 HD2 LYS 569 HD2 LYS 569 2.637 -20.358 0.892 502 HD3 LYS 569 HD3 LYS 569 2.040 -20.257 2.547 503 HE2 LYS 569 HE2 LYS 569 0.557 -22.122 2.148 504 HE3 LYS 569 HE3 LYS 569 0.957 -22.125 0.434 505 HZ1 LYS 569 HZ1 LYS 569 2.816 -22.754 2.668 506 HZ2 LYS 569 HZ2 LYS 569 3.243 -22.740 1.045 507 HZ3 LYS 569 HZ3 LYS 569 2.142 -23.879 1.615 508 H THR 570 H THR 570 -2.123 -22.008 2.449 509 HA THR 570 HA THR 570 -4.480 -21.016 3.867 510 HB THR 570 HB THR 570 -5.230 -23.456 3.896 511 HG1 THR 570 HG1 THR 570 -3.408 -23.535 1.739 512 HG21 THR 570 HG21 THR 570 -6.466 -21.778 2.650 513 HG22 THR 570 HG22 THR 570 -6.424 -23.289 1.766 514 HG23 THR 570 HG23 THR 570 -5.373 -21.948 1.268 515 H ILE 571 H ILE 571 -4.706 -21.704 5.949 516 HA ILE 571 HA ILE 571 -2.407 -23.089 7.119 517 HB ILE 571 HB ILE 571 -4.710 -21.647 8.518 518 HG12 ILE 571 HG12 ILE 571 -2.783 -20.258 9.478 519 HG13 ILE 571 HG13 ILE 571 -1.808 -20.973 8.204 520 HG21 ILE 571 HG21 ILE 571 -3.581 -22.101 10.625 521 HG22 ILE 571 HG22 ILE 571 -2.333 -23.002 9.766 522 HG23 ILE 571 HG23 ILE 571 -3.989 -23.602 9.785 523 HD11 ILE 571 HD11 ILE 571 -2.575 -18.770 7.638 524 HD12 ILE 571 HD12 ILE 571 -4.256 -19.290 7.807 525 HD13 ILE 571 HD13 ILE 571 -3.234 -19.979 6.537 526 H SER 572 H SER 572 -2.604 -25.176 7.469 527 HA SER 572 HA SER 572 -5.243 -26.411 7.403 528 HB2 SER 572 HB2 SER 572 -3.720 -28.492 7.250 529 HB3 SER 572 HB3 SER 572 -3.789 -27.416 5.855 530 HG SER 572 HG SER 572 -1.725 -27.870 7.672 531 H VAL 573 H VAL 573 -6.167 -26.750 9.258 532 HA VAL 573 HA VAL 573 -4.470 -27.198 11.631 533 HB VAL 573 HB VAL 573 -7.204 -25.918 11.517 534 HG11 VAL 573 HG11 VAL 573 -6.970 -25.494 13.920 535 HG12 VAL 573 HG12 VAL 573 -5.492 -26.465 13.943 536 HG13 VAL 573 HG13 VAL 573 -7.049 -27.212 13.538 537 HG21 VAL 573 HG21 VAL 573 -4.510 -24.789 12.206 538 HG22 VAL 573 HG22 VAL 573 -6.031 -23.929 12.413 539 HG23 VAL 573 HG23 VAL 573 -5.500 -24.402 10.796 540 H LYS 574 H LYS 574 -4.791 -29.017 12.800 541 HA LYS 574 HA LYS 574 -6.816 -30.865 11.924 542 HB2 LYS 574 HB2 LYS 574 -4.703 -31.901 12.298 543 HB3 LYS 574 HB3 LYS 574 -4.465 -31.056 13.813 544 HG2 LYS 574 HG2 LYS 574 -4.927 -33.353 14.311 545 HG3 LYS 574 HG3 LYS 574 -6.317 -32.391 14.786 546 HD2 LYS 574 HD2 LYS 574 -7.440 -33.079 12.660 547 HD3 LYS 574 HD3 LYS 574 -6.073 -34.155 12.338 548 HE2 LYS 574 HE2 LYS 574 -6.502 -35.256 14.542 549 HE3 LYS 574 HE3 LYS 574 -7.928 -34.249 14.720 550 HZ1 LYS 574 HZ1 LYS 574 -8.792 -35.348 12.614 551 HZ2 LYS 574 HZ2 LYS 574 -8.638 -36.324 13.942 552 HZ3 LYS 574 HZ3 LYS 574 -7.479 -36.412 12.743 553 H VAL 575 H VAL 575 -8.700 -30.618 12.667 554 HA VAL 575 HA VAL 575 -9.200 -29.530 15.310 555 HB VAL 575 HB VAL 575 -11.154 -30.718 13.297 556 HG11 VAL 575 HG11 VAL 575 -12.879 -29.541 14.597 557 HG12 VAL 575 HG12 VAL 575 -11.647 -28.997 15.729 558 HG13 VAL 575 HG13 VAL 575 -12.009 -30.717 15.582 559 HG21 VAL 575 HG21 VAL 575 -10.459 -27.819 13.791 560 HG22 VAL 575 HG22 VAL 575 -11.740 -28.398 12.724 561 HG23 VAL 575 HG23 VAL 575 -10.055 -28.756 12.352 562 H ILE 576 H ILE 576 -9.418 -30.862 17.049 563 HA ILE 576 HA ILE 576 -8.775 -33.599 16.538 564 HB ILE 576 HB ILE 576 -9.339 -32.247 19.151 565 HG12 ILE 576 HG12 ILE 576 -7.414 -31.250 17.976 566 HG13 ILE 576 HG13 ILE 576 -6.921 -32.084 19.439 567 HG21 ILE 576 HG21 ILE 576 -9.588 -34.661 19.313 568 HG22 ILE 576 HG22 ILE 576 -8.098 -34.141 20.130 569 HG23 ILE 576 HG23 ILE 576 -8.016 -34.885 18.533 570 HD11 ILE 576 HD11 ILE 576 -6.675 -33.156 16.632 571 HD12 ILE 576 HD12 ILE 576 -6.140 -33.970 18.101 572 HD13 ILE 576 HD13 ILE 576 -5.368 -32.466 17.594 573 H ASP 577 H ASP 577 -10.018 -35.035 16.341 574 HA ASP 577 HA ASP 577 -12.876 -34.684 16.552 575 HB2 ASP 577 HB2 ASP 577 -13.008 -36.839 15.328 576 HB3 ASP 577 HB3 ASP 577 -12.007 -35.670 14.487 577 H ASP 578 H ASP 578 -14.100 -35.578 18.023 578 HA ASP 578 HA ASP 578 -13.139 -37.612 19.802 579 HB2 ASP 578 HB2 ASP 578 -11.977 -35.748 20.764 580 HB3 ASP 578 HB3 ASP 578 -13.430 -34.765 20.722 581 H GLU 579 H GLU 579 -15.446 -34.989 20.489 582 HA GLU 579 HA GLU 579 -17.753 -36.655 20.010 583 HB2 GLU 579 HB2 GLU 579 -17.092 -35.757 22.848 584 HB3 GLU 579 HB3 GLU 579 -18.622 -36.432 22.340 585 HG2 GLU 579 HG2 GLU 579 -17.498 -38.563 21.858 586 HG3 GLU 579 HG3 GLU 579 -15.971 -37.862 22.390 587 H GLU 580 H GLU 580 -19.741 -35.384 20.489 588 HA GLU 580 HA GLU 580 -19.299 -32.518 20.063 589 HB2 GLU 580 HB2 GLU 580 -21.496 -32.473 19.148 590 HB3 GLU 580 HB3 GLU 580 -20.664 -33.822 18.398 591 HG2 GLU 580 HG2 GLU 580 -22.590 -34.129 20.716 592 HG3 GLU 580 HG3 GLU 580 -23.104 -34.174 19.044 593 H TYR 581 H TYR 581 -19.331 -34.166 22.611 594 HA TYR 581 HA TYR 581 -21.823 -33.675 23.921 595 HB2 TYR 581 HB2 TYR 581 -20.496 -35.689 24.334 596 HB3 TYR 581 HB3 TYR 581 -19.221 -34.712 25.039 597 HD1 TYR 581 HD1 TYR 581 -22.812 -35.597 25.465 598 HD2 TYR 581 HD2 TYR 581 -19.228 -34.304 27.352 599 HE1 TYR 581 HE1 TYR 581 -23.881 -35.840 27.664 600 HE2 TYR 581 HE2 TYR 581 -20.301 -34.544 29.554 601 HH TYR 581 HH TYR 581 -23.245 -36.173 29.947 602 H GLU 582 H GLU 582 -19.125 -31.648 23.510 603 HA GLU 582 HA GLU 582 -19.393 -30.581 26.112 604 HB2 GLU 582 HB2 GLU 582 -17.610 -28.843 25.161 605 HB3 GLU 582 HB3 GLU 582 -17.196 -30.423 25.793 606 HG2 GLU 582 HG2 GLU 582 -16.024 -29.970 23.699 607 HG3 GLU 582 HG3 GLU 582 -17.158 -31.326 23.595 608 H LYS 583 H LYS 583 -19.090 -28.257 23.434 609 HA LYS 583 HA LYS 583 -21.656 -27.072 24.178 610 HB2 LYS 583 HB2 LYS 583 -20.047 -26.200 25.786 611 HB3 LYS 583 HB3 LYS 583 -18.969 -25.744 24.496 612 HG2 LYS 583 HG2 LYS 583 -20.719 -24.161 23.647 613 HG3 LYS 583 HG3 LYS 583 -21.656 -24.523 25.101 614 HD2 LYS 583 HD2 LYS 583 -19.848 -23.705 26.503 615 HD3 LYS 583 HD3 LYS 583 -18.846 -23.421 25.082 616 HE2 LYS 583 HE2 LYS 583 -21.451 -22.019 25.723 617 HE3 LYS 583 HE3 LYS 583 -19.840 -21.346 25.933 618 HZ1 LYS 583 HZ1 LYS 583 -19.538 -21.576 23.473 619 HZ2 LYS 583 HZ2 LYS 583 -20.714 -20.507 23.948 620 HZ3 LYS 583 HZ3 LYS 583 -21.182 -21.990 23.345 621 H ASN 584 H ASN 584 -18.715 -26.102 22.659 622 HA ASN 584 HA ASN 584 -19.264 -26.144 20.062 623 HB2 ASN 584 HB2 ASN 584 -21.207 -24.642 20.454 624 HB3 ASN 584 HB3 ASN 584 -20.186 -23.525 21.345 625 HD21 ASN 584 HD21 ASN 584 -21.178 -24.644 18.216 626 HD22 ASN 584 HD22 ASN 584 -20.374 -23.422 17.318 627 H LYS 585 H LYS 585 -17.029 -26.044 19.704 628 HA LYS 585 HA LYS 585 -15.515 -24.319 21.509 629 HB2 LYS 585 HB2 LYS 585 -14.543 -26.560 19.737 630 HB3 LYS 585 HB3 LYS 585 -13.516 -25.588 20.782 631 HG2 LYS 585 HG2 LYS 585 -15.708 -27.469 21.623 632 HG3 LYS 585 HG3 LYS 585 -13.972 -27.668 21.875 633 HD2 LYS 585 HD2 LYS 585 -13.960 -25.691 23.333 634 HD3 LYS 585 HD3 LYS 585 -15.689 -25.484 23.067 635 HE2 LYS 585 HE2 LYS 585 -15.386 -26.546 25.161 636 HE3 LYS 585 HE3 LYS 585 -16.059 -27.723 24.038 637 HZ1 LYS 585 HZ1 LYS 585 -13.247 -27.493 24.904 638 HZ2 LYS 585 HZ2 LYS 585 -13.715 -28.561 23.736 639 HZ3 LYS 585 HZ3 LYS 585 -14.307 -28.726 25.316 640 H THR 586 H THR 586 -14.004 -22.869 20.815 641 HA THR 586 HA THR 586 -13.788 -22.400 18.022 642 HB THR 586 HB THR 586 -15.877 -21.247 18.377 643 HG1 THR 586 HG1 THR 586 -14.096 -20.174 17.203 644 HG21 THR 586 HG21 THR 586 -16.158 -19.439 19.978 645 HG22 THR 586 HG22 THR 586 -14.533 -19.735 20.615 646 HG23 THR 586 HG23 THR 586 -15.797 -20.964 20.787 647 H PHE 587 H PHE 587 -11.987 -21.312 17.507 648 HA PHE 587 HA PHE 587 -10.398 -20.180 19.657 649 HB2 PHE 587 HB2 PHE 587 -8.369 -21.335 18.894 650 HB3 PHE 587 HB3 PHE 587 -9.580 -22.500 19.389 651 HD1 PHE 587 HD1 PHE 587 -10.782 -23.823 17.642 652 HD2 PHE 587 HD2 PHE 587 -7.501 -21.282 16.708 653 HE1 PHE 587 HE1 PHE 587 -10.466 -25.008 15.505 654 HE2 PHE 587 HE2 PHE 587 -7.193 -22.459 14.571 655 HZ PHE 587 HZ PHE 587 -8.679 -24.324 13.974 656 H PHE 588 H PHE 588 -8.301 -19.200 18.415 657 HA PHE 588 HA PHE 588 -9.498 -17.781 16.147 658 HB2 PHE 588 HB2 PHE 588 -7.817 -16.521 18.346 659 HB3 PHE 588 HB3 PHE 588 -8.431 -15.703 16.921 660 HD1 PHE 588 HD1 PHE 588 -9.380 -17.320 20.100 661 HD2 PHE 588 HD2 PHE 588 -10.659 -14.899 16.832 662 HE1 PHE 588 HE1 PHE 588 -11.429 -16.778 21.316 663 HE2 PHE 588 HE2 PHE 588 -12.722 -14.363 18.051 664 HZ PHE 588 HZ PHE 588 -13.118 -15.296 20.282 665 H LEU 589 H LEU 589 -8.057 -17.022 14.624 666 HA LEU 589 HA LEU 589 -5.389 -18.284 14.705 667 HB2 LEU 589 HB2 LEU 589 -7.392 -18.937 12.969 668 HB3 LEU 589 HB3 LEU 589 -6.664 -17.596 12.116 669 HG LEU 589 HG LEU 589 -5.803 -19.629 11.233 670 HD11 LEU 589 HD11 LEU 589 -4.180 -17.889 11.275 671 HD12 LEU 589 HD12 LEU 589 -3.391 -19.432 11.612 672 HD13 LEU 589 HD13 LEU 589 -3.721 -18.303 12.926 673 HD21 LEU 589 HD21 LEU 589 -4.567 -21.236 12.618 674 HD22 LEU 589 HD22 LEU 589 -6.275 -21.098 13.053 675 HD23 LEU 589 HD23 LEU 589 -5.053 -20.324 14.051 676 H GLU 590 H GLU 590 -3.783 -16.810 14.477 677 HA GLU 590 HA GLU 590 -4.524 -14.158 13.449 678 HB2 GLU 590 HB2 GLU 590 -4.029 -14.000 15.810 679 HB3 GLU 590 HB3 GLU 590 -2.502 -14.852 15.590 680 HG2 GLU 590 HG2 GLU 590 -1.846 -12.948 14.041 681 HG3 GLU 590 HG3 GLU 590 -3.256 -12.094 14.653 682 H ILE 591 H ILE 591 -3.318 -13.432 11.821 683 HA ILE 591 HA ILE 591 -0.816 -14.807 11.281 684 HB ILE 591 HB ILE 591 -0.917 -13.758 8.997 685 HG12 ILE 591 HG12 ILE 591 -3.773 -13.127 9.781 686 HG13 ILE 591 HG13 ILE 591 -2.486 -11.955 9.505 687 HG21 ILE 591 HG21 ILE 591 -3.148 -15.649 9.681 688 HG22 ILE 591 HG22 ILE 591 -1.486 -16.074 9.330 689 HG23 ILE 591 HG23 ILE 591 -2.503 -15.376 8.059 690 HD11 ILE 591 HD11 ILE 591 -4.018 -12.079 7.634 691 HD12 ILE 591 HD12 ILE 591 -3.677 -13.799 7.459 692 HD13 ILE 591 HD13 ILE 591 -2.403 -12.611 7.158 693 H GLY 592 H GLY 592 0.968 -13.679 11.287 694 HA2 GLY 592 HA2 GLY 592 0.787 -11.198 12.771 695 HA3 GLY 592 HA3 GLY 592 2.238 -12.151 12.500 696 H GLU 593 H GLU 593 3.120 -10.033 12.127 697 HA GLU 593 HA GLU 593 2.265 -8.619 9.818 698 HB2 GLU 593 HB2 GLU 593 4.617 -8.204 11.637 699 HB3 GLU 593 HB3 GLU 593 4.239 -7.158 10.274 700 HG2 GLU 593 HG2 GLU 593 2.052 -6.696 11.253 701 HG3 GLU 593 HG3 GLU 593 2.475 -7.694 12.643 702 HA PRO 594 HA PRO 594 4.587 -10.881 6.902 703 HB2 PRO 594 HB2 PRO 594 4.405 -9.084 4.860 704 HB3 PRO 594 HB3 PRO 594 3.057 -10.113 5.340 705 HG2 PRO 594 HG2 PRO 594 3.613 -7.276 6.041 706 HG3 PRO 594 HG3 PRO 594 2.073 -8.006 5.582 707 HD2 PRO 594 HD2 PRO 594 2.723 -7.462 8.116 708 HD3 PRO 594 HD3 PRO 594 1.727 -8.869 7.706 709 H ARG 595 H ARG 595 6.665 -10.916 6.105 710 HA ARG 595 HA ARG 595 8.292 -8.479 6.422 711 HB2 ARG 595 HB2 ARG 595 10.215 -9.801 7.124 712 HB3 ARG 595 HB3 ARG 595 8.871 -10.139 8.197 713 HG2 ARG 595 HG2 ARG 595 8.462 -12.244 7.039 714 HG3 ARG 595 HG3 ARG 595 9.791 -11.905 5.929 715 HD2 ARG 595 HD2 ARG 595 11.334 -11.854 7.868 716 HD3 ARG 595 HD3 ARG 595 9.979 -12.301 8.913 717 HE ARG 595 HE ARG 595 11.183 -13.988 6.825 718 HH11 ARG 595 HH11 ARG 595 9.277 -13.709 9.845 719 HH12 ARG 595 HH12 ARG 595 9.231 -15.400 10.074 720 HH21 ARG 595 HH21 ARG 595 11.119 -16.272 7.235 721 HH22 ARG 595 HH22 ARG 595 10.253 -16.874 8.582 722 H LEU 596 H LEU 596 9.619 -7.968 4.691 723 HA LEU 596 HA LEU 596 9.124 -9.378 2.257 724 HB2 LEU 596 HB2 LEU 596 9.524 -6.806 2.735 725 HB3 LEU 596 HB3 LEU 596 11.205 -7.256 2.654 726 HG LEU 596 HG LEU 596 10.383 -6.290 0.541 727 HD11 LEU 596 HD11 LEU 596 12.233 -7.803 0.379 728 HD12 LEU 596 HD12 LEU 596 11.148 -8.006 -1.002 729 HD13 LEU 596 HD13 LEU 596 11.134 -9.181 0.312 730 HD21 LEU 596 HD21 LEU 596 8.104 -7.088 0.800 731 HD22 LEU 596 HD22 LEU 596 8.659 -8.719 0.396 732 HD23 LEU 596 HD23 LEU 596 8.766 -7.425 -0.806 733 H VAL 597 H VAL 597 10.402 -10.912 1.473 734 HA VAL 597 HA VAL 597 12.698 -11.662 3.063 735 HB VAL 597 HB VAL 597 11.599 -13.025 0.593 736 HG11 VAL 597 HG11 VAL 597 13.449 -14.036 2.752 737 HG12 VAL 597 HG12 VAL 597 13.901 -13.657 1.089 738 HG13 VAL 597 HG13 VAL 597 12.804 -14.997 1.421 739 HG21 VAL 597 HG21 VAL 597 9.902 -12.923 2.304 740 HG22 VAL 597 HG22 VAL 597 11.032 -13.574 3.496 741 HG23 VAL 597 HG23 VAL 597 10.503 -14.574 2.137 742 H GLU 598 H GLU 598 14.062 -9.993 2.643 743 HA GLU 598 HA GLU 598 15.175 -9.989 -0.073 744 HB2 GLU 598 HB2 GLU 598 14.179 -7.799 0.903 745 HB3 GLU 598 HB3 GLU 598 15.581 -7.793 1.955 746 HG2 GLU 598 HG2 GLU 598 16.017 -6.369 0.107 747 HG3 GLU 598 HG3 GLU 598 17.028 -7.808 -0.047 748 H MET 599 H MET 599 16.456 -8.877 3.067 749 HA MET 599 HA MET 599 18.918 -10.306 2.619 750 HB2 MET 599 HB2 MET 599 17.938 -8.707 5.003 751 HB3 MET 599 HB3 MET 599 19.536 -9.418 4.888 752 HG2 MET 599 HG2 MET 599 20.070 -8.007 2.994 753 HG3 MET 599 HG3 MET 599 18.440 -7.345 2.996 754 HE1 MET 599 HE1 MET 599 19.525 -4.893 2.984 755 HE2 MET 599 HE2 MET 599 21.142 -5.593 3.030 756 HE3 MET 599 HE3 MET 599 20.687 -4.338 4.187 757 H SER 600 H SER 600 15.920 -10.856 4.037 758 HA SER 600 HA SER 600 14.894 -12.659 4.887 759 HB2 SER 600 HB2 SER 600 17.460 -14.167 4.353 760 HB3 SER 600 HB3 SER 600 15.837 -14.849 4.516 761 HG SER 600 HG SER 600 16.597 -12.967 2.544 762 H GLU 601 H GLU 601 16.586 -10.852 6.495 763 HA GLU 601 HA GLU 601 17.517 -12.558 8.618 764 HB2 GLU 601 HB2 GLU 601 18.942 -10.696 8.079 765 HB3 GLU 601 HB3 GLU 601 17.605 -9.571 8.253 766 HG2 GLU 601 HG2 GLU 601 17.489 -10.005 10.623 767 HG3 GLU 601 HG3 GLU 601 18.752 -11.223 10.485 768 H LYS 602 H LYS 602 15.836 -13.422 9.594 769 HA LYS 602 HA LYS 602 13.621 -11.834 10.506 770 HB2 LYS 602 HB2 LYS 602 13.392 -14.287 9.946 771 HB3 LYS 602 HB3 LYS 602 14.473 -14.657 11.272 772 HG2 LYS 602 HG2 LYS 602 11.863 -13.236 11.739 773 HG3 LYS 602 HG3 LYS 602 11.933 -14.983 11.599 774 HD2 LYS 602 HD2 LYS 602 13.674 -13.512 13.566 775 HD3 LYS 602 HD3 LYS 602 12.009 -13.881 13.966 776 HE2 LYS 602 HE2 LYS 602 13.474 -15.563 14.903 777 HE3 LYS 602 HE3 LYS 602 12.490 -16.286 13.642 778 HZ1 LYS 602 HZ1 LYS 602 14.424 -16.209 12.166 779 HZ2 LYS 602 HZ2 LYS 602 14.754 -17.039 13.574 780 HZ3 LYS 602 HZ3 LYS 602 15.342 -15.478 13.388 781 H LYS 603 H LYS 603 14.115 -10.324 11.954 782 HA LYS 603 HA LYS 603 16.408 -10.496 13.611 783 HB2 LYS 603 HB2 LYS 603 14.136 -8.512 13.669 784 HB3 LYS 603 HB3 LYS 603 15.614 -8.386 14.608 785 HG2 LYS 603 HG2 LYS 603 16.917 -8.303 12.526 786 HG3 LYS 603 HG3 LYS 603 15.418 -8.380 11.605 787 HD2 LYS 603 HD2 LYS 603 16.209 -6.075 11.765 788 HD3 LYS 603 HD3 LYS 603 14.687 -6.271 12.636 789 HE2 LYS 603 HE2 LYS 603 15.874 -6.384 14.748 790 HE3 LYS 603 HE3 LYS 603 17.421 -6.317 13.914 791 HZ1 LYS 603 HZ1 LYS 603 16.761 -4.164 14.842 792 HZ2 LYS 603 HZ2 LYS 603 15.377 -4.158 13.903 793 HZ3 LYS 603 HZ3 LYS 603 16.892 -4.100 13.175 794 H GLY 604 H GLY 604 13.011 -11.053 14.150 795 HA2 GLY 604 HA2 GLY 604 13.263 -12.917 16.072 796 HA3 GLY 604 HA3 GLY 604 13.448 -11.419 16.977 797 H GLY 605 H GLY 605 11.673 -9.785 15.715 798 HA2 GLY 605 HA2 GLY 605 9.390 -9.426 15.418 799 HA3 GLY 605 HA3 GLY 605 9.094 -11.130 15.765 800 H PHE 606 H PHE 606 10.676 -8.481 17.434 801 HA PHE 606 HA PHE 606 9.954 -9.440 19.994 802 HB2 PHE 606 HB2 PHE 606 12.007 -8.133 19.600 803 HB3 PHE 606 HB3 PHE 606 11.035 -6.731 19.181 804 HD1 PHE 606 HD1 PHE 606 11.822 -9.067 21.952 805 HD2 PHE 606 HD2 PHE 606 10.323 -5.237 20.850 806 HE1 PHE 606 HE1 PHE 606 11.841 -8.384 24.314 807 HE2 PHE 606 HE2 PHE 606 10.338 -4.549 23.212 808 HZ PHE 606 HZ PHE 606 11.097 -6.121 24.947 809 H THR 607 H THR 607 7.907 -9.511 20.507 810 HA THR 607 HA THR 607 6.237 -7.156 20.075 811 HB THR 607 HB THR 607 5.396 -9.960 20.868 812 HG1 THR 607 HG1 THR 607 6.444 -9.171 18.603 813 HG21 THR 607 HG21 THR 607 3.748 -8.165 21.282 814 HG22 THR 607 HG22 THR 607 3.207 -9.243 19.997 815 HG23 THR 607 HG23 THR 607 3.880 -7.663 19.597 816 H ILE 608 H ILE 608 6.299 -5.892 21.840 817 HA ILE 608 HA ILE 608 6.991 -7.065 24.400 818 HB ILE 608 HB ILE 608 8.195 -5.037 23.700 819 HG12 ILE 608 HG12 ILE 608 6.427 -4.454 26.083 820 HG13 ILE 608 HG13 ILE 608 7.862 -5.471 26.123 821 HG21 ILE 608 HG21 ILE 608 5.520 -3.661 23.775 822 HG22 ILE 608 HG22 ILE 608 6.560 -3.912 22.367 823 HG23 ILE 608 HG23 ILE 608 7.074 -2.839 23.663 824 HD11 ILE 608 HD11 ILE 608 7.788 -2.527 25.490 825 HD12 ILE 608 HD12 ILE 608 9.233 -3.535 25.507 826 HD13 ILE 608 HD13 ILE 608 8.333 -3.259 26.999 827 H THR 609 H THR 609 4.278 -5.618 22.801 828 HA THR 609 HA THR 609 2.656 -5.820 25.204 829 HB THR 609 HB THR 609 1.905 -4.887 22.405 830 HG1 THR 609 HG1 THR 609 2.977 -3.597 24.659 831 HG21 THR 609 HG21 THR 609 0.006 -3.812 23.545 832 HG22 THR 609 HG22 THR 609 0.553 -4.482 25.082 833 HG23 THR 609 HG23 THR 609 -0.012 -5.557 23.805 834 H GLU 610 H GLU 610 2.228 -7.941 25.538 835 HA GLU 610 HA GLU 610 1.837 -9.672 23.243 836 HB2 GLU 610 HB2 GLU 610 2.140 -10.340 26.169 837 HB3 GLU 610 HB3 GLU 610 2.051 -11.515 24.859 838 HG2 GLU 610 HG2 GLU 610 4.089 -10.641 23.884 839 HG3 GLU 610 HG3 GLU 610 4.165 -9.389 25.117 840 H GLU 611 H GLU 611 0.037 -8.234 25.797 841 HA GLU 611 HA GLU 611 -2.374 -9.647 24.861 842 HB2 GLU 611 HB2 GLU 611 -1.797 -9.427 27.383 843 HB3 GLU 611 HB3 GLU 611 -2.180 -7.724 27.207 844 HG2 GLU 611 HG2 GLU 611 -4.064 -10.060 26.816 845 HG3 GLU 611 HG3 GLU 611 -4.039 -8.957 28.180 846 H TYR 612 H TYR 612 -3.425 -8.544 23.303 847 HA TYR 612 HA TYR 612 -3.342 -5.693 23.466 848 HB2 TYR 612 HB2 TYR 612 -2.971 -5.650 20.888 849 HB3 TYR 612 HB3 TYR 612 -1.605 -5.786 21.979 850 HD1 TYR 612 HD1 TYR 612 -3.830 -7.800 19.759 851 HD2 TYR 612 HD2 TYR 612 -0.118 -7.572 21.799 852 HE1 TYR 612 HE1 TYR 612 -3.055 -9.809 18.576 853 HE2 TYR 612 HE2 TYR 612 0.663 -9.575 20.632 854 HH TYR 612 HH TYR 612 -1.182 -11.030 18.034 855 H ASP 613 H ASP 613 -5.292 -5.064 23.618 856 HA ASP 613 HA ASP 613 -7.422 -6.359 22.137 857 HB2 ASP 613 HB2 ASP 613 -8.944 -4.742 23.191 858 HB3 ASP 613 HB3 ASP 613 -7.897 -5.431 24.417 859 H ASP 614 H ASP 614 -5.148 -3.964 21.749 860 HA ASP 614 HA ASP 614 -6.489 -2.848 19.390 861 HB2 ASP 614 HB2 ASP 614 -5.706 -1.235 21.122 862 HB3 ASP 614 HB3 ASP 614 -4.071 -1.841 20.926 863 H LYS 615 H LYS 615 -6.049 -4.426 17.899 864 HA LYS 615 HA LYS 615 -3.583 -5.821 17.763 865 HB2 LYS 615 HB2 LYS 615 -6.041 -5.758 16.082 866 HB3 LYS 615 HB3 LYS 615 -4.577 -6.374 15.345 867 HG2 LYS 615 HG2 LYS 615 -5.929 -8.191 16.217 868 HG3 LYS 615 HG3 LYS 615 -4.412 -8.080 17.094 869 HD2 LYS 615 HD2 LYS 615 -5.608 -6.929 18.934 870 HD3 LYS 615 HD3 LYS 615 -7.111 -7.117 18.031 871 HE2 LYS 615 HE2 LYS 615 -6.906 -9.525 18.089 872 HE3 LYS 615 HE3 LYS 615 -5.349 -9.398 18.900 873 HZ1 LYS 615 HZ1 LYS 615 -7.972 -8.556 20.013 874 HZ2 LYS 615 HZ2 LYS 615 -6.477 -8.359 20.776 875 HZ3 LYS 615 HZ3 LYS 615 -7.066 -9.898 20.480 876 H GLN 616 H GLN 616 -4.927 -3.179 15.880 877 HA GLN 616 HA GLN 616 -2.223 -2.553 15.025 878 HB2 GLN 616 HB2 GLN 616 -4.623 -2.872 13.244 879 HB3 GLN 616 HB3 GLN 616 -3.318 -1.781 12.798 880 HG2 GLN 616 HG2 GLN 616 -2.977 -4.712 13.387 881 HG3 GLN 616 HG3 GLN 616 -3.147 -4.023 11.771 882 HE21 GLN 616 HE21 GLN 616 -1.076 -4.291 14.562 883 HE22 GLN 616 HE22 GLN 616 0.365 -3.728 13.775 884 HA PRO 617 HA PRO 617 -2.870 1.425 16.577 885 HB2 PRO 617 HB2 PRO 617 -1.903 2.923 14.385 886 HB3 PRO 617 HB3 PRO 617 -0.981 2.389 15.791 887 HG2 PRO 617 HG2 PRO 617 -1.144 1.213 13.077 888 HG3 PRO 617 HG3 PRO 617 0.180 1.194 14.248 889 HD2 PRO 617 HD2 PRO 617 -1.331 -0.981 13.759 890 HD3 PRO 617 HD3 PRO 617 -0.650 -0.646 15.362 891 H LEU 618 H LEU 618 -4.683 2.407 16.742 892 HA LEU 618 HA LEU 618 -6.665 2.381 14.732 893 HB2 LEU 618 HB2 LEU 618 -7.210 2.245 17.088 894 HB3 LEU 618 HB3 LEU 618 -6.525 3.827 17.364 895 HG LEU 618 HG LEU 618 -8.303 4.834 15.995 896 HD11 LEU 618 HD11 LEU 618 -9.407 2.030 15.881 897 HD12 LEU 618 HD12 LEU 618 -8.783 2.961 14.515 898 HD13 LEU 618 HD13 LEU 618 -10.243 3.489 15.351 899 HD21 LEU 618 HD21 LEU 618 -9.263 3.052 18.220 900 HD22 LEU 618 HD22 LEU 618 -10.109 4.462 17.586 901 HD23 LEU 618 HD23 LEU 618 -8.556 4.658 18.401 902 H THR 619 H THR 619 -5.034 5.138 16.325 903 HA THR 619 HA THR 619 -5.132 6.485 13.772 904 HB THR 619 HB THR 619 -5.769 8.619 15.129 905 HG1 THR 619 HG1 THR 619 -6.098 6.737 17.009 906 HG21 THR 619 HG21 THR 619 -7.108 7.726 13.288 907 HG22 THR 619 HG22 THR 619 -8.155 8.248 14.604 908 HG23 THR 619 HG23 THR 619 -7.820 6.530 14.370 909 H SER 620 H SER 620 -3.236 7.118 13.285 910 HA SER 620 HA SER 620 -1.267 7.729 15.280 911 HB2 SER 620 HB2 SER 620 -0.672 6.443 13.213 912 HB3 SER 620 HB3 SER 620 -1.190 7.805 12.233 913 HG SER 620 HG SER 620 0.725 8.415 14.145 914 H LYS 621 H LYS 621 -1.225 9.761 16.041 915 HA LYS 621 HA LYS 621 -2.831 11.795 14.727 916 HB2 LYS 621 HB2 LYS 621 -1.223 11.996 17.303 917 HB3 LYS 621 HB3 LYS 621 -2.279 13.240 16.673 918 HG2 LYS 621 HG2 LYS 621 -3.470 12.182 18.415 919 HG3 LYS 621 HG3 LYS 621 -4.185 11.591 16.919 920 HD2 LYS 621 HD2 LYS 621 -2.850 9.533 17.123 921 HD3 LYS 621 HD3 LYS 621 -2.170 10.137 18.632 922 HE2 LYS 621 HE2 LYS 621 -4.484 10.240 19.550 923 HE3 LYS 621 HE3 LYS 621 -5.058 9.496 18.062 924 HZ1 LYS 621 HZ1 LYS 621 -3.679 7.555 18.558 925 HZ2 LYS 621 HZ2 LYS 621 -4.783 7.860 19.787 926 HZ3 LYS 621 HZ3 LYS 621 -3.170 8.272 20.003 927 H GLU 622 H GLU 622 0.432 11.635 16.020 928 HA GLU 622 HA GLU 622 1.368 13.393 13.914 929 HB2 GLU 622 HB2 GLU 622 2.218 13.617 16.257 930 HB3 GLU 622 HB3 GLU 622 2.827 11.972 16.161 931 HG2 GLU 622 HG2 GLU 622 4.259 12.708 14.250 932 HG3 GLU 622 HG3 GLU 622 3.761 14.364 14.600 933 H GLU 623 H GLU 623 2.053 12.464 12.047 934 HA GLU 623 HA GLU 623 1.909 9.724 11.595 935 HB2 GLU 623 HB2 GLU 623 3.332 11.859 10.029 936 HB3 GLU 623 HB3 GLU 623 3.189 10.195 9.489 937 HG2 GLU 623 HG2 GLU 623 0.742 10.425 9.543 938 HG3 GLU 623 HG3 GLU 623 0.941 12.125 9.977 939 H GLU 624 H GLU 624 3.052 8.328 12.553 940 HA GLU 624 HA GLU 624 5.569 8.580 13.688 941 HB2 GLU 624 HB2 GLU 624 4.182 6.120 12.627 942 HB3 GLU 624 HB3 GLU 624 5.578 6.121 13.695 943 HG2 GLU 624 HG2 GLU 624 2.947 7.382 14.403 944 HG3 GLU 624 HG3 GLU 624 3.383 5.724 14.806 945 H GLU 625 H GLU 625 7.458 8.891 12.721 946 HA GLU 625 HA GLU 625 7.866 8.615 9.980 947 HB2 GLU 625 HB2 GLU 625 10.386 8.719 10.622 948 HB3 GLU 625 HB3 GLU 625 9.374 10.110 10.944 949 HG2 GLU 625 HG2 GLU 625 10.930 9.675 12.773 950 HG3 GLU 625 HG3 GLU 625 9.262 9.501 13.300 951 H ARG 626 H ARG 626 8.160 6.403 12.510 952 HA ARG 626 HA ARG 626 9.358 4.189 11.480 953 HB2 ARG 626 HB2 ARG 626 6.858 4.481 13.094 954 HB3 ARG 626 HB3 ARG 626 7.494 2.916 12.651 955 HG2 ARG 626 HG2 ARG 626 9.536 3.386 13.890 956 HG3 ARG 626 HG3 ARG 626 8.913 4.990 14.316 957 HD2 ARG 626 HD2 ARG 626 8.590 3.137 16.045 958 HD3 ARG 626 HD3 ARG 626 7.154 4.069 15.603 959 HE ARG 626 HE ARG 626 7.619 1.684 14.048 960 HH11 ARG 626 HH11 ARG 626 6.008 2.883 16.974 961 HH12 ARG 626 HH12 ARG 626 4.673 1.846 16.797 962 HH21 ARG 626 HH21 ARG 626 5.787 0.347 13.788 963 HH22 ARG 626 HH22 ARG 626 4.524 0.368 14.928 964 H ARG 627 H ARG 627 5.879 5.111 10.994 965 HA ARG 627 HA ARG 627 5.445 2.880 9.345 966 HB2 ARG 627 HB2 ARG 627 3.684 3.883 10.757 967 HB3 ARG 627 HB3 ARG 627 3.740 5.341 9.790 968 HG2 ARG 627 HG2 ARG 627 3.047 2.714 8.515 969 HG3 ARG 627 HG3 ARG 627 1.849 3.613 9.442 970 HD2 ARG 627 HD2 ARG 627 3.412 4.673 7.101 971 HD3 ARG 627 HD3 ARG 627 1.725 4.123 7.007 972 HE ARG 627 HE ARG 627 1.815 5.973 9.004 973 HH11 ARG 627 HH11 ARG 627 2.276 6.057 5.455 974 HH12 ARG 627 HH12 ARG 627 2.150 7.734 5.355 975 HH21 ARG 627 HH21 ARG 627 1.595 8.222 8.858 976 HH22 ARG 627 HH22 ARG 627 1.720 9.057 7.386 977 H ILE 628 H ILE 628 6.543 6.070 8.813 978 HA ILE 628 HA ILE 628 6.078 6.157 6.004 979 HB ILE 628 HB ILE 628 8.172 7.646 7.645 980 HG12 ILE 628 HG12 ILE 628 5.395 8.496 6.779 981 HG13 ILE 628 HG13 ILE 628 5.841 8.007 8.406 982 HG21 ILE 628 HG21 ILE 628 8.696 7.668 5.247 983 HG22 ILE 628 HG22 ILE 628 8.185 9.266 5.786 984 HG23 ILE 628 HG23 ILE 628 7.068 8.242 4.887 985 HD11 ILE 628 HD11 ILE 628 5.678 10.415 8.228 986 HD12 ILE 628 HD12 ILE 628 6.861 10.415 6.922 987 HD13 ILE 628 HD13 ILE 628 7.348 9.943 8.545 988 H ALA 629 H ALA 629 8.577 4.823 8.030 989 HA ALA 629 HA ALA 629 10.206 4.047 5.767 990 HB1 ALA 629 HB1 ALA 629 10.449 3.336 8.696 991 HB2 ALA 629 HB2 ALA 629 11.299 4.650 7.880 992 HB3 ALA 629 HB3 ALA 629 11.646 2.975 7.453 993 H GLU 630 H GLU 630 7.899 2.659 7.985 994 HA GLU 630 HA GLU 630 8.240 -0.011 7.097 995 HB2 GLU 630 HB2 GLU 630 6.013 1.185 8.748 996 HB3 GLU 630 HB3 GLU 630 6.196 -0.524 8.413 997 HG2 GLU 630 HG2 GLU 630 8.339 -0.567 9.535 998 HG3 GLU 630 HG3 GLU 630 8.239 1.167 9.828 999 H MET 631 H MET 631 6.581 2.577 5.696 1000 HA MET 631 HA MET 631 4.693 0.971 4.263 1001 HB2 MET 631 HB2 MET 631 4.306 2.874 2.826 1002 HB3 MET 631 HB3 MET 631 4.520 3.498 4.452 1003 HG2 MET 631 HG2 MET 631 6.817 4.110 3.919 1004 HG3 MET 631 HG3 MET 631 6.610 3.469 2.293 1005 HE1 MET 631 HE1 MET 631 7.701 6.358 2.844 1006 HE2 MET 631 HE2 MET 631 6.819 7.287 1.628 1007 HE3 MET 631 HE3 MET 631 7.443 5.678 1.241 1008 H GLY 632 H GLY 632 8.036 1.367 4.168 1009 HA2 GLY 632 HA2 GLY 632 8.382 0.551 1.432 1010 HA3 GLY 632 HA3 GLY 632 9.645 0.868 2.614 1011 H ARG 633 H ARG 633 7.281 -1.083 3.970 1012 HA ARG 633 HA ARG 633 8.555 -3.566 3.093 1013 HB2 ARG 633 HB2 ARG 633 8.640 -4.451 5.347 1014 HB3 ARG 633 HB3 ARG 633 9.364 -2.858 5.418 1015 HG2 ARG 633 HG2 ARG 633 7.466 -1.932 6.488 1016 HG3 ARG 633 HG3 ARG 633 6.496 -3.360 6.141 1017 HD2 ARG 633 HD2 ARG 633 7.891 -4.693 7.629 1018 HD3 ARG 633 HD3 ARG 633 8.914 -3.290 7.929 1019 HE ARG 633 HE ARG 633 7.195 -2.302 9.183 1020 HH11 ARG 633 HH11 ARG 633 6.140 -5.523 8.055 1021 HH12 ARG 633 HH12 ARG 633 5.074 -5.749 9.352 1022 HH21 ARG 633 HH21 ARG 633 5.747 -2.626 10.906 1023 HH22 ARG 633 HH22 ARG 633 4.807 -4.053 11.057 1024 HA PRO 634 HA PRO 634 4.317 -4.766 2.742 1025 HB2 PRO 634 HB2 PRO 634 4.359 -7.384 3.525 1026 HB3 PRO 634 HB3 PRO 634 4.894 -6.841 1.933 1027 HG2 PRO 634 HG2 PRO 634 6.513 -7.551 4.330 1028 HG3 PRO 634 HG3 PRO 634 6.850 -7.842 2.618 1029 HD2 PRO 634 HD2 PRO 634 8.011 -5.849 4.052 1030 HD3 PRO 634 HD3 PRO 634 7.729 -5.750 2.305 1031 H ILE 635 H ILE 635 2.591 -4.599 3.924 1032 HA ILE 635 HA ILE 635 2.788 -5.131 6.749 1033 HB ILE 635 HB ILE 635 1.377 -3.087 7.167 1034 HG12 ILE 635 HG12 ILE 635 1.704 -1.185 5.440 1035 HG13 ILE 635 HG13 ILE 635 2.119 -2.443 4.294 1036 HG21 ILE 635 HG21 ILE 635 4.117 -2.685 6.030 1037 HG22 ILE 635 HG22 ILE 635 3.735 -3.102 7.704 1038 HG23 ILE 635 HG23 ILE 635 3.306 -1.507 7.064 1039 HD11 ILE 635 HD11 ILE 635 -0.117 -3.395 4.547 1040 HD12 ILE 635 HD12 ILE 635 -0.175 -1.705 4.037 1041 HD13 ILE 635 HD13 ILE 635 -0.514 -2.134 5.714 1042 H LEU 636 H LEU 636 0.493 -5.121 7.721 1043 HA LEU 636 HA LEU 636 -1.043 -6.751 5.876 1044 HB2 LEU 636 HB2 LEU 636 -2.156 -7.632 8.006 1045 HB3 LEU 636 HB3 LEU 636 -0.524 -8.134 7.654 1046 HG LEU 636 HG LEU 636 0.303 -6.491 9.330 1047 HD11 LEU 636 HD11 LEU 636 -1.525 -4.923 9.291 1048 HD12 LEU 636 HD12 LEU 636 -1.255 -5.523 10.929 1049 HD13 LEU 636 HD13 LEU 636 -2.613 -6.131 9.973 1050 HD21 LEU 636 HD21 LEU 636 -1.701 -8.477 10.349 1051 HD22 LEU 636 HD22 LEU 636 -0.379 -7.767 11.282 1052 HD23 LEU 636 HD23 LEU 636 -0.029 -8.821 9.909 1053 H GLY 637 H GLY 637 -3.508 -6.837 6.888 1054 HA2 GLY 637 HA2 GLY 637 -4.542 -4.328 5.967 1055 HA3 GLY 637 HA3 GLY 637 -5.445 -5.753 6.469 1056 H GLU 638 H GLU 638 -6.923 -4.524 7.555 1057 HA GLU 638 HA GLU 638 -6.090 -2.754 9.647 1058 HB2 GLU 638 HB2 GLU 638 -8.113 -2.405 8.188 1059 HB3 GLU 638 HB3 GLU 638 -8.869 -3.745 9.037 1060 HG2 GLU 638 HG2 GLU 638 -9.627 -1.636 9.934 1061 HG3 GLU 638 HG3 GLU 638 -8.676 -2.504 11.138 1062 H HIS 639 H HIS 639 -7.729 -5.889 9.442 1063 HA HIS 639 HA HIS 639 -6.817 -6.469 12.166 1064 HB2 HIS 639 HB2 HIS 639 -9.592 -7.041 11.071 1065 HB3 HIS 639 HB3 HIS 639 -8.940 -7.781 12.518 1066 HD1 HIS 639 HD1 HIS 639 -9.596 -6.602 14.658 1067 HD2 HIS 639 HD2 HIS 639 -9.826 -4.134 11.325 1068 HE1 HIS 639 HE1 HIS 639 -10.553 -4.422 15.470 1069 H THR 640 H THR 640 -5.779 -8.390 12.247 1070 HA THR 640 HA THR 640 -6.402 -10.248 10.117 1071 HB THR 640 HB THR 640 -4.080 -11.133 10.445 1072 HG1 THR 640 HG1 THR 640 -2.668 -10.051 11.648 1073 HG21 THR 640 HG21 THR 640 -4.308 -8.304 9.422 1074 HG22 THR 640 HG22 THR 640 -4.777 -9.748 8.546 1075 HG23 THR 640 HG23 THR 640 -3.076 -9.484 8.947 1076 H LYS 641 H LYS 641 -7.884 -11.371 11.144 1077 HA LYS 641 HA LYS 641 -7.047 -13.162 13.211 1078 HB2 LYS 641 HB2 LYS 641 -7.527 -11.142 14.563 1079 HB3 LYS 641 HB3 LYS 641 -9.148 -11.101 13.876 1080 HG2 LYS 641 HG2 LYS 641 -9.581 -13.335 14.881 1081 HG3 LYS 641 HG3 LYS 641 -8.001 -13.251 15.656 1082 HD2 LYS 641 HD2 LYS 641 -9.783 -12.600 17.198 1083 HD3 LYS 641 HD3 LYS 641 -8.699 -11.245 16.868 1084 HE2 LYS 641 HE2 LYS 641 -10.269 -10.291 15.336 1085 HE3 LYS 641 HE3 LYS 641 -11.321 -11.699 15.444 1086 HZ1 LYS 641 HZ1 LYS 641 -10.679 -9.846 17.670 1087 HZ2 LYS 641 HZ2 LYS 641 -11.780 -11.130 17.730 1088 HZ3 LYS 641 HZ3 LYS 641 -12.085 -9.795 16.758 1089 H LEU 642 H LEU 642 -8.243 -14.882 13.185 1090 HA LEU 642 HA LEU 642 -10.705 -14.928 11.569 1091 HB2 LEU 642 HB2 LEU 642 -8.751 -16.005 10.547 1092 HB3 LEU 642 HB3 LEU 642 -8.565 -16.971 11.993 1093 HG LEU 642 HG LEU 642 -10.921 -17.866 11.450 1094 HD11 LEU 642 HD11 LEU 642 -11.488 -16.237 9.739 1095 HD12 LEU 642 HD12 LEU 642 -11.469 -17.893 9.116 1096 HD13 LEU 642 HD13 LEU 642 -10.129 -16.813 8.764 1097 HD21 LEU 642 HD21 LEU 642 -9.876 -19.482 9.889 1098 HD22 LEU 642 HD22 LEU 642 -9.017 -19.205 11.399 1099 HD23 LEU 642 HD23 LEU 642 -8.429 -18.458 9.920 1100 H GLU 643 H GLU 643 -12.391 -15.591 12.796 1101 HA GLU 643 HA GLU 643 -11.841 -16.920 15.340 1102 HB2 GLU 643 HB2 GLU 643 -13.419 -14.923 15.173 1103 HB3 GLU 643 HB3 GLU 643 -14.473 -15.947 14.229 1104 HG2 GLU 643 HG2 GLU 643 -14.789 -17.441 16.084 1105 HG3 GLU 643 HG3 GLU 643 -13.625 -16.533 17.050 1106 H VAL 644 H VAL 644 -11.752 -19.084 15.202 1107 HA VAL 644 HA VAL 644 -13.216 -20.394 13.029 1108 HB VAL 644 HB VAL 644 -11.051 -21.545 14.802 1109 HG11 VAL 644 HG11 VAL 644 -10.953 -23.342 13.168 1110 HG12 VAL 644 HG12 VAL 644 -12.253 -22.590 12.241 1111 HG13 VAL 644 HG13 VAL 644 -12.568 -23.209 13.865 1112 HG21 VAL 644 HG21 VAL 644 -10.863 -20.476 11.992 1113 HG22 VAL 644 HG22 VAL 644 -9.574 -21.326 12.836 1114 HG23 VAL 644 HG23 VAL 644 -10.140 -19.760 13.427 1115 H ILE 645 H ILE 645 -15.111 -21.093 13.621 1116 HA ILE 645 HA ILE 645 -15.527 -22.037 16.359 1117 HB ILE 645 HB ILE 645 -17.518 -21.347 14.187 1118 HG12 ILE 645 HG12 ILE 645 -16.826 -19.794 16.676 1119 HG13 ILE 645 HG13 ILE 645 -16.140 -19.451 15.094 1120 HG21 ILE 645 HG21 ILE 645 -19.176 -21.448 15.998 1121 HG22 ILE 645 HG22 ILE 645 -17.907 -21.957 17.116 1122 HG23 ILE 645 HG23 ILE 645 -18.369 -23.004 15.775 1123 HD11 ILE 645 HD11 ILE 645 -17.981 -17.972 15.634 1124 HD12 ILE 645 HD12 ILE 645 -19.063 -19.377 15.766 1125 HD13 ILE 645 HD13 ILE 645 -18.285 -18.978 14.222 1126 H ILE 646 H ILE 646 -15.558 -24.066 16.738 1127 HA ILE 646 HA ILE 646 -15.621 -26.007 14.574 1128 HB ILE 646 HB ILE 646 -15.016 -26.371 17.531 1129 HG12 ILE 646 HG12 ILE 646 -13.032 -26.265 15.246 1130 HG13 ILE 646 HG13 ILE 646 -13.334 -24.924 16.346 1131 HG21 ILE 646 HG21 ILE 646 -14.093 -28.535 16.856 1132 HG22 ILE 646 HG22 ILE 646 -14.631 -28.234 15.204 1133 HG23 ILE 646 HG23 ILE 646 -15.816 -28.395 16.499 1134 HD11 ILE 646 HD11 ILE 646 -12.548 -26.261 18.215 1135 HD12 ILE 646 HD12 ILE 646 -11.319 -26.200 16.951 1136 HD13 ILE 646 HD13 ILE 646 -12.316 -27.642 17.150 1137 H GLU 647 H GLU 647 -17.594 -26.686 14.159 1138 HA GLU 647 HA GLU 647 -19.434 -27.164 16.414 1139 HB2 GLU 647 HB2 GLU 647 -20.121 -26.715 13.514 1140 HB3 GLU 647 HB3 GLU 647 -21.254 -26.948 14.828 1141 HG2 GLU 647 HG2 GLU 647 -20.558 -24.847 15.823 1142 HG3 GLU 647 HG3 GLU 647 -19.386 -24.620 14.522 1143 H GLU 648 H GLU 648 -20.672 -29.182 16.177 1144 HA GLU 648 HA GLU 648 -19.140 -31.117 14.788 1145 HB2 GLU 648 HB2 GLU 648 -20.666 -32.799 15.673 1146 HB3 GLU 648 HB3 GLU 648 -20.116 -31.752 16.954 1147 HG2 GLU 648 HG2 GLU 648 -22.398 -32.167 17.395 1148 HG3 GLU 648 HG3 GLU 648 -22.308 -30.537 16.724 1149 H SER 649 H SER 649 -19.792 -32.187 13.040 1150 HA SER 649 HA SER 649 -22.229 -31.172 11.833 1151 HB2 SER 649 HB2 SER 649 -19.522 -31.332 10.626 1152 HB3 SER 649 HB3 SER 649 -20.992 -31.064 9.630 1153 HG SER 649 HG SER 649 -20.854 -29.446 11.778 1154 H TYR 650 H TYR 650 -22.280 -33.445 13.185 1155 HA TYR 650 HA TYR 650 -21.944 -35.676 11.342 1156 HB2 TYR 650 HB2 TYR 650 -23.526 -35.574 13.919 1157 HB3 TYR 650 HB3 TYR 650 -23.023 -37.002 13.047 1158 HD1 TYR 650 HD2 TYR 650 -20.180 -36.692 12.690 1159 HD2 TYR 650 HD1 TYR 650 -22.622 -35.522 15.961 1160 HE1 TYR 650 HE2 TYR 650 -18.254 -36.876 14.209 1161 HE2 TYR 650 HE1 TYR 650 -20.710 -35.708 17.472 1162 HH TYR 650 HH TYR 650 -17.624 -35.814 16.395 1163 H GLU 651 H GLU 651 -24.394 -33.868 13.033 1164 HA GLU 651 HA GLU 651 -26.588 -35.080 11.673 1165 HB2 GLU 651 HB2 GLU 651 -26.432 -32.651 13.447 1166 HB3 GLU 651 HB3 GLU 651 -27.907 -33.470 12.955 1167 HG2 GLU 651 HG2 GLU 651 -25.707 -34.728 14.576 1168 HG3 GLU 651 HG3 GLU 651 -27.187 -34.033 15.239 1169 H PHE 652 H PHE 652 -25.074 -31.893 11.752 1170 HA PHE 652 HA PHE 652 -25.462 -29.973 10.626 1171 HB2 PHE 652 HB2 PHE 652 -23.638 -31.328 9.421 1172 HB3 PHE 652 HB3 PHE 652 -24.864 -31.660 8.200 1173 HD1 PHE 652 HD2 PHE 652 -22.930 -28.999 9.848 1174 HD2 PHE 652 HD1 PHE 652 -25.448 -30.016 6.576 1175 HE1 PHE 652 HE2 PHE 652 -22.402 -26.849 8.784 1176 HE2 PHE 652 HE1 PHE 652 -24.922 -27.866 5.504 1177 HZ PHE 652 HZ PHE 652 -23.401 -26.279 6.609 1178 H LYS 653 H LYS 653 -27.676 -29.794 11.072 1179 HA LYS 653 HA LYS 653 -29.391 -30.084 8.754 1180 HB2 LYS 653 HB2 LYS 653 -31.061 -31.378 10.092 1181 HB3 LYS 653 HB3 LYS 653 -29.584 -32.265 9.735 1182 HG2 LYS 653 HG2 LYS 653 -28.766 -31.667 12.011 1183 HG3 LYS 653 HG3 LYS 653 -30.353 -30.980 12.336 1184 HD2 LYS 653 HD2 LYS 653 -29.849 -33.848 11.549 1185 HD3 LYS 653 HD3 LYS 653 -30.059 -33.290 13.204 1186 HE2 LYS 653 HE2 LYS 653 -32.317 -32.441 12.544 1187 HE3 LYS 653 HE3 LYS 653 -32.077 -33.191 10.967 1188 HZ1 LYS 653 HZ1 LYS 653 -32.067 -34.630 13.561 1189 HZ2 LYS 653 HZ2 LYS 653 -31.905 -35.344 12.037 1190 HZ3 LYS 653 HZ3 LYS 653 -33.350 -34.606 12.475 1191 H SER 654 H SER 654 -31.355 -28.993 8.999 1192 HA SER 654 HA SER 654 -31.178 -26.701 10.743 1193 HB2 SER 654 HB2 SER 654 -31.747 -26.407 8.371 1194 HB3 SER 654 HB3 SER 654 -33.139 -27.464 8.556 1195 HG SER 654 HG SER 654 -34.137 -25.675 8.942 1196 H THR 655 H THR 655 -31.805 -27.228 12.819 1197 HA THR 655 HA THR 655 -34.523 -27.954 13.120 1198 HB THR 655 HB THR 655 -33.484 -30.186 12.864 1199 HG1 THR 655 HG1 THR 655 -35.259 -29.765 14.314 1200 HG21 THR 655 HG21 THR 655 -31.958 -31.071 14.579 1201 HG22 THR 655 HG22 THR 655 -31.935 -29.498 15.372 1202 HG23 THR 655 HG23 THR 655 -31.241 -29.677 13.763 1203 H VAL 656 H VAL 656 -35.310 -26.894 14.746 1204 HA VAL 656 HA VAL 656 -33.582 -26.236 17.021 1205 HB VAL 656 HB VAL 656 -34.980 -24.274 17.485 1206 HG11 VAL 656 HG11 VAL 656 -34.002 -24.247 14.642 1207 HG12 VAL 656 HG12 VAL 656 -33.054 -23.893 16.085 1208 HG13 VAL 656 HG13 VAL 656 -34.370 -22.821 15.611 1209 HG21 VAL 656 HG21 VAL 656 -36.502 -24.979 14.967 1210 HG22 VAL 656 HG22 VAL 656 -36.708 -23.496 15.894 1211 HG23 VAL 656 HG23 VAL 656 -37.115 -25.050 16.618 1212 H ASP 657 H ASP 657 -34.872 -26.166 19.090 1213 HA ASP 657 HA ASP 657 -36.481 -28.532 19.174 1214 HB2 ASP 657 HB2 ASP 657 -35.013 -27.950 21.072 1215 HB3 ASP 657 HB3 ASP 657 -35.988 -26.515 21.378 Start of MODEL 9 1 H HIS 501 H HIS 501 4.373 -0.333 -1.914 2 HA HIS 501 HA HIS 501 3.534 -0.281 0.657 3 HB2 HIS 501 HB2 HIS 501 2.196 1.730 -0.242 4 HB3 HIS 501 HB3 HIS 501 1.328 0.580 -1.244 5 HD1 HIS 501 HD1 HIS 501 1.157 2.209 1.988 6 HD2 HIS 501 HD2 HIS 501 -0.050 -1.437 0.407 7 HE1 HIS 501 HE1 HIS 501 -0.539 1.274 3.593 8 H ALA 502 H ALA 502 2.626 -2.327 1.030 9 HA ALA 502 HA ALA 502 2.756 -4.111 -1.259 10 HB1 ALA 502 HB1 ALA 502 2.443 -4.779 1.661 11 HB2 ALA 502 HB2 ALA 502 3.971 -4.692 0.774 12 HB3 ALA 502 HB3 ALA 502 2.777 -5.920 0.354 13 H GLY 503 H GLY 503 0.347 -3.244 1.239 14 HA2 GLY 503 HA2 GLY 503 -1.888 -2.998 0.145 15 HA3 GLY 503 HA3 GLY 503 -1.598 -4.625 -0.462 16 H ILE 504 H ILE 504 -3.062 -5.856 0.566 17 HA ILE 504 HA ILE 504 -3.258 -5.550 3.460 18 HB ILE 504 HB ILE 504 -5.445 -6.238 1.483 19 HG12 ILE 504 HG12 ILE 504 -6.564 -4.170 2.643 20 HG13 ILE 504 HG13 ILE 504 -4.915 -3.759 3.085 21 HG21 ILE 504 HG21 ILE 504 -5.626 -6.086 4.465 22 HG22 ILE 504 HG22 ILE 504 -5.712 -7.531 3.446 23 HG23 ILE 504 HG23 ILE 504 -6.978 -6.304 3.341 24 HD11 ILE 504 HD11 ILE 504 -4.297 -3.657 0.750 25 HD12 ILE 504 HD12 ILE 504 -5.666 -2.590 1.090 26 HD13 ILE 504 HD13 ILE 504 -5.929 -4.137 0.283 27 H PHE 505 H PHE 505 -2.210 -7.329 4.261 28 HA PHE 505 HA PHE 505 -2.951 -9.955 3.174 29 HB2 PHE 505 HB2 PHE 505 -0.767 -9.068 5.050 30 HB3 PHE 505 HB3 PHE 505 -1.398 -10.694 5.212 31 HD1 PHE 505 HD1 PHE 505 -1.589 -11.898 2.780 32 HD2 PHE 505 HD2 PHE 505 1.183 -8.875 3.885 33 HE1 PHE 505 HE1 PHE 505 -0.027 -12.713 1.068 34 HE2 PHE 505 HE2 PHE 505 2.744 -9.676 2.161 35 HZ PHE 505 HZ PHE 505 2.131 -11.604 0.749 36 H THR 506 H THR 506 -4.662 -10.935 4.067 37 HA THR 506 HA THR 506 -5.030 -10.951 6.864 38 HB THR 506 HB THR 506 -5.996 -8.676 6.322 39 HG1 THR 506 HG1 THR 506 -7.861 -9.041 7.568 40 HG21 THR 506 HG21 THR 506 -8.102 -10.308 4.870 41 HG22 THR 506 HG22 THR 506 -6.954 -9.215 4.100 42 HG23 THR 506 HG23 THR 506 -8.187 -8.575 5.189 43 H PHE 507 H PHE 507 -7.411 -11.883 7.201 44 HA PHE 507 HA PHE 507 -7.308 -14.381 5.750 45 HB2 PHE 507 HB2 PHE 507 -9.006 -13.423 8.041 46 HB3 PHE 507 HB3 PHE 507 -9.210 -14.997 7.281 47 HD1 PHE 507 HD2 PHE 507 -7.517 -16.669 7.473 48 HD2 PHE 507 HD1 PHE 507 -7.164 -12.958 9.487 49 HE1 PHE 507 HE2 PHE 507 -5.861 -17.661 8.932 50 HE2 PHE 507 HE1 PHE 507 -5.480 -13.912 10.989 51 HZ PHE 507 HZ PHE 507 -4.798 -16.259 10.729 52 H GLU 508 H GLU 508 -8.904 -15.177 4.387 53 HA GLU 508 HA GLU 508 -10.284 -13.315 2.824 54 HB2 GLU 508 HB2 GLU 508 -9.529 -15.607 2.139 55 HB3 GLU 508 HB3 GLU 508 -10.835 -16.270 3.108 56 HG2 GLU 508 HG2 GLU 508 -12.441 -15.034 1.726 57 HG3 GLU 508 HG3 GLU 508 -11.080 -14.458 0.757 58 H GLU 509 H GLU 509 -11.242 -15.263 5.560 59 HA GLU 509 HA GLU 509 -13.729 -13.771 5.663 60 HB2 GLU 509 HB2 GLU 509 -14.782 -15.822 6.681 61 HB3 GLU 509 HB3 GLU 509 -14.415 -15.983 4.983 62 HG2 GLU 509 HG2 GLU 509 -12.235 -17.118 5.819 63 HG3 GLU 509 HG3 GLU 509 -13.107 -17.243 7.348 64 HA PRO 510 HA PRO 510 -12.120 -12.834 9.656 65 HB2 PRO 510 HB2 PRO 510 -14.295 -11.773 10.822 66 HB3 PRO 510 HB3 PRO 510 -13.450 -10.952 9.503 67 HG2 PRO 510 HG2 PRO 510 -15.986 -12.534 9.437 68 HG3 PRO 510 HG3 PRO 510 -15.566 -11.051 8.563 69 HD2 PRO 510 HD2 PRO 510 -15.478 -13.606 7.476 70 HD3 PRO 510 HD3 PRO 510 -14.568 -12.205 6.868 71 H VAL 511 H VAL 511 -14.936 -14.866 9.369 72 HA VAL 511 HA VAL 511 -14.244 -16.210 11.866 73 HB VAL 511 HB VAL 511 -17.103 -15.539 11.072 74 HG11 VAL 511 HG11 VAL 511 -16.036 -16.856 13.551 75 HG12 VAL 511 HG12 VAL 511 -16.941 -17.618 12.253 76 HG13 VAL 511 HG13 VAL 511 -17.719 -16.405 13.274 77 HG21 VAL 511 HG21 VAL 511 -15.484 -14.306 13.312 78 HG22 VAL 511 HG22 VAL 511 -17.196 -14.025 13.000 79 HG23 VAL 511 HG23 VAL 511 -15.991 -13.495 11.831 80 H THR 512 H THR 512 -14.340 -18.387 11.579 81 HA THR 512 HA THR 512 -15.808 -19.313 9.258 82 HB THR 512 HB THR 512 -13.339 -19.084 8.768 83 HG1 THR 512 HG1 THR 512 -14.241 -20.302 7.490 84 HG21 THR 512 HG21 THR 512 -11.815 -20.819 9.620 85 HG22 THR 512 HG22 THR 512 -13.100 -21.417 10.670 86 HG23 THR 512 HG23 THR 512 -12.435 -19.806 10.928 87 H HIS 513 H HIS 513 -16.928 -21.151 9.636 88 HA HIS 513 HA HIS 513 -16.493 -22.369 12.237 89 HB2 HIS 513 HB2 HIS 513 -18.891 -23.173 12.166 90 HB3 HIS 513 HB3 HIS 513 -18.720 -21.435 12.285 91 HD1 HIS 513 HD1 HIS 513 -19.931 -20.054 10.503 92 HD2 HIS 513 HD2 HIS 513 -19.795 -24.115 9.612 93 HE1 HIS 513 HE1 HIS 513 -21.423 -20.386 8.516 94 H VAL 514 H VAL 514 -15.766 -24.269 12.312 95 HA VAL 514 HA VAL 514 -15.681 -25.769 9.811 96 HB VAL 514 HB VAL 514 -13.621 -26.825 10.580 97 HG11 VAL 514 HG11 VAL 514 -13.362 -24.789 9.319 98 HG12 VAL 514 HG12 VAL 514 -12.115 -24.849 10.573 99 HG13 VAL 514 HG13 VAL 514 -13.529 -23.825 10.783 100 HG21 VAL 514 HG21 VAL 514 -13.862 -25.081 13.045 101 HG22 VAL 514 HG22 VAL 514 -12.474 -26.089 12.640 102 HG23 VAL 514 HG23 VAL 514 -14.031 -26.836 12.996 103 H SER 515 H SER 515 -15.287 -28.179 10.334 104 HA SER 515 HA SER 515 -17.520 -29.049 11.927 105 HB2 SER 515 HB2 SER 515 -16.083 -31.045 10.495 106 HB3 SER 515 HB3 SER 515 -17.691 -30.429 10.182 107 HG SER 515 HG SER 515 -16.951 -28.965 8.806 108 H GLU 516 H GLU 516 -17.185 -30.928 13.317 109 HA GLU 516 HA GLU 516 -14.618 -31.075 14.611 110 HB2 GLU 516 HB2 GLU 516 -16.675 -31.282 15.952 111 HB3 GLU 516 HB3 GLU 516 -17.193 -32.665 15.028 112 HG2 GLU 516 HG2 GLU 516 -14.681 -32.733 16.692 113 HG3 GLU 516 HG3 GLU 516 -16.264 -33.031 17.395 114 H SER 517 H SER 517 -16.635 -33.353 12.762 115 HA SER 517 HA SER 517 -14.578 -35.318 12.492 116 HB2 SER 517 HB2 SER 517 -17.204 -35.066 11.028 117 HB3 SER 517 HB3 SER 517 -16.262 -36.531 11.296 118 HG SER 517 HG SER 517 -16.753 -35.458 13.707 119 H ILE 518 H ILE 518 -13.900 -32.675 11.296 120 HA ILE 518 HA ILE 518 -14.054 -33.191 8.415 121 HB ILE 518 HB ILE 518 -14.656 -30.946 9.144 122 HG12 ILE 518 HG12 ILE 518 -12.073 -30.997 7.597 123 HG13 ILE 518 HG13 ILE 518 -13.695 -31.163 6.930 124 HG21 ILE 518 HG21 ILE 518 -11.850 -30.714 10.227 125 HG22 ILE 518 HG22 ILE 518 -13.391 -30.720 11.125 126 HG23 ILE 518 HG23 ILE 518 -13.014 -29.393 10.044 127 HD11 ILE 518 HD11 ILE 518 -12.868 -28.938 6.542 128 HD12 ILE 518 HD12 ILE 518 -12.509 -28.779 8.265 129 HD13 ILE 518 HD13 ILE 518 -14.198 -28.891 7.733 130 H GLY 519 H GLY 519 -11.809 -33.335 11.032 131 HA2 GLY 519 HA2 GLY 519 -9.714 -34.289 10.982 132 HA3 GLY 519 HA3 GLY 519 -9.800 -34.278 9.223 133 H ILE 520 H ILE 520 -9.604 -32.222 8.176 134 HA ILE 520 HA ILE 520 -7.753 -30.470 9.633 135 HB ILE 520 HB ILE 520 -7.391 -31.468 6.800 136 HG12 ILE 520 HG12 ILE 520 -6.813 -33.255 8.407 137 HG13 ILE 520 HG13 ILE 520 -5.397 -32.682 7.539 138 HG21 ILE 520 HG21 ILE 520 -5.624 -29.670 8.432 139 HG22 ILE 520 HG22 ILE 520 -6.589 -29.222 7.025 140 HG23 ILE 520 HG23 ILE 520 -5.224 -30.323 6.842 141 HD11 ILE 520 HD11 ILE 520 -4.882 -33.078 9.864 142 HD12 ILE 520 HD12 ILE 520 -6.178 -31.996 10.361 143 HD13 ILE 520 HD13 ILE 520 -4.769 -31.350 9.514 144 H MET 521 H MET 521 -8.297 -28.433 9.337 145 HA MET 521 HA MET 521 -10.114 -27.798 7.130 146 HB2 MET 521 HB2 MET 521 -10.918 -25.918 8.429 147 HB3 MET 521 HB3 MET 521 -11.026 -27.380 9.386 148 HG2 MET 521 HG2 MET 521 -10.191 -25.872 10.983 149 HG3 MET 521 HG3 MET 521 -8.728 -26.540 10.312 150 HE1 MET 521 HE1 MET 521 -9.514 -23.621 11.789 151 HE2 MET 521 HE2 MET 521 -8.330 -22.555 11.027 152 HE3 MET 521 HE3 MET 521 -7.827 -24.122 11.649 153 H GLU 522 H GLU 522 -9.654 -26.077 5.783 154 HA GLU 522 HA GLU 522 -7.002 -24.853 6.072 155 HB2 GLU 522 HB2 GLU 522 -8.269 -26.114 3.690 156 HB3 GLU 522 HB3 GLU 522 -7.216 -24.730 3.450 157 HG2 GLU 522 HG2 GLU 522 -5.415 -25.842 4.483 158 HG3 GLU 522 HG3 GLU 522 -6.412 -27.244 4.901 159 H VAL 523 H VAL 523 -7.093 -22.792 6.317 160 HA VAL 523 HA VAL 523 -9.430 -21.250 5.394 161 HB VAL 523 HB VAL 523 -7.259 -20.536 7.391 162 HG11 VAL 523 HG11 VAL 523 -8.234 -18.574 6.186 163 HG12 VAL 523 HG12 VAL 523 -8.456 -18.600 7.918 164 HG13 VAL 523 HG13 VAL 523 -9.815 -19.023 6.865 165 HG21 VAL 523 HG21 VAL 523 -10.153 -21.221 7.837 166 HG22 VAL 523 HG22 VAL 523 -8.918 -20.904 9.073 167 HG23 VAL 523 HG23 VAL 523 -8.807 -22.329 8.056 168 H LYS 524 H LYS 524 -9.227 -19.816 3.750 169 HA LYS 524 HA LYS 524 -6.705 -19.533 2.350 170 HB2 LYS 524 HB2 LYS 524 -9.415 -18.275 1.808 171 HB3 LYS 524 HB3 LYS 524 -8.003 -18.179 0.770 172 HG2 LYS 524 HG2 LYS 524 -9.383 -20.729 1.497 173 HG3 LYS 524 HG3 LYS 524 -9.775 -19.759 0.080 174 HD2 LYS 524 HD2 LYS 524 -7.035 -20.012 -0.057 175 HD3 LYS 524 HD3 LYS 524 -7.571 -21.584 0.543 176 HE2 LYS 524 HE2 LYS 524 -8.659 -20.153 -1.827 177 HE3 LYS 524 HE3 LYS 524 -7.501 -21.488 -1.921 178 HZ1 LYS 524 HZ1 LYS 524 -9.758 -22.213 -2.330 179 HZ2 LYS 524 HZ2 LYS 524 -10.275 -21.631 -0.836 180 HZ3 LYS 524 HZ3 LYS 524 -9.181 -22.917 -0.921 181 H VAL 525 H VAL 525 -5.414 -17.777 2.346 182 HA VAL 525 HA VAL 525 -6.228 -15.468 3.965 183 HB VAL 525 HB VAL 525 -3.417 -16.454 3.351 184 HG11 VAL 525 HG11 VAL 525 -3.497 -14.017 3.656 185 HG12 VAL 525 HG12 VAL 525 -2.670 -14.806 5.005 186 HG13 VAL 525 HG13 VAL 525 -4.334 -14.250 5.194 187 HG21 VAL 525 HG21 VAL 525 -5.002 -16.570 5.907 188 HG22 VAL 525 HG22 VAL 525 -3.316 -17.050 5.715 189 HG23 VAL 525 HG23 VAL 525 -4.588 -17.933 4.870 190 H LEU 526 H LEU 526 -6.212 -13.502 3.052 191 HA LEU 526 HA LEU 526 -6.060 -13.325 0.188 192 HB2 LEU 526 HB2 LEU 526 -6.642 -11.264 2.313 193 HB3 LEU 526 HB3 LEU 526 -6.696 -10.940 0.594 194 HG LEU 526 HG LEU 526 -8.485 -12.924 2.020 195 HD11 LEU 526 HD11 LEU 526 -10.248 -11.265 1.674 196 HD12 LEU 526 HD12 LEU 526 -9.060 -10.132 1.030 197 HD13 LEU 526 HD13 LEU 526 -8.973 -10.641 2.717 198 HD21 LEU 526 HD21 LEU 526 -9.760 -12.871 -0.078 199 HD22 LEU 526 HD22 LEU 526 -8.132 -13.498 -0.305 200 HD23 LEU 526 HD23 LEU 526 -8.518 -11.848 -0.801 201 H ARG 527 H ARG 527 -4.402 -12.701 -0.933 202 HA ARG 527 HA ARG 527 -1.901 -12.012 0.303 203 HB2 ARG 527 HB2 ARG 527 -2.144 -13.538 -1.662 204 HB3 ARG 527 HB3 ARG 527 -2.691 -12.174 -2.613 205 HG2 ARG 527 HG2 ARG 527 -0.473 -11.094 -2.192 206 HG3 ARG 527 HG3 ARG 527 0.048 -12.602 -1.430 207 HD2 ARG 527 HD2 ARG 527 0.793 -12.640 -3.699 208 HD3 ARG 527 HD3 ARG 527 -0.544 -13.781 -3.558 209 HE ARG 527 HE ARG 527 -0.582 -11.161 -4.875 210 HH11 ARG 527 HH11 ARG 527 -2.273 -14.220 -4.227 211 HH12 ARG 527 HH12 ARG 527 -3.443 -13.993 -5.431 212 HH21 ARG 527 HH21 ARG 527 -2.182 -10.859 -6.541 213 HH22 ARG 527 HH22 ARG 527 -3.394 -12.020 -6.781 214 H THR 528 H THR 528 -0.699 -10.055 -0.280 215 HA THR 528 HA THR 528 -2.094 -7.684 -0.113 216 HB THR 528 HB THR 528 0.250 -6.901 -1.010 217 HG1 THR 528 HG1 THR 528 1.445 -8.559 -1.469 218 HG21 THR 528 HG21 THR 528 -0.187 -8.247 1.657 219 HG22 THR 528 HG22 THR 528 -0.584 -6.573 1.264 220 HG23 THR 528 HG23 THR 528 1.100 -7.099 1.292 221 H SER 529 H SER 529 -2.541 -6.110 -1.539 222 HA SER 529 HA SER 529 -3.419 -6.782 -4.073 223 HB2 SER 529 HB2 SER 529 -4.296 -4.930 -2.709 224 HB3 SER 529 HB3 SER 529 -2.775 -4.081 -2.860 225 HG SER 529 HG SER 529 -4.862 -4.279 -4.592 226 H GLY 530 H GLY 530 -0.358 -5.448 -2.934 227 HA2 GLY 530 HA2 GLY 530 0.705 -5.738 -5.654 228 HA3 GLY 530 HA3 GLY 530 1.121 -4.368 -4.624 229 H ALA 531 H ALA 531 1.316 -7.878 -4.909 230 HA ALA 531 HA ALA 531 3.277 -8.006 -2.786 231 HB1 ALA 531 HB1 ALA 531 2.271 -10.140 -4.684 232 HB2 ALA 531 HB2 ALA 531 1.669 -9.850 -3.051 233 HB3 ALA 531 HB3 ALA 531 3.321 -10.418 -3.295 234 H ARG 532 H ARG 532 5.291 -7.441 -3.202 235 HA ARG 532 HA ARG 532 6.284 -7.899 -5.907 236 HB2 ARG 532 HB2 ARG 532 6.973 -5.617 -4.052 237 HB3 ARG 532 HB3 ARG 532 7.695 -5.898 -5.627 238 HG2 ARG 532 HG2 ARG 532 4.799 -5.268 -5.084 239 HG3 ARG 532 HG3 ARG 532 5.979 -4.144 -5.743 240 HD2 ARG 532 HD2 ARG 532 6.258 -5.674 -7.691 241 HD3 ARG 532 HD3 ARG 532 5.004 -6.707 -7.011 242 HE ARG 532 HE ARG 532 4.359 -3.928 -7.513 243 HH11 ARG 532 HH11 ARG 532 3.853 -7.336 -8.362 244 HH12 ARG 532 HH12 ARG 532 2.702 -7.033 -9.567 245 HH21 ARG 532 HH21 ARG 532 2.735 -3.498 -9.182 246 HH22 ARG 532 HH22 ARG 532 2.058 -4.795 -10.046 247 H GLY 533 H GLY 533 7.319 -9.736 -5.635 248 HA2 GLY 533 HA2 GLY 533 9.544 -10.528 -5.311 249 HA3 GLY 533 HA3 GLY 533 9.592 -9.648 -3.790 250 H ASN 534 H ASN 534 9.733 -11.035 -2.223 251 HA ASN 534 HA ASN 534 7.916 -13.325 -2.125 252 HB2 ASN 534 HB2 ASN 534 10.081 -14.175 -2.887 253 HB3 ASN 534 HB3 ASN 534 10.898 -13.343 -1.578 254 HD21 ASN 534 HD21 ASN 534 7.864 -15.147 -1.185 255 HD22 ASN 534 HD22 ASN 534 8.555 -16.373 -0.211 256 H VAL 535 H VAL 535 6.885 -13.445 -0.196 257 HA VAL 535 HA VAL 535 7.933 -11.916 2.070 258 HB VAL 535 HB VAL 535 5.063 -11.981 1.092 259 HG11 VAL 535 HG11 VAL 535 5.151 -11.807 3.484 260 HG12 VAL 535 HG12 VAL 535 4.654 -10.252 2.808 261 HG13 VAL 535 HG13 VAL 535 6.307 -10.484 3.375 262 HG21 VAL 535 HG21 VAL 535 7.067 -9.746 1.010 263 HG22 VAL 535 HG22 VAL 535 5.360 -9.594 0.560 264 HG23 VAL 535 HG23 VAL 535 6.445 -10.648 -0.366 265 H ILE 536 H ILE 536 7.582 -12.894 4.027 266 HA ILE 536 HA ILE 536 6.114 -15.441 4.007 267 HB ILE 536 HB ILE 536 8.364 -14.565 5.843 268 HG12 ILE 536 HG12 ILE 536 9.204 -15.365 3.704 269 HG13 ILE 536 HG13 ILE 536 9.533 -16.564 4.949 270 HG21 ILE 536 HG21 ILE 536 8.126 -16.790 6.937 271 HG22 ILE 536 HG22 ILE 536 6.658 -17.037 5.975 272 HG23 ILE 536 HG23 ILE 536 6.721 -15.742 7.146 273 HD11 ILE 536 HD11 ILE 536 7.523 -17.801 4.167 274 HD12 ILE 536 HD12 ILE 536 8.818 -17.687 2.976 275 HD13 ILE 536 HD13 ILE 536 7.402 -16.665 2.822 276 H VAL 537 H VAL 537 4.379 -15.588 5.211 277 HA VAL 537 HA VAL 537 3.876 -13.427 7.103 278 HB VAL 537 HB VAL 537 1.775 -15.118 5.727 279 HG11 VAL 537 HG11 VAL 537 1.540 -12.550 7.283 280 HG12 VAL 537 HG12 VAL 537 1.024 -14.151 7.818 281 HG13 VAL 537 HG13 VAL 537 0.216 -13.371 6.456 282 HG21 VAL 537 HG21 VAL 537 2.721 -12.354 5.000 283 HG22 VAL 537 HG22 VAL 537 1.362 -13.202 4.248 284 HG23 VAL 537 HG23 VAL 537 3.010 -13.830 4.090 285 HA PRO 538 HA PRO 538 4.089 -17.072 9.806 286 HB2 PRO 538 HB2 PRO 538 4.477 -15.708 12.098 287 HB3 PRO 538 HB3 PRO 538 5.782 -16.038 10.955 288 HG2 PRO 538 HG2 PRO 538 4.236 -13.525 11.410 289 HG3 PRO 538 HG3 PRO 538 5.949 -13.726 11.007 290 HD2 PRO 538 HD2 PRO 538 3.986 -13.033 9.199 291 HD3 PRO 538 HD3 PRO 538 5.526 -13.794 8.769 292 H TYR 539 H TYR 539 2.720 -17.948 11.317 293 HA TYR 539 HA TYR 539 0.440 -16.395 12.270 294 HB2 TYR 539 HB2 TYR 539 -1.268 -17.919 11.392 295 HB3 TYR 539 HB3 TYR 539 -0.295 -17.219 10.102 296 HD1 TYR 539 HD2 TYR 539 -0.930 -20.331 12.000 297 HD2 TYR 539 HD1 TYR 539 0.963 -18.546 8.648 298 HE1 TYR 539 HE2 TYR 539 -0.475 -22.557 11.091 299 HE2 TYR 539 HE1 TYR 539 1.421 -20.766 7.722 300 HH TYR 539 HH TYR 539 0.028 -23.603 8.967 301 H LYS 540 H LYS 540 -0.954 -17.646 13.728 302 HA LYS 540 HA LYS 540 0.144 -20.046 14.916 303 HB2 LYS 540 HB2 LYS 540 0.394 -19.108 17.144 304 HB3 LYS 540 HB3 LYS 540 1.468 -18.273 16.027 305 HG2 LYS 540 HG2 LYS 540 0.023 -16.403 15.917 306 HG3 LYS 540 HG3 LYS 540 -1.239 -17.251 16.800 307 HD2 LYS 540 HD2 LYS 540 0.233 -17.327 18.767 308 HD3 LYS 540 HD3 LYS 540 1.443 -16.402 17.864 309 HE2 LYS 540 HE2 LYS 540 -1.369 -15.512 18.271 310 HE3 LYS 540 HE3 LYS 540 -0.065 -15.047 19.370 311 HZ1 LYS 540 HZ1 LYS 540 1.027 -13.927 17.553 312 HZ2 LYS 540 HZ2 LYS 540 -0.556 -13.356 17.567 313 HZ3 LYS 540 HZ3 LYS 540 -0.080 -14.483 16.437 314 H THR 541 H THR 541 -1.302 -20.976 16.410 315 HA THR 541 HA THR 541 -4.033 -20.168 16.114 316 HB THR 541 HB THR 541 -4.316 -22.224 17.649 317 HG1 THR 541 HG1 THR 541 -2.294 -22.609 18.370 318 HG21 THR 541 HG21 THR 541 -4.858 -22.262 15.284 319 HG22 THR 541 HG22 THR 541 -4.048 -23.767 15.726 320 HG23 THR 541 HG23 THR 541 -3.156 -22.487 14.890 321 H ILE 542 H ILE 542 -5.306 -19.404 17.729 322 HA ILE 542 HA ILE 542 -4.028 -18.635 20.261 323 HB ILE 542 HB ILE 542 -6.301 -17.423 18.716 324 HG12 ILE 542 HG12 ILE 542 -3.588 -16.232 19.289 325 HG13 ILE 542 HG13 ILE 542 -4.083 -16.937 17.752 326 HG21 ILE 542 HG21 ILE 542 -6.278 -15.612 20.419 327 HG22 ILE 542 HG22 ILE 542 -5.090 -16.540 21.341 328 HG23 ILE 542 HG23 ILE 542 -6.710 -17.186 21.089 329 HD11 ILE 542 HD11 ILE 542 -5.740 -15.261 17.449 330 HD12 ILE 542 HD12 ILE 542 -4.196 -14.467 17.819 331 HD13 ILE 542 HD13 ILE 542 -5.447 -14.604 19.058 332 H GLU 543 H GLU 543 -5.040 -19.427 22.031 333 HA GLU 543 HA GLU 543 -7.195 -21.284 21.676 334 HB2 GLU 543 HB2 GLU 543 -5.745 -20.339 24.146 335 HB3 GLU 543 HB3 GLU 543 -6.876 -21.684 24.067 336 HG2 GLU 543 HG2 GLU 543 -5.417 -22.921 22.649 337 HG3 GLU 543 HG3 GLU 543 -4.312 -21.552 22.509 338 H GLY 544 H GLY 544 -9.203 -21.085 22.647 339 HA2 GLY 544 HA2 GLY 544 -9.931 -18.492 23.779 340 HA3 GLY 544 HA3 GLY 544 -10.817 -19.067 22.360 341 H THR 545 H THR 545 -12.654 -20.064 22.846 342 HA THR 545 HA THR 545 -12.968 -21.271 25.410 343 HB THR 545 HB THR 545 -15.190 -22.050 24.372 344 HG1 THR 545 HG1 THR 545 -15.704 -20.748 22.489 345 HG21 THR 545 HG21 THR 545 -14.581 -19.102 24.353 346 HG22 THR 545 HG22 THR 545 -15.006 -20.050 25.779 347 HG23 THR 545 HG23 THR 545 -16.185 -19.823 24.483 348 H ALA 546 H ALA 546 -11.983 -22.132 22.264 349 HA ALA 546 HA ALA 546 -11.907 -24.964 22.888 350 HB1 ALA 546 HB1 ALA 546 -12.501 -24.336 20.596 351 HB2 ALA 546 HB2 ALA 546 -10.945 -25.167 20.592 352 HB3 ALA 546 HB3 ALA 546 -11.013 -23.410 20.446 353 H ARG 547 H ARG 547 -10.014 -25.972 23.464 354 HA ARG 547 HA ARG 547 -7.843 -24.133 24.116 355 HB2 ARG 547 HB2 ARG 547 -8.691 -26.686 25.351 356 HB3 ARG 547 HB3 ARG 547 -7.224 -25.855 25.819 357 HG2 ARG 547 HG2 ARG 547 -8.678 -23.829 26.286 358 HG3 ARG 547 HG3 ARG 547 -10.069 -24.875 26.016 359 HD2 ARG 547 HD2 ARG 547 -9.687 -24.773 28.329 360 HD3 ARG 547 HD3 ARG 547 -9.179 -26.371 27.748 361 HE ARG 547 HE ARG 547 -7.241 -24.219 28.125 362 HH11 ARG 547 HH11 ARG 547 -8.146 -27.587 28.615 363 HH12 ARG 547 HH12 ARG 547 -7.001 -27.896 29.833 364 HH21 ARG 547 HH21 ARG 547 -5.564 -24.658 29.750 365 HH22 ARG 547 HH22 ARG 547 -5.470 -26.190 30.475 366 H GLY 548 H GLY 548 -5.677 -24.764 23.974 367 HA2 GLY 548 HA2 GLY 548 -5.162 -26.484 21.696 368 HA3 GLY 548 HA3 GLY 548 -4.044 -25.352 22.446 369 H GLY 549 H GLY 549 -2.760 -27.394 22.042 370 HA2 GLY 549 HA2 GLY 549 -1.429 -28.874 23.228 371 HA3 GLY 549 HA3 GLY 549 -2.625 -28.906 24.526 372 H GLY 550 H GLY 550 -3.665 -29.218 21.230 373 HA2 GLY 550 HA2 GLY 550 -4.540 -30.997 20.067 374 HA3 GLY 550 HA3 GLY 550 -3.659 -32.051 21.162 375 H GLU 551 H GLU 551 -5.891 -29.588 22.206 376 HA GLU 551 HA GLU 551 -7.352 -31.692 23.590 377 HB2 GLU 551 HB2 GLU 551 -6.394 -29.774 24.898 378 HB3 GLU 551 HB3 GLU 551 -7.507 -28.692 24.102 379 HG2 GLU 551 HG2 GLU 551 -9.370 -29.675 25.131 380 HG3 GLU 551 HG3 GLU 551 -8.443 -31.085 25.639 381 H ASP 552 H ASP 552 -8.340 -28.580 22.172 382 HA ASP 552 HA ASP 552 -10.649 -30.002 21.026 383 HB2 ASP 552 HB2 ASP 552 -10.150 -27.036 21.362 384 HB3 ASP 552 HB3 ASP 552 -11.566 -27.720 20.576 385 H PHE 553 H PHE 553 -7.934 -27.954 20.319 386 HA PHE 553 HA PHE 553 -8.117 -28.833 17.551 387 HB2 PHE 553 HB2 PHE 553 -7.464 -26.643 16.727 388 HB3 PHE 553 HB3 PHE 553 -8.930 -26.476 17.679 389 HD1 PHE 553 HD1 PHE 553 -8.864 -25.337 19.852 390 HD2 PHE 553 HD2 PHE 553 -5.392 -25.658 17.422 391 HE1 PHE 553 HE1 PHE 553 -7.775 -23.561 21.162 392 HE2 PHE 553 HE2 PHE 553 -4.300 -23.902 18.732 393 HZ PHE 553 HZ PHE 553 -5.488 -22.843 20.595 394 H GLU 554 H GLU 554 -6.104 -28.853 16.502 395 HA GLU 554 HA GLU 554 -3.896 -29.344 18.301 396 HB2 GLU 554 HB2 GLU 554 -4.814 -30.520 16.001 397 HB3 GLU 554 HB3 GLU 554 -3.489 -29.532 15.401 398 HG2 GLU 554 HG2 GLU 554 -3.313 -31.521 17.621 399 HG3 GLU 554 HG3 GLU 554 -2.860 -31.865 15.967 400 H ASP 555 H ASP 555 -2.287 -27.941 18.540 401 HA ASP 555 HA ASP 555 -2.588 -25.219 17.743 402 HB2 ASP 555 HB2 ASP 555 -0.152 -26.542 18.937 403 HB3 ASP 555 HB3 ASP 555 -0.513 -24.827 18.915 404 H THR 556 H THR 556 -1.589 -24.130 16.142 405 HA THR 556 HA THR 556 0.651 -25.418 14.902 406 HB THR 556 HB THR 556 -1.218 -26.121 13.459 407 HG1 THR 556 HG1 THR 556 0.056 -25.847 11.827 408 HG21 THR 556 HG21 THR 556 -1.727 -23.170 13.114 409 HG22 THR 556 HG22 THR 556 -2.832 -24.358 13.829 410 HG23 THR 556 HG23 THR 556 -2.437 -24.429 12.114 411 H CYS 557 H CYS 557 2.076 -24.090 14.028 412 HA CYS 557 HA CYS 557 1.547 -21.290 13.865 413 HB2 CYS 557 HB2 CYS 557 3.728 -20.786 15.049 414 HB3 CYS 557 HB3 CYS 557 2.468 -21.405 16.100 415 HG CYS 557 HG CYS 557 4.152 -22.970 17.204 416 H GLY 558 H GLY 558 2.682 -20.447 12.095 417 HA2 GLY 558 HA2 GLY 558 4.698 -22.059 10.909 418 HA3 GLY 558 HA3 GLY 558 3.146 -22.136 10.088 419 H GLU 559 H GLU 559 4.530 -21.335 8.425 420 HA GLU 559 HA GLU 559 4.546 -18.424 8.374 421 HB2 GLU 559 HB2 GLU 559 6.806 -20.289 7.740 422 HB3 GLU 559 HB3 GLU 559 6.803 -18.585 7.282 423 HG2 GLU 559 HG2 GLU 559 6.769 -17.970 9.647 424 HG3 GLU 559 HG3 GLU 559 6.662 -19.664 10.080 425 H LEU 560 H LEU 560 3.295 -17.973 6.686 426 HA LEU 560 HA LEU 560 3.003 -19.870 4.506 427 HB2 LEU 560 HB2 LEU 560 1.636 -17.246 5.040 428 HB3 LEU 560 HB3 LEU 560 1.285 -18.301 3.689 429 HG LEU 560 HG LEU 560 0.819 -18.904 6.599 430 HD11 LEU 560 HD11 LEU 560 -1.532 -18.868 5.954 431 HD12 LEU 560 HD12 LEU 560 -1.072 -18.372 4.325 432 HD13 LEU 560 HD13 LEU 560 -0.750 -17.311 5.697 433 HD21 LEU 560 HD21 LEU 560 -0.314 -20.943 5.741 434 HD22 LEU 560 HD22 LEU 560 1.426 -20.937 5.482 435 HD23 LEU 560 HD23 LEU 560 0.347 -20.590 4.141 436 H GLU 561 H GLU 561 3.838 -19.572 2.535 437 HA GLU 561 HA GLU 561 5.549 -17.238 2.264 438 HB2 GLU 561 HB2 GLU 561 6.549 -19.515 2.091 439 HB3 GLU 561 HB3 GLU 561 5.585 -19.768 0.643 440 HG2 GLU 561 HG2 GLU 561 6.717 -17.698 -0.306 441 HG3 GLU 561 HG3 GLU 561 7.722 -17.747 1.092 442 H PHE 562 H PHE 562 4.889 -15.666 1.052 443 HA PHE 562 HA PHE 562 3.142 -16.248 -1.223 444 HB2 PHE 562 HB2 PHE 562 3.142 -13.845 0.612 445 HB3 PHE 562 HB3 PHE 562 2.335 -13.862 -0.949 446 HD1 PHE 562 HD1 PHE 562 2.292 -15.167 2.477 447 HD2 PHE 562 HD2 PHE 562 0.289 -15.076 -1.272 448 HE1 PHE 562 HE1 PHE 562 0.270 -16.085 3.534 449 HE2 PHE 562 HE2 PHE 562 -1.729 -15.989 -0.221 450 HZ PHE 562 HZ PHE 562 -1.742 -16.498 2.182 451 H GLN 563 H GLN 563 3.527 -14.962 -3.084 452 HA GLN 563 HA GLN 563 5.972 -13.431 -3.159 453 HB2 GLN 563 HB2 GLN 563 5.559 -15.791 -5.034 454 HB3 GLN 563 HB3 GLN 563 6.923 -14.687 -4.989 455 HG2 GLN 563 HG2 GLN 563 7.511 -15.528 -2.767 456 HG3 GLN 563 HG3 GLN 563 6.195 -16.691 -2.860 457 HE21 GLN 563 HE21 GLN 563 8.332 -15.809 -5.510 458 HE22 GLN 563 HE22 GLN 563 9.122 -17.342 -5.538 459 H ASN 564 H ASN 564 6.165 -12.740 -5.600 460 HA ASN 564 HA ASN 564 3.709 -11.481 -6.266 461 HB2 ASN 564 HB2 ASN 564 4.904 -10.628 -8.293 462 HB3 ASN 564 HB3 ASN 564 5.791 -10.344 -6.807 463 HD21 ASN 564 HD21 ASN 564 5.744 -12.021 -9.849 464 HD22 ASN 564 HD22 ASN 564 7.355 -12.620 -9.749 465 H ASP 565 H ASP 565 5.210 -14.430 -7.204 466 HA ASP 565 HA ASP 565 3.352 -14.874 -9.394 467 HB2 ASP 565 HB2 ASP 565 5.654 -15.636 -9.644 468 HB3 ASP 565 HB3 ASP 565 5.475 -16.667 -8.231 469 H GLU 566 H GLU 566 3.774 -15.903 -6.072 470 HA GLU 566 HA GLU 566 2.051 -18.119 -6.143 471 HB2 GLU 566 HB2 GLU 566 3.052 -16.383 -3.914 472 HB3 GLU 566 HB3 GLU 566 2.058 -17.803 -3.658 473 HG2 GLU 566 HG2 GLU 566 4.790 -17.745 -4.924 474 HG3 GLU 566 HG3 GLU 566 4.402 -18.318 -3.302 475 H ILE 567 H ILE 567 -0.012 -18.310 -5.166 476 HA ILE 567 HA ILE 567 -1.560 -15.891 -5.566 477 HB ILE 567 HB ILE 567 -3.543 -17.566 -5.760 478 HG12 ILE 567 HG12 ILE 567 -1.294 -19.374 -6.667 479 HG13 ILE 567 HG13 ILE 567 -2.054 -19.571 -5.104 480 HG21 ILE 567 HG21 ILE 567 -1.480 -17.250 -7.933 481 HG22 ILE 567 HG22 ILE 567 -2.773 -16.117 -7.541 482 HG23 ILE 567 HG23 ILE 567 -3.164 -17.716 -8.176 483 HD11 ILE 567 HD11 ILE 567 -3.416 -19.782 -7.775 484 HD12 ILE 567 HD12 ILE 567 -4.168 -19.982 -6.178 485 HD13 ILE 567 HD13 ILE 567 -2.937 -21.121 -6.719 486 H VAL 568 H VAL 568 -2.585 -18.789 -3.776 487 HA VAL 568 HA VAL 568 -2.883 -17.093 -1.431 488 HB VAL 568 HB VAL 568 -5.075 -17.219 -2.598 489 HG11 VAL 568 HG11 VAL 568 -6.332 -19.304 -2.646 490 HG12 VAL 568 HG12 VAL 568 -4.887 -20.177 -2.151 491 HG13 VAL 568 HG13 VAL 568 -4.923 -19.340 -3.714 492 HG21 VAL 568 HG21 VAL 568 -6.441 -17.990 -0.714 493 HG22 VAL 568 HG22 VAL 568 -5.091 -16.980 -0.191 494 HG23 VAL 568 HG23 VAL 568 -5.010 -18.729 0.003 495 H LYS 569 H LYS 569 -2.761 -18.193 0.532 496 HA LYS 569 HA LYS 569 -1.971 -21.003 0.394 497 HB2 LYS 569 HB2 LYS 569 -0.896 -18.806 2.148 498 HB3 LYS 569 HB3 LYS 569 -0.706 -20.509 2.528 499 HG2 LYS 569 HG2 LYS 569 0.166 -20.086 -0.152 500 HG3 LYS 569 HG3 LYS 569 0.903 -18.862 0.877 501 HD2 LYS 569 HD2 LYS 569 2.337 -20.861 0.769 502 HD3 LYS 569 HD3 LYS 569 1.729 -20.596 2.396 503 HE2 LYS 569 HE2 LYS 569 0.055 -22.312 2.115 504 HE3 LYS 569 HE3 LYS 569 0.487 -22.524 0.425 505 HZ1 LYS 569 HZ1 LYS 569 1.410 -24.253 1.797 506 HZ2 LYS 569 HZ2 LYS 569 2.210 -23.131 2.769 507 HZ3 LYS 569 HZ3 LYS 569 2.657 -23.330 1.154 508 H THR 570 H THR 570 -2.453 -22.199 2.358 509 HA THR 570 HA THR 570 -4.753 -21.137 3.810 510 HB THR 570 HB THR 570 -5.346 -23.657 3.952 511 HG1 THR 570 HG1 THR 570 -4.563 -24.920 2.335 512 HG21 THR 570 HG21 THR 570 -6.604 -23.582 1.891 513 HG22 THR 570 HG22 THR 570 -5.657 -22.196 1.326 514 HG23 THR 570 HG23 THR 570 -6.723 -22.035 2.728 515 H ILE 571 H ILE 571 -4.927 -21.800 5.931 516 HA ILE 571 HA ILE 571 -2.539 -23.026 7.103 517 HB ILE 571 HB ILE 571 -4.891 -21.652 8.488 518 HG12 ILE 571 HG12 ILE 571 -3.013 -20.124 9.359 519 HG13 ILE 571 HG13 ILE 571 -2.042 -20.834 8.072 520 HG21 ILE 571 HG21 ILE 571 -3.702 -21.969 10.590 521 HG22 ILE 571 HG22 ILE 571 -2.419 -22.822 9.737 522 HG23 ILE 571 HG23 ILE 571 -4.033 -23.520 9.809 523 HD11 ILE 571 HD11 ILE 571 -4.598 -19.305 7.683 524 HD12 ILE 571 HD12 ILE 571 -3.555 -19.962 6.414 525 HD13 ILE 571 HD13 ILE 571 -2.967 -18.672 7.467 526 H SER 572 H SER 572 -2.649 -25.116 7.542 527 HA SER 572 HA SER 572 -5.286 -26.391 7.511 528 HB2 SER 572 HB2 SER 572 -3.887 -28.497 7.189 529 HB3 SER 572 HB3 SER 572 -3.859 -27.346 5.854 530 HG SER 572 HG SER 572 -1.933 -27.078 7.836 531 H VAL 573 H VAL 573 -6.151 -26.784 9.374 532 HA VAL 573 HA VAL 573 -4.414 -27.292 11.715 533 HB VAL 573 HB VAL 573 -7.125 -25.948 11.643 534 HG11 VAL 573 HG11 VAL 573 -6.877 -27.238 13.686 535 HG12 VAL 573 HG12 VAL 573 -6.857 -25.508 14.010 536 HG13 VAL 573 HG13 VAL 573 -5.343 -26.420 14.038 537 HG21 VAL 573 HG21 VAL 573 -5.445 -24.468 10.837 538 HG22 VAL 573 HG22 VAL 573 -4.393 -24.849 12.200 539 HG23 VAL 573 HG23 VAL 573 -5.887 -23.955 12.469 540 H LYS 574 H LYS 574 -4.769 -29.126 12.809 541 HA LYS 574 HA LYS 574 -6.862 -30.895 11.970 542 HB2 LYS 574 HB2 LYS 574 -4.755 -31.948 12.334 543 HB3 LYS 574 HB3 LYS 574 -4.523 -31.136 13.867 544 HG2 LYS 574 HG2 LYS 574 -5.000 -33.513 14.163 545 HG3 LYS 574 HG3 LYS 574 -6.251 -32.507 14.882 546 HD2 LYS 574 HD2 LYS 574 -7.647 -32.893 12.864 547 HD3 LYS 574 HD3 LYS 574 -6.407 -33.996 12.258 548 HE2 LYS 574 HE2 LYS 574 -6.700 -35.447 14.148 549 HE3 LYS 574 HE3 LYS 574 -7.783 -34.295 14.916 550 HZ1 LYS 574 HZ1 LYS 574 -8.350 -35.813 12.420 551 HZ2 LYS 574 HZ2 LYS 574 -9.374 -34.657 13.124 552 HZ3 LYS 574 HZ3 LYS 574 -9.031 -36.070 13.944 553 H VAL 575 H VAL 575 -8.756 -30.823 12.796 554 HA VAL 575 HA VAL 575 -9.248 -29.566 15.366 555 HB VAL 575 HB VAL 575 -11.200 -30.942 13.472 556 HG11 VAL 575 HG11 VAL 575 -11.711 -29.082 15.799 557 HG12 VAL 575 HG12 VAL 575 -12.035 -30.812 15.763 558 HG13 VAL 575 HG13 VAL 575 -12.933 -29.721 14.710 559 HG21 VAL 575 HG21 VAL 575 -11.859 -28.685 12.755 560 HG22 VAL 575 HG22 VAL 575 -10.169 -29.020 12.378 561 HG23 VAL 575 HG23 VAL 575 -10.579 -28.000 13.757 562 H ILE 576 H ILE 576 -9.232 -30.740 17.171 563 HA ILE 576 HA ILE 576 -8.573 -33.507 16.998 564 HB ILE 576 HB ILE 576 -9.226 -31.814 19.412 565 HG12 ILE 576 HG12 ILE 576 -7.312 -30.925 18.199 566 HG13 ILE 576 HG13 ILE 576 -6.800 -31.626 19.729 567 HG21 ILE 576 HG21 ILE 576 -7.839 -34.489 19.272 568 HG22 ILE 576 HG22 ILE 576 -9.428 -34.167 19.989 569 HG23 ILE 576 HG23 ILE 576 -7.963 -33.473 20.705 570 HD11 ILE 576 HD11 ILE 576 -6.533 -32.911 17.012 571 HD12 ILE 576 HD12 ILE 576 -6.022 -33.622 18.542 572 HD13 ILE 576 HD13 ILE 576 -5.242 -32.158 17.949 573 H ASP 577 H ASP 577 -9.692 -35.129 17.255 574 HA ASP 577 HA ASP 577 -12.556 -34.989 16.934 575 HB2 ASP 577 HB2 ASP 577 -10.838 -37.457 17.348 576 HB3 ASP 577 HB3 ASP 577 -12.490 -37.405 16.771 577 H ASP 578 H ASP 578 -14.020 -35.935 18.346 578 HA ASP 578 HA ASP 578 -13.893 -35.175 20.968 579 HB2 ASP 578 HB2 ASP 578 -15.856 -36.515 21.457 580 HB3 ASP 578 HB3 ASP 578 -16.000 -35.785 19.870 581 H GLU 579 H GLU 579 -12.954 -35.678 22.659 582 HA GLU 579 HA GLU 579 -11.844 -38.380 23.185 583 HB2 GLU 579 HB2 GLU 579 -10.561 -35.684 23.645 584 HB3 GLU 579 HB3 GLU 579 -9.973 -37.172 24.357 585 HG2 GLU 579 HG2 GLU 579 -10.194 -36.689 21.408 586 HG3 GLU 579 HG3 GLU 579 -8.738 -36.380 22.351 587 H GLU 580 H GLU 580 -12.543 -35.207 24.586 588 HA GLU 580 HA GLU 580 -12.991 -36.432 27.227 589 HB2 GLU 580 HB2 GLU 580 -12.384 -33.600 26.371 590 HB3 GLU 580 HB3 GLU 580 -12.760 -34.066 28.022 591 HG2 GLU 580 HG2 GLU 580 -10.472 -35.240 26.483 592 HG3 GLU 580 HG3 GLU 580 -10.323 -33.767 27.441 593 H TYR 581 H TYR 581 -14.081 -33.572 25.563 594 HA TYR 581 HA TYR 581 -16.673 -34.124 25.117 595 HB2 TYR 581 HB2 TYR 581 -17.887 -32.764 26.870 596 HB3 TYR 581 HB3 TYR 581 -17.241 -34.277 27.462 597 HD1 TYR 581 HD1 TYR 581 -15.223 -34.205 28.990 598 HD2 TYR 581 HD2 TYR 581 -17.295 -30.678 27.829 599 HE1 TYR 581 HE1 TYR 581 -14.264 -33.013 30.907 600 HE2 TYR 581 HE2 TYR 581 -16.320 -29.474 29.728 601 HH TYR 581 HH TYR 581 -13.753 -30.595 31.519 602 H GLU 582 H GLU 582 -15.726 -33.229 23.417 603 HA GLU 582 HA GLU 582 -15.023 -30.474 23.487 604 HB2 GLU 582 HB2 GLU 582 -15.183 -32.538 21.273 605 HB3 GLU 582 HB3 GLU 582 -14.732 -30.863 20.983 606 HG2 GLU 582 HG2 GLU 582 -12.770 -32.399 21.150 607 HG3 GLU 582 HG3 GLU 582 -12.735 -31.092 22.324 608 H LYS 583 H LYS 583 -16.184 -28.878 22.236 609 HA LYS 583 HA LYS 583 -19.018 -29.465 21.890 610 HB2 LYS 583 HB2 LYS 583 -18.591 -29.008 24.340 611 HB3 LYS 583 HB3 LYS 583 -17.991 -27.425 23.896 612 HG2 LYS 583 HG2 LYS 583 -20.240 -26.865 23.009 613 HG3 LYS 583 HG3 LYS 583 -20.823 -28.434 23.565 614 HD2 LYS 583 HD2 LYS 583 -19.623 -26.290 25.330 615 HD3 LYS 583 HD3 LYS 583 -21.344 -26.583 25.130 616 HE2 LYS 583 HE2 LYS 583 -19.353 -28.584 26.234 617 HE3 LYS 583 HE3 LYS 583 -20.416 -27.581 27.205 618 HZ1 LYS 583 HZ1 LYS 583 -22.318 -28.672 26.170 619 HZ2 LYS 583 HZ2 LYS 583 -21.331 -29.775 26.943 620 HZ3 LYS 583 HZ3 LYS 583 -21.294 -29.667 25.271 621 H ASN 584 H ASN 584 -20.063 -27.229 21.238 622 HA ASN 584 HA ASN 584 -18.631 -26.013 19.154 623 HB2 ASN 584 HB2 ASN 584 -21.122 -25.994 19.320 624 HB3 ASN 584 HB3 ASN 584 -21.003 -24.958 20.730 625 HD21 ASN 584 HD21 ASN 584 -22.355 -24.576 18.197 626 HD22 ASN 584 HD22 ASN 584 -21.751 -23.099 17.536 627 H LYS 585 H LYS 585 -16.762 -25.237 19.691 628 HA LYS 585 HA LYS 585 -16.563 -23.057 21.640 629 HB2 LYS 585 HB2 LYS 585 -14.516 -25.216 21.094 630 HB3 LYS 585 HB3 LYS 585 -14.342 -23.886 22.222 631 HG2 LYS 585 HG2 LYS 585 -16.038 -24.842 23.658 632 HG3 LYS 585 HG3 LYS 585 -16.332 -26.140 22.490 633 HD2 LYS 585 HD2 LYS 585 -13.954 -26.794 22.712 634 HD3 LYS 585 HD3 LYS 585 -13.779 -25.567 23.959 635 HE2 LYS 585 HE2 LYS 585 -15.372 -26.751 25.370 636 HE3 LYS 585 HE3 LYS 585 -15.645 -27.940 24.092 637 HZ1 LYS 585 HZ1 LYS 585 -13.251 -28.456 24.211 638 HZ2 LYS 585 HZ2 LYS 585 -14.024 -28.854 25.657 639 HZ3 LYS 585 HZ3 LYS 585 -13.099 -27.455 25.534 640 H THR 586 H THR 586 -14.499 -21.799 21.048 641 HA THR 586 HA THR 586 -13.823 -22.082 18.265 642 HB THR 586 HB THR 586 -15.697 -20.579 18.134 643 HG1 THR 586 HG1 THR 586 -13.665 -20.053 17.019 644 HG21 THR 586 HG21 THR 586 -15.784 -19.854 20.433 645 HG22 THR 586 HG22 THR 586 -15.820 -18.474 19.332 646 HG23 THR 586 HG23 THR 586 -14.330 -18.874 20.208 647 H PHE 587 H PHE 587 -11.901 -21.160 17.692 648 HA PHE 587 HA PHE 587 -10.303 -19.972 19.795 649 HB2 PHE 587 HB2 PHE 587 -8.344 -21.234 19.061 650 HB3 PHE 587 HB3 PHE 587 -9.594 -22.355 19.553 651 HD1 PHE 587 HD1 PHE 587 -10.871 -23.585 17.732 652 HD2 PHE 587 HD2 PHE 587 -7.393 -21.266 16.958 653 HE1 PHE 587 HE1 PHE 587 -10.529 -24.793 15.602 654 HE2 PHE 587 HE2 PHE 587 -7.056 -22.462 14.835 655 HZ PHE 587 HZ PHE 587 -8.628 -24.229 14.163 656 H PHE 588 H PHE 588 -8.251 -19.029 18.506 657 HA PHE 588 HA PHE 588 -9.465 -17.720 16.193 658 HB2 PHE 588 HB2 PHE 588 -7.814 -16.364 18.364 659 HB3 PHE 588 HB3 PHE 588 -8.315 -15.610 16.859 660 HD1 PHE 588 HD1 PHE 588 -9.487 -17.019 20.050 661 HD2 PHE 588 HD2 PHE 588 -10.486 -14.725 16.615 662 HE1 PHE 588 HE1 PHE 588 -11.598 -16.338 21.131 663 HE2 PHE 588 HE2 PHE 588 -12.598 -14.044 17.680 664 HZ PHE 588 HZ PHE 588 -13.154 -14.848 19.939 665 H LEU 589 H LEU 589 -8.026 -16.981 14.654 666 HA LEU 589 HA LEU 589 -5.366 -18.240 14.751 667 HB2 LEU 589 HB2 LEU 589 -7.377 -18.947 13.024 668 HB3 LEU 589 HB3 LEU 589 -6.626 -17.644 12.132 669 HG LEU 589 HG LEU 589 -5.777 -19.738 11.338 670 HD11 LEU 589 HD11 LEU 589 -3.371 -19.516 11.709 671 HD12 LEU 589 HD12 LEU 589 -3.695 -18.323 12.970 672 HD13 LEU 589 HD13 LEU 589 -4.152 -17.994 11.295 673 HD21 LEU 589 HD21 LEU 589 -6.226 -21.134 13.225 674 HD22 LEU 589 HD22 LEU 589 -5.024 -20.283 14.187 675 HD23 LEU 589 HD23 LEU 589 -4.513 -21.259 12.804 676 H GLU 590 H GLU 590 -3.786 -16.769 14.504 677 HA GLU 590 HA GLU 590 -4.547 -14.148 13.441 678 HB2 GLU 590 HB2 GLU 590 -4.440 -14.113 15.887 679 HB3 GLU 590 HB3 GLU 590 -2.776 -14.681 15.828 680 HG2 GLU 590 HG2 GLU 590 -2.173 -12.600 14.641 681 HG3 GLU 590 HG3 GLU 590 -3.839 -12.050 14.818 682 H ILE 591 H ILE 591 -3.145 -13.315 12.067 683 HA ILE 591 HA ILE 591 -0.664 -14.766 11.607 684 HB ILE 591 HB ILE 591 -0.629 -13.579 9.375 685 HG12 ILE 591 HG12 ILE 591 -3.471 -12.917 10.120 686 HG13 ILE 591 HG13 ILE 591 -2.171 -11.750 9.895 687 HG21 ILE 591 HG21 ILE 591 -2.409 -15.035 8.353 688 HG22 ILE 591 HG22 ILE 591 -2.818 -15.538 10.009 689 HG23 ILE 591 HG23 ILE 591 -1.210 -15.827 9.357 690 HD11 ILE 591 HD11 ILE 591 -3.398 -13.514 7.787 691 HD12 ILE 591 HD12 ILE 591 -2.066 -12.383 7.514 692 HD13 ILE 591 HD13 ILE 591 -3.659 -11.786 7.999 693 H GLY 592 H GLY 592 1.228 -13.680 11.521 694 HA2 GLY 592 HA2 GLY 592 1.245 -11.245 13.114 695 HA3 GLY 592 HA3 GLY 592 2.635 -12.250 12.716 696 H GLU 593 H GLU 593 3.324 -9.859 12.374 697 HA GLU 593 HA GLU 593 2.418 -8.683 9.987 698 HB2 GLU 593 HB2 GLU 593 4.899 -8.117 11.613 699 HB3 GLU 593 HB3 GLU 593 4.404 -7.174 10.218 700 HG2 GLU 593 HG2 GLU 593 2.288 -6.663 11.351 701 HG3 GLU 593 HG3 GLU 593 2.864 -7.520 12.778 702 HA PRO 594 HA PRO 594 4.522 -11.177 7.085 703 HB2 PRO 594 HB2 PRO 594 4.333 -9.434 4.972 704 HB3 PRO 594 HB3 PRO 594 3.025 -10.499 5.467 705 HG2 PRO 594 HG2 PRO 594 3.446 -7.611 5.996 706 HG3 PRO 594 HG3 PRO 594 1.918 -8.449 5.747 707 HD2 PRO 594 HD2 PRO 594 2.827 -7.639 8.150 708 HD3 PRO 594 HD3 PRO 594 1.766 -9.038 7.968 709 H ARG 595 H ARG 595 6.573 -11.405 6.452 710 HA ARG 595 HA ARG 595 8.322 -9.061 6.710 711 HB2 ARG 595 HB2 ARG 595 10.131 -10.648 7.287 712 HB3 ARG 595 HB3 ARG 595 8.813 -10.663 8.447 713 HG2 ARG 595 HG2 ARG 595 7.943 -12.700 7.375 714 HG3 ARG 595 HG3 ARG 595 9.322 -12.674 6.275 715 HD2 ARG 595 HD2 ARG 595 9.668 -14.217 8.110 716 HD3 ARG 595 HD3 ARG 595 10.841 -12.897 8.168 717 HE ARG 595 HE ARG 595 8.956 -11.991 9.804 718 HH11 ARG 595 HH11 ARG 595 10.378 -15.233 9.618 719 HH12 ARG 595 HH12 ARG 595 10.276 -15.526 11.274 720 HH21 ARG 595 HH21 ARG 595 8.825 -12.368 12.063 721 HH22 ARG 595 HH22 ARG 595 9.373 -13.855 12.715 722 H LEU 596 H LEU 596 9.580 -8.508 5.045 723 HA LEU 596 HA LEU 596 9.169 -9.737 2.521 724 HB2 LEU 596 HB2 LEU 596 9.623 -7.241 3.205 725 HB3 LEU 596 HB3 LEU 596 11.296 -7.732 3.224 726 HG LEU 596 HG LEU 596 10.620 -6.553 1.148 727 HD11 LEU 596 HD11 LEU 596 12.529 -8.045 1.058 728 HD12 LEU 596 HD12 LEU 596 11.630 -8.073 -0.455 729 HD13 LEU 596 HD13 LEU 596 11.466 -9.402 0.695 730 HD21 LEU 596 HD21 LEU 596 9.159 -7.603 -0.445 731 HD22 LEU 596 HD22 LEU 596 8.337 -7.466 1.134 732 HD23 LEU 596 HD23 LEU 596 9.000 -9.006 0.615 733 H VAL 597 H VAL 597 10.467 -11.263 1.653 734 HA VAL 597 HA VAL 597 12.675 -12.204 3.273 735 HB VAL 597 HB VAL 597 11.689 -13.310 0.621 736 HG11 VAL 597 HG11 VAL 597 12.861 -15.353 1.295 737 HG12 VAL 597 HG12 VAL 597 13.430 -14.548 2.757 738 HG13 VAL 597 HG13 VAL 597 13.974 -13.989 1.173 739 HG21 VAL 597 HG21 VAL 597 9.915 -13.375 2.284 740 HG22 VAL 597 HG22 VAL 597 11.006 -14.163 3.427 741 HG23 VAL 597 HG23 VAL 597 10.521 -15.000 1.951 742 H GLU 598 H GLU 598 14.063 -10.615 3.130 743 HA GLU 598 HA GLU 598 14.929 -9.619 0.559 744 HB2 GLU 598 HB2 GLU 598 14.400 -7.992 2.279 745 HB3 GLU 598 HB3 GLU 598 15.499 -8.765 3.401 746 HG2 GLU 598 HG2 GLU 598 16.363 -6.674 2.484 747 HG3 GLU 598 HG3 GLU 598 17.388 -8.060 2.117 748 H MET 599 H MET 599 16.937 -9.819 -0.185 749 HA MET 599 HA MET 599 18.446 -12.151 0.740 750 HB2 MET 599 HB2 MET 599 18.961 -10.396 -1.669 751 HB3 MET 599 HB3 MET 599 19.585 -12.014 -1.391 752 HG2 MET 599 HG2 MET 599 16.713 -11.274 -1.876 753 HG3 MET 599 HG3 MET 599 17.791 -11.990 -3.064 754 HE1 MET 599 HE1 MET 599 19.345 -14.185 -1.419 755 HE2 MET 599 HE2 MET 599 18.617 -14.470 -3.000 756 HE3 MET 599 HE3 MET 599 18.304 -15.585 -1.675 757 H SER 600 H SER 600 18.618 -8.724 0.274 758 HA SER 600 HA SER 600 21.314 -8.492 1.389 759 HB2 SER 600 HB2 SER 600 20.663 -7.261 -0.708 760 HB3 SER 600 HB3 SER 600 19.393 -6.448 0.195 761 HG SER 600 HG SER 600 22.173 -6.290 0.699 762 H GLU 601 H GLU 601 19.399 -9.511 3.111 763 HA GLU 601 HA GLU 601 17.773 -7.695 4.460 764 HB2 GLU 601 HB2 GLU 601 17.571 -9.394 6.237 765 HB3 GLU 601 HB3 GLU 601 17.323 -10.058 4.634 766 HG2 GLU 601 HG2 GLU 601 19.522 -11.055 4.661 767 HG3 GLU 601 HG3 GLU 601 19.886 -10.280 6.203 768 H LYS 602 H LYS 602 18.190 -6.107 5.726 769 HA LYS 602 HA LYS 602 20.726 -6.107 7.157 770 HB2 LYS 602 HB2 LYS 602 18.922 -3.819 6.354 771 HB3 LYS 602 HB3 LYS 602 20.381 -3.648 7.325 772 HG2 LYS 602 HG2 LYS 602 21.732 -4.433 5.483 773 HG3 LYS 602 HG3 LYS 602 20.289 -4.714 4.512 774 HD2 LYS 602 HD2 LYS 602 19.771 -2.309 4.643 775 HD3 LYS 602 HD3 LYS 602 21.253 -2.058 5.560 776 HE2 LYS 602 HE2 LYS 602 21.562 -1.516 3.190 777 HE3 LYS 602 HE3 LYS 602 22.579 -2.862 3.693 778 HZ1 LYS 602 HZ1 LYS 602 19.995 -3.130 2.238 779 HZ2 LYS 602 HZ2 LYS 602 21.060 -4.400 2.629 780 HZ3 LYS 602 HZ3 LYS 602 21.520 -3.215 1.547 781 H LYS 603 H LYS 603 20.635 -6.381 9.205 782 HA LYS 603 HA LYS 603 18.341 -7.140 10.625 783 HB2 LYS 603 HB2 LYS 603 20.920 -6.052 11.747 784 HB3 LYS 603 HB3 LYS 603 19.733 -6.996 12.610 785 HG2 LYS 603 HG2 LYS 603 21.386 -8.003 10.301 786 HG3 LYS 603 HG3 LYS 603 21.794 -8.226 11.994 787 HD2 LYS 603 HD2 LYS 603 20.749 -10.214 11.646 788 HD3 LYS 603 HD3 LYS 603 19.330 -9.249 12.021 789 HE2 LYS 603 HE2 LYS 603 18.889 -8.935 9.634 790 HE3 LYS 603 HE3 LYS 603 20.345 -9.840 9.239 791 HZ1 LYS 603 HZ1 LYS 603 17.946 -10.932 10.621 792 HZ2 LYS 603 HZ2 LYS 603 19.380 -11.787 10.311 793 HZ3 LYS 603 HZ3 LYS 603 18.447 -11.257 9.035 794 H GLY 604 H GLY 604 16.739 -5.878 11.443 795 HA2 GLY 604 HA2 GLY 604 17.018 -3.055 11.749 796 HA3 GLY 604 HA3 GLY 604 15.705 -4.041 12.416 797 H GLY 605 H GLY 605 16.784 -5.769 13.946 798 HA2 GLY 605 HA2 GLY 605 18.037 -6.363 15.770 799 HA3 GLY 605 HA3 GLY 605 19.061 -4.974 15.466 800 H PHE 606 H PHE 606 17.809 -2.874 15.922 801 HA PHE 606 HA PHE 606 17.316 -3.094 18.751 802 HB2 PHE 606 HB2 PHE 606 17.593 -0.606 17.085 803 HB3 PHE 606 HB3 PHE 606 17.648 -0.704 18.844 804 HD1 PHE 606 HD1 PHE 606 19.496 -2.153 19.866 805 HD2 PHE 606 HD2 PHE 606 19.539 -0.785 15.843 806 HE1 PHE 606 HE1 PHE 606 21.907 -2.555 19.758 807 HE2 PHE 606 HE2 PHE 606 21.963 -1.181 15.727 808 HZ PHE 606 HZ PHE 606 23.151 -2.072 17.690 809 H THR 607 H THR 607 15.284 -4.075 18.551 810 HA THR 607 HA THR 607 13.124 -2.171 18.035 811 HB THR 607 HB THR 607 11.660 -4.225 18.172 812 HG1 THR 607 HG1 THR 607 12.614 -6.228 18.147 813 HG21 THR 607 HG21 THR 607 13.835 -4.296 16.074 814 HG22 THR 607 HG22 THR 607 12.324 -3.384 15.984 815 HG23 THR 607 HG23 THR 607 12.295 -5.146 15.973 816 H ILE 608 H ILE 608 11.474 -2.052 19.761 817 HA ILE 608 HA ILE 608 12.739 -2.467 22.333 818 HB ILE 608 HB ILE 608 10.001 -1.226 21.799 819 HG12 ILE 608 HG12 ILE 608 11.773 0.120 20.745 820 HG13 ILE 608 HG13 ILE 608 11.076 0.963 22.119 821 HG21 ILE 608 HG21 ILE 608 10.303 -2.089 24.089 822 HG22 ILE 608 HG22 ILE 608 10.184 -0.332 24.065 823 HG23 ILE 608 HG23 ILE 608 11.757 -1.104 24.262 824 HD11 ILE 608 HD11 ILE 608 13.482 1.256 22.048 825 HD12 ILE 608 HD12 ILE 608 13.719 -0.490 22.072 826 HD13 ILE 608 HD13 ILE 608 13.025 0.323 23.476 827 H THR 609 H THR 609 12.744 -4.704 21.927 828 HA THR 609 HA THR 609 10.539 -6.012 23.231 829 HB THR 609 HB THR 609 11.458 -7.013 20.505 830 HG1 THR 609 HG1 THR 609 9.737 -5.094 21.094 831 HG21 THR 609 HG21 THR 609 9.559 -8.565 20.729 832 HG22 THR 609 HG22 THR 609 9.194 -7.890 22.317 833 HG23 THR 609 HG23 THR 609 10.702 -8.766 22.058 834 H GLU 610 H GLU 610 11.702 -6.870 24.818 835 HA GLU 610 HA GLU 610 14.264 -8.162 24.224 836 HB2 GLU 610 HB2 GLU 610 13.056 -7.281 26.858 837 HB3 GLU 610 HB3 GLU 610 14.652 -7.983 26.640 838 HG2 GLU 610 HG2 GLU 610 15.349 -6.067 25.327 839 HG3 GLU 610 HG3 GLU 610 13.738 -5.374 25.468 840 H GLU 611 H GLU 611 11.333 -8.977 24.000 841 HA GLU 611 HA GLU 611 11.218 -11.350 25.693 842 HB2 GLU 611 HB2 GLU 611 9.267 -9.847 25.546 843 HB3 GLU 611 HB3 GLU 611 9.210 -10.102 23.814 844 HG2 GLU 611 HG2 GLU 611 8.696 -12.455 24.173 845 HG3 GLU 611 HG3 GLU 611 8.773 -12.204 25.920 846 H TYR 612 H TYR 612 11.940 -13.167 24.868 847 HA TYR 612 HA TYR 612 12.979 -13.370 22.242 848 HB2 TYR 612 HB2 TYR 612 13.973 -14.501 24.179 849 HB3 TYR 612 HB3 TYR 612 12.530 -15.484 24.357 850 HD1 TYR 612 HD2 TYR 612 15.529 -14.889 22.300 851 HD2 TYR 612 HD1 TYR 612 12.173 -17.411 22.975 852 HE1 TYR 612 HE2 TYR 612 16.539 -16.610 20.858 853 HE2 TYR 612 HE1 TYR 612 13.164 -19.128 21.544 854 HH TYR 612 HH TYR 612 16.432 -18.918 20.428 855 H ASP 613 H ASP 613 10.000 -14.293 23.723 856 HA ASP 613 HA ASP 613 9.104 -16.131 21.748 857 HB2 ASP 613 HB2 ASP 613 7.535 -14.503 23.750 858 HB3 ASP 613 HB3 ASP 613 6.795 -15.661 22.663 859 H ASP 614 H ASP 614 9.046 -12.667 21.948 860 HA ASP 614 HA ASP 614 8.076 -10.991 20.750 861 HB2 ASP 614 HB2 ASP 614 8.376 -13.035 18.528 862 HB3 ASP 614 HB3 ASP 614 7.700 -11.445 18.234 863 H LYS 615 H LYS 615 6.395 -12.258 22.311 864 HA LYS 615 HA LYS 615 4.039 -13.211 20.977 865 HB2 LYS 615 HB2 LYS 615 4.779 -14.111 23.135 866 HB3 LYS 615 HB3 LYS 615 4.667 -12.520 23.861 867 HG2 LYS 615 HG2 LYS 615 2.194 -12.595 23.375 868 HG3 LYS 615 HG3 LYS 615 2.417 -14.286 22.919 869 HD2 LYS 615 HD2 LYS 615 3.101 -13.077 25.605 870 HD3 LYS 615 HD3 LYS 615 1.688 -14.070 25.262 871 HE2 LYS 615 HE2 LYS 615 3.092 -15.962 24.757 872 HE3 LYS 615 HE3 LYS 615 4.552 -14.992 24.954 873 HZ1 LYS 615 HZ1 LYS 615 4.148 -16.314 26.878 874 HZ2 LYS 615 HZ2 LYS 615 2.602 -15.694 27.081 875 HZ3 LYS 615 HZ3 LYS 615 3.952 -14.694 27.281 876 H GLN 616 H GLN 616 4.904 -10.531 23.123 877 HA GLN 616 HA GLN 616 3.250 -8.863 21.462 878 HB2 GLN 616 HB2 GLN 616 2.174 -7.700 23.357 879 HB3 GLN 616 HB3 GLN 616 1.701 -9.378 23.247 880 HG2 GLN 616 HG2 GLN 616 3.154 -9.918 25.124 881 HG3 GLN 616 HG3 GLN 616 3.694 -8.238 25.195 882 HE21 GLN 616 HE21 GLN 616 1.041 -10.417 25.805 883 HE22 GLN 616 HE22 GLN 616 0.132 -9.326 26.767 884 HA PRO 617 HA PRO 617 7.173 -6.724 21.877 885 HB2 PRO 617 HB2 PRO 617 6.184 -5.367 19.464 886 HB3 PRO 617 HB3 PRO 617 7.667 -6.298 19.685 887 HG2 PRO 617 HG2 PRO 617 5.636 -7.219 18.193 888 HG3 PRO 617 HG3 PRO 617 6.641 -8.299 19.175 889 HD2 PRO 617 HD2 PRO 617 3.912 -7.215 19.754 890 HD3 PRO 617 HD3 PRO 617 4.565 -8.855 19.989 891 H LEU 618 H LEU 618 7.653 -4.506 22.265 892 HA LEU 618 HA LEU 618 5.347 -2.928 23.057 893 HB2 LEU 618 HB2 LEU 618 8.316 -2.531 23.523 894 HB3 LEU 618 HB3 LEU 618 7.101 -1.386 24.035 895 HG LEU 618 HG LEU 618 6.177 -3.203 25.546 896 HD11 LEU 618 HD11 LEU 618 7.635 -5.055 26.154 897 HD12 LEU 618 HD12 LEU 618 8.750 -4.605 24.862 898 HD13 LEU 618 HD13 LEU 618 7.123 -5.157 24.469 899 HD21 LEU 618 HD21 LEU 618 9.009 -2.296 26.009 900 HD22 LEU 618 HD22 LEU 618 7.906 -2.903 27.243 901 HD23 LEU 618 HD23 LEU 618 7.542 -1.397 26.399 902 H THR 619 H THR 619 5.776 -0.437 22.534 903 HA THR 619 HA THR 619 5.776 -0.331 19.703 904 HB THR 619 HB THR 619 5.585 2.154 20.010 905 HG1 THR 619 HG1 THR 619 5.407 1.705 22.796 906 HG21 THR 619 HG21 THR 619 3.393 2.116 21.118 907 HG22 THR 619 HG22 THR 619 3.745 0.502 21.735 908 HG23 THR 619 HG23 THR 619 3.580 0.764 20.000 909 H SER 620 H SER 620 7.443 -0.055 18.358 910 HA SER 620 HA SER 620 9.975 0.721 19.568 911 HB2 SER 620 HB2 SER 620 9.479 -0.785 16.983 912 HB3 SER 620 HB3 SER 620 11.051 -0.490 17.736 913 HG SER 620 HG SER 620 9.073 -1.685 19.260 914 H LYS 621 H LYS 621 9.648 2.865 19.489 915 HA LYS 621 HA LYS 621 8.929 4.032 16.915 916 HB2 LYS 621 HB2 LYS 621 8.836 5.258 19.665 917 HB3 LYS 621 HB3 LYS 621 8.302 6.013 18.177 918 HG2 LYS 621 HG2 LYS 621 6.552 4.348 17.922 919 HG3 LYS 621 HG3 LYS 621 7.113 3.522 19.371 920 HD2 LYS 621 HD2 LYS 621 6.162 6.384 19.384 921 HD3 LYS 621 HD3 LYS 621 5.072 5.029 19.619 922 HE2 LYS 621 HE2 LYS 621 5.660 5.925 21.778 923 HE3 LYS 621 HE3 LYS 621 6.418 4.355 21.602 924 HZ1 LYS 621 HZ1 LYS 621 7.849 6.928 21.151 925 HZ2 LYS 621 HZ2 LYS 621 8.541 5.375 21.372 926 HZ3 LYS 621 HZ3 LYS 621 7.770 6.136 22.615 927 H GLU 622 H GLU 622 10.980 3.945 16.044 928 HA GLU 622 HA GLU 622 13.164 5.337 17.247 929 HB2 GLU 622 HB2 GLU 622 12.710 4.564 14.333 930 HB3 GLU 622 HB3 GLU 622 14.164 5.292 14.939 931 HG2 GLU 622 HG2 GLU 622 14.517 2.941 14.649 932 HG3 GLU 622 HG3 GLU 622 14.570 3.328 16.359 933 H GLU 623 H GLU 623 14.103 7.357 16.093 934 HA GLU 623 HA GLU 623 11.980 9.295 16.042 935 HB2 GLU 623 HB2 GLU 623 13.743 10.984 15.758 936 HB3 GLU 623 HB3 GLU 623 14.080 9.908 17.101 937 HG2 GLU 623 HG2 GLU 623 15.705 8.715 15.738 938 HG3 GLU 623 HG3 GLU 623 15.334 9.758 14.366 939 H GLU 624 H GLU 624 13.158 7.306 13.824 940 HA GLU 624 HA GLU 624 13.120 8.840 11.425 941 HB2 GLU 624 HB2 GLU 624 12.828 5.881 11.919 942 HB3 GLU 624 HB3 GLU 624 13.122 6.629 10.358 943 HG2 GLU 624 HG2 GLU 624 15.275 7.434 11.118 944 HG3 GLU 624 HG3 GLU 624 14.969 6.784 12.725 945 H GLU 625 H GLU 625 11.490 8.329 9.696 946 HA GLU 625 HA GLU 625 8.802 8.653 10.674 947 HB2 GLU 625 HB2 GLU 625 9.726 8.139 7.836 948 HB3 GLU 625 HB3 GLU 625 8.191 8.825 8.344 949 HG2 GLU 625 HG2 GLU 625 9.279 10.843 9.068 950 HG3 GLU 625 HG3 GLU 625 10.866 10.139 8.753 951 H ARG 626 H ARG 626 8.256 6.716 11.711 952 HA ARG 626 HA ARG 626 8.988 4.169 10.649 953 HB2 ARG 626 HB2 ARG 626 7.013 4.803 12.837 954 HB3 ARG 626 HB3 ARG 626 7.645 3.209 12.452 955 HG2 ARG 626 HG2 ARG 626 9.211 5.564 13.486 956 HG3 ARG 626 HG3 ARG 626 8.817 4.080 14.357 957 HD2 ARG 626 HD2 ARG 626 10.592 4.306 11.912 958 HD3 ARG 626 HD3 ARG 626 11.095 4.036 13.574 959 HE ARG 626 HE ARG 626 9.556 1.975 13.305 960 HH11 ARG 626 HH11 ARG 626 11.779 3.230 10.774 961 HH12 ARG 626 HH12 ARG 626 12.194 1.693 10.216 962 HH21 ARG 626 HH21 ARG 626 10.170 -0.130 12.495 963 HH22 ARG 626 HH22 ARG 626 11.247 -0.258 11.186 964 H ARG 627 H ARG 627 5.999 5.922 10.781 965 HA ARG 627 HA ARG 627 4.353 3.996 9.522 966 HB2 ARG 627 HB2 ARG 627 4.246 6.939 9.953 967 HB3 ARG 627 HB3 ARG 627 3.153 6.241 8.776 968 HG2 ARG 627 HG2 ARG 627 3.351 5.332 11.621 969 HG3 ARG 627 HG3 ARG 627 2.199 6.553 11.044 970 HD2 ARG 627 HD2 ARG 627 1.487 4.933 9.346 971 HD3 ARG 627 HD3 ARG 627 2.451 3.705 10.144 972 HE ARG 627 HE ARG 627 0.494 5.124 11.764 973 HH11 ARG 627 HH11 ARG 627 1.439 2.042 10.244 974 HH12 ARG 627 HH12 ARG 627 0.111 1.184 10.879 975 HH21 ARG 627 HH21 ARG 627 -1.331 3.891 12.623 976 HH22 ARG 627 HH22 ARG 627 -1.460 2.228 12.260 977 H ILE 628 H ILE 628 6.533 6.308 8.274 978 HA ILE 628 HA ILE 628 5.497 5.925 5.617 979 HB ILE 628 HB ILE 628 7.760 7.707 6.570 980 HG12 ILE 628 HG12 ILE 628 4.840 8.278 6.026 981 HG13 ILE 628 HG13 ILE 628 5.517 8.103 7.609 982 HG21 ILE 628 HG21 ILE 628 6.150 7.717 3.993 983 HG22 ILE 628 HG22 ILE 628 7.819 7.174 4.134 984 HG23 ILE 628 HG23 ILE 628 7.416 8.868 4.428 985 HD11 ILE 628 HD11 ILE 628 5.237 10.439 7.070 986 HD12 ILE 628 HD12 ILE 628 6.187 10.243 5.601 987 HD13 ILE 628 HD13 ILE 628 6.962 10.085 7.178 988 H ALA 629 H ALA 629 8.144 4.888 7.589 989 HA ALA 629 HA ALA 629 9.602 3.670 5.452 990 HB1 ALA 629 HB1 ALA 629 9.723 3.141 8.418 991 HB2 ALA 629 HB2 ALA 629 10.687 4.336 7.551 992 HB3 ALA 629 HB3 ALA 629 10.902 2.616 7.216 993 H GLU 630 H GLU 630 6.837 2.878 7.302 994 HA GLU 630 HA GLU 630 7.123 0.098 7.157 995 HB2 GLU 630 HB2 GLU 630 5.046 -0.102 8.273 996 HB3 GLU 630 HB3 GLU 630 5.606 1.490 8.761 997 HG2 GLU 630 HG2 GLU 630 4.132 2.584 7.343 998 HG3 GLU 630 HG3 GLU 630 3.647 1.072 6.564 999 H MET 631 H MET 631 6.408 2.280 4.743 1000 HA MET 631 HA MET 631 4.737 0.526 3.163 1001 HB2 MET 631 HB2 MET 631 4.945 2.115 1.361 1002 HB3 MET 631 HB3 MET 631 4.717 3.023 2.846 1003 HG2 MET 631 HG2 MET 631 7.113 3.503 2.930 1004 HG3 MET 631 HG3 MET 631 7.354 2.567 1.457 1005 HE1 MET 631 HE1 MET 631 8.365 5.577 1.843 1006 HE2 MET 631 HE2 MET 631 7.949 6.244 0.264 1007 HE3 MET 631 HE3 MET 631 8.624 4.618 0.386 1008 H GLY 632 H GLY 632 8.076 0.784 3.854 1009 HA2 GLY 632 HA2 GLY 632 8.963 -0.436 1.376 1010 HA3 GLY 632 HA3 GLY 632 9.974 0.050 2.732 1011 H ARG 633 H ARG 633 7.468 -1.541 4.002 1012 HA ARG 633 HA ARG 633 8.683 -4.181 3.743 1013 HB2 ARG 633 HB2 ARG 633 8.187 -4.586 6.134 1014 HB3 ARG 633 HB3 ARG 633 9.279 -3.220 5.967 1015 HG2 ARG 633 HG2 ARG 633 7.395 -1.689 6.252 1016 HG3 ARG 633 HG3 ARG 633 6.314 -3.062 6.435 1017 HD2 ARG 633 HD2 ARG 633 8.631 -2.412 8.252 1018 HD3 ARG 633 HD3 ARG 633 6.942 -2.050 8.590 1019 HE ARG 633 HE ARG 633 8.047 -4.761 8.309 1020 HH11 ARG 633 HH11 ARG 633 5.684 -2.541 9.818 1021 HH12 ARG 633 HH12 ARG 633 5.084 -3.742 10.882 1022 HH21 ARG 633 HH21 ARG 633 7.233 -6.332 9.889 1023 HH22 ARG 633 HH22 ARG 633 6.008 -5.836 10.972 1024 HA PRO 634 HA PRO 634 4.450 -5.105 2.808 1025 HB2 PRO 634 HB2 PRO 634 4.356 -7.743 3.555 1026 HB3 PRO 634 HB3 PRO 634 5.023 -7.184 2.018 1027 HG2 PRO 634 HG2 PRO 634 6.439 -8.062 4.477 1028 HG3 PRO 634 HG3 PRO 634 6.923 -8.197 2.786 1029 HD2 PRO 634 HD2 PRO 634 7.910 -6.326 4.555 1030 HD3 PRO 634 HD3 PRO 634 7.926 -6.158 2.789 1031 H ILE 635 H ILE 635 2.592 -4.891 3.883 1032 HA ILE 635 HA ILE 635 2.680 -5.483 6.701 1033 HB ILE 635 HB ILE 635 1.302 -3.458 7.163 1034 HG12 ILE 635 HG12 ILE 635 1.696 -1.500 5.484 1035 HG13 ILE 635 HG13 ILE 635 2.017 -2.760 4.307 1036 HG21 ILE 635 HG21 ILE 635 3.234 -1.886 7.135 1037 HG22 ILE 635 HG22 ILE 635 4.062 -3.030 6.070 1038 HG23 ILE 635 HG23 ILE 635 3.652 -3.505 7.716 1039 HD11 ILE 635 HD11 ILE 635 -0.552 -2.353 5.817 1040 HD12 ILE 635 HD12 ILE 635 -0.243 -3.623 4.631 1041 HD13 ILE 635 HD13 ILE 635 -0.247 -1.933 4.131 1042 H LEU 636 H LEU 636 0.547 -5.592 7.706 1043 HA LEU 636 HA LEU 636 -1.090 -7.192 5.937 1044 HB2 LEU 636 HB2 LEU 636 -2.145 -7.974 8.146 1045 HB3 LEU 636 HB3 LEU 636 -0.550 -8.541 7.723 1046 HG LEU 636 HG LEU 636 0.418 -6.897 9.333 1047 HD11 LEU 636 HD11 LEU 636 -1.355 -5.243 9.350 1048 HD12 LEU 636 HD12 LEU 636 -1.014 -5.831 10.979 1049 HD13 LEU 636 HD13 LEU 636 -2.442 -6.403 10.112 1050 HD21 LEU 636 HD21 LEU 636 -1.619 -8.786 10.466 1051 HD22 LEU 636 HD22 LEU 636 -0.249 -8.099 11.343 1052 HD23 LEU 636 HD23 LEU 636 0.030 -9.193 9.987 1053 H GLY 637 H GLY 637 -3.522 -7.261 6.981 1054 HA2 GLY 637 HA2 GLY 637 -4.632 -4.792 6.077 1055 HA3 GLY 637 HA3 GLY 637 -5.515 -6.176 6.683 1056 H GLU 638 H GLU 638 -6.869 -4.555 7.663 1057 HA GLU 638 HA GLU 638 -5.772 -2.901 9.721 1058 HB2 GLU 638 HB2 GLU 638 -7.698 -2.152 8.356 1059 HB3 GLU 638 HB3 GLU 638 -8.667 -3.453 9.026 1060 HG2 GLU 638 HG2 GLU 638 -8.577 -2.458 11.218 1061 HG3 GLU 638 HG3 GLU 638 -7.423 -1.258 10.660 1062 H HIS 639 H HIS 639 -7.851 -5.810 9.673 1063 HA HIS 639 HA HIS 639 -6.663 -6.457 12.250 1064 HB2 HIS 639 HB2 HIS 639 -9.627 -6.598 11.671 1065 HB3 HIS 639 HB3 HIS 639 -8.865 -7.511 12.960 1066 HD1 HIS 639 HD1 HIS 639 -8.213 -6.220 15.103 1067 HD2 HIS 639 HD2 HIS 639 -9.826 -3.851 12.095 1068 HE1 HIS 639 HE1 HIS 639 -8.641 -3.976 16.140 1069 H THR 640 H THR 640 -5.723 -8.300 12.144 1070 HA THR 640 HA THR 640 -6.655 -10.149 10.127 1071 HB THR 640 HB THR 640 -4.352 -11.138 10.299 1072 HG1 THR 640 HG1 THR 640 -2.896 -10.239 11.600 1073 HG21 THR 640 HG21 THR 640 -5.053 -9.628 8.514 1074 HG22 THR 640 HG22 THR 640 -3.340 -9.457 8.895 1075 HG23 THR 640 HG23 THR 640 -4.501 -8.248 9.464 1076 H LYS 641 H LYS 641 -8.108 -11.314 11.137 1077 HA LYS 641 HA LYS 641 -7.255 -12.972 13.318 1078 HB2 LYS 641 HB2 LYS 641 -8.072 -10.972 14.499 1079 HB3 LYS 641 HB3 LYS 641 -9.576 -11.035 13.594 1080 HG2 LYS 641 HG2 LYS 641 -10.025 -13.268 14.641 1081 HG3 LYS 641 HG3 LYS 641 -8.605 -13.018 15.649 1082 HD2 LYS 641 HD2 LYS 641 -10.993 -11.169 15.568 1083 HD3 LYS 641 HD3 LYS 641 -10.760 -12.443 16.760 1084 HE2 LYS 641 HE2 LYS 641 -8.697 -11.355 17.509 1085 HE3 LYS 641 HE3 LYS 641 -8.940 -10.091 16.303 1086 HZ1 LYS 641 HZ1 LYS 641 -10.960 -9.427 17.421 1087 HZ2 LYS 641 HZ2 LYS 641 -9.724 -9.464 18.567 1088 HZ3 LYS 641 HZ3 LYS 641 -10.839 -10.719 18.482 1089 H LEU 642 H LEU 642 -8.445 -14.789 13.387 1090 HA LEU 642 HA LEU 642 -10.779 -15.008 11.645 1091 HB2 LEU 642 HB2 LEU 642 -8.795 -15.998 10.602 1092 HB3 LEU 642 HB3 LEU 642 -8.553 -16.965 12.044 1093 HG LEU 642 HG LEU 642 -10.848 -17.968 11.572 1094 HD11 LEU 642 HD11 LEU 642 -11.586 -17.926 9.289 1095 HD12 LEU 642 HD12 LEU 642 -10.345 -16.745 8.891 1096 HD13 LEU 642 HD13 LEU 642 -11.646 -16.315 10.008 1097 HD21 LEU 642 HD21 LEU 642 -9.887 -19.455 9.879 1098 HD22 LEU 642 HD22 LEU 642 -8.883 -19.209 11.307 1099 HD23 LEU 642 HD23 LEU 642 -8.472 -18.389 9.803 1100 H GLU 643 H GLU 643 -12.393 -15.531 12.951 1101 HA GLU 643 HA GLU 643 -11.873 -16.894 15.471 1102 HB2 GLU 643 HB2 GLU 643 -13.439 -14.954 15.371 1103 HB3 GLU 643 HB3 GLU 643 -14.448 -15.855 14.261 1104 HG2 GLU 643 HG2 GLU 643 -14.894 -17.506 15.997 1105 HG3 GLU 643 HG3 GLU 643 -13.860 -16.614 17.110 1106 H VAL 644 H VAL 644 -11.660 -19.053 15.268 1107 HA VAL 644 HA VAL 644 -13.137 -20.407 13.138 1108 HB VAL 644 HB VAL 644 -10.913 -21.523 14.852 1109 HG11 VAL 644 HG11 VAL 644 -12.434 -23.169 13.855 1110 HG12 VAL 644 HG12 VAL 644 -10.793 -23.296 13.253 1111 HG13 VAL 644 HG13 VAL 644 -12.041 -22.547 12.246 1112 HG21 VAL 644 HG21 VAL 644 -10.057 -19.667 13.523 1113 HG22 VAL 644 HG22 VAL 644 -10.745 -20.370 12.067 1114 HG23 VAL 644 HG23 VAL 644 -9.440 -21.198 12.906 1115 H ILE 645 H ILE 645 -14.976 -21.109 13.795 1116 HA ILE 645 HA ILE 645 -15.427 -21.976 16.561 1117 HB ILE 645 HB ILE 645 -17.399 -21.750 14.267 1118 HG12 ILE 645 HG12 ILE 645 -16.890 -19.704 16.437 1119 HG13 ILE 645 HG13 ILE 645 -16.231 -19.582 14.811 1120 HG21 ILE 645 HG21 ILE 645 -18.137 -23.159 16.143 1121 HG22 ILE 645 HG22 ILE 645 -19.080 -21.673 16.067 1122 HG23 ILE 645 HG23 ILE 645 -17.803 -21.845 17.265 1123 HD11 ILE 645 HD11 ILE 645 -18.210 -18.212 15.090 1124 HD12 ILE 645 HD12 ILE 645 -19.155 -19.648 15.514 1125 HD13 ILE 645 HD13 ILE 645 -18.460 -19.484 13.899 1126 H ILE 646 H ILE 646 -15.533 -24.057 17.064 1127 HA ILE 646 HA ILE 646 -15.335 -26.024 14.894 1128 HB ILE 646 HB ILE 646 -14.791 -26.384 17.871 1129 HG12 ILE 646 HG12 ILE 646 -12.833 -26.282 15.562 1130 HG13 ILE 646 HG13 ILE 646 -13.117 -24.955 16.682 1131 HG21 ILE 646 HG21 ILE 646 -14.390 -28.298 15.589 1132 HG22 ILE 646 HG22 ILE 646 -15.591 -28.430 16.875 1133 HG23 ILE 646 HG23 ILE 646 -13.873 -28.556 17.256 1134 HD11 ILE 646 HD11 ILE 646 -11.098 -26.199 17.244 1135 HD12 ILE 646 HD12 ILE 646 -12.049 -27.676 17.417 1136 HD13 ILE 646 HD13 ILE 646 -12.304 -26.327 18.522 1137 H GLU 647 H GLU 647 -17.318 -26.646 14.286 1138 HA GLU 647 HA GLU 647 -19.191 -27.282 16.431 1139 HB2 GLU 647 HB2 GLU 647 -19.809 -26.451 13.601 1140 HB3 GLU 647 HB3 GLU 647 -21.006 -27.004 14.764 1141 HG2 GLU 647 HG2 GLU 647 -20.266 -25.109 16.246 1142 HG3 GLU 647 HG3 GLU 647 -19.336 -24.516 14.872 1143 H GLU 648 H GLU 648 -19.686 -29.246 16.725 1144 HA GLU 648 HA GLU 648 -18.846 -31.429 15.075 1145 HB2 GLU 648 HB2 GLU 648 -19.094 -31.468 17.505 1146 HB3 GLU 648 HB3 GLU 648 -20.844 -31.284 17.335 1147 HG2 GLU 648 HG2 GLU 648 -20.827 -33.470 16.141 1148 HG3 GLU 648 HG3 GLU 648 -19.108 -33.606 16.526 1149 H SER 649 H SER 649 -19.727 -32.015 13.333 1150 HA SER 649 HA SER 649 -22.572 -31.822 12.865 1151 HB2 SER 649 HB2 SER 649 -21.689 -29.640 12.091 1152 HB3 SER 649 HB3 SER 649 -20.470 -30.465 11.131 1153 HG SER 649 HG SER 649 -21.949 -30.177 9.665 1154 H TYR 650 H TYR 650 -22.918 -33.895 12.367 1155 HA TYR 650 HA TYR 650 -20.904 -35.416 10.879 1156 HB2 TYR 650 HB2 TYR 650 -23.498 -36.311 12.134 1157 HB3 TYR 650 HB3 TYR 650 -22.293 -37.357 11.395 1158 HD1 TYR 650 HD1 TYR 650 -23.133 -35.309 14.249 1159 HD2 TYR 650 HD2 TYR 650 -20.227 -37.844 12.530 1160 HE1 TYR 650 HE1 TYR 650 -22.045 -35.520 16.446 1161 HE2 TYR 650 HE2 TYR 650 -19.106 -38.069 14.714 1162 HH TYR 650 HH TYR 650 -18.964 -36.770 16.775 1163 H GLU 651 H GLU 651 -23.617 -33.594 10.446 1164 HA GLU 651 HA GLU 651 -25.093 -35.032 8.677 1165 HB2 GLU 651 HB2 GLU 651 -24.877 -32.026 8.821 1166 HB3 GLU 651 HB3 GLU 651 -26.126 -32.898 7.951 1167 HG2 GLU 651 HG2 GLU 651 -27.156 -32.276 9.946 1168 HG3 GLU 651 HG3 GLU 651 -26.704 -33.953 10.219 1169 H PHE 652 H PHE 652 -22.146 -33.307 8.036 1170 HA PHE 652 HA PHE 652 -22.604 -33.356 5.160 1171 HB2 PHE 652 HB2 PHE 652 -20.643 -32.056 4.875 1172 HB3 PHE 652 HB3 PHE 652 -21.375 -31.439 6.346 1173 HD1 PHE 652 HD2 PHE 652 -20.409 -32.343 8.585 1174 HD2 PHE 652 HD1 PHE 652 -18.431 -32.716 4.835 1175 HE1 PHE 652 HE2 PHE 652 -18.275 -32.721 9.740 1176 HE2 PHE 652 HE1 PHE 652 -16.296 -33.093 5.991 1177 HZ PHE 652 HZ PHE 652 -16.220 -33.096 8.450 1178 H LYS 653 H LYS 653 -21.355 -35.466 7.504 1179 HA LYS 653 HA LYS 653 -20.507 -37.337 5.542 1180 HB2 LYS 653 HB2 LYS 653 -18.484 -35.731 5.894 1181 HB3 LYS 653 HB3 LYS 653 -18.358 -36.453 7.484 1182 HG2 LYS 653 HG2 LYS 653 -18.158 -37.975 4.879 1183 HG3 LYS 653 HG3 LYS 653 -16.786 -37.416 5.825 1184 HD2 LYS 653 HD2 LYS 653 -17.402 -38.883 7.637 1185 HD3 LYS 653 HD3 LYS 653 -18.888 -39.342 6.805 1186 HE2 LYS 653 HE2 LYS 653 -17.521 -40.267 4.968 1187 HE3 LYS 653 HE3 LYS 653 -16.069 -39.893 5.896 1188 HZ1 LYS 653 HZ1 LYS 653 -18.249 -41.694 6.779 1189 HZ2 LYS 653 HZ2 LYS 653 -16.820 -41.383 7.618 1190 HZ3 LYS 653 HZ3 LYS 653 -16.761 -42.198 6.145 1191 H SER 654 H SER 654 -21.877 -38.762 6.455 1192 HA SER 654 HA SER 654 -21.524 -39.409 9.283 1193 HB2 SER 654 HB2 SER 654 -23.804 -40.071 7.388 1194 HB3 SER 654 HB3 SER 654 -23.749 -40.386 9.123 1195 HG SER 654 HG SER 654 -23.237 -37.785 8.479 1196 H THR 655 H THR 655 -22.541 -42.044 9.157 1197 HA THR 655 HA THR 655 -20.344 -43.495 8.092 1198 HB THR 655 HB THR 655 -23.036 -44.551 9.035 1199 HG1 THR 655 HG1 THR 655 -22.271 -43.471 10.751 1200 HG21 THR 655 HG21 THR 655 -21.636 -46.206 7.855 1201 HG22 THR 655 HG22 THR 655 -21.770 -46.590 9.570 1202 HG23 THR 655 HG23 THR 655 -20.295 -45.847 8.946 1203 H VAL 656 H VAL 656 -23.706 -42.955 7.149 1204 HA VAL 656 HA VAL 656 -23.064 -43.667 4.407 1205 HB VAL 656 HB VAL 656 -25.310 -44.740 4.131 1206 HG11 VAL 656 HG11 VAL 656 -24.767 -46.895 5.156 1207 HG12 VAL 656 HG12 VAL 656 -23.530 -46.107 6.137 1208 HG13 VAL 656 HG13 VAL 656 -23.362 -46.160 4.382 1209 HG21 VAL 656 HG21 VAL 656 -26.457 -43.768 6.049 1210 HG22 VAL 656 HG22 VAL 656 -25.397 -44.652 7.148 1211 HG23 VAL 656 HG23 VAL 656 -26.527 -45.530 6.120 1212 H ASP 657 H ASP 657 -24.821 -42.793 2.938 1213 HA ASP 657 HA ASP 657 -26.148 -40.473 4.117 1214 HB2 ASP 657 HB2 ASP 657 -25.403 -38.944 2.427 1215 HB3 ASP 657 HB3 ASP 657 -23.964 -39.734 3.047 Start of MODEL 10 1 H HIS 501 H HIS 501 3.603 0.366 -3.087 2 HA HIS 501 HA HIS 501 3.779 0.491 -0.334 3 HB2 HIS 501 HB2 HIS 501 1.893 2.155 -0.743 4 HB3 HIS 501 HB3 HIS 501 1.015 0.876 -1.558 5 HD1 HIS 501 HD1 HIS 501 1.233 2.487 1.673 6 HD2 HIS 501 HD2 HIS 501 0.521 -1.388 0.343 7 HE1 HIS 501 HE1 HIS 501 0.090 1.296 3.558 8 H ALA 502 H ALA 502 3.319 -1.644 0.385 9 HA ALA 502 HA ALA 502 3.333 -3.630 -1.627 10 HB1 ALA 502 HB1 ALA 502 4.442 -3.941 0.540 11 HB2 ALA 502 HB2 ALA 502 3.286 -5.235 0.207 12 HB3 ALA 502 HB3 ALA 502 2.863 -3.936 1.324 13 H GLY 503 H GLY 503 0.894 -3.546 1.048 14 HA2 GLY 503 HA2 GLY 503 -1.378 -3.270 -0.391 15 HA3 GLY 503 HA3 GLY 503 -0.899 -4.943 -0.666 16 H ILE 504 H ILE 504 -2.519 -5.928 0.441 17 HA ILE 504 HA ILE 504 -2.715 -5.344 3.312 18 HB ILE 504 HB ILE 504 -5.005 -5.886 1.395 19 HG12 ILE 504 HG12 ILE 504 -5.958 -3.766 2.514 20 HG13 ILE 504 HG13 ILE 504 -4.318 -3.477 3.067 21 HG21 ILE 504 HG21 ILE 504 -6.528 -5.798 3.297 22 HG22 ILE 504 HG22 ILE 504 -5.135 -5.768 4.382 23 HG23 ILE 504 HG23 ILE 504 -5.421 -7.170 3.351 24 HD11 ILE 504 HD11 ILE 504 -4.827 -2.210 1.068 25 HD12 ILE 504 HD12 ILE 504 -5.209 -3.706 0.206 26 HD13 ILE 504 HD13 ILE 504 -3.560 -3.403 0.759 27 H PHE 505 H PHE 505 -2.143 -7.122 4.412 28 HA PHE 505 HA PHE 505 -2.937 -9.735 3.350 29 HB2 PHE 505 HB2 PHE 505 -0.822 -8.935 5.332 30 HB3 PHE 505 HB3 PHE 505 -1.504 -10.554 5.384 31 HD1 PHE 505 HD2 PHE 505 -1.392 -11.948 3.307 32 HD2 PHE 505 HD1 PHE 505 0.891 -8.413 3.835 33 HE1 PHE 505 HE2 PHE 505 0.148 -12.707 1.555 34 HE2 PHE 505 HE1 PHE 505 2.453 -9.161 2.068 35 HZ PHE 505 HZ PHE 505 2.058 -11.337 0.923 36 H THR 506 H THR 506 -4.636 -10.732 4.227 37 HA THR 506 HA THR 506 -5.259 -10.498 6.977 38 HB THR 506 HB THR 506 -6.229 -8.340 6.218 39 HG1 THR 506 HG1 THR 506 -7.556 -8.969 7.798 40 HG21 THR 506 HG21 THR 506 -6.681 -8.937 3.874 41 HG22 THR 506 HG22 THR 506 -8.135 -8.314 4.658 42 HG23 THR 506 HG23 THR 506 -7.941 -10.049 4.406 43 H PHE 507 H PHE 507 -7.395 -11.710 7.390 44 HA PHE 507 HA PHE 507 -7.220 -14.179 5.958 45 HB2 PHE 507 HB2 PHE 507 -8.873 -13.203 8.257 46 HB3 PHE 507 HB3 PHE 507 -9.257 -14.731 7.459 47 HD1 PHE 507 HD1 PHE 507 -7.625 -16.531 7.474 48 HD2 PHE 507 HD2 PHE 507 -7.055 -12.979 9.721 49 HE1 PHE 507 HE1 PHE 507 -5.989 -17.693 8.833 50 HE2 PHE 507 HE2 PHE 507 -5.383 -14.123 11.112 51 HZ PHE 507 HZ PHE 507 -4.836 -16.472 10.681 52 H GLU 508 H GLU 508 -8.824 -15.165 4.702 53 HA GLU 508 HA GLU 508 -10.197 -13.427 2.956 54 HB2 GLU 508 HB2 GLU 508 -9.250 -15.645 2.378 55 HB3 GLU 508 HB3 GLU 508 -10.483 -16.399 3.376 56 HG2 GLU 508 HG2 GLU 508 -12.194 -15.416 1.923 57 HG3 GLU 508 HG3 GLU 508 -10.893 -14.771 0.915 58 H GLU 509 H GLU 509 -11.036 -15.068 5.858 59 HA GLU 509 HA GLU 509 -13.594 -13.754 5.878 60 HB2 GLU 509 HB2 GLU 509 -14.644 -15.834 6.808 61 HB3 GLU 509 HB3 GLU 509 -14.207 -15.981 5.124 62 HG2 GLU 509 HG2 GLU 509 -12.028 -17.050 6.053 63 HG3 GLU 509 HG3 GLU 509 -12.977 -17.221 7.534 64 HA PRO 510 HA PRO 510 -11.937 -12.857 9.885 65 HB2 PRO 510 HB2 PRO 510 -14.167 -11.894 11.089 66 HB3 PRO 510 HB3 PRO 510 -13.297 -10.992 9.842 67 HG2 PRO 510 HG2 PRO 510 -15.794 -12.624 9.600 68 HG3 PRO 510 HG3 PRO 510 -15.399 -11.064 8.858 69 HD2 PRO 510 HD2 PRO 510 -15.216 -13.469 7.527 70 HD3 PRO 510 HD3 PRO 510 -14.231 -12.038 7.143 71 H VAL 511 H VAL 511 -14.742 -14.868 9.499 72 HA VAL 511 HA VAL 511 -14.069 -16.345 11.931 73 HB VAL 511 HB VAL 511 -16.899 -15.761 10.986 74 HG11 VAL 511 HG11 VAL 511 -15.901 -17.170 13.443 75 HG12 VAL 511 HG12 VAL 511 -16.742 -17.881 12.069 76 HG13 VAL 511 HG13 VAL 511 -17.582 -16.750 13.131 77 HG21 VAL 511 HG21 VAL 511 -15.972 -13.706 11.910 78 HG22 VAL 511 HG22 VAL 511 -15.478 -14.552 13.374 79 HG23 VAL 511 HG23 VAL 511 -17.191 -14.370 12.994 80 H THR 512 H THR 512 -14.078 -18.528 11.509 81 HA THR 512 HA THR 512 -15.327 -19.345 9.027 82 HB THR 512 HB THR 512 -12.823 -19.118 8.697 83 HG1 THR 512 HG1 THR 512 -13.902 -20.409 7.394 84 HG21 THR 512 HG21 THR 512 -11.387 -20.885 9.639 85 HG22 THR 512 HG22 THR 512 -12.753 -21.464 10.596 86 HG23 THR 512 HG23 THR 512 -12.075 -19.865 10.904 87 H HIS 513 H HIS 513 -16.290 -21.323 9.120 88 HA HIS 513 HA HIS 513 -16.178 -22.526 11.753 89 HB2 HIS 513 HB2 HIS 513 -18.516 -23.263 11.538 90 HB3 HIS 513 HB3 HIS 513 -18.393 -21.524 11.408 91 HD1 HIS 513 HD1 HIS 513 -20.430 -23.919 10.205 92 HD2 HIS 513 HD2 HIS 513 -18.113 -21.097 8.242 93 HE1 HIS 513 HE1 HIS 513 -21.472 -23.629 7.913 94 H VAL 514 H VAL 514 -15.512 -24.459 11.916 95 HA VAL 514 HA VAL 514 -15.128 -25.993 9.451 96 HB VAL 514 HB VAL 514 -13.125 -26.986 10.421 97 HG11 VAL 514 HG11 VAL 514 -13.113 -23.986 10.640 98 HG12 VAL 514 HG12 VAL 514 -12.764 -24.949 9.203 99 HG13 VAL 514 HG13 VAL 514 -11.667 -24.985 10.581 100 HG21 VAL 514 HG21 VAL 514 -13.778 -27.018 12.780 101 HG22 VAL 514 HG22 VAL 514 -13.655 -25.258 12.848 102 HG23 VAL 514 HG23 VAL 514 -12.209 -26.234 12.584 103 H SER 515 H SER 515 -14.771 -28.436 10.160 104 HA SER 515 HA SER 515 -17.185 -29.033 11.695 105 HB2 SER 515 HB2 SER 515 -17.189 -29.710 9.292 106 HB3 SER 515 HB3 SER 515 -15.783 -30.696 9.629 107 HG SER 515 HG SER 515 -18.090 -31.587 9.734 108 H GLU 516 H GLU 516 -17.194 -30.591 13.156 109 HA GLU 516 HA GLU 516 -15.045 -31.436 14.709 110 HB2 GLU 516 HB2 GLU 516 -17.220 -31.473 15.593 111 HB3 GLU 516 HB3 GLU 516 -17.885 -32.314 14.220 112 HG2 GLU 516 HG2 GLU 516 -16.459 -34.288 15.061 113 HG3 GLU 516 HG3 GLU 516 -16.410 -33.365 16.574 114 H SER 517 H SER 517 -16.304 -32.597 11.637 115 HA SER 517 HA SER 517 -14.580 -34.962 11.838 116 HB2 SER 517 HB2 SER 517 -17.148 -35.266 11.911 117 HB3 SER 517 HB3 SER 517 -17.108 -34.849 10.202 118 HG SER 517 HG SER 517 -15.752 -36.952 11.493 119 H ILE 518 H ILE 518 -14.003 -32.213 10.684 120 HA ILE 518 HA ILE 518 -13.912 -32.722 7.826 121 HB ILE 518 HB ILE 518 -14.324 -30.389 8.556 122 HG12 ILE 518 HG12 ILE 518 -11.687 -30.755 7.147 123 HG13 ILE 518 HG13 ILE 518 -13.279 -30.711 6.395 124 HG21 ILE 518 HG21 ILE 518 -13.092 -30.360 10.618 125 HG22 ILE 518 HG22 ILE 518 -12.558 -29.046 9.570 126 HG23 ILE 518 HG23 ILE 518 -11.560 -30.494 9.748 127 HD11 ILE 518 HD11 ILE 518 -12.079 -28.619 6.097 128 HD12 ILE 518 HD12 ILE 518 -11.929 -28.481 7.855 129 HD13 ILE 518 HD13 ILE 518 -13.524 -28.379 7.103 130 H GLY 519 H GLY 519 -11.810 -33.031 10.567 131 HA2 GLY 519 HA2 GLY 519 -9.815 -34.242 10.618 132 HA3 GLY 519 HA3 GLY 519 -9.781 -34.168 8.861 133 H ILE 520 H ILE 520 -9.308 -32.153 7.905 134 HA ILE 520 HA ILE 520 -7.510 -30.498 9.531 135 HB ILE 520 HB ILE 520 -7.004 -31.439 6.713 136 HG12 ILE 520 HG12 ILE 520 -6.609 -33.291 8.289 137 HG13 ILE 520 HG13 ILE 520 -5.112 -32.765 7.532 138 HG21 ILE 520 HG21 ILE 520 -4.757 -30.388 6.989 139 HG22 ILE 520 HG22 ILE 520 -5.290 -29.762 8.554 140 HG23 ILE 520 HG23 ILE 520 -6.087 -29.234 7.078 141 HD11 ILE 520 HD11 ILE 520 -6.047 -32.111 10.311 142 HD12 ILE 520 HD12 ILE 520 -4.555 -31.517 9.583 143 HD13 ILE 520 HD13 ILE 520 -4.773 -33.245 9.874 144 H MET 521 H MET 521 -7.860 -28.416 9.147 145 HA MET 521 HA MET 521 -9.733 -27.772 6.991 146 HB2 MET 521 HB2 MET 521 -10.491 -25.892 8.321 147 HB3 MET 521 HB3 MET 521 -10.620 -27.372 9.246 148 HG2 MET 521 HG2 MET 521 -9.776 -25.928 10.866 149 HG3 MET 521 HG3 MET 521 -8.304 -26.588 10.176 150 HE1 MET 521 HE1 MET 521 -7.318 -24.149 11.549 151 HE2 MET 521 HE2 MET 521 -9.026 -23.814 11.789 152 HE3 MET 521 HE3 MET 521 -7.989 -22.593 11.046 153 H GLU 522 H GLU 522 -9.306 -26.093 5.628 154 HA GLU 522 HA GLU 522 -6.651 -24.867 5.821 155 HB2 GLU 522 HB2 GLU 522 -8.191 -25.871 3.464 156 HB3 GLU 522 HB3 GLU 522 -7.145 -24.484 3.273 157 HG2 GLU 522 HG2 GLU 522 -5.977 -26.428 2.563 158 HG3 GLU 522 HG3 GLU 522 -5.271 -25.848 4.068 159 H VAL 523 H VAL 523 -6.821 -22.843 6.310 160 HA VAL 523 HA VAL 523 -9.149 -21.338 5.312 161 HB VAL 523 HB VAL 523 -7.347 -20.682 7.673 162 HG11 VAL 523 HG11 VAL 523 -8.000 -18.635 6.487 163 HG12 VAL 523 HG12 VAL 523 -8.797 -18.751 8.044 164 HG13 VAL 523 HG13 VAL 523 -9.697 -19.119 6.572 165 HG21 VAL 523 HG21 VAL 523 -9.020 -22.463 7.992 166 HG22 VAL 523 HG22 VAL 523 -10.293 -21.315 7.565 167 HG23 VAL 523 HG23 VAL 523 -9.300 -21.059 9.005 168 H LYS 524 H LYS 524 -8.863 -19.733 3.935 169 HA LYS 524 HA LYS 524 -6.206 -19.432 2.862 170 HB2 LYS 524 HB2 LYS 524 -8.905 -18.631 1.855 171 HB3 LYS 524 HB3 LYS 524 -7.397 -18.179 1.063 172 HG2 LYS 524 HG2 LYS 524 -6.782 -20.493 0.860 173 HG3 LYS 524 HG3 LYS 524 -8.279 -20.965 1.661 174 HD2 LYS 524 HD2 LYS 524 -9.564 -20.103 -0.120 175 HD3 LYS 524 HD3 LYS 524 -8.104 -19.398 -0.862 176 HE2 LYS 524 HE2 LYS 524 -7.186 -21.471 -1.245 177 HE3 LYS 524 HE3 LYS 524 -8.444 -22.326 -0.345 178 HZ1 LYS 524 HZ1 LYS 524 -8.760 -20.860 -2.915 179 HZ2 LYS 524 HZ2 LYS 524 -10.046 -21.571 -2.069 180 HZ3 LYS 524 HZ3 LYS 524 -8.814 -22.526 -2.704 181 H VAL 525 H VAL 525 -5.180 -17.600 2.600 182 HA VAL 525 HA VAL 525 -6.097 -15.316 4.207 183 HB VAL 525 HB VAL 525 -3.257 -16.012 3.445 184 HG11 VAL 525 HG11 VAL 525 -4.314 -14.028 5.441 185 HG12 VAL 525 HG12 VAL 525 -3.577 -13.643 3.884 186 HG13 VAL 525 HG13 VAL 525 -2.608 -14.381 5.163 187 HG21 VAL 525 HG21 VAL 525 -4.099 -17.716 4.927 188 HG22 VAL 525 HG22 VAL 525 -4.648 -16.486 6.066 189 HG23 VAL 525 HG23 VAL 525 -2.922 -16.708 5.769 190 H LEU 526 H LEU 526 -6.159 -13.372 3.208 191 HA LEU 526 HA LEU 526 -6.024 -13.353 0.356 192 HB2 LEU 526 HB2 LEU 526 -6.686 -11.224 2.387 193 HB3 LEU 526 HB3 LEU 526 -6.740 -10.972 0.654 194 HG LEU 526 HG LEU 526 -8.439 -12.999 2.118 195 HD11 LEU 526 HD11 LEU 526 -10.284 -11.432 1.719 196 HD12 LEU 526 HD12 LEU 526 -9.124 -10.237 1.128 197 HD13 LEU 526 HD13 LEU 526 -9.067 -10.773 2.805 198 HD21 LEU 526 HD21 LEU 526 -8.538 -11.951 -0.711 199 HD22 LEU 526 HD22 LEU 526 -9.713 -13.039 0.021 200 HD23 LEU 526 HD23 LEU 526 -8.051 -13.574 -0.213 201 H ARG 527 H ARG 527 -4.273 -13.098 -0.626 202 HA ARG 527 HA ARG 527 -1.811 -12.292 0.526 203 HB2 ARG 527 HB2 ARG 527 -2.026 -13.878 -1.362 204 HB3 ARG 527 HB3 ARG 527 -2.641 -12.574 -2.360 205 HG2 ARG 527 HG2 ARG 527 -0.460 -11.410 -2.085 206 HG3 ARG 527 HG3 ARG 527 0.141 -12.837 -1.236 207 HD2 ARG 527 HD2 ARG 527 0.785 -12.874 -3.573 208 HD3 ARG 527 HD3 ARG 527 -0.329 -14.189 -3.197 209 HE ARG 527 HE ARG 527 -2.038 -12.373 -4.048 210 HH11 ARG 527 HH11 ARG 527 0.919 -13.535 -5.551 211 HH12 ARG 527 HH12 ARG 527 0.566 -12.923 -7.105 212 HH21 ARG 527 HH21 ARG 527 -2.577 -11.576 -6.150 213 HH22 ARG 527 HH22 ARG 527 -1.486 -11.787 -7.440 214 H THR 528 H THR 528 -0.573 -10.432 -0.131 215 HA THR 528 HA THR 528 -1.830 -8.004 0.082 216 HB THR 528 HB THR 528 0.484 -8.171 0.641 217 HG1 THR 528 HG1 THR 528 1.193 -6.686 -1.427 218 HG21 THR 528 HG21 THR 528 2.240 -8.604 -1.012 219 HG22 THR 528 HG22 THR 528 0.987 -8.891 -2.228 220 HG23 THR 528 HG23 THR 528 1.136 -9.976 -0.843 221 H SER 529 H SER 529 -2.798 -6.666 -1.249 222 HA SER 529 HA SER 529 -3.696 -7.121 -3.733 223 HB2 SER 529 HB2 SER 529 -3.030 -4.437 -2.570 224 HB3 SER 529 HB3 SER 529 -4.464 -4.918 -3.495 225 HG SER 529 HG SER 529 -5.364 -5.461 -1.672 226 H GLY 530 H GLY 530 -0.592 -5.812 -2.727 227 HA2 GLY 530 HA2 GLY 530 0.215 -5.704 -5.542 228 HA3 GLY 530 HA3 GLY 530 0.875 -4.597 -4.335 229 H ALA 531 H ALA 531 0.889 -7.788 -5.569 230 HA ALA 531 HA ALA 531 2.767 -8.671 -3.544 231 HB1 ALA 531 HB1 ALA 531 0.937 -10.170 -4.215 232 HB2 ALA 531 HB2 ALA 531 2.522 -10.869 -4.519 233 HB3 ALA 531 HB3 ALA 531 1.582 -10.202 -5.856 234 H ARG 532 H ARG 532 4.724 -7.881 -3.877 235 HA ARG 532 HA ARG 532 5.962 -8.392 -6.478 236 HB2 ARG 532 HB2 ARG 532 6.318 -5.923 -4.757 237 HB3 ARG 532 HB3 ARG 532 7.278 -6.299 -6.176 238 HG2 ARG 532 HG2 ARG 532 4.299 -5.825 -6.165 239 HG3 ARG 532 HG3 ARG 532 5.509 -4.635 -6.618 240 HD2 ARG 532 HD2 ARG 532 6.264 -6.126 -8.452 241 HD3 ARG 532 HD3 ARG 532 5.046 -7.307 -7.980 242 HE ARG 532 HE ARG 532 4.120 -4.657 -8.659 243 HH11 ARG 532 HH11 ARG 532 4.548 -8.018 -9.732 244 HH12 ARG 532 HH12 ARG 532 3.462 -7.911 -11.028 245 HH21 ARG 532 HH21 ARG 532 2.630 -4.499 -10.485 246 HH22 ARG 532 HH22 ARG 532 2.337 -5.872 -11.455 247 H GLY 533 H GLY 533 7.229 -10.066 -6.008 248 HA2 GLY 533 HA2 GLY 533 9.382 -10.737 -5.301 249 HA3 GLY 533 HA3 GLY 533 9.236 -9.662 -3.914 250 H ASN 534 H ASN 534 9.493 -11.023 -2.248 251 HA ASN 534 HA ASN 534 7.545 -13.175 -1.948 252 HB2 ASN 534 HB2 ASN 534 9.660 -14.225 -2.640 253 HB3 ASN 534 HB3 ASN 534 10.517 -13.371 -1.368 254 HD21 ASN 534 HD21 ASN 534 7.341 -14.907 -0.929 255 HD22 ASN 534 HD22 ASN 534 7.928 -16.104 0.146 256 H VAL 535 H VAL 535 6.573 -13.157 -0.009 257 HA VAL 535 HA VAL 535 7.728 -11.602 2.175 258 HB VAL 535 HB VAL 535 4.819 -11.574 1.297 259 HG11 VAL 535 HG11 VAL 535 5.040 -11.352 3.685 260 HG12 VAL 535 HG12 VAL 535 4.541 -9.814 2.974 261 HG13 VAL 535 HG13 VAL 535 6.210 -10.050 3.481 262 HG21 VAL 535 HG21 VAL 535 6.874 -9.378 1.069 263 HG22 VAL 535 HG22 VAL 535 5.152 -9.214 0.703 264 HG23 VAL 535 HG23 VAL 535 6.167 -10.291 -0.261 265 H ILE 536 H ILE 536 7.537 -12.710 4.074 266 HA ILE 536 HA ILE 536 6.030 -15.230 3.993 267 HB ILE 536 HB ILE 536 8.214 -14.358 5.904 268 HG12 ILE 536 HG12 ILE 536 9.097 -14.945 3.715 269 HG13 ILE 536 HG13 ILE 536 9.537 -16.177 4.898 270 HG21 ILE 536 HG21 ILE 536 6.577 -15.721 7.021 271 HG22 ILE 536 HG22 ILE 536 8.084 -16.628 6.819 272 HG23 ILE 536 HG23 ILE 536 6.702 -16.939 5.756 273 HD11 ILE 536 HD11 ILE 536 7.641 -17.536 4.034 274 HD12 ILE 536 HD12 ILE 536 8.923 -17.229 2.862 275 HD13 ILE 536 HD13 ILE 536 7.420 -16.317 2.776 276 H VAL 537 H VAL 537 4.357 -15.533 5.307 277 HA VAL 537 HA VAL 537 3.896 -13.447 7.279 278 HB VAL 537 HB VAL 537 1.745 -14.978 5.781 279 HG11 VAL 537 HG11 VAL 537 1.045 -14.336 8.028 280 HG12 VAL 537 HG12 VAL 537 0.184 -13.389 6.813 281 HG13 VAL 537 HG13 VAL 537 1.523 -12.669 7.709 282 HG21 VAL 537 HG21 VAL 537 2.929 -13.418 4.347 283 HG22 VAL 537 HG22 VAL 537 2.649 -12.123 5.503 284 HG23 VAL 537 HG23 VAL 537 1.281 -12.851 4.647 285 HA PRO 538 HA PRO 538 4.146 -17.169 9.861 286 HB2 PRO 538 HB2 PRO 538 4.385 -15.846 12.206 287 HB3 PRO 538 HB3 PRO 538 5.746 -16.112 11.115 288 HG2 PRO 538 HG2 PRO 538 4.100 -13.659 11.545 289 HG3 PRO 538 HG3 PRO 538 5.837 -13.798 11.230 290 HD2 PRO 538 HD2 PRO 538 3.975 -13.111 9.336 291 HD3 PRO 538 HD3 PRO 538 5.538 -13.861 8.966 292 H TYR 539 H TYR 539 2.735 -18.136 11.316 293 HA TYR 539 HA TYR 539 0.458 -16.592 12.249 294 HB2 TYR 539 HB2 TYR 539 -1.252 -18.028 11.346 295 HB3 TYR 539 HB3 TYR 539 -0.203 -17.493 10.044 296 HD1 TYR 539 HD2 TYR 539 -1.016 -20.409 12.195 297 HD2 TYR 539 HD1 TYR 539 0.881 -19.053 8.642 298 HE1 TYR 539 HE2 TYR 539 -0.794 -22.733 11.443 299 HE2 TYR 539 HE1 TYR 539 1.094 -21.381 7.871 300 HH TYR 539 HH TYR 539 1.122 -23.623 8.765 301 H LYS 540 H LYS 540 -0.913 -17.810 13.734 302 HA LYS 540 HA LYS 540 0.199 -20.195 14.965 303 HB2 LYS 540 HB2 LYS 540 0.410 -19.163 17.176 304 HB3 LYS 540 HB3 LYS 540 1.536 -18.447 16.024 305 HG2 LYS 540 HG2 LYS 540 0.132 -16.535 15.752 306 HG3 LYS 540 HG3 LYS 540 -1.125 -17.271 16.735 307 HD2 LYS 540 HD2 LYS 540 0.350 -17.222 18.664 308 HD3 LYS 540 HD3 LYS 540 1.615 -16.470 17.678 309 HE2 LYS 540 HE2 LYS 540 -1.130 -15.381 17.999 310 HE3 LYS 540 HE3 LYS 540 0.212 -14.877 19.039 311 HZ1 LYS 540 HZ1 LYS 540 -0.235 -13.379 17.117 312 HZ2 LYS 540 HZ2 LYS 540 0.256 -14.618 16.057 313 HZ3 LYS 540 HZ3 LYS 540 1.335 -13.977 17.155 314 H THR 541 H THR 541 -1.275 -21.144 16.481 315 HA THR 541 HA THR 541 -3.994 -20.285 16.205 316 HB THR 541 HB THR 541 -4.317 -22.361 17.680 317 HG1 THR 541 HG1 THR 541 -2.323 -22.872 18.450 318 HG21 THR 541 HG21 THR 541 -4.777 -22.366 15.276 319 HG22 THR 541 HG22 THR 541 -4.046 -23.892 15.772 320 HG23 THR 541 HG23 THR 541 -3.072 -22.669 14.953 321 H ILE 542 H ILE 542 -5.198 -19.467 17.826 322 HA ILE 542 HA ILE 542 -3.856 -18.714 20.324 323 HB ILE 542 HB ILE 542 -6.247 -17.574 18.909 324 HG12 ILE 542 HG12 ILE 542 -3.509 -16.364 19.249 325 HG13 ILE 542 HG13 ILE 542 -4.118 -17.087 17.763 326 HG21 ILE 542 HG21 ILE 542 -6.108 -15.721 20.561 327 HG22 ILE 542 HG22 ILE 542 -4.853 -16.623 21.413 328 HG23 ILE 542 HG23 ILE 542 -6.484 -17.281 21.294 329 HD11 ILE 542 HD11 ILE 542 -5.800 -15.397 17.570 330 HD12 ILE 542 HD12 ILE 542 -4.225 -14.610 17.798 331 HD13 ILE 542 HD13 ILE 542 -5.366 -14.725 19.137 332 H GLU 543 H GLU 543 -4.673 -19.637 22.121 333 HA GLU 543 HA GLU 543 -7.024 -21.317 21.979 334 HB2 GLU 543 HB2 GLU 543 -5.211 -20.628 24.300 335 HB3 GLU 543 HB3 GLU 543 -6.501 -21.821 24.351 336 HG2 GLU 543 HG2 GLU 543 -5.356 -23.165 22.710 337 HG3 GLU 543 HG3 GLU 543 -4.080 -21.951 22.569 338 H GLY 544 H GLY 544 -8.695 -21.050 23.723 339 HA2 GLY 544 HA2 GLY 544 -9.164 -18.686 25.119 340 HA3 GLY 544 HA3 GLY 544 -9.838 -18.445 23.511 341 H THR 545 H THR 545 -11.415 -19.800 22.736 342 HA THR 545 HA THR 545 -13.134 -20.726 24.885 343 HB THR 545 HB THR 545 -13.917 -20.337 22.006 344 HG1 THR 545 HG1 THR 545 -13.462 -18.344 24.018 345 HG21 THR 545 HG21 THR 545 -15.223 -19.788 24.639 346 HG22 THR 545 HG22 THR 545 -15.537 -21.212 23.620 347 HG23 THR 545 HG23 THR 545 -15.989 -19.584 23.062 348 H ALA 546 H ALA 546 -10.784 -22.022 23.513 349 HA ALA 546 HA ALA 546 -11.711 -24.685 23.420 350 HB1 ALA 546 HB1 ALA 546 -10.559 -23.430 20.910 351 HB2 ALA 546 HB2 ALA 546 -12.204 -24.032 21.087 352 HB3 ALA 546 HB3 ALA 546 -10.844 -25.157 21.142 353 H ARG 547 H ARG 547 -9.888 -26.059 23.664 354 HA ARG 547 HA ARG 547 -7.511 -24.656 24.585 355 HB2 ARG 547 HB2 ARG 547 -8.721 -27.312 25.192 356 HB3 ARG 547 HB3 ARG 547 -7.156 -26.781 25.805 357 HG2 ARG 547 HG2 ARG 547 -8.035 -25.165 27.095 358 HG3 ARG 547 HG3 ARG 547 -9.515 -25.019 26.151 359 HD2 ARG 547 HD2 ARG 547 -8.774 -27.352 27.879 360 HD3 ARG 547 HD3 ARG 547 -9.934 -26.084 28.330 361 HE ARG 547 HE ARG 547 -10.485 -27.421 25.821 362 HH11 ARG 547 HH11 ARG 547 -11.270 -27.451 29.280 363 HH12 ARG 547 HH12 ARG 547 -12.681 -28.390 29.063 364 HH21 ARG 547 HH21 ARG 547 -12.306 -28.629 25.550 365 HH22 ARG 547 HH22 ARG 547 -13.334 -29.098 26.844 366 H GLY 548 H GLY 548 -5.512 -25.253 23.935 367 HA2 GLY 548 HA2 GLY 548 -5.389 -26.605 21.352 368 HA3 GLY 548 HA3 GLY 548 -4.122 -25.636 22.090 369 H GLY 549 H GLY 549 -2.700 -27.338 21.455 370 HA2 GLY 549 HA2 GLY 549 -1.301 -29.065 22.036 371 HA3 GLY 549 HA3 GLY 549 -2.157 -29.151 23.564 372 H GLY 550 H GLY 550 -4.249 -29.478 20.877 373 HA2 GLY 550 HA2 GLY 550 -4.972 -31.374 19.732 374 HA3 GLY 550 HA3 GLY 550 -3.913 -32.361 20.729 375 H GLU 551 H GLU 551 -5.803 -30.030 22.345 376 HA GLU 551 HA GLU 551 -7.282 -32.171 23.583 377 HB2 GLU 551 HB2 GLU 551 -6.055 -30.432 24.905 378 HB3 GLU 551 HB3 GLU 551 -7.188 -29.238 24.308 379 HG2 GLU 551 HG2 GLU 551 -8.923 -30.062 25.574 380 HG3 GLU 551 HG3 GLU 551 -8.173 -31.645 25.739 381 H ASP 552 H ASP 552 -8.313 -28.873 22.537 382 HA ASP 552 HA ASP 552 -10.748 -30.150 21.422 383 HB2 ASP 552 HB2 ASP 552 -10.179 -27.187 21.822 384 HB3 ASP 552 HB3 ASP 552 -11.687 -27.875 21.247 385 H PHE 553 H PHE 553 -7.943 -28.268 20.690 386 HA PHE 553 HA PHE 553 -8.259 -29.078 17.932 387 HB2 PHE 553 HB2 PHE 553 -7.702 -26.898 17.029 388 HB3 PHE 553 HB3 PHE 553 -9.111 -26.731 18.056 389 HD1 PHE 553 HD2 PHE 553 -8.936 -25.544 20.203 390 HD2 PHE 553 HD1 PHE 553 -5.625 -25.839 17.551 391 HE1 PHE 553 HE2 PHE 553 -7.809 -23.705 21.393 392 HE2 PHE 553 HE1 PHE 553 -4.498 -24.017 18.736 393 HZ PHE 553 HZ PHE 553 -5.587 -22.939 20.652 394 H GLU 554 H GLU 554 -6.238 -29.131 16.805 395 HA GLU 554 HA GLU 554 -4.032 -29.681 18.565 396 HB2 GLU 554 HB2 GLU 554 -4.940 -30.959 16.450 397 HB3 GLU 554 HB3 GLU 554 -4.035 -29.761 15.559 398 HG2 GLU 554 HG2 GLU 554 -2.908 -31.670 17.578 399 HG3 GLU 554 HG3 GLU 554 -2.864 -31.876 15.830 400 H ASP 555 H ASP 555 -2.506 -28.179 18.953 401 HA ASP 555 HA ASP 555 -2.930 -25.472 17.966 402 HB2 ASP 555 HB2 ASP 555 -2.589 -25.864 20.373 403 HB3 ASP 555 HB3 ASP 555 -0.993 -26.526 20.044 404 H THR 556 H THR 556 -1.709 -24.487 16.450 405 HA THR 556 HA THR 556 0.780 -25.778 15.683 406 HB THR 556 HB THR 556 -1.057 -26.748 14.280 407 HG1 THR 556 HG1 THR 556 0.555 -26.916 12.982 408 HG21 THR 556 HG21 THR 556 -1.328 -23.916 13.248 409 HG22 THR 556 HG22 THR 556 -2.558 -24.826 14.124 410 HG23 THR 556 HG23 THR 556 -2.072 -25.331 12.513 411 H CYS 557 H CYS 557 1.923 -24.449 14.012 412 HA CYS 557 HA CYS 557 1.298 -21.691 13.744 413 HB2 CYS 557 HB2 CYS 557 3.473 -20.947 14.742 414 HB3 CYS 557 HB3 CYS 557 2.320 -21.540 15.927 415 HG CYS 557 HG CYS 557 5.158 -23.104 14.820 416 H GLY 558 H GLY 558 3.039 -20.672 12.276 417 HA2 GLY 558 HA2 GLY 558 5.020 -22.159 11.082 418 HA3 GLY 558 HA3 GLY 558 3.538 -22.452 10.177 419 H GLU 559 H GLU 559 4.905 -21.417 8.519 420 HA GLU 559 HA GLU 559 4.395 -18.563 8.488 421 HB2 GLU 559 HB2 GLU 559 7.024 -19.908 7.903 422 HB3 GLU 559 HB3 GLU 559 6.642 -18.285 7.346 423 HG2 GLU 559 HG2 GLU 559 6.395 -17.597 9.715 424 HG3 GLU 559 HG3 GLU 559 6.881 -19.218 10.205 425 H LEU 560 H LEU 560 3.395 -18.043 6.691 426 HA LEU 560 HA LEU 560 3.275 -20.011 4.544 427 HB2 LEU 560 HB2 LEU 560 1.643 -17.542 5.081 428 HB3 LEU 560 HB3 LEU 560 1.413 -18.606 3.709 429 HG LEU 560 HG LEU 560 1.026 -19.347 6.601 430 HD11 LEU 560 HD11 LEU 560 -0.682 -17.839 5.781 431 HD12 LEU 560 HD12 LEU 560 -1.325 -19.460 6.034 432 HD13 LEU 560 HD13 LEU 560 -0.972 -18.898 4.400 433 HD21 LEU 560 HD21 LEU 560 0.665 -20.945 4.063 434 HD22 LEU 560 HD22 LEU 560 -0.004 -21.405 5.623 435 HD23 LEU 560 HD23 LEU 560 1.746 -21.295 5.416 436 H GLU 561 H GLU 561 4.151 -19.666 2.618 437 HA GLU 561 HA GLU 561 5.733 -17.258 2.338 438 HB2 GLU 561 HB2 GLU 561 6.725 -19.540 2.046 439 HB3 GLU 561 HB3 GLU 561 5.749 -19.707 0.583 440 HG2 GLU 561 HG2 GLU 561 6.886 -17.609 -0.251 441 HG3 GLU 561 HG3 GLU 561 7.909 -17.720 1.150 442 H PHE 562 H PHE 562 4.762 -15.603 1.359 443 HA PHE 562 HA PHE 562 2.992 -16.185 -0.899 444 HB2 PHE 562 HB2 PHE 562 3.132 -13.808 0.942 445 HB3 PHE 562 HB3 PHE 562 2.244 -13.788 -0.577 446 HD1 PHE 562 HD2 PHE 562 0.319 -15.245 -0.888 447 HD2 PHE 562 HD1 PHE 562 2.283 -14.905 2.857 448 HE1 PHE 562 HE2 PHE 562 -1.652 -16.197 0.221 449 HE2 PHE 562 HE1 PHE 562 0.320 -15.863 3.982 450 HZ PHE 562 HZ PHE 562 -1.642 -16.517 2.663 451 H GLN 563 H GLN 563 3.330 -15.172 -2.824 452 HA GLN 563 HA GLN 563 5.693 -13.487 -3.027 453 HB2 GLN 563 HB2 GLN 563 5.230 -15.888 -4.802 454 HB3 GLN 563 HB3 GLN 563 6.526 -14.720 -4.958 455 HG2 GLN 563 HG2 GLN 563 7.333 -15.459 -2.718 456 HG3 GLN 563 HG3 GLN 563 6.126 -16.745 -2.781 457 HE21 GLN 563 HE21 GLN 563 9.079 -15.518 -4.083 458 HE22 GLN 563 HE22 GLN 563 9.517 -16.952 -4.906 459 H ASN 564 H ASN 564 5.854 -12.854 -5.389 460 HA ASN 564 HA ASN 564 3.469 -11.591 -6.255 461 HB2 ASN 564 HB2 ASN 564 4.763 -10.980 -8.285 462 HB3 ASN 564 HB3 ASN 564 5.655 -10.630 -6.816 463 HD21 ASN 564 HD21 ASN 564 6.605 -11.016 -9.534 464 HD22 ASN 564 HD22 ASN 564 7.753 -12.291 -9.482 465 H ASP 565 H ASP 565 5.114 -14.507 -7.018 466 HA ASP 565 HA ASP 565 3.379 -15.201 -9.211 467 HB2 ASP 565 HB2 ASP 565 5.727 -15.797 -9.324 468 HB3 ASP 565 HB3 ASP 565 5.576 -16.761 -7.858 469 H GLU 566 H GLU 566 3.835 -16.246 -5.855 470 HA GLU 566 HA GLU 566 2.045 -18.392 -5.897 471 HB2 GLU 566 HB2 GLU 566 3.179 -16.676 -3.738 472 HB3 GLU 566 HB3 GLU 566 1.995 -17.920 -3.388 473 HG2 GLU 566 HG2 GLU 566 4.684 -18.314 -4.664 474 HG3 GLU 566 HG3 GLU 566 4.217 -18.729 -3.007 475 H ILE 567 H ILE 567 -0.048 -18.536 -5.597 476 HA ILE 567 HA ILE 567 -1.578 -16.115 -5.709 477 HB ILE 567 HB ILE 567 -3.565 -17.774 -5.863 478 HG12 ILE 567 HG12 ILE 567 -1.376 -19.671 -6.712 479 HG13 ILE 567 HG13 ILE 567 -2.057 -19.777 -5.104 480 HG21 ILE 567 HG21 ILE 567 -2.740 -16.439 -7.713 481 HG22 ILE 567 HG22 ILE 567 -3.146 -18.063 -8.267 482 HG23 ILE 567 HG23 ILE 567 -1.461 -17.613 -8.013 483 HD11 ILE 567 HD11 ILE 567 -3.530 -20.103 -7.706 484 HD12 ILE 567 HD12 ILE 567 -4.235 -20.175 -6.079 485 HD13 ILE 567 HD13 ILE 567 -3.053 -21.383 -6.577 486 H VAL 568 H VAL 568 -2.479 -18.995 -3.772 487 HA VAL 568 HA VAL 568 -2.809 -17.171 -1.513 488 HB VAL 568 HB VAL 568 -5.028 -17.789 -2.673 489 HG11 VAL 568 HG11 VAL 568 -4.568 -20.061 -3.272 490 HG12 VAL 568 HG12 VAL 568 -5.994 -19.937 -2.225 491 HG13 VAL 568 HG13 VAL 568 -4.467 -20.494 -1.558 492 HG21 VAL 568 HG21 VAL 568 -4.763 -18.662 0.193 493 HG22 VAL 568 HG22 VAL 568 -6.242 -18.154 -0.628 494 HG23 VAL 568 HG23 VAL 568 -4.939 -16.996 -0.350 495 H LYS 569 H LYS 569 -2.679 -18.238 0.553 496 HA LYS 569 HA LYS 569 -1.547 -20.926 0.546 497 HB2 LYS 569 HB2 LYS 569 -0.849 -18.548 2.253 498 HB3 LYS 569 HB3 LYS 569 -0.393 -20.203 2.629 499 HG2 LYS 569 HG2 LYS 569 0.281 -19.417 -0.030 500 HG3 LYS 569 HG3 LYS 569 1.080 -18.397 1.184 501 HD2 LYS 569 HD2 LYS 569 2.547 -20.263 0.685 502 HD3 LYS 569 HD3 LYS 569 1.828 -20.563 2.253 503 HE2 LYS 569 HE2 LYS 569 0.254 -22.116 1.320 504 HE3 LYS 569 HE3 LYS 569 0.784 -21.741 -0.315 505 HZ1 LYS 569 HZ1 LYS 569 2.952 -22.663 0.233 506 HZ2 LYS 569 HZ2 LYS 569 1.730 -23.793 0.450 507 HZ3 LYS 569 HZ3 LYS 569 2.422 -23.043 1.793 508 H THR 570 H THR 570 -2.012 -22.025 2.535 509 HA THR 570 HA THR 570 -4.470 -21.076 3.812 510 HB THR 570 HB THR 570 -5.053 -23.590 3.875 511 HG1 THR 570 HG1 THR 570 -3.039 -24.288 2.990 512 HG21 THR 570 HG21 THR 570 -6.390 -21.953 2.621 513 HG22 THR 570 HG22 THR 570 -6.242 -23.439 1.719 514 HG23 THR 570 HG23 THR 570 -5.273 -22.038 1.264 515 H ILE 571 H ILE 571 -4.744 -21.651 5.917 516 HA ILE 571 HA ILE 571 -2.436 -22.768 7.326 517 HB ILE 571 HB ILE 571 -4.995 -21.474 8.358 518 HG12 ILE 571 HG12 ILE 571 -3.335 -19.873 9.469 519 HG13 ILE 571 HG13 ILE 571 -2.124 -20.584 8.410 520 HG21 ILE 571 HG21 ILE 571 -4.439 -23.253 9.845 521 HG22 ILE 571 HG22 ILE 571 -4.137 -21.701 10.631 522 HG23 ILE 571 HG23 ILE 571 -2.787 -22.657 10.015 523 HD11 ILE 571 HD11 ILE 571 -4.597 -19.120 7.553 524 HD12 ILE 571 HD12 ILE 571 -3.402 -19.859 6.484 525 HD13 ILE 571 HD13 ILE 571 -2.939 -18.514 7.527 526 H SER 572 H SER 572 -2.445 -24.849 7.869 527 HA SER 572 HA SER 572 -4.965 -26.366 7.680 528 HB2 SER 572 HB2 SER 572 -2.101 -27.307 7.536 529 HB3 SER 572 HB3 SER 572 -3.542 -28.310 7.329 530 HG SER 572 HG SER 572 -4.069 -27.250 5.533 531 H VAL 573 H VAL 573 -5.838 -26.849 9.509 532 HA VAL 573 HA VAL 573 -4.134 -27.368 11.862 533 HB VAL 573 HB VAL 573 -6.808 -25.946 11.798 534 HG11 VAL 573 HG11 VAL 573 -6.650 -25.722 14.226 535 HG12 VAL 573 HG12 VAL 573 -5.222 -26.760 14.239 536 HG13 VAL 573 HG13 VAL 573 -6.793 -27.405 13.730 537 HG21 VAL 573 HG21 VAL 573 -4.100 -25.040 12.719 538 HG22 VAL 573 HG22 VAL 573 -5.581 -24.087 12.834 539 HG23 VAL 573 HG23 VAL 573 -4.928 -24.532 11.250 540 H LYS 574 H LYS 574 -4.507 -29.237 12.883 541 HA LYS 574 HA LYS 574 -6.527 -31.015 11.887 542 HB2 LYS 574 HB2 LYS 574 -4.370 -31.974 12.467 543 HB3 LYS 574 HB3 LYS 574 -4.453 -31.302 14.082 544 HG2 LYS 574 HG2 LYS 574 -4.874 -33.713 14.096 545 HG3 LYS 574 HG3 LYS 574 -6.289 -32.818 14.635 546 HD2 LYS 574 HD2 LYS 574 -7.314 -33.084 12.437 547 HD3 LYS 574 HD3 LYS 574 -5.880 -33.926 11.855 548 HE2 LYS 574 HE2 LYS 574 -7.711 -35.474 12.423 549 HE3 LYS 574 HE3 LYS 574 -6.280 -35.748 13.408 550 HZ1 LYS 574 HZ1 LYS 574 -8.640 -34.166 14.322 551 HZ2 LYS 574 HZ2 LYS 574 -7.354 -34.744 15.284 552 HZ3 LYS 574 HZ3 LYS 574 -8.434 -35.796 14.609 553 H VAL 575 H VAL 575 -8.497 -30.882 12.525 554 HA VAL 575 HA VAL 575 -9.177 -29.548 14.992 555 HB VAL 575 HB VAL 575 -10.980 -30.923 12.970 556 HG11 VAL 575 HG11 VAL 575 -11.657 -28.985 15.193 557 HG12 VAL 575 HG12 VAL 575 -11.995 -30.705 15.192 558 HG13 VAL 575 HG13 VAL 575 -12.796 -29.652 14.024 559 HG21 VAL 575 HG21 VAL 575 -9.777 -29.055 11.952 560 HG22 VAL 575 HG22 VAL 575 -10.294 -27.994 13.262 561 HG23 VAL 575 HG23 VAL 575 -11.486 -28.665 12.149 562 H ILE 576 H ILE 576 -9.628 -30.596 16.853 563 HA ILE 576 HA ILE 576 -9.357 -33.469 16.823 564 HB ILE 576 HB ILE 576 -9.722 -31.546 19.102 565 HG12 ILE 576 HG12 ILE 576 -7.650 -31.094 17.902 566 HG13 ILE 576 HG13 ILE 576 -7.316 -31.723 19.504 567 HG21 ILE 576 HG21 ILE 576 -10.384 -33.814 19.708 568 HG22 ILE 576 HG22 ILE 576 -8.926 -33.309 20.563 569 HG23 ILE 576 HG23 ILE 576 -8.799 -34.414 19.193 570 HD11 ILE 576 HD11 ILE 576 -5.796 -32.651 17.864 571 HD12 ILE 576 HD12 ILE 576 -7.148 -33.227 16.892 572 HD13 ILE 576 HD13 ILE 576 -6.843 -33.927 18.485 573 H ASP 577 H ASP 577 -10.906 -34.749 17.004 574 HA ASP 577 HA ASP 577 -13.563 -33.680 16.959 575 HB2 ASP 577 HB2 ASP 577 -14.301 -35.983 16.378 576 HB3 ASP 577 HB3 ASP 577 -13.089 -35.341 15.279 577 H ASP 578 H ASP 578 -13.640 -32.914 18.896 578 HA ASP 578 HA ASP 578 -13.348 -34.562 21.238 579 HB2 ASP 578 HB2 ASP 578 -12.516 -32.254 21.234 580 HB3 ASP 578 HB3 ASP 578 -14.140 -31.659 20.928 581 H GLU 579 H GLU 579 -14.950 -35.196 22.577 582 HA GLU 579 HA GLU 579 -17.590 -35.375 21.362 583 HB2 GLU 579 HB2 GLU 579 -16.391 -36.802 23.726 584 HB3 GLU 579 HB3 GLU 579 -17.955 -37.151 22.998 585 HG2 GLU 579 HG2 GLU 579 -16.897 -37.817 20.947 586 HG3 GLU 579 HG3 GLU 579 -15.314 -37.368 21.579 587 H GLU 580 H GLU 580 -16.126 -33.291 23.398 588 HA GLU 580 HA GLU 580 -18.400 -32.990 25.184 589 HB2 GLU 580 HB2 GLU 580 -16.226 -33.026 26.274 590 HB3 GLU 580 HB3 GLU 580 -15.616 -31.810 25.171 591 HG2 GLU 580 HG2 GLU 580 -17.357 -30.253 26.155 592 HG3 GLU 580 HG3 GLU 580 -17.583 -31.472 27.410 593 H TYR 581 H TYR 581 -19.784 -32.159 23.584 594 HA TYR 581 HA TYR 581 -19.002 -29.497 22.861 595 HB2 TYR 581 HB2 TYR 581 -20.688 -29.725 20.866 596 HB3 TYR 581 HB3 TYR 581 -19.051 -30.338 20.735 597 HD1 TYR 581 HD2 TYR 581 -18.626 -32.731 20.705 598 HD2 TYR 581 HD1 TYR 581 -22.594 -31.224 20.867 599 HE1 TYR 581 HE2 TYR 581 -19.473 -34.925 20.018 600 HE2 TYR 581 HE1 TYR 581 -23.457 -33.426 20.176 601 HH TYR 581 HH TYR 581 -21.577 -36.199 20.259 602 H GLU 582 H GLU 582 -19.651 -29.189 24.901 603 HA GLU 582 HA GLU 582 -22.454 -28.889 25.506 604 HB2 GLU 582 HB2 GLU 582 -19.960 -27.825 26.832 605 HB3 GLU 582 HB3 GLU 582 -21.560 -27.702 27.521 606 HG2 GLU 582 HG2 GLU 582 -19.998 -30.220 26.987 607 HG3 GLU 582 HG3 GLU 582 -20.357 -29.506 28.560 608 H LYS 583 H LYS 583 -19.775 -27.034 24.372 609 HA LYS 583 HA LYS 583 -21.473 -24.958 23.376 610 HB2 LYS 583 HB2 LYS 583 -20.629 -24.176 25.603 611 HB3 LYS 583 HB3 LYS 583 -18.990 -24.486 25.066 612 HG2 LYS 583 HG2 LYS 583 -19.128 -22.784 23.392 613 HG3 LYS 583 HG3 LYS 583 -20.842 -22.546 23.708 614 HD2 LYS 583 HD2 LYS 583 -19.680 -20.734 24.705 615 HD3 LYS 583 HD3 LYS 583 -20.216 -21.767 26.018 616 HE2 LYS 583 HE2 LYS 583 -17.418 -21.749 24.860 617 HE3 LYS 583 HE3 LYS 583 -17.907 -20.798 26.249 618 HZ1 LYS 583 HZ1 LYS 583 -18.486 -23.013 27.325 619 HZ2 LYS 583 HZ2 LYS 583 -16.888 -22.650 27.102 620 HZ3 LYS 583 HZ3 LYS 583 -17.590 -23.757 26.083 621 H ASN 584 H ASN 584 -20.593 -24.295 21.420 622 HA ASN 584 HA ASN 584 -18.793 -25.997 20.159 623 HB2 ASN 584 HB2 ASN 584 -19.836 -23.288 19.362 624 HB3 ASN 584 HB3 ASN 584 -18.631 -24.124 18.389 625 HD21 ASN 584 HD21 ASN 584 -19.187 -26.007 17.359 626 HD22 ASN 584 HD22 ASN 584 -20.822 -26.528 17.133 627 H LYS 585 H LYS 585 -16.775 -26.015 19.847 628 HA LYS 585 HA LYS 585 -15.181 -24.385 21.625 629 HB2 LYS 585 HB2 LYS 585 -14.383 -26.672 19.799 630 HB3 LYS 585 HB3 LYS 585 -13.412 -25.985 21.093 631 HG2 LYS 585 HG2 LYS 585 -16.040 -27.426 21.485 632 HG3 LYS 585 HG3 LYS 585 -14.446 -28.157 21.717 633 HD2 LYS 585 HD2 LYS 585 -13.980 -26.513 23.486 634 HD3 LYS 585 HD3 LYS 585 -15.573 -25.801 23.235 635 HE2 LYS 585 HE2 LYS 585 -15.566 -27.286 25.191 636 HE3 LYS 585 HE3 LYS 585 -16.641 -27.887 23.950 637 HZ1 LYS 585 HZ1 LYS 585 -15.234 -29.701 23.509 638 HZ2 LYS 585 HZ2 LYS 585 -14.954 -29.482 25.156 639 HZ3 LYS 585 HZ3 LYS 585 -13.871 -28.877 24.021 640 H THR 586 H THR 586 -14.227 -22.603 20.896 641 HA THR 586 HA THR 586 -13.563 -22.509 18.092 642 HB THR 586 HB THR 586 -15.666 -21.348 18.128 643 HG1 THR 586 HG1 THR 586 -13.807 -20.392 17.007 644 HG21 THR 586 HG21 THR 586 -15.767 -20.789 20.526 645 HG22 THR 586 HG22 THR 586 -16.135 -19.411 19.492 646 HG23 THR 586 HG23 THR 586 -14.553 -19.529 20.260 647 H PHE 587 H PHE 587 -11.712 -21.684 17.603 648 HA PHE 587 HA PHE 587 -10.204 -20.352 19.721 649 HB2 PHE 587 HB2 PHE 587 -8.165 -21.459 18.957 650 HB3 PHE 587 HB3 PHE 587 -9.350 -22.651 19.440 651 HD1 PHE 587 HD1 PHE 587 -10.577 -23.939 17.632 652 HD2 PHE 587 HD2 PHE 587 -7.228 -21.439 16.821 653 HE1 PHE 587 HE1 PHE 587 -10.203 -25.117 15.489 654 HE2 PHE 587 HE2 PHE 587 -6.867 -22.610 14.691 655 HZ PHE 587 HZ PHE 587 -8.355 -24.446 14.032 656 H PHE 588 H PHE 588 -8.179 -19.243 18.558 657 HA PHE 588 HA PHE 588 -9.385 -17.923 16.257 658 HB2 PHE 588 HB2 PHE 588 -7.787 -16.600 18.481 659 HB3 PHE 588 HB3 PHE 588 -8.323 -15.814 17.003 660 HD1 PHE 588 HD2 PHE 588 -9.351 -17.235 20.214 661 HD2 PHE 588 HD1 PHE 588 -10.594 -15.156 16.726 662 HE1 PHE 588 HE2 PHE 588 -11.483 -16.652 21.330 663 HE2 PHE 588 HE1 PHE 588 -12.715 -14.564 17.826 664 HZ PHE 588 HZ PHE 588 -13.156 -15.311 20.130 665 H LEU 589 H LEU 589 -7.958 -17.151 14.738 666 HA LEU 589 HA LEU 589 -5.274 -18.378 14.850 667 HB2 LEU 589 HB2 LEU 589 -7.255 -19.038 13.081 668 HB3 LEU 589 HB3 LEU 589 -6.493 -17.711 12.232 669 HG LEU 589 HG LEU 589 -5.644 -19.786 11.400 670 HD11 LEU 589 HD11 LEU 589 -3.573 -18.446 13.107 671 HD12 LEU 589 HD12 LEU 589 -3.996 -18.047 11.437 672 HD13 LEU 589 HD13 LEU 589 -3.244 -19.592 11.812 673 HD21 LEU 589 HD21 LEU 589 -4.444 -21.370 12.841 674 HD22 LEU 589 HD22 LEU 589 -6.153 -21.204 13.243 675 HD23 LEU 589 HD23 LEU 589 -4.936 -20.416 14.243 676 H GLU 590 H GLU 590 -3.670 -16.893 14.643 677 HA GLU 590 HA GLU 590 -4.419 -14.301 13.523 678 HB2 GLU 590 HB2 GLU 590 -4.270 -14.010 15.910 679 HB3 GLU 590 HB3 GLU 590 -2.681 -14.764 15.957 680 HG2 GLU 590 HG2 GLU 590 -1.757 -12.910 14.676 681 HG3 GLU 590 HG3 GLU 590 -3.355 -12.184 14.549 682 H ILE 591 H ILE 591 -3.115 -13.522 12.082 683 HA ILE 591 HA ILE 591 -0.651 -14.961 11.567 684 HB ILE 591 HB ILE 591 -0.689 -13.816 9.333 685 HG12 ILE 591 HG12 ILE 591 -3.502 -13.023 10.147 686 HG13 ILE 591 HG13 ILE 591 -2.153 -11.922 9.899 687 HG21 ILE 591 HG21 ILE 591 -1.401 -16.096 9.524 688 HG22 ILE 591 HG22 ILE 591 -2.424 -15.271 8.347 689 HG23 ILE 591 HG23 ILE 591 -3.023 -15.596 9.979 690 HD11 ILE 591 HD11 ILE 591 -3.456 -13.638 7.802 691 HD12 ILE 591 HD12 ILE 591 -2.104 -12.536 7.529 692 HD13 ILE 591 HD13 ILE 591 -3.682 -11.901 8.009 693 H GLY 592 H GLY 592 1.198 -13.872 11.490 694 HA2 GLY 592 HA2 GLY 592 1.206 -11.455 13.075 695 HA3 GLY 592 HA3 GLY 592 2.618 -12.390 12.591 696 H GLU 593 H GLU 593 3.011 -9.887 12.399 697 HA GLU 593 HA GLU 593 2.101 -8.689 10.044 698 HB2 GLU 593 HB2 GLU 593 4.413 -8.042 11.866 699 HB3 GLU 593 HB3 GLU 593 4.002 -7.059 10.460 700 HG2 GLU 593 HG2 GLU 593 1.800 -6.641 11.345 701 HG3 GLU 593 HG3 GLU 593 2.121 -7.688 12.721 702 HA PRO 594 HA PRO 594 4.251 -10.958 7.040 703 HB2 PRO 594 HB2 PRO 594 4.185 -9.052 5.045 704 HB3 PRO 594 HB3 PRO 594 2.830 -10.105 5.449 705 HG2 PRO 594 HG2 PRO 594 3.370 -7.298 6.287 706 HG3 PRO 594 HG3 PRO 594 1.830 -8.005 5.798 707 HD2 PRO 594 HD2 PRO 594 2.437 -7.560 8.335 708 HD3 PRO 594 HD3 PRO 594 1.507 -9.000 7.891 709 H ARG 595 H ARG 595 6.333 -11.267 6.594 710 HA ARG 595 HA ARG 595 8.153 -9.013 6.995 711 HB2 ARG 595 HB2 ARG 595 9.880 -10.719 7.623 712 HB3 ARG 595 HB3 ARG 595 8.517 -10.640 8.726 713 HG2 ARG 595 HG2 ARG 595 7.560 -12.640 7.586 714 HG3 ARG 595 HG3 ARG 595 9.035 -12.706 6.617 715 HD2 ARG 595 HD2 ARG 595 9.113 -14.274 8.506 716 HD3 ARG 595 HD3 ARG 595 10.367 -13.042 8.621 717 HE ARG 595 HE ARG 595 8.599 -11.912 10.148 718 HH11 ARG 595 HH11 ARG 595 8.985 -15.484 10.019 719 HH12 ARG 595 HH12 ARG 595 8.843 -15.627 11.689 720 HH21 ARG 595 HH21 ARG 595 8.343 -12.253 12.448 721 HH22 ARG 595 HH22 ARG 595 8.470 -13.820 13.087 722 H LEU 596 H LEU 596 9.122 -8.279 5.294 723 HA LEU 596 HA LEU 596 8.945 -9.392 2.734 724 HB2 LEU 596 HB2 LEU 596 9.281 -6.941 3.548 725 HB3 LEU 596 HB3 LEU 596 10.967 -7.372 3.663 726 HG LEU 596 HG LEU 596 10.341 -6.074 1.611 727 HD11 LEU 596 HD11 LEU 596 11.488 -8.800 1.075 728 HD12 LEU 596 HD12 LEU 596 12.388 -7.379 1.604 729 HD13 LEU 596 HD13 LEU 596 11.614 -7.394 0.018 730 HD21 LEU 596 HD21 LEU 596 8.989 -8.623 0.810 731 HD22 LEU 596 HD22 LEU 596 9.118 -7.141 -0.164 732 HD23 LEU 596 HD23 LEU 596 8.174 -7.162 1.338 733 H VAL 597 H VAL 597 10.277 -10.758 1.708 734 HA VAL 597 HA VAL 597 12.527 -11.837 3.196 735 HB VAL 597 HB VAL 597 11.250 -12.803 0.624 736 HG11 VAL 597 HG11 VAL 597 12.497 -14.864 0.995 737 HG12 VAL 597 HG12 VAL 597 13.238 -14.170 2.430 738 HG13 VAL 597 HG13 VAL 597 13.601 -13.496 0.839 739 HG21 VAL 597 HG21 VAL 597 9.736 -12.958 2.503 740 HG22 VAL 597 HG22 VAL 597 10.972 -13.804 3.443 741 HG23 VAL 597 HG23 VAL 597 10.283 -14.559 2.001 742 H GLU 598 H GLU 598 14.243 -10.638 2.948 743 HA GLU 598 HA GLU 598 14.869 -9.262 0.511 744 HB2 GLU 598 HB2 GLU 598 15.452 -8.712 3.056 745 HB3 GLU 598 HB3 GLU 598 16.837 -9.733 2.738 746 HG2 GLU 598 HG2 GLU 598 16.127 -7.111 1.439 747 HG3 GLU 598 HG3 GLU 598 17.531 -7.490 2.426 748 H MET 599 H MET 599 15.692 -10.381 -1.146 749 HA MET 599 HA MET 599 16.828 -13.016 -0.715 750 HB2 MET 599 HB2 MET 599 16.249 -11.513 -3.278 751 HB3 MET 599 HB3 MET 599 16.950 -13.119 -3.213 752 HG2 MET 599 HG2 MET 599 14.238 -12.362 -2.153 753 HG3 MET 599 HG3 MET 599 14.552 -13.148 -3.701 754 HE1 MET 599 HE1 MET 599 12.921 -16.034 -1.650 755 HE2 MET 599 HE2 MET 599 12.894 -15.116 -3.154 756 HE3 MET 599 HE3 MET 599 12.501 -14.322 -1.628 757 H SER 600 H SER 600 17.837 -10.194 -2.594 758 HA SER 600 HA SER 600 20.430 -10.154 -1.520 759 HB2 SER 600 HB2 SER 600 20.693 -12.162 -2.958 760 HB3 SER 600 HB3 SER 600 20.122 -11.246 -4.345 761 HG SER 600 HG SER 600 22.367 -10.417 -2.852 762 H GLU 601 H GLU 601 19.706 -8.020 -1.234 763 HA GLU 601 HA GLU 601 20.049 -6.366 -3.631 764 HB2 GLU 601 HB2 GLU 601 17.646 -6.506 -2.961 765 HB3 GLU 601 HB3 GLU 601 18.077 -5.920 -1.369 766 HG2 GLU 601 HG2 GLU 601 18.650 -3.771 -2.260 767 HG3 GLU 601 HG3 GLU 601 18.452 -4.358 -3.914 768 H LYS 602 H LYS 602 21.274 -4.442 -3.210 769 HA LYS 602 HA LYS 602 22.967 -4.811 -0.906 770 HB2 LYS 602 HB2 LYS 602 23.193 -2.707 -3.071 771 HB3 LYS 602 HB3 LYS 602 24.419 -3.094 -1.871 772 HG2 LYS 602 HG2 LYS 602 24.570 -5.370 -2.803 773 HG3 LYS 602 HG3 LYS 602 23.410 -4.910 -4.044 774 HD2 LYS 602 HD2 LYS 602 25.001 -3.140 -4.783 775 HD3 LYS 602 HD3 LYS 602 26.161 -3.755 -3.607 776 HE2 LYS 602 HE2 LYS 602 24.984 -5.310 -5.916 777 HE3 LYS 602 HE3 LYS 602 26.617 -4.658 -5.832 778 HZ1 LYS 602 HZ1 LYS 602 25.522 -6.729 -3.989 779 HZ2 LYS 602 HZ2 LYS 602 27.107 -6.140 -4.024 780 HZ3 LYS 602 HZ3 LYS 602 26.520 -7.016 -5.317 781 H LYS 603 H LYS 603 21.485 -4.411 0.626 782 HA LYS 603 HA LYS 603 21.129 -1.662 1.421 783 HB2 LYS 603 HB2 LYS 603 19.289 -2.175 -0.118 784 HB3 LYS 603 HB3 LYS 603 18.846 -3.556 0.852 785 HG2 LYS 603 HG2 LYS 603 18.191 -2.109 2.687 786 HG3 LYS 603 HG3 LYS 603 18.725 -0.689 1.776 787 HD2 LYS 603 HD2 LYS 603 16.570 -2.607 0.849 788 HD3 LYS 603 HD3 LYS 603 16.251 -1.065 1.652 789 HE2 LYS 603 HE2 LYS 603 17.230 0.159 -0.159 790 HE3 LYS 603 HE3 LYS 603 17.848 -1.296 -0.916 791 HZ1 LYS 603 HZ1 LYS 603 15.638 -2.002 -1.368 792 HZ2 LYS 603 HZ2 LYS 603 15.922 -0.457 -2.015 793 HZ3 LYS 603 HZ3 LYS 603 14.972 -0.605 -0.642 794 H GLY 604 H GLY 604 22.025 -1.945 3.389 795 HA2 GLY 604 HA2 GLY 604 21.113 -4.241 4.966 796 HA3 GLY 604 HA3 GLY 604 22.808 -3.775 4.904 797 H GLY 605 H GLY 605 21.888 -3.929 7.285 798 HA2 GLY 605 HA2 GLY 605 22.393 -1.751 8.663 799 HA3 GLY 605 HA3 GLY 605 20.713 -1.466 8.192 800 H PHE 606 H PHE 606 20.308 -1.610 10.530 801 HA PHE 606 HA PHE 606 20.134 -4.416 11.323 802 HB2 PHE 606 HB2 PHE 606 20.542 -1.986 13.061 803 HB3 PHE 606 HB3 PHE 606 20.081 -3.557 13.701 804 HD1 PHE 606 HD2 PHE 606 22.761 -1.644 12.073 805 HD2 PHE 606 HD1 PHE 606 21.651 -5.358 13.822 806 HE1 PHE 606 HE2 PHE 606 25.121 -2.314 12.138 807 HE2 PHE 606 HE1 PHE 606 24.010 -6.035 13.888 808 HZ PHE 606 HZ PHE 606 25.747 -4.507 13.040 809 H THR 607 H THR 607 18.209 -5.208 11.279 810 HA THR 607 HA THR 607 15.866 -3.771 10.893 811 HB THR 607 HB THR 607 14.805 -6.016 11.694 812 HG1 THR 607 HG1 THR 607 17.222 -7.224 11.159 813 HG21 THR 607 HG21 THR 607 15.028 -5.390 9.326 814 HG22 THR 607 HG22 THR 607 15.369 -7.103 9.554 815 HG23 THR 607 HG23 THR 607 16.693 -5.966 9.325 816 H ILE 608 H ILE 608 17.403 -4.911 13.796 817 HA ILE 608 HA ILE 608 15.297 -3.830 15.463 818 HB ILE 608 HB ILE 608 18.053 -4.835 16.288 819 HG12 ILE 608 HG12 ILE 608 15.417 -6.325 16.330 820 HG13 ILE 608 HG13 ILE 608 16.704 -6.590 15.160 821 HG21 ILE 608 HG21 ILE 608 17.032 -3.388 17.969 822 HG22 ILE 608 HG22 ILE 608 17.043 -5.058 18.539 823 HG23 ILE 608 HG23 ILE 608 15.553 -4.346 17.920 824 HD11 ILE 608 HD11 ILE 608 16.701 -8.294 16.894 825 HD12 ILE 608 HD12 ILE 608 16.893 -7.050 18.131 826 HD13 ILE 608 HD13 ILE 608 18.178 -7.334 16.960 827 H THR 609 H THR 609 15.410 -1.709 14.541 828 HA THR 609 HA THR 609 17.847 -0.227 14.806 829 HB THR 609 HB THR 609 15.124 0.870 14.100 830 HG1 THR 609 HG1 THR 609 16.974 -0.682 12.555 831 HG21 THR 609 HG21 THR 609 17.943 1.665 13.332 832 HG22 THR 609 HG22 THR 609 16.926 2.506 14.499 833 HG23 THR 609 HG23 THR 609 16.472 2.472 12.794 834 H GLU 610 H GLU 610 14.698 -0.418 16.405 835 HA GLU 610 HA GLU 610 15.436 1.582 18.322 836 HB2 GLU 610 HB2 GLU 610 13.152 -0.414 18.324 837 HB3 GLU 610 HB3 GLU 610 13.370 0.858 19.518 838 HG2 GLU 610 HG2 GLU 610 12.851 1.222 16.581 839 HG3 GLU 610 HG3 GLU 610 11.719 1.527 17.900 840 H GLU 611 H GLU 611 17.060 1.127 19.603 841 HA GLU 611 HA GLU 611 17.372 -1.611 20.528 842 HB2 GLU 611 HB2 GLU 611 19.296 -0.342 19.468 843 HB3 GLU 611 HB3 GLU 611 19.276 0.717 20.868 844 HG2 GLU 611 HG2 GLU 611 21.007 -0.912 21.123 845 HG3 GLU 611 HG3 GLU 611 19.736 -1.237 22.303 846 H TYR 612 H TYR 612 15.701 -1.576 21.959 847 HA TYR 612 HA TYR 612 15.748 0.392 24.079 848 HB2 TYR 612 HB2 TYR 612 13.535 -0.738 24.761 849 HB3 TYR 612 HB3 TYR 612 13.554 0.219 23.295 850 HD1 TYR 612 HD2 TYR 612 13.365 -0.869 21.109 851 HD2 TYR 612 HD1 TYR 612 13.153 -3.140 24.695 852 HE1 TYR 612 HE2 TYR 612 12.376 -2.733 19.858 853 HE2 TYR 612 HE1 TYR 612 12.156 -5.014 23.452 854 HH TYR 612 HH TYR 612 12.162 -5.141 20.067 855 H ASP 613 H ASP 613 16.215 0.031 26.124 856 HA ASP 613 HA ASP 613 17.501 -2.520 26.654 857 HB2 ASP 613 HB2 ASP 613 18.522 -1.446 28.622 858 HB3 ASP 613 HB3 ASP 613 18.878 -0.564 27.148 859 H ASP 614 H ASP 614 14.626 -0.995 27.274 860 HA ASP 614 HA ASP 614 14.040 -2.748 29.559 861 HB2 ASP 614 HB2 ASP 614 13.218 -0.313 29.523 862 HB3 ASP 614 HB3 ASP 614 12.179 -0.764 28.179 863 H LYS 615 H LYS 615 11.582 -3.728 29.106 864 HA LYS 615 HA LYS 615 12.004 -5.260 26.679 865 HB2 LYS 615 HB2 LYS 615 10.144 -6.700 27.486 866 HB3 LYS 615 HB3 LYS 615 11.473 -6.590 28.624 867 HG2 LYS 615 HG2 LYS 615 10.192 -4.991 29.949 868 HG3 LYS 615 HG3 LYS 615 8.852 -5.127 28.804 869 HD2 LYS 615 HD2 LYS 615 8.628 -7.476 29.293 870 HD3 LYS 615 HD3 LYS 615 10.032 -7.434 30.352 871 HE2 LYS 615 HE2 LYS 615 8.813 -5.810 31.791 872 HE3 LYS 615 HE3 LYS 615 7.397 -6.021 30.761 873 HZ1 LYS 615 HZ1 LYS 615 7.227 -7.388 32.685 874 HZ2 LYS 615 HZ2 LYS 615 8.733 -8.068 32.427 875 HZ3 LYS 615 HZ3 LYS 615 7.457 -8.415 31.355 876 H GLN 616 H GLN 616 10.296 -2.561 27.733 877 HA GLN 616 HA GLN 616 8.991 -2.561 25.193 878 HB2 GLN 616 HB2 GLN 616 6.833 -1.684 26.181 879 HB3 GLN 616 HB3 GLN 616 7.181 -3.381 26.380 880 HG2 GLN 616 HG2 GLN 616 6.159 -2.582 28.370 881 HG3 GLN 616 HG3 GLN 616 7.843 -2.907 28.738 882 HE21 GLN 616 HE21 GLN 616 9.120 -1.213 29.468 883 HE22 GLN 616 HE22 GLN 616 8.492 0.353 29.777 884 HA PRO 617 HA PRO 617 9.820 1.800 25.578 885 HB2 PRO 617 HB2 PRO 617 9.908 2.208 22.854 886 HB3 PRO 617 HB3 PRO 617 11.293 1.690 23.819 887 HG2 PRO 617 HG2 PRO 617 9.886 0.203 21.816 888 HG3 PRO 617 HG3 PRO 617 11.265 -0.322 22.788 889 HD2 PRO 617 HD2 PRO 617 8.381 -0.872 23.161 890 HD3 PRO 617 HD3 PRO 617 9.814 -1.784 23.704 891 H LEU 618 H LEU 618 8.623 3.742 24.558 892 HA LEU 618 HA LEU 618 5.817 3.029 24.308 893 HB2 LEU 618 HB2 LEU 618 5.364 5.494 24.568 894 HB3 LEU 618 HB3 LEU 618 6.130 4.726 25.933 895 HG LEU 618 HG LEU 618 8.315 5.754 25.086 896 HD11 LEU 618 HD11 LEU 618 6.447 7.401 23.420 897 HD12 LEU 618 HD12 LEU 618 7.682 6.291 22.829 898 HD13 LEU 618 HD13 LEU 618 8.150 7.742 23.717 899 HD21 LEU 618 HD21 LEU 618 6.094 7.561 25.995 900 HD22 LEU 618 HD22 LEU 618 7.817 7.922 26.090 901 HD23 LEU 618 HD23 LEU 618 7.143 6.586 27.025 902 H THR 619 H THR 619 7.445 2.359 22.196 903 HA THR 619 HA THR 619 7.742 3.909 19.995 904 HB THR 619 HB THR 619 6.821 1.035 20.002 905 HG1 THR 619 HG1 THR 619 9.412 2.184 20.322 906 HG21 THR 619 HG21 THR 619 8.167 0.860 17.953 907 HG22 THR 619 HG22 THR 619 8.571 2.574 18.066 908 HG23 THR 619 HG23 THR 619 6.908 2.080 17.764 909 H SER 620 H SER 620 6.190 5.334 19.448 910 HA SER 620 HA SER 620 4.018 4.517 17.820 911 HB2 SER 620 HB2 SER 620 2.138 5.339 19.296 912 HB3 SER 620 HB3 SER 620 2.880 3.817 19.795 913 HG SER 620 HG SER 620 4.263 5.215 21.152 914 H LYS 621 H LYS 621 5.857 7.020 19.401 915 HA LYS 621 HA LYS 621 4.455 9.013 17.779 916 HB2 LYS 621 HB2 LYS 621 4.411 10.587 19.682 917 HB3 LYS 621 HB3 LYS 621 3.396 9.172 19.925 918 HG2 LYS 621 HG2 LYS 621 4.980 8.210 21.449 919 HG3 LYS 621 HG3 LYS 621 6.163 9.465 21.085 920 HD2 LYS 621 HD2 LYS 621 5.080 9.902 23.225 921 HD3 LYS 621 HD3 LYS 621 4.666 11.151 22.055 922 HE2 LYS 621 HE2 LYS 621 2.513 10.027 21.649 923 HE3 LYS 621 HE3 LYS 621 2.932 8.806 22.849 924 HZ1 LYS 621 HZ1 LYS 621 2.997 10.580 24.527 925 HZ2 LYS 621 HZ2 LYS 621 1.493 10.504 23.763 926 HZ3 LYS 621 HZ3 LYS 621 2.554 11.712 23.351 927 H GLU 622 H GLU 622 7.157 7.663 17.888 928 HA GLU 622 HA GLU 622 8.990 9.717 18.681 929 HB2 GLU 622 HB2 GLU 622 9.579 7.267 16.997 930 HB3 GLU 622 HB3 GLU 622 10.774 8.312 17.736 931 HG2 GLU 622 HG2 GLU 622 10.693 6.419 19.096 932 HG3 GLU 622 HG3 GLU 622 9.760 7.621 19.972 933 H GLU 623 H GLU 623 8.466 8.236 15.502 934 HA GLU 623 HA GLU 623 8.696 10.832 14.223 935 HB2 GLU 623 HB2 GLU 623 10.487 8.462 13.711 936 HB3 GLU 623 HB3 GLU 623 10.213 9.699 12.502 937 HG2 GLU 623 HG2 GLU 623 11.305 10.275 15.243 938 HG3 GLU 623 HG3 GLU 623 12.315 9.940 13.836 939 H GLU 624 H GLU 624 6.889 10.913 13.081 940 HA GLU 624 HA GLU 624 5.410 8.638 12.321 941 HB2 GLU 624 HB2 GLU 624 4.375 10.830 12.733 942 HB3 GLU 624 HB3 GLU 624 5.181 11.479 11.312 943 HG2 GLU 624 HG2 GLU 624 3.941 9.925 9.901 944 HG3 GLU 624 HG3 GLU 624 3.138 9.277 11.327 945 H GLU 625 H GLU 625 8.126 9.979 10.988 946 HA GLU 625 HA GLU 625 8.062 9.567 8.276 947 HB2 GLU 625 HB2 GLU 625 9.966 10.434 9.545 948 HB3 GLU 625 HB3 GLU 625 10.243 8.839 10.222 949 HG2 GLU 625 HG2 GLU 625 10.777 7.992 8.014 950 HG3 GLU 625 HG3 GLU 625 10.482 9.590 7.321 951 H ARG 626 H ARG 626 8.183 7.164 10.856 952 HA ARG 626 HA ARG 626 8.790 4.884 9.294 953 HB2 ARG 626 HB2 ARG 626 7.972 3.567 11.152 954 HB3 ARG 626 HB3 ARG 626 8.940 4.913 11.734 955 HG2 ARG 626 HG2 ARG 626 6.931 6.141 12.314 956 HG3 ARG 626 HG3 ARG 626 5.938 4.814 11.708 957 HD2 ARG 626 HD2 ARG 626 6.153 4.749 14.129 958 HD3 ARG 626 HD3 ARG 626 6.889 3.335 13.374 959 HE ARG 626 HE ARG 626 8.999 4.852 13.569 960 HH11 ARG 626 HH11 ARG 626 6.427 4.535 15.953 961 HH12 ARG 626 HH12 ARG 626 7.523 4.638 17.292 962 HH21 ARG 626 HH21 ARG 626 10.434 5.066 15.451 963 HH22 ARG 626 HH22 ARG 626 9.697 4.912 16.998 964 H ARG 627 H ARG 627 5.848 6.637 9.839 965 HA ARG 627 HA ARG 627 4.030 4.592 9.001 966 HB2 ARG 627 HB2 ARG 627 3.405 6.383 10.525 967 HB3 ARG 627 HB3 ARG 627 3.760 7.575 9.295 968 HG2 ARG 627 HG2 ARG 627 1.916 6.754 7.946 969 HG3 ARG 627 HG3 ARG 627 1.573 5.516 9.168 970 HD2 ARG 627 HD2 ARG 627 1.213 7.139 10.797 971 HD3 ARG 627 HD3 ARG 627 1.653 8.453 9.698 972 HE ARG 627 HE ARG 627 -0.567 6.780 8.871 973 HH11 ARG 627 HH11 ARG 627 0.290 9.906 10.515 974 HH12 ARG 627 HH12 ARG 627 -1.239 10.543 10.239 975 HH21 ARG 627 HH21 ARG 627 -2.613 7.767 8.561 976 HH22 ARG 627 HH22 ARG 627 -2.928 9.346 9.133 977 H ILE 628 H ILE 628 6.040 6.887 7.482 978 HA ILE 628 HA ILE 628 4.641 6.677 4.952 979 HB ILE 628 HB ILE 628 7.339 7.960 5.532 980 HG12 ILE 628 HG12 ILE 628 4.605 9.264 5.336 981 HG13 ILE 628 HG13 ILE 628 5.501 9.012 6.827 982 HG21 ILE 628 HG21 ILE 628 6.985 7.380 3.179 983 HG22 ILE 628 HG22 ILE 628 6.960 9.130 3.402 984 HG23 ILE 628 HG23 ILE 628 5.449 8.248 3.188 985 HD11 ILE 628 HD11 ILE 628 6.352 10.758 4.527 986 HD12 ILE 628 HD12 ILE 628 7.252 10.514 6.025 987 HD13 ILE 628 HD13 ILE 628 5.678 11.308 6.063 988 H ALA 629 H ALA 629 7.676 5.734 6.467 989 HA ALA 629 HA ALA 629 8.710 4.225 4.324 990 HB1 ALA 629 HB1 ALA 629 10.090 5.088 6.161 991 HB2 ALA 629 HB2 ALA 629 10.304 3.350 5.944 992 HB3 ALA 629 HB3 ALA 629 9.310 3.958 7.267 993 H GLU 630 H GLU 630 6.283 3.478 6.635 994 HA GLU 630 HA GLU 630 6.582 0.686 6.674 995 HB2 GLU 630 HB2 GLU 630 4.455 0.580 7.827 996 HB3 GLU 630 HB3 GLU 630 5.253 2.055 8.351 997 HG2 GLU 630 HG2 GLU 630 3.905 3.397 6.986 998 HG3 GLU 630 HG3 GLU 630 3.138 1.978 6.269 999 H MET 631 H MET 631 5.394 2.763 4.243 1000 HA MET 631 HA MET 631 3.722 0.770 2.986 1001 HB2 MET 631 HB2 MET 631 3.470 2.288 1.135 1002 HB3 MET 631 HB3 MET 631 3.375 3.223 2.614 1003 HG2 MET 631 HG2 MET 631 5.633 4.020 2.301 1004 HG3 MET 631 HG3 MET 631 5.820 3.004 0.876 1005 HE1 MET 631 HE1 MET 631 6.363 6.200 1.075 1006 HE2 MET 631 HE2 MET 631 5.772 6.666 -0.525 1007 HE3 MET 631 HE3 MET 631 6.703 5.178 -0.317 1008 H GLY 632 H GLY 632 7.033 1.381 3.206 1009 HA2 GLY 632 HA2 GLY 632 7.766 0.271 0.653 1010 HA3 GLY 632 HA3 GLY 632 8.860 0.757 1.942 1011 H ARG 633 H ARG 633 6.884 -0.895 3.661 1012 HA ARG 633 HA ARG 633 8.126 -3.480 3.084 1013 HB2 ARG 633 HB2 ARG 633 8.221 -3.948 5.439 1014 HB3 ARG 633 HB3 ARG 633 8.857 -2.328 5.248 1015 HG2 ARG 633 HG2 ARG 633 6.675 -1.421 5.959 1016 HG3 ARG 633 HG3 ARG 633 6.104 -3.070 6.212 1017 HD2 ARG 633 HD2 ARG 633 8.025 -3.393 7.789 1018 HD3 ARG 633 HD3 ARG 633 8.347 -1.668 7.648 1019 HE ARG 633 HE ARG 633 5.813 -2.776 8.650 1020 HH11 ARG 633 HH11 ARG 633 8.405 -0.332 8.928 1021 HH12 ARG 633 HH12 ARG 633 7.733 0.381 10.312 1022 HH21 ARG 633 HH21 ARG 633 4.932 -1.792 10.513 1023 HH22 ARG 633 HH22 ARG 633 5.644 -0.419 11.216 1024 HA PRO 634 HA PRO 634 3.913 -4.751 2.805 1025 HB2 PRO 634 HB2 PRO 634 3.968 -7.349 3.553 1026 HB3 PRO 634 HB3 PRO 634 4.635 -6.766 2.019 1027 HG2 PRO 634 HG2 PRO 634 6.061 -7.539 4.523 1028 HG3 PRO 634 HG3 PRO 634 6.558 -7.747 2.838 1029 HD2 PRO 634 HD2 PRO 634 7.436 -5.735 4.547 1030 HD3 PRO 634 HD3 PRO 634 7.544 -5.698 2.777 1031 H ILE 635 H ILE 635 2.152 -4.553 3.992 1032 HA ILE 635 HA ILE 635 2.448 -5.039 6.823 1033 HB ILE 635 HB ILE 635 0.994 -3.073 7.292 1034 HG12 ILE 635 HG12 ILE 635 1.136 -1.181 5.497 1035 HG13 ILE 635 HG13 ILE 635 1.449 -2.477 4.359 1036 HG21 ILE 635 HG21 ILE 635 3.638 -2.542 5.989 1037 HG22 ILE 635 HG22 ILE 635 3.358 -2.943 7.687 1038 HG23 ILE 635 HG23 ILE 635 2.814 -1.389 7.042 1039 HD11 ILE 635 HD11 ILE 635 -0.730 -3.457 4.899 1040 HD12 ILE 635 HD12 ILE 635 -0.876 -1.801 4.312 1041 HD13 ILE 635 HD13 ILE 635 -1.030 -2.144 6.037 1042 H LEU 636 H LEU 636 0.174 -4.960 7.893 1043 HA LEU 636 HA LEU 636 -1.365 -6.727 6.219 1044 HB2 LEU 636 HB2 LEU 636 -2.355 -7.553 8.405 1045 HB3 LEU 636 HB3 LEU 636 -0.740 -8.054 7.969 1046 HG LEU 636 HG LEU 636 0.171 -6.417 9.605 1047 HD11 LEU 636 HD11 LEU 636 -1.312 -5.412 11.262 1048 HD12 LEU 636 HD12 LEU 636 -2.715 -6.027 10.384 1049 HD13 LEU 636 HD13 LEU 636 -1.670 -4.814 9.638 1050 HD21 LEU 636 HD21 LEU 636 -1.844 -8.343 10.656 1051 HD22 LEU 636 HD22 LEU 636 -0.456 -7.708 11.564 1052 HD23 LEU 636 HD23 LEU 636 -0.209 -8.746 10.144 1053 H GLY 637 H GLY 637 -3.681 -6.915 6.989 1054 HA2 GLY 637 HA2 GLY 637 -4.833 -4.451 6.131 1055 HA3 GLY 637 HA3 GLY 637 -5.610 -6.000 6.447 1056 H GLU 638 H GLU 638 -7.306 -4.777 7.244 1057 HA GLU 638 HA GLU 638 -7.147 -3.002 9.418 1058 HB2 GLU 638 HB2 GLU 638 -8.928 -3.025 7.726 1059 HB3 GLU 638 HB3 GLU 638 -9.483 -4.570 8.339 1060 HG2 GLU 638 HG2 GLU 638 -10.121 -3.541 10.425 1061 HG3 GLU 638 HG3 GLU 638 -9.451 -2.002 9.884 1062 H HIS 639 H HIS 639 -8.373 -6.338 9.241 1063 HA HIS 639 HA HIS 639 -7.552 -6.679 12.035 1064 HB2 HIS 639 HB2 HIS 639 -10.045 -7.760 10.694 1065 HB3 HIS 639 HB3 HIS 639 -9.401 -8.414 12.187 1066 HD1 HIS 639 HD1 HIS 639 -9.930 -7.126 14.353 1067 HD2 HIS 639 HD2 HIS 639 -11.197 -5.201 10.900 1068 HE1 HIS 639 HE1 HIS 639 -11.468 -5.293 15.105 1069 H THR 640 H THR 640 -6.333 -8.447 12.373 1070 HA THR 640 HA THR 640 -6.366 -10.413 10.254 1071 HB THR 640 HB THR 640 -3.987 -10.884 10.849 1072 HG1 THR 640 HG1 THR 640 -4.118 -9.166 12.646 1073 HG21 THR 640 HG21 THR 640 -4.712 -9.989 8.737 1074 HG22 THR 640 HG22 THR 640 -3.159 -9.290 9.185 1075 HG23 THR 640 HG23 THR 640 -4.646 -8.343 9.366 1076 H LYS 641 H LYS 641 -7.852 -11.394 11.470 1077 HA LYS 641 HA LYS 641 -6.836 -13.249 13.404 1078 HB2 LYS 641 HB2 LYS 641 -7.298 -11.234 14.818 1079 HB3 LYS 641 HB3 LYS 641 -8.969 -11.289 14.272 1080 HG2 LYS 641 HG2 LYS 641 -9.140 -13.585 15.271 1081 HG3 LYS 641 HG3 LYS 641 -7.532 -13.349 15.949 1082 HD2 LYS 641 HD2 LYS 641 -9.191 -12.854 17.629 1083 HD3 LYS 641 HD3 LYS 641 -8.391 -11.354 17.159 1084 HE2 LYS 641 HE2 LYS 641 -10.274 -10.813 15.685 1085 HE3 LYS 641 HE3 LYS 641 -11.066 -12.320 16.138 1086 HZ1 LYS 641 HZ1 LYS 641 -11.931 -10.407 17.290 1087 HZ2 LYS 641 HZ2 LYS 641 -10.406 -10.093 17.968 1088 HZ3 LYS 641 HZ3 LYS 641 -11.252 -11.496 18.385 1089 H LEU 642 H LEU 642 -8.093 -14.969 13.484 1090 HA LEU 642 HA LEU 642 -10.543 -14.987 11.855 1091 HB2 LEU 642 HB2 LEU 642 -8.631 -16.023 10.789 1092 HB3 LEU 642 HB3 LEU 642 -8.367 -17.001 12.213 1093 HG LEU 642 HG LEU 642 -10.619 -18.052 11.770 1094 HD11 LEU 642 HD11 LEU 642 -11.455 -17.914 9.517 1095 HD12 LEU 642 HD12 LEU 642 -10.267 -16.670 9.140 1096 HD13 LEU 642 HD13 LEU 642 -11.533 -16.349 10.329 1097 HD21 LEU 642 HD21 LEU 642 -8.340 -18.299 9.853 1098 HD22 LEU 642 HD22 LEU 642 -9.701 -19.421 9.950 1099 HD23 LEU 642 HD23 LEU 642 -8.618 -19.227 11.331 1100 H GLU 643 H GLU 643 -12.237 -15.693 12.994 1101 HA GLU 643 HA GLU 643 -11.865 -17.054 15.554 1102 HB2 GLU 643 HB2 GLU 643 -13.475 -15.157 15.357 1103 HB3 GLU 643 HB3 GLU 643 -14.357 -16.060 14.142 1104 HG2 GLU 643 HG2 GLU 643 -14.902 -17.766 15.835 1105 HG3 GLU 643 HG3 GLU 643 -14.050 -16.806 17.047 1106 H VAL 644 H VAL 644 -11.550 -19.226 15.289 1107 HA VAL 644 HA VAL 644 -12.882 -20.555 13.041 1108 HB VAL 644 HB VAL 644 -10.755 -21.678 14.874 1109 HG11 VAL 644 HG11 VAL 644 -10.495 -23.389 13.172 1110 HG12 VAL 644 HG12 VAL 644 -11.753 -22.636 12.192 1111 HG13 VAL 644 HG13 VAL 644 -12.157 -23.344 13.758 1112 HG21 VAL 644 HG21 VAL 644 -9.831 -19.799 13.653 1113 HG22 VAL 644 HG22 VAL 644 -10.461 -20.460 12.146 1114 HG23 VAL 644 HG23 VAL 644 -9.184 -21.319 13.014 1115 H ILE 645 H ILE 645 -14.771 -21.278 13.566 1116 HA ILE 645 HA ILE 645 -15.280 -22.231 16.277 1117 HB ILE 645 HB ILE 645 -17.207 -21.928 13.970 1118 HG12 ILE 645 HG12 ILE 645 -16.790 -20.018 16.272 1119 HG13 ILE 645 HG13 ILE 645 -16.103 -19.779 14.668 1120 HG21 ILE 645 HG21 ILE 645 -17.958 -23.459 15.702 1121 HG22 ILE 645 HG22 ILE 645 -18.910 -21.972 15.769 1122 HG23 ILE 645 HG23 ILE 645 -17.619 -22.254 16.942 1123 HD11 ILE 645 HD11 ILE 645 -19.030 -20.015 15.285 1124 HD12 ILE 645 HD12 ILE 645 -18.275 -19.710 13.705 1125 HD13 ILE 645 HD13 ILE 645 -18.147 -18.504 14.986 1126 H ILE 646 H ILE 646 -15.104 -24.347 16.654 1127 HA ILE 646 HA ILE 646 -15.139 -26.224 14.460 1128 HB ILE 646 HB ILE 646 -14.820 -26.645 17.458 1129 HG12 ILE 646 HG12 ILE 646 -12.709 -26.712 15.282 1130 HG13 ILE 646 HG13 ILE 646 -12.963 -25.365 16.384 1131 HG21 ILE 646 HG21 ILE 646 -14.436 -28.585 15.183 1132 HG22 ILE 646 HG22 ILE 646 -15.723 -28.626 16.387 1133 HG23 ILE 646 HG23 ILE 646 -14.050 -28.904 16.875 1134 HD11 ILE 646 HD11 ILE 646 -12.372 -26.788 18.268 1135 HD12 ILE 646 HD12 ILE 646 -11.082 -26.757 17.063 1136 HD13 ILE 646 HD13 ILE 646 -12.151 -28.154 17.177 1137 H GLU 647 H GLU 647 -17.112 -26.769 13.758 1138 HA GLU 647 HA GLU 647 -19.220 -26.950 15.766 1139 HB2 GLU 647 HB2 GLU 647 -19.512 -26.772 12.783 1140 HB3 GLU 647 HB3 GLU 647 -20.810 -26.802 13.960 1141 HG2 GLU 647 HG2 GLU 647 -19.957 -24.671 14.879 1142 HG3 GLU 647 HG3 GLU 647 -18.789 -24.622 13.556 1143 H GLU 648 H GLU 648 -20.283 -28.729 15.999 1144 HA GLU 648 HA GLU 648 -19.049 -31.085 15.081 1145 HB2 GLU 648 HB2 GLU 648 -20.735 -32.238 16.415 1146 HB3 GLU 648 HB3 GLU 648 -19.786 -31.072 17.297 1147 HG2 GLU 648 HG2 GLU 648 -22.566 -30.505 16.267 1148 HG3 GLU 648 HG3 GLU 648 -22.264 -31.106 17.900 1149 H SER 649 H SER 649 -19.532 -32.215 13.364 1150 HA SER 649 HA SER 649 -22.079 -31.961 12.111 1151 HB2 SER 649 HB2 SER 649 -19.677 -30.724 10.769 1152 HB3 SER 649 HB3 SER 649 -21.229 -31.013 9.984 1153 HG SER 649 HG SER 649 -21.518 -29.738 12.322 1154 H TYR 650 H TYR 650 -21.847 -34.262 12.500 1155 HA TYR 650 HA TYR 650 -20.257 -35.619 10.479 1156 HB2 TYR 650 HB2 TYR 650 -22.165 -36.578 12.604 1157 HB3 TYR 650 HB3 TYR 650 -21.723 -37.631 11.270 1158 HD1 TYR 650 HD1 TYR 650 -19.491 -38.447 11.055 1159 HD2 TYR 650 HD2 TYR 650 -20.622 -36.051 14.326 1160 HE1 TYR 650 HE1 TYR 650 -17.448 -39.178 12.272 1161 HE2 TYR 650 HE2 TYR 650 -18.606 -36.741 15.570 1162 HH TYR 650 HH TYR 650 -17.066 -38.625 15.582 1163 H GLU 651 H GLU 651 -23.528 -34.797 11.265 1164 HA GLU 651 HA GLU 651 -24.556 -36.019 8.940 1165 HB2 GLU 651 HB2 GLU 651 -25.801 -35.810 11.090 1166 HB3 GLU 651 HB3 GLU 651 -25.905 -34.078 10.826 1167 HG2 GLU 651 HG2 GLU 651 -27.971 -35.184 10.233 1168 HG3 GLU 651 HG3 GLU 651 -27.212 -34.466 8.809 1169 H PHE 652 H PHE 652 -24.016 -32.720 10.098 1170 HA PHE 652 HA PHE 652 -24.798 -31.450 7.651 1171 HB2 PHE 652 HB2 PHE 652 -25.050 -30.376 9.888 1172 HB3 PHE 652 HB3 PHE 652 -23.309 -30.348 10.059 1173 HD1 PHE 652 HD2 PHE 652 -26.208 -28.855 8.430 1174 HD2 PHE 652 HD1 PHE 652 -21.982 -28.712 8.843 1175 HE1 PHE 652 HE2 PHE 652 -26.191 -26.624 7.403 1176 HE2 PHE 652 HE1 PHE 652 -21.948 -26.472 7.818 1177 HZ PHE 652 HZ PHE 652 -24.058 -25.425 7.094 1178 H LYS 653 H LYS 653 -23.459 -30.584 6.101 1179 HA LYS 653 HA LYS 653 -20.598 -30.571 6.379 1180 HB2 LYS 653 HB2 LYS 653 -20.221 -31.870 4.296 1181 HB3 LYS 653 HB3 LYS 653 -20.922 -32.863 5.568 1182 HG2 LYS 653 HG2 LYS 653 -23.081 -32.753 4.540 1183 HG3 LYS 653 HG3 LYS 653 -22.503 -31.601 3.340 1184 HD2 LYS 653 HD2 LYS 653 -21.013 -33.281 2.415 1185 HD3 LYS 653 HD3 LYS 653 -21.515 -34.434 3.655 1186 HE2 LYS 653 HE2 LYS 653 -22.670 -34.845 1.532 1187 HE3 LYS 653 HE3 LYS 653 -23.789 -34.384 2.807 1188 HZ1 LYS 653 HZ1 LYS 653 -23.843 -32.117 1.861 1189 HZ2 LYS 653 HZ2 LYS 653 -24.285 -33.288 0.721 1190 HZ3 LYS 653 HZ3 LYS 653 -22.765 -32.620 0.661 1191 H SER 654 H SER 654 -19.696 -29.667 4.214 1192 HA SER 654 HA SER 654 -21.103 -27.300 3.591 1193 HB2 SER 654 HB2 SER 654 -18.792 -28.569 2.099 1194 HB3 SER 654 HB3 SER 654 -19.276 -26.874 2.049 1195 HG SER 654 HG SER 654 -17.530 -27.888 3.629 1196 H THR 655 H THR 655 -23.147 -27.986 2.814 1197 HA THR 655 HA THR 655 -23.188 -29.511 0.331 1198 HB THR 655 HB THR 655 -25.451 -28.842 2.228 1199 HG1 THR 655 HG1 THR 655 -24.427 -30.271 3.351 1200 HG21 THR 655 HG21 THR 655 -26.190 -29.345 -0.093 1201 HG22 THR 655 HG22 THR 655 -26.690 -30.593 1.043 1202 HG23 THR 655 HG23 THR 655 -25.316 -30.879 -0.019 1203 H VAL 656 H VAL 656 -23.475 -28.437 -1.481 1204 HA VAL 656 HA VAL 656 -24.576 -25.757 -1.383 1205 HB VAL 656 HB VAL 656 -23.776 -25.568 -3.784 1206 HG11 VAL 656 HG11 VAL 656 -22.514 -24.608 -1.957 1207 HG12 VAL 656 HG12 VAL 656 -21.401 -25.298 -3.142 1208 HG13 VAL 656 HG13 VAL 656 -21.746 -26.160 -1.642 1209 HG21 VAL 656 HG21 VAL 656 -22.330 -28.146 -3.116 1210 HG22 VAL 656 HG22 VAL 656 -22.078 -27.169 -4.564 1211 HG23 VAL 656 HG23 VAL 656 -23.625 -27.976 -4.302 1212 H ASP 657 H ASP 657 -26.580 -25.484 -1.738 1213 HA ASP 657 HA ASP 657 -28.113 -27.505 -3.213 1214 HB2 ASP 657 HB2 ASP 657 -28.977 -27.090 -1.012 1215 HB3 ASP 657 HB3 ASP 657 -28.952 -25.349 -1.276 Start of MODEL 11 1 H HIS 501 H HIS 501 2.724 0.894 -2.097 2 HA HIS 501 HA HIS 501 2.562 0.122 0.312 3 HB2 HIS 501 HB2 HIS 501 -0.280 0.897 -0.349 4 HB3 HIS 501 HB3 HIS 501 0.115 -0.254 0.916 5 HD1 HIS 501 HD1 HIS 501 0.466 3.455 0.102 6 HD2 HIS 501 HD2 HIS 501 1.000 0.791 3.240 7 HE1 HIS 501 HE1 HIS 501 0.890 4.859 2.127 8 H ALA 502 H ALA 502 2.608 -2.013 0.410 9 HA ALA 502 HA ALA 502 2.474 -3.595 -1.865 10 HB1 ALA 502 HB1 ALA 502 2.659 -5.499 -0.352 11 HB2 ALA 502 HB2 ALA 502 2.213 -4.470 1.009 12 HB3 ALA 502 HB3 ALA 502 3.729 -4.192 0.156 13 H GLY 503 H GLY 503 0.079 -3.236 0.746 14 HA2 GLY 503 HA2 GLY 503 -2.196 -3.126 -0.394 15 HA3 GLY 503 HA3 GLY 503 -1.788 -4.771 -0.874 16 H ILE 504 H ILE 504 -3.426 -5.740 0.305 17 HA ILE 504 HA ILE 504 -3.320 -5.337 3.185 18 HB ILE 504 HB ILE 504 -5.640 -6.001 1.353 19 HG12 ILE 504 HG12 ILE 504 -6.653 -3.909 2.507 20 HG13 ILE 504 HG13 ILE 504 -4.999 -3.541 2.967 21 HG21 ILE 504 HG21 ILE 504 -5.681 -5.868 4.319 22 HG22 ILE 504 HG22 ILE 504 -5.870 -7.298 3.295 23 HG23 ILE 504 HG23 ILE 504 -7.087 -6.016 3.255 24 HD11 ILE 504 HD11 ILE 504 -4.369 -3.446 0.601 25 HD12 ILE 504 HD12 ILE 504 -5.668 -2.310 0.965 26 HD13 ILE 504 HD13 ILE 504 -6.025 -3.828 0.140 27 H PHE 505 H PHE 505 -2.286 -7.115 4.067 28 HA PHE 505 HA PHE 505 -2.909 -9.805 3.064 29 HB2 PHE 505 HB2 PHE 505 -0.986 -8.761 5.136 30 HB3 PHE 505 HB3 PHE 505 -1.519 -10.426 5.214 31 HD1 PHE 505 HD2 PHE 505 -1.141 -11.864 3.144 32 HD2 PHE 505 HD1 PHE 505 0.816 -8.158 3.819 33 HE1 PHE 505 HE2 PHE 505 0.639 -12.532 1.597 34 HE2 PHE 505 HE1 PHE 505 2.611 -8.825 2.271 35 HZ PHE 505 HZ PHE 505 2.524 -11.011 1.161 36 H THR 506 H THR 506 -4.571 -10.941 3.907 37 HA THR 506 HA THR 506 -5.276 -10.749 6.631 38 HB THR 506 HB THR 506 -6.205 -8.556 5.787 39 HG1 THR 506 HG1 THR 506 -7.354 -9.122 7.492 40 HG21 THR 506 HG21 THR 506 -6.825 -9.280 3.510 41 HG22 THR 506 HG22 THR 506 -8.210 -8.585 4.354 42 HG23 THR 506 HG23 THR 506 -8.066 -10.334 4.188 43 H PHE 507 H PHE 507 -7.396 -11.926 6.968 44 HA PHE 507 HA PHE 507 -7.452 -14.360 5.402 45 HB2 PHE 507 HB2 PHE 507 -9.005 -13.335 7.759 46 HB3 PHE 507 HB3 PHE 507 -9.364 -14.889 7.000 47 HD1 PHE 507 HD2 PHE 507 -7.635 -16.642 7.058 48 HD2 PHE 507 HD1 PHE 507 -7.271 -13.059 9.300 49 HE1 PHE 507 HE2 PHE 507 -6.019 -17.738 8.494 50 HE2 PHE 507 HE1 PHE 507 -5.628 -14.131 10.771 51 HZ PHE 507 HZ PHE 507 -4.985 -16.476 10.381 52 H GLU 508 H GLU 508 -9.428 -15.102 4.314 53 HA GLU 508 HA GLU 508 -10.671 -13.114 2.749 54 HB2 GLU 508 HB2 GLU 508 -11.743 -15.863 3.344 55 HB3 GLU 508 HB3 GLU 508 -12.216 -14.827 2.002 56 HG2 GLU 508 HG2 GLU 508 -9.832 -15.018 1.215 57 HG3 GLU 508 HG3 GLU 508 -9.639 -16.288 2.426 58 H GLU 509 H GLU 509 -11.552 -14.626 5.753 59 HA GLU 509 HA GLU 509 -13.783 -12.815 6.072 60 HB2 GLU 509 HB2 GLU 509 -15.171 -14.739 6.878 61 HB3 GLU 509 HB3 GLU 509 -14.787 -14.808 5.165 62 HG2 GLU 509 HG2 GLU 509 -12.862 -16.349 5.853 63 HG3 GLU 509 HG3 GLU 509 -13.715 -16.495 7.388 64 HA PRO 510 HA PRO 510 -11.888 -12.645 10.069 65 HB2 PRO 510 HB2 PRO 510 -13.906 -11.666 11.576 66 HB3 PRO 510 HB3 PRO 510 -13.052 -10.680 10.383 67 HG2 PRO 510 HG2 PRO 510 -15.695 -12.066 10.157 68 HG3 PRO 510 HG3 PRO 510 -15.236 -10.440 9.617 69 HD2 PRO 510 HD2 PRO 510 -15.382 -12.579 7.930 70 HD3 PRO 510 HD3 PRO 510 -14.265 -11.225 7.685 71 H VAL 511 H VAL 511 -14.853 -14.489 9.657 72 HA VAL 511 HA VAL 511 -14.077 -16.142 11.957 73 HB VAL 511 HB VAL 511 -16.930 -15.487 11.186 74 HG11 VAL 511 HG11 VAL 511 -16.765 -17.637 12.185 75 HG12 VAL 511 HG12 VAL 511 -17.496 -16.531 13.353 76 HG13 VAL 511 HG13 VAL 511 -15.814 -17.005 13.522 77 HG21 VAL 511 HG21 VAL 511 -15.932 -13.477 12.115 78 HG22 VAL 511 HG22 VAL 511 -15.353 -14.374 13.515 79 HG23 VAL 511 HG23 VAL 511 -17.085 -14.163 13.256 80 H THR 512 H THR 512 -14.129 -18.316 11.505 81 HA THR 512 HA THR 512 -15.571 -19.155 9.143 82 HB THR 512 HB THR 512 -13.099 -18.863 8.578 83 HG1 THR 512 HG1 THR 512 -13.586 -20.331 7.178 84 HG21 THR 512 HG21 THR 512 -11.511 -20.580 9.399 85 HG22 THR 512 HG22 THR 512 -12.765 -21.203 10.465 86 HG23 THR 512 HG23 THR 512 -12.135 -19.579 10.710 87 H HIS 513 H HIS 513 -16.521 -21.157 9.444 88 HA HIS 513 HA HIS 513 -16.090 -22.285 12.111 89 HB2 HIS 513 HB2 HIS 513 -18.361 -23.134 12.116 90 HB3 HIS 513 HB3 HIS 513 -18.425 -21.434 11.692 91 HD1 HIS 513 HD1 HIS 513 -20.110 -24.311 10.912 92 HD2 HIS 513 HD2 HIS 513 -18.358 -21.393 8.560 93 HE1 HIS 513 HE1 HIS 513 -21.171 -24.525 8.617 94 H VAL 514 H VAL 514 -15.622 -24.416 12.325 95 HA VAL 514 HA VAL 514 -15.373 -25.928 9.849 96 HB VAL 514 HB VAL 514 -13.237 -26.859 10.520 97 HG11 VAL 514 HG11 VAL 514 -13.052 -24.873 9.210 98 HG12 VAL 514 HG12 VAL 514 -11.773 -24.835 10.436 99 HG13 VAL 514 HG13 VAL 514 -13.220 -23.858 10.636 100 HG21 VAL 514 HG21 VAL 514 -12.000 -26.065 12.509 101 HG22 VAL 514 HG22 VAL 514 -13.515 -26.853 12.951 102 HG23 VAL 514 HG23 VAL 514 -13.398 -25.096 12.976 103 H SER 515 H SER 515 -15.382 -28.190 10.195 104 HA SER 515 HA SER 515 -17.279 -28.965 12.209 105 HB2 SER 515 HB2 SER 515 -17.271 -29.759 9.798 106 HB3 SER 515 HB3 SER 515 -15.781 -30.568 10.180 107 HG SER 515 HG SER 515 -18.204 -31.101 11.540 108 H GLU 516 H GLU 516 -16.808 -30.399 13.900 109 HA GLU 516 HA GLU 516 -14.186 -30.744 14.791 110 HB2 GLU 516 HB2 GLU 516 -15.957 -30.861 16.425 111 HB3 GLU 516 HB3 GLU 516 -16.835 -31.921 15.340 112 HG2 GLU 516 HG2 GLU 516 -14.380 -33.052 16.457 113 HG3 GLU 516 HG3 GLU 516 -15.719 -32.772 17.582 114 H SER 517 H SER 517 -16.211 -32.558 12.597 115 HA SER 517 HA SER 517 -14.370 -34.809 12.565 116 HB2 SER 517 HB2 SER 517 -17.059 -34.475 11.241 117 HB3 SER 517 HB3 SER 517 -16.150 -35.972 11.432 118 HG SER 517 HG SER 517 -16.338 -35.083 13.859 119 H ILE 518 H ILE 518 -13.932 -32.034 11.154 120 HA ILE 518 HA ILE 518 -14.096 -32.747 8.356 121 HB ILE 518 HB ILE 518 -14.405 -30.385 8.933 122 HG12 ILE 518 HG12 ILE 518 -11.855 -30.794 7.378 123 HG13 ILE 518 HG13 ILE 518 -13.491 -30.847 6.726 124 HG21 ILE 518 HG21 ILE 518 -13.061 -30.240 10.886 125 HG22 ILE 518 HG22 ILE 518 -12.589 -28.995 9.736 126 HG23 ILE 518 HG23 ILE 518 -11.577 -30.436 9.945 127 HD11 ILE 518 HD11 ILE 518 -12.176 -28.461 7.976 128 HD12 ILE 518 HD12 ILE 518 -13.790 -28.496 7.264 129 HD13 ILE 518 HD13 ILE 518 -12.355 -28.739 6.242 130 H GLY 519 H GLY 519 -11.691 -32.963 10.812 131 HA2 GLY 519 HA2 GLY 519 -9.736 -34.283 10.645 132 HA3 GLY 519 HA3 GLY 519 -9.899 -34.219 8.898 133 H ILE 520 H ILE 520 -9.498 -32.135 7.896 134 HA ILE 520 HA ILE 520 -7.485 -30.564 9.350 135 HB ILE 520 HB ILE 520 -7.324 -31.459 6.482 136 HG12 ILE 520 HG12 ILE 520 -6.722 -33.333 7.975 137 HG13 ILE 520 HG13 ILE 520 -5.339 -32.788 7.039 138 HG21 ILE 520 HG21 ILE 520 -6.387 -29.263 6.724 139 HG22 ILE 520 HG22 ILE 520 -5.050 -30.395 6.499 140 HG23 ILE 520 HG23 ILE 520 -5.421 -29.769 8.103 141 HD11 ILE 520 HD11 ILE 520 -4.674 -33.291 9.280 142 HD12 ILE 520 HD12 ILE 520 -5.914 -32.228 9.929 143 HD13 ILE 520 HD13 ILE 520 -4.552 -31.546 9.032 144 H MET 521 H MET 521 -8.126 -28.516 9.246 145 HA MET 521 HA MET 521 -9.991 -27.810 7.105 146 HB2 MET 521 HB2 MET 521 -10.738 -25.959 8.454 147 HB3 MET 521 HB3 MET 521 -10.754 -27.402 9.442 148 HG2 MET 521 HG2 MET 521 -9.932 -25.758 10.888 149 HG3 MET 521 HG3 MET 521 -8.486 -26.558 10.306 150 HE1 MET 521 HE1 MET 521 -7.914 -22.528 10.763 151 HE2 MET 521 HE2 MET 521 -7.491 -24.063 11.506 152 HE3 MET 521 HE3 MET 521 -9.167 -23.477 11.557 153 H GLU 522 H GLU 522 -9.638 -25.913 5.855 154 HA GLU 522 HA GLU 522 -6.992 -24.773 6.092 155 HB2 GLU 522 HB2 GLU 522 -8.224 -25.997 3.666 156 HB3 GLU 522 HB3 GLU 522 -7.120 -24.641 3.500 157 HG2 GLU 522 HG2 GLU 522 -5.394 -25.820 4.565 158 HG3 GLU 522 HG3 GLU 522 -6.444 -27.192 4.941 159 H VAL 523 H VAL 523 -6.966 -22.739 6.064 160 HA VAL 523 HA VAL 523 -9.328 -21.263 5.117 161 HB VAL 523 HB VAL 523 -7.359 -20.474 7.286 162 HG11 VAL 523 HG11 VAL 523 -8.266 -18.556 6.021 163 HG12 VAL 523 HG12 VAL 523 -8.778 -18.589 7.696 164 HG13 VAL 523 HG13 VAL 523 -9.906 -19.087 6.429 165 HG21 VAL 523 HG21 VAL 523 -9.151 -20.880 8.847 166 HG22 VAL 523 HG22 VAL 523 -8.908 -22.324 7.872 167 HG23 VAL 523 HG23 VAL 523 -10.259 -21.249 7.529 168 H LYS 524 H LYS 524 -9.014 -19.749 3.653 169 HA LYS 524 HA LYS 524 -6.466 -19.611 2.270 170 HB2 LYS 524 HB2 LYS 524 -9.155 -18.379 1.668 171 HB3 LYS 524 HB3 LYS 524 -7.769 -18.463 0.586 172 HG2 LYS 524 HG2 LYS 524 -8.785 -21.024 1.675 173 HG3 LYS 524 HG3 LYS 524 -9.806 -20.202 0.506 174 HD2 LYS 524 HD2 LYS 524 -6.904 -20.620 -0.081 175 HD3 LYS 524 HD3 LYS 524 -8.049 -21.955 -0.325 176 HE2 LYS 524 HE2 LYS 524 -9.373 -20.376 -1.753 177 HE3 LYS 524 HE3 LYS 524 -8.055 -19.220 -1.601 178 HZ1 LYS 524 HZ1 LYS 524 -7.841 -20.455 -3.622 179 HZ2 LYS 524 HZ2 LYS 524 -7.912 -21.919 -2.827 180 HZ3 LYS 524 HZ3 LYS 524 -6.574 -20.920 -2.615 181 H VAL 525 H VAL 525 -5.102 -17.996 2.509 182 HA VAL 525 HA VAL 525 -5.978 -15.502 3.810 183 HB VAL 525 HB VAL 525 -3.187 -16.663 3.658 184 HG11 VAL 525 HG11 VAL 525 -3.166 -14.189 3.742 185 HG12 VAL 525 HG12 VAL 525 -2.571 -14.879 5.251 186 HG13 VAL 525 HG13 VAL 525 -4.212 -14.243 5.163 187 HG21 VAL 525 HG21 VAL 525 -4.604 -17.932 5.099 188 HG22 VAL 525 HG22 VAL 525 -5.112 -16.469 5.950 189 HG23 VAL 525 HG23 VAL 525 -3.434 -17.022 6.051 190 H LEU 526 H LEU 526 -5.810 -13.691 2.779 191 HA LEU 526 HA LEU 526 -5.365 -13.765 -0.055 192 HB2 LEU 526 HB2 LEU 526 -6.255 -11.567 1.796 193 HB3 LEU 526 HB3 LEU 526 -6.308 -11.505 0.048 194 HG LEU 526 HG LEU 526 -7.920 -13.420 1.768 195 HD11 LEU 526 HD11 LEU 526 -8.672 -11.178 2.101 196 HD12 LEU 526 HD12 LEU 526 -9.830 -12.050 1.097 197 HD13 LEU 526 HD13 LEU 526 -8.722 -10.889 0.363 198 HD21 LEU 526 HD21 LEU 526 -7.436 -14.349 -0.427 199 HD22 LEU 526 HD22 LEU 526 -7.951 -12.847 -1.187 200 HD23 LEU 526 HD23 LEU 526 -9.129 -13.849 -0.343 201 H ARG 527 H ARG 527 -3.545 -13.164 -1.024 202 HA ARG 527 HA ARG 527 -1.336 -11.853 0.239 203 HB2 ARG 527 HB2 ARG 527 -0.940 -13.340 -1.680 204 HB3 ARG 527 HB3 ARG 527 -2.017 -12.395 -2.684 205 HG2 ARG 527 HG2 ARG 527 0.191 -11.902 -3.392 206 HG3 ARG 527 HG3 ARG 527 -0.365 -10.496 -2.496 207 HD2 ARG 527 HD2 ARG 527 0.843 -11.775 -0.494 208 HD3 ARG 527 HD3 ARG 527 1.737 -12.485 -1.842 209 HE ARG 527 HE ARG 527 1.506 -9.570 -1.540 210 HH11 ARG 527 HH11 ARG 527 3.614 -12.346 -2.058 211 HH12 ARG 527 HH12 ARG 527 5.071 -11.459 -1.959 212 HH21 ARG 527 HH21 ARG 527 3.523 -8.329 -1.371 213 HH22 ARG 527 HH22 ARG 527 4.993 -9.123 -1.565 214 H THR 528 H THR 528 -0.533 -9.716 -0.460 215 HA THR 528 HA THR 528 -2.322 -7.606 -0.340 216 HB THR 528 HB THR 528 -0.329 -6.310 -1.194 217 HG1 THR 528 HG1 THR 528 1.100 -7.434 -2.147 218 HG21 THR 528 HG21 THR 528 0.960 -6.662 0.849 219 HG22 THR 528 HG22 THR 528 0.090 -8.168 1.140 220 HG23 THR 528 HG23 THR 528 -0.770 -6.627 1.186 221 H SER 529 H SER 529 -2.979 -6.116 -1.826 222 HA SER 529 HA SER 529 -3.984 -6.816 -4.250 223 HB2 SER 529 HB2 SER 529 -4.630 -4.838 -2.904 224 HB3 SER 529 HB3 SER 529 -3.085 -4.092 -3.246 225 HG SER 529 HG SER 529 -5.030 -4.800 -5.182 226 H GLY 530 H GLY 530 -0.822 -5.521 -3.428 227 HA2 GLY 530 HA2 GLY 530 0.050 -5.997 -6.185 228 HA3 GLY 530 HA3 GLY 530 0.793 -4.826 -5.086 229 H ALA 531 H ALA 531 0.765 -8.054 -6.124 230 HA ALA 531 HA ALA 531 2.186 -9.008 -3.797 231 HB1 ALA 531 HB1 ALA 531 2.228 -11.151 -4.903 232 HB2 ALA 531 HB2 ALA 531 1.687 -10.427 -6.408 233 HB3 ALA 531 HB3 ALA 531 0.591 -10.489 -5.020 234 H ARG 532 H ARG 532 4.131 -8.138 -3.637 235 HA ARG 532 HA ARG 532 5.923 -8.402 -5.942 236 HB2 ARG 532 HB2 ARG 532 6.029 -6.181 -3.882 237 HB3 ARG 532 HB3 ARG 532 7.027 -6.343 -5.314 238 HG2 ARG 532 HG2 ARG 532 4.063 -5.800 -5.286 239 HG3 ARG 532 HG3 ARG 532 5.335 -4.617 -5.578 240 HD2 ARG 532 HD2 ARG 532 5.962 -5.715 -7.621 241 HD3 ARG 532 HD3 ARG 532 4.872 -7.061 -7.278 242 HE ARG 532 HE ARG 532 3.712 -4.412 -7.480 243 HH11 ARG 532 HH11 ARG 532 4.360 -7.473 -9.120 244 HH12 ARG 532 HH12 ARG 532 3.057 -7.357 -10.207 245 HH21 ARG 532 HH21 ARG 532 1.926 -4.212 -8.966 246 HH22 ARG 532 HH22 ARG 532 1.607 -5.422 -10.108 247 H GLY 533 H GLY 533 7.352 -9.853 -5.450 248 HA2 GLY 533 HA2 GLY 533 9.176 -10.734 -4.448 249 HA3 GLY 533 HA3 GLY 533 9.040 -9.542 -3.170 250 H ASN 534 H ASN 534 9.900 -11.831 -2.444 251 HA ASN 534 HA ASN 534 7.794 -13.609 -1.610 252 HB2 ASN 534 HB2 ASN 534 9.929 -14.536 -2.400 253 HB3 ASN 534 HB3 ASN 534 10.778 -13.694 -1.111 254 HD21 ASN 534 HD21 ASN 534 7.651 -15.282 -0.674 255 HD22 ASN 534 HD22 ASN 534 8.268 -16.519 0.346 256 H VAL 535 H VAL 535 6.828 -13.486 0.214 257 HA VAL 535 HA VAL 535 7.948 -11.896 2.377 258 HB VAL 535 HB VAL 535 5.090 -11.831 1.353 259 HG11 VAL 535 HG11 VAL 535 6.365 -10.281 3.590 260 HG12 VAL 535 HG12 VAL 535 5.092 -11.502 3.735 261 HG13 VAL 535 HG13 VAL 535 4.766 -9.964 2.937 262 HG21 VAL 535 HG21 VAL 535 7.252 -9.777 1.186 263 HG22 VAL 535 HG22 VAL 535 5.561 -9.490 0.730 264 HG23 VAL 535 HG23 VAL 535 6.544 -10.679 -0.147 265 H ILE 536 H ILE 536 7.717 -12.911 4.265 266 HA ILE 536 HA ILE 536 6.147 -15.372 4.265 267 HB ILE 536 HB ILE 536 8.385 -14.503 6.111 268 HG12 ILE 536 HG12 ILE 536 9.184 -15.254 3.931 269 HG13 ILE 536 HG13 ILE 536 9.606 -16.441 5.166 270 HG21 ILE 536 HG21 ILE 536 6.718 -16.989 6.131 271 HG22 ILE 536 HG22 ILE 536 6.707 -15.718 7.341 272 HG23 ILE 536 HG23 ILE 536 8.146 -16.738 7.147 273 HD11 ILE 536 HD11 ILE 536 7.482 -16.596 3.046 274 HD12 ILE 536 HD12 ILE 536 7.558 -17.712 4.393 275 HD13 ILE 536 HD13 ILE 536 8.895 -17.632 3.240 276 H VAL 537 H VAL 537 4.442 -15.546 5.490 277 HA VAL 537 HA VAL 537 3.966 -13.444 7.444 278 HB VAL 537 HB VAL 537 1.851 -14.958 5.878 279 HG11 VAL 537 HG11 VAL 537 0.274 -13.342 6.828 280 HG12 VAL 537 HG12 VAL 537 1.588 -12.613 7.753 281 HG13 VAL 537 HG13 VAL 537 1.089 -14.270 8.090 282 HG21 VAL 537 HG21 VAL 537 2.799 -12.122 5.593 283 HG22 VAL 537 HG22 VAL 537 1.467 -12.855 4.682 284 HG23 VAL 537 HG23 VAL 537 3.128 -13.438 4.477 285 HA PRO 538 HA PRO 538 4.146 -17.227 9.950 286 HB2 PRO 538 HB2 PRO 538 4.330 -15.920 12.319 287 HB3 PRO 538 HB3 PRO 538 5.727 -16.270 11.292 288 HG2 PRO 538 HG2 PRO 538 4.235 -13.727 11.701 289 HG3 PRO 538 HG3 PRO 538 5.953 -13.970 11.362 290 HD2 PRO 538 HD2 PRO 538 4.082 -13.164 9.514 291 HD3 PRO 538 HD3 PRO 538 5.618 -13.950 9.108 292 H TYR 539 H TYR 539 2.671 -18.225 11.303 293 HA TYR 539 HA TYR 539 0.436 -16.624 12.243 294 HB2 TYR 539 HB2 TYR 539 -1.286 -17.993 11.303 295 HB3 TYR 539 HB3 TYR 539 -0.196 -17.540 10.006 296 HD1 TYR 539 HD1 TYR 539 -1.281 -20.331 12.172 297 HD2 TYR 539 HD2 TYR 539 0.953 -19.208 8.739 298 HE1 TYR 539 HE1 TYR 539 -1.168 -22.679 11.499 299 HE2 TYR 539 HE2 TYR 539 1.078 -21.573 8.051 300 HH TYR 539 HH TYR 539 0.848 -23.777 8.960 301 H LYS 540 H LYS 540 -0.939 -17.815 13.709 302 HA LYS 540 HA LYS 540 0.141 -20.225 14.921 303 HB2 LYS 540 HB2 LYS 540 0.360 -19.282 17.148 304 HB3 LYS 540 HB3 LYS 540 1.447 -18.466 16.036 305 HG2 LYS 540 HG2 LYS 540 0.052 -16.552 15.940 306 HG3 LYS 540 HG3 LYS 540 -1.245 -17.380 16.798 307 HD2 LYS 540 HD2 LYS 540 0.222 -17.547 18.772 308 HD3 LYS 540 HD3 LYS 540 1.452 -16.624 17.904 309 HE2 LYS 540 HE2 LYS 540 -1.334 -15.666 18.325 310 HE3 LYS 540 HE3 LYS 540 -0.039 -15.298 19.476 311 HZ1 LYS 540 HZ1 LYS 540 1.123 -14.128 17.722 312 HZ2 LYS 540 HZ2 LYS 540 -0.445 -13.500 17.788 313 HZ3 LYS 540 HZ3 LYS 540 -0.025 -14.575 16.586 314 H THR 541 H THR 541 -1.375 -21.310 16.208 315 HA THR 541 HA THR 541 -4.073 -20.382 15.990 316 HB THR 541 HB THR 541 -4.475 -22.517 17.338 317 HG1 THR 541 HG1 THR 541 -2.473 -23.026 18.181 318 HG21 THR 541 HG21 THR 541 -4.812 -22.400 14.924 319 HG22 THR 541 HG22 THR 541 -4.154 -23.969 15.392 320 HG23 THR 541 HG23 THR 541 -3.102 -22.742 14.668 321 H ILE 542 H ILE 542 -5.198 -19.463 17.561 322 HA ILE 542 HA ILE 542 -3.847 -18.951 20.104 323 HB ILE 542 HB ILE 542 -6.175 -17.566 18.808 324 HG12 ILE 542 HG12 ILE 542 -3.339 -16.558 19.078 325 HG13 ILE 542 HG13 ILE 542 -4.022 -17.238 17.604 326 HG21 ILE 542 HG21 ILE 542 -4.557 -16.804 21.255 327 HG22 ILE 542 HG22 ILE 542 -6.211 -17.405 21.253 328 HG23 ILE 542 HG23 ILE 542 -5.847 -15.831 20.544 329 HD11 ILE 542 HD11 ILE 542 -5.626 -15.453 17.483 330 HD12 ILE 542 HD12 ILE 542 -3.990 -14.783 17.616 331 HD13 ILE 542 HD13 ILE 542 -5.057 -14.801 19.018 332 H GLU 543 H GLU 543 -4.703 -20.019 21.779 333 HA GLU 543 HA GLU 543 -7.061 -21.599 21.506 334 HB2 GLU 543 HB2 GLU 543 -5.283 -20.981 23.857 335 HB3 GLU 543 HB3 GLU 543 -6.675 -22.052 23.956 336 HG2 GLU 543 HG2 GLU 543 -5.719 -23.597 22.472 337 HG3 GLU 543 HG3 GLU 543 -4.460 -22.468 21.981 338 H GLY 544 H GLY 544 -9.048 -21.215 22.200 339 HA2 GLY 544 HA2 GLY 544 -9.549 -18.675 23.595 340 HA3 GLY 544 HA3 GLY 544 -10.551 -19.198 22.239 341 H THR 545 H THR 545 -12.229 -20.492 22.627 342 HA THR 545 HA THR 545 -12.518 -21.467 25.321 343 HB THR 545 HB THR 545 -14.867 -22.054 24.391 344 HG1 THR 545 HG1 THR 545 -15.262 -20.427 22.622 345 HG21 THR 545 HG21 THR 545 -15.621 -19.727 24.668 346 HG22 THR 545 HG22 THR 545 -13.947 -19.183 24.557 347 HG23 THR 545 HG23 THR 545 -14.461 -20.182 25.914 348 H ALA 546 H ALA 546 -11.753 -22.485 22.161 349 HA ALA 546 HA ALA 546 -12.236 -25.289 22.678 350 HB1 ALA 546 HB1 ALA 546 -12.491 -24.417 20.401 351 HB2 ALA 546 HB2 ALA 546 -11.227 -25.649 20.470 352 HB3 ALA 546 HB3 ALA 546 -10.790 -23.940 20.381 353 H ARG 547 H ARG 547 -10.640 -26.792 23.061 354 HA ARG 547 HA ARG 547 -8.401 -25.641 24.471 355 HB2 ARG 547 HB2 ARG 547 -9.569 -28.406 24.521 356 HB3 ARG 547 HB3 ARG 547 -8.112 -27.956 25.411 357 HG2 ARG 547 HG2 ARG 547 -9.304 -26.237 26.574 358 HG3 ARG 547 HG3 ARG 547 -10.770 -26.585 25.669 359 HD2 ARG 547 HD2 ARG 547 -10.945 -28.758 26.725 360 HD3 ARG 547 HD3 ARG 547 -9.387 -28.520 27.527 361 HE ARG 547 HE ARG 547 -10.918 -26.367 28.199 362 HH11 ARG 547 HH11 ARG 547 -11.466 -29.851 28.637 363 HH12 ARG 547 HH12 ARG 547 -12.083 -29.688 30.219 364 HH21 ARG 547 HH21 ARG 547 -11.796 -26.163 30.375 365 HH22 ARG 547 HH22 ARG 547 -12.273 -27.558 31.208 366 H GLY 548 H GLY 548 -6.430 -25.561 23.895 367 HA2 GLY 548 HA2 GLY 548 -5.639 -26.668 21.352 368 HA3 GLY 548 HA3 GLY 548 -4.686 -25.609 22.381 369 H GLY 549 H GLY 549 -2.895 -26.964 21.966 370 HA2 GLY 549 HA2 GLY 549 -1.395 -28.560 22.614 371 HA3 GLY 549 HA3 GLY 549 -2.498 -28.961 23.918 372 H GLY 550 H GLY 550 -3.933 -29.150 20.832 373 HA2 GLY 550 HA2 GLY 550 -4.378 -30.915 19.419 374 HA3 GLY 550 HA3 GLY 550 -3.138 -31.847 20.251 375 H GLU 551 H GLU 551 -5.952 -30.278 21.667 376 HA GLU 551 HA GLU 551 -6.860 -32.953 22.521 377 HB2 GLU 551 HB2 GLU 551 -6.165 -31.249 24.268 378 HB3 GLU 551 HB3 GLU 551 -7.566 -30.315 23.742 379 HG2 GLU 551 HG2 GLU 551 -8.215 -31.543 25.668 380 HG3 GLU 551 HG3 GLU 551 -8.995 -32.277 24.274 381 H ASP 552 H ASP 552 -8.055 -29.715 21.716 382 HA ASP 552 HA ASP 552 -10.600 -30.831 20.718 383 HB2 ASP 552 HB2 ASP 552 -10.331 -28.842 22.394 384 HB3 ASP 552 HB3 ASP 552 -9.783 -27.941 21.005 385 H PHE 553 H PHE 553 -7.969 -28.635 20.032 386 HA PHE 553 HA PHE 553 -8.099 -29.387 17.215 387 HB2 PHE 553 HB2 PHE 553 -7.688 -27.113 16.463 388 HB3 PHE 553 HB3 PHE 553 -9.131 -27.127 17.464 389 HD1 PHE 553 HD1 PHE 553 -9.097 -26.072 19.685 390 HD2 PHE 553 HD2 PHE 553 -5.709 -25.946 17.116 391 HE1 PHE 553 HE1 PHE 553 -8.138 -24.251 21.028 392 HE2 PHE 553 HE2 PHE 553 -4.748 -24.136 18.463 393 HZ PHE 553 HZ PHE 553 -5.959 -23.281 20.411 394 H GLU 554 H GLU 554 -6.061 -29.241 16.150 395 HA GLU 554 HA GLU 554 -3.868 -29.785 17.920 396 HB2 GLU 554 HB2 GLU 554 -4.470 -30.853 15.619 397 HB3 GLU 554 HB3 GLU 554 -3.691 -29.424 14.948 398 HG2 GLU 554 HG2 GLU 554 -1.695 -30.049 16.396 399 HG3 GLU 554 HG3 GLU 554 -2.555 -31.568 16.646 400 H ASP 555 H ASP 555 -2.616 -28.224 18.679 401 HA ASP 555 HA ASP 555 -2.945 -25.510 17.767 402 HB2 ASP 555 HB2 ASP 555 -2.561 -26.004 20.162 403 HB3 ASP 555 HB3 ASP 555 -0.974 -26.656 19.763 404 H THR 556 H THR 556 -1.706 -24.498 16.310 405 HA THR 556 HA THR 556 0.704 -25.853 15.485 406 HB THR 556 HB THR 556 -1.191 -26.819 14.145 407 HG1 THR 556 HG1 THR 556 0.920 -26.684 13.304 408 HG21 THR 556 HG21 THR 556 -2.184 -25.416 12.344 409 HG22 THR 556 HG22 THR 556 -1.444 -23.997 13.082 410 HG23 THR 556 HG23 THR 556 -2.668 -24.909 13.954 411 H CYS 557 H CYS 557 1.984 -24.549 14.056 412 HA CYS 557 HA CYS 557 1.274 -21.798 13.729 413 HB2 CYS 557 HB2 CYS 557 3.456 -21.053 14.664 414 HB3 CYS 557 HB3 CYS 557 2.380 -21.727 15.877 415 HG CYS 557 HG CYS 557 3.723 -24.063 16.212 416 H GLY 558 H GLY 558 3.001 -20.790 12.265 417 HA2 GLY 558 HA2 GLY 558 4.841 -22.342 10.949 418 HA3 GLY 558 HA3 GLY 558 3.313 -22.486 10.081 419 H GLU 559 H GLU 559 4.841 -21.475 8.505 420 HA GLU 559 HA GLU 559 4.484 -18.588 8.590 421 HB2 GLU 559 HB2 GLU 559 7.010 -20.086 7.914 422 HB3 GLU 559 HB3 GLU 559 6.754 -18.397 7.513 423 HG2 GLU 559 HG2 GLU 559 6.596 -17.839 9.867 424 HG3 GLU 559 HG3 GLU 559 6.754 -19.541 10.298 425 H LEU 560 H LEU 560 3.375 -18.017 6.896 426 HA LEU 560 HA LEU 560 3.085 -19.838 4.660 427 HB2 LEU 560 HB2 LEU 560 1.786 -17.202 5.274 428 HB3 LEU 560 HB3 LEU 560 1.420 -18.192 3.878 429 HG LEU 560 HG LEU 560 0.941 -18.921 6.753 430 HD11 LEU 560 HD11 LEU 560 -1.410 -18.795 6.119 431 HD12 LEU 560 HD12 LEU 560 -0.945 -18.214 4.520 432 HD13 LEU 560 HD13 LEU 560 -0.593 -17.243 5.950 433 HD21 LEU 560 HD21 LEU 560 0.445 -20.454 4.204 434 HD22 LEU 560 HD22 LEU 560 -0.280 -20.869 5.755 435 HD23 LEU 560 HD23 LEU 560 1.471 -20.931 5.556 436 H GLU 561 H GLU 561 3.932 -19.555 2.747 437 HA GLU 561 HA GLU 561 5.786 -17.346 2.491 438 HB2 GLU 561 HB2 GLU 561 6.562 -19.723 2.380 439 HB3 GLU 561 HB3 GLU 561 5.622 -19.877 0.891 440 HG2 GLU 561 HG2 GLU 561 7.030 -17.978 -0.025 441 HG3 GLU 561 HG3 GLU 561 7.942 -18.087 1.436 442 H PHE 562 H PHE 562 4.823 -15.698 1.518 443 HA PHE 562 HA PHE 562 3.157 -16.228 -0.831 444 HB2 PHE 562 HB2 PHE 562 3.394 -13.805 0.955 445 HB3 PHE 562 HB3 PHE 562 2.535 -13.796 -0.576 446 HD1 PHE 562 HD1 PHE 562 0.412 -14.960 -0.821 447 HD2 PHE 562 HD2 PHE 562 2.501 -14.921 2.888 448 HE1 PHE 562 HE1 PHE 562 -1.617 -15.684 0.326 449 HE2 PHE 562 HE2 PHE 562 0.455 -15.658 4.038 450 HZ PHE 562 HZ PHE 562 -1.600 -16.033 2.752 451 H GLN 563 H GLN 563 3.627 -15.018 -2.758 452 HA GLN 563 HA GLN 563 6.155 -13.602 -2.817 453 HB2 GLN 563 HB2 GLN 563 5.586 -15.872 -4.746 454 HB3 GLN 563 HB3 GLN 563 7.025 -14.877 -4.687 455 HG2 GLN 563 HG2 GLN 563 7.292 -15.865 -2.303 456 HG3 GLN 563 HG3 GLN 563 6.174 -17.096 -2.878 457 HE21 GLN 563 HE21 GLN 563 8.686 -15.473 -4.768 458 HE22 GLN 563 HE22 GLN 563 9.631 -16.878 -4.979 459 H ASN 564 H ASN 564 6.313 -13.173 -5.489 460 HA ASN 564 HA ASN 564 3.932 -11.669 -6.019 461 HB2 ASN 564 HB2 ASN 564 5.045 -10.989 -8.109 462 HB3 ASN 564 HB3 ASN 564 6.160 -10.868 -6.765 463 HD21 ASN 564 HD21 ASN 564 6.589 -11.152 -9.646 464 HD22 ASN 564 HD22 ASN 564 7.630 -12.504 -9.830 465 H ASP 565 H ASP 565 5.080 -14.744 -6.587 466 HA ASP 565 HA ASP 565 3.216 -15.457 -8.687 467 HB2 ASP 565 HB2 ASP 565 5.421 -16.457 -8.742 468 HB3 ASP 565 HB3 ASP 565 5.227 -17.066 -7.105 469 H GLU 566 H GLU 566 3.700 -16.240 -5.211 470 HA GLU 566 HA GLU 566 1.341 -17.794 -5.019 471 HB2 GLU 566 HB2 GLU 566 3.162 -16.579 -2.967 472 HB3 GLU 566 HB3 GLU 566 1.670 -17.467 -2.620 473 HG2 GLU 566 HG2 GLU 566 3.860 -18.647 -4.264 474 HG3 GLU 566 HG3 GLU 566 3.897 -18.726 -2.502 475 H ILE 567 H ILE 567 -0.599 -17.126 -4.846 476 HA ILE 567 HA ILE 567 -1.122 -14.361 -4.103 477 HB ILE 567 HB ILE 567 -3.388 -14.945 -5.192 478 HG12 ILE 567 HG12 ILE 567 -2.703 -16.432 -7.350 479 HG13 ILE 567 HG13 ILE 567 -1.596 -17.082 -6.192 480 HG21 ILE 567 HG21 ILE 567 -0.873 -14.382 -6.784 481 HG22 ILE 567 HG22 ILE 567 -1.905 -13.188 -5.992 482 HG23 ILE 567 HG23 ILE 567 -2.507 -14.093 -7.380 483 HD11 ILE 567 HD11 ILE 567 -3.344 -17.721 -4.726 484 HD12 ILE 567 HD12 ILE 567 -3.597 -18.431 -6.323 485 HD13 ILE 567 HD13 ILE 567 -4.567 -17.049 -5.801 486 H VAL 568 H VAL 568 -2.049 -17.614 -3.375 487 HA VAL 568 HA VAL 568 -3.155 -16.564 -0.893 488 HB VAL 568 HB VAL 568 -5.076 -16.943 -2.507 489 HG11 VAL 568 HG11 VAL 568 -4.330 -18.943 -3.634 490 HG12 VAL 568 HG12 VAL 568 -5.885 -19.198 -2.834 491 HG13 VAL 568 HG13 VAL 568 -4.412 -19.815 -2.102 492 HG21 VAL 568 HG21 VAL 568 -5.140 -18.575 0.010 493 HG22 VAL 568 HG22 VAL 568 -6.538 -17.996 -0.906 494 HG23 VAL 568 HG23 VAL 568 -5.460 -16.845 -0.124 495 H LYS 569 H LYS 569 -2.945 -17.861 0.810 496 HA LYS 569 HA LYS 569 -1.800 -20.534 0.400 497 HB2 LYS 569 HB2 LYS 569 -1.007 -18.488 2.451 498 HB3 LYS 569 HB3 LYS 569 -0.603 -20.195 2.576 499 HG2 LYS 569 HG2 LYS 569 0.195 -19.239 0.007 500 HG3 LYS 569 HG3 LYS 569 0.807 -18.150 1.256 501 HD2 LYS 569 HD2 LYS 569 2.438 -19.869 0.863 502 HD3 LYS 569 HD3 LYS 569 1.716 -20.141 2.432 503 HE2 LYS 569 HE2 LYS 569 1.982 -22.236 1.228 504 HE3 LYS 569 HE3 LYS 569 0.278 -21.872 1.493 505 HZ1 LYS 569 HZ1 LYS 569 0.790 -22.734 -0.738 506 HZ2 LYS 569 HZ2 LYS 569 1.705 -21.364 -1.095 507 HZ3 LYS 569 HZ3 LYS 569 0.067 -21.229 -0.816 508 H THR 570 H THR 570 -2.177 -21.984 2.244 509 HA THR 570 HA THR 570 -4.626 -21.246 3.655 510 HB THR 570 HB THR 570 -4.969 -23.855 3.662 511 HG1 THR 570 HG1 THR 570 -4.213 -24.902 1.991 512 HG21 THR 570 HG21 THR 570 -6.385 -23.688 1.699 513 HG22 THR 570 HG22 THR 570 -5.625 -22.146 1.251 514 HG23 THR 570 HG23 THR 570 -6.571 -22.282 2.739 515 H ILE 571 H ILE 571 -4.814 -21.724 5.714 516 HA ILE 571 HA ILE 571 -2.529 -22.907 7.103 517 HB ILE 571 HB ILE 571 -5.046 -21.568 8.132 518 HG12 ILE 571 HG12 ILE 571 -3.362 -20.069 9.331 519 HG13 ILE 571 HG13 ILE 571 -2.155 -20.806 8.285 520 HG21 ILE 571 HG21 ILE 571 -4.221 -21.877 10.425 521 HG22 ILE 571 HG22 ILE 571 -2.939 -22.916 9.784 522 HG23 ILE 571 HG23 ILE 571 -4.637 -23.365 9.575 523 HD11 ILE 571 HD11 ILE 571 -2.915 -18.656 7.485 524 HD12 ILE 571 HD12 ILE 571 -4.560 -19.289 7.362 525 HD13 ILE 571 HD13 ILE 571 -3.277 -19.957 6.351 526 H SER 572 H SER 572 -2.560 -24.999 7.345 527 HA SER 572 HA SER 572 -5.096 -26.441 7.261 528 HB2 SER 572 HB2 SER 572 -3.479 -28.425 7.049 529 HB3 SER 572 HB3 SER 572 -3.558 -27.312 5.685 530 HG SER 572 HG SER 572 -1.549 -27.656 7.611 531 H VAL 573 H VAL 573 -5.994 -26.855 9.119 532 HA VAL 573 HA VAL 573 -4.260 -27.384 11.431 533 HB VAL 573 HB VAL 573 -6.886 -25.881 11.393 534 HG11 VAL 573 HG11 VAL 573 -5.349 -26.795 13.842 535 HG12 VAL 573 HG12 VAL 573 -6.916 -27.426 13.323 536 HG13 VAL 573 HG13 VAL 573 -6.764 -25.738 13.827 537 HG21 VAL 573 HG21 VAL 573 -4.186 -25.157 12.458 538 HG22 VAL 573 HG22 VAL 573 -5.603 -24.100 12.416 539 HG23 VAL 573 HG23 VAL 573 -4.845 -24.654 10.913 540 H LYS 574 H LYS 574 -4.422 -29.266 12.196 541 HA LYS 574 HA LYS 574 -6.427 -31.162 11.505 542 HB2 LYS 574 HB2 LYS 574 -4.250 -31.977 12.019 543 HB3 LYS 574 HB3 LYS 574 -4.178 -31.062 13.506 544 HG2 LYS 574 HG2 LYS 574 -4.473 -33.253 14.198 545 HG3 LYS 574 HG3 LYS 574 -6.072 -32.548 14.341 546 HD2 LYS 574 HD2 LYS 574 -6.338 -34.720 13.391 547 HD3 LYS 574 HD3 LYS 574 -6.560 -33.575 12.060 548 HE2 LYS 574 HE2 LYS 574 -4.327 -33.950 11.280 549 HE3 LYS 574 HE3 LYS 574 -3.937 -34.899 12.707 550 HZ1 LYS 574 HZ1 LYS 574 -5.872 -35.700 10.581 551 HZ2 LYS 574 HZ2 LYS 574 -5.478 -36.599 11.946 552 HZ3 LYS 574 HZ3 LYS 574 -4.311 -36.290 10.791 553 H VAL 575 H VAL 575 -8.390 -31.166 12.350 554 HA VAL 575 HA VAL 575 -8.786 -29.948 14.958 555 HB VAL 575 HB VAL 575 -10.891 -31.178 13.125 556 HG11 VAL 575 HG11 VAL 575 -12.465 -29.808 14.464 557 HG12 VAL 575 HG12 VAL 575 -11.141 -29.307 15.494 558 HG13 VAL 575 HG13 VAL 575 -11.617 -31.003 15.441 559 HG21 VAL 575 HG21 VAL 575 -11.455 -28.892 12.431 560 HG22 VAL 575 HG22 VAL 575 -9.802 -29.312 11.978 561 HG23 VAL 575 HG23 VAL 575 -10.099 -28.273 13.374 562 H ILE 576 H ILE 576 -9.120 -31.212 16.708 563 HA ILE 576 HA ILE 576 -8.212 -33.933 16.382 564 HB ILE 576 HB ILE 576 -8.821 -32.302 18.873 565 HG12 ILE 576 HG12 ILE 576 -7.026 -31.305 17.556 566 HG13 ILE 576 HG13 ILE 576 -6.430 -31.940 19.079 567 HG21 ILE 576 HG21 ILE 576 -7.242 -34.870 18.673 568 HG22 ILE 576 HG22 ILE 576 -8.874 -34.699 19.336 569 HG23 ILE 576 HG23 ILE 576 -7.523 -33.905 20.132 570 HD11 ILE 576 HD11 ILE 576 -4.885 -32.369 17.259 571 HD12 ILE 576 HD12 ILE 576 -6.152 -33.235 16.379 572 HD13 ILE 576 HD13 ILE 576 -5.538 -33.878 17.907 573 H ASP 577 H ASP 577 -9.397 -35.707 17.169 574 HA ASP 577 HA ASP 577 -12.238 -35.540 16.975 575 HB2 ASP 577 HB2 ASP 577 -10.987 -37.605 16.372 576 HB3 ASP 577 HB3 ASP 577 -10.498 -37.787 18.050 577 H ASP 578 H ASP 578 -12.857 -34.097 18.400 578 HA ASP 578 HA ASP 578 -11.924 -33.900 21.031 579 HB2 ASP 578 HB2 ASP 578 -12.607 -31.951 19.805 580 HB3 ASP 578 HB3 ASP 578 -14.241 -32.572 19.647 581 H GLU 579 H GLU 579 -12.303 -35.271 22.460 582 HA GLU 579 HA GLU 579 -14.569 -37.063 22.504 583 HB2 GLU 579 HB2 GLU 579 -12.387 -36.714 24.548 584 HB3 GLU 579 HB3 GLU 579 -13.443 -38.103 24.350 585 HG2 GLU 579 HG2 GLU 579 -12.425 -38.664 22.260 586 HG3 GLU 579 HG3 GLU 579 -11.473 -37.179 22.276 587 H GLU 580 H GLU 580 -13.277 -34.484 24.521 588 HA GLU 580 HA GLU 580 -15.650 -34.471 26.173 589 HB2 GLU 580 HB2 GLU 580 -14.433 -32.551 27.331 590 HB3 GLU 580 HB3 GLU 580 -13.606 -34.094 27.397 591 HG2 GLU 580 HG2 GLU 580 -12.168 -33.339 25.525 592 HG3 GLU 580 HG3 GLU 580 -12.951 -31.759 25.606 593 H TYR 581 H TYR 581 -16.075 -31.703 26.490 594 HA TYR 581 HA TYR 581 -16.013 -30.373 23.996 595 HB2 TYR 581 HB2 TYR 581 -18.426 -30.274 23.493 596 HB3 TYR 581 HB3 TYR 581 -17.795 -31.906 23.358 597 HD1 TYR 581 HD2 TYR 581 -19.902 -29.652 25.389 598 HD2 TYR 581 HD1 TYR 581 -18.639 -33.663 24.768 599 HE1 TYR 581 HE2 TYR 581 -21.694 -30.439 26.867 600 HE2 TYR 581 HE1 TYR 581 -20.438 -34.453 26.244 601 HH TYR 581 HH TYR 581 -21.791 -33.613 28.037 602 H GLU 582 H GLU 582 -17.344 -28.412 24.002 603 HA GLU 582 HA GLU 582 -18.322 -27.488 26.518 604 HB2 GLU 582 HB2 GLU 582 -15.875 -26.726 26.361 605 HB3 GLU 582 HB3 GLU 582 -16.325 -25.854 24.902 606 HG2 GLU 582 HG2 GLU 582 -17.933 -24.535 26.196 607 HG3 GLU 582 HG3 GLU 582 -17.446 -25.393 27.651 608 H LYS 583 H LYS 583 -19.842 -25.894 26.093 609 HA LYS 583 HA LYS 583 -21.346 -26.269 23.746 610 HB2 LYS 583 HB2 LYS 583 -22.331 -25.616 25.900 611 HB3 LYS 583 HB3 LYS 583 -21.534 -24.057 25.772 612 HG2 LYS 583 HG2 LYS 583 -22.841 -23.617 23.718 613 HG3 LYS 583 HG3 LYS 583 -23.701 -25.131 23.984 614 HD2 LYS 583 HD2 LYS 583 -25.023 -23.293 24.842 615 HD3 LYS 583 HD3 LYS 583 -24.448 -24.277 26.187 616 HE2 LYS 583 HE2 LYS 583 -24.258 -21.889 26.668 617 HE3 LYS 583 HE3 LYS 583 -22.677 -22.649 26.631 618 HZ1 LYS 583 HZ1 LYS 583 -22.636 -20.553 25.464 619 HZ2 LYS 583 HZ2 LYS 583 -23.884 -21.015 24.445 620 HZ3 LYS 583 HZ3 LYS 583 -22.390 -21.768 24.344 621 H ASN 584 H ASN 584 -20.332 -25.760 21.896 622 HA ASN 584 HA ASN 584 -19.625 -24.597 20.129 623 HB2 ASN 584 HB2 ASN 584 -21.798 -23.422 20.390 624 HB3 ASN 584 HB3 ASN 584 -21.004 -22.225 21.401 625 HD21 ASN 584 HD21 ASN 584 -21.316 -23.468 18.158 626 HD22 ASN 584 HD22 ASN 584 -20.672 -22.087 17.351 627 H LYS 585 H LYS 585 -17.531 -24.855 20.580 628 HA LYS 585 HA LYS 585 -16.309 -22.485 21.673 629 HB2 LYS 585 HB2 LYS 585 -14.283 -24.166 22.106 630 HB3 LYS 585 HB3 LYS 585 -15.538 -23.818 23.277 631 HG2 LYS 585 HG2 LYS 585 -15.134 -26.150 23.257 632 HG3 LYS 585 HG3 LYS 585 -16.712 -25.869 22.530 633 HD2 LYS 585 HD2 LYS 585 -15.725 -26.193 20.321 634 HD3 LYS 585 HD3 LYS 585 -14.138 -26.425 21.068 635 HE2 LYS 585 HE2 LYS 585 -15.150 -28.277 22.419 636 HE3 LYS 585 HE3 LYS 585 -16.588 -28.135 21.432 637 HZ1 LYS 585 HZ1 LYS 585 -14.982 -29.866 20.749 638 HZ2 LYS 585 HZ2 LYS 585 -13.875 -28.668 20.359 639 HZ3 LYS 585 HZ3 LYS 585 -15.327 -28.782 19.485 640 H THR 586 H THR 586 -14.332 -21.738 21.022 641 HA THR 586 HA THR 586 -13.686 -22.314 18.236 642 HB THR 586 HB THR 586 -15.481 -20.666 18.111 643 HG1 THR 586 HG1 THR 586 -13.429 -20.360 16.867 644 HG21 THR 586 HG21 THR 586 -15.364 -19.805 20.353 645 HG22 THR 586 HG22 THR 586 -15.344 -18.485 19.180 646 HG23 THR 586 HG23 THR 586 -13.848 -18.974 19.996 647 H PHE 587 H PHE 587 -11.704 -21.297 17.577 648 HA PHE 587 HA PHE 587 -10.076 -20.180 19.686 649 HB2 PHE 587 HB2 PHE 587 -8.147 -21.459 18.935 650 HB3 PHE 587 HB3 PHE 587 -9.428 -22.580 19.360 651 HD1 PHE 587 HD1 PHE 587 -10.702 -23.693 17.470 652 HD2 PHE 587 HD2 PHE 587 -7.180 -21.415 16.861 653 HE1 PHE 587 HE1 PHE 587 -10.348 -24.805 15.279 654 HE2 PHE 587 HE2 PHE 587 -6.832 -22.510 14.682 655 HZ PHE 587 HZ PHE 587 -8.417 -24.209 13.904 656 H PHE 588 H PHE 588 -8.107 -19.137 18.460 657 HA PHE 588 HA PHE 588 -9.322 -17.819 16.148 658 HB2 PHE 588 HB2 PHE 588 -7.631 -16.531 18.320 659 HB3 PHE 588 HB3 PHE 588 -8.083 -15.751 16.812 660 HD1 PHE 588 HD2 PHE 588 -9.442 -17.270 19.896 661 HD2 PHE 588 HD1 PHE 588 -10.112 -14.655 16.618 662 HE1 PHE 588 HE2 PHE 588 -11.531 -16.503 20.948 663 HE2 PHE 588 HE1 PHE 588 -12.198 -13.893 17.649 664 HZ PHE 588 HZ PHE 588 -12.917 -14.811 19.819 665 H LEU 589 H LEU 589 -7.917 -17.046 14.609 666 HA LEU 589 HA LEU 589 -5.267 -18.321 14.603 667 HB2 LEU 589 HB2 LEU 589 -7.346 -18.923 12.897 668 HB3 LEU 589 HB3 LEU 589 -6.545 -17.631 12.034 669 HG LEU 589 HG LEU 589 -5.776 -19.730 11.192 670 HD11 LEU 589 HD11 LEU 589 -3.646 -18.447 12.875 671 HD12 LEU 589 HD12 LEU 589 -4.092 -18.012 11.224 672 HD13 LEU 589 HD13 LEU 589 -3.367 -19.582 11.558 673 HD21 LEU 589 HD21 LEU 589 -5.035 -20.370 14.030 674 HD22 LEU 589 HD22 LEU 589 -4.593 -21.337 12.623 675 HD23 LEU 589 HD23 LEU 589 -6.292 -21.135 13.062 676 H GLU 590 H GLU 590 -3.717 -16.828 14.460 677 HA GLU 590 HA GLU 590 -4.461 -14.228 13.347 678 HB2 GLU 590 HB2 GLU 590 -4.342 -14.021 15.761 679 HB3 GLU 590 HB3 GLU 590 -2.721 -14.712 15.764 680 HG2 GLU 590 HG2 GLU 590 -1.926 -12.785 14.474 681 HG3 GLU 590 HG3 GLU 590 -3.545 -12.096 14.516 682 H ILE 591 H ILE 591 -3.200 -13.556 11.836 683 HA ILE 591 HA ILE 591 -0.699 -14.938 11.408 684 HB ILE 591 HB ILE 591 -0.750 -13.846 9.142 685 HG12 ILE 591 HG12 ILE 591 -3.588 -13.102 9.943 686 HG13 ILE 591 HG13 ILE 591 -2.269 -11.966 9.691 687 HG21 ILE 591 HG21 ILE 591 -1.425 -16.138 9.456 688 HG22 ILE 591 HG22 ILE 591 -2.445 -15.393 8.220 689 HG23 ILE 591 HG23 ILE 591 -3.056 -15.634 9.863 690 HD11 ILE 591 HD11 ILE 591 -3.514 -13.734 7.587 691 HD12 ILE 591 HD12 ILE 591 -2.199 -12.588 7.321 692 HD13 ILE 591 HD13 ILE 591 -3.796 -12.009 7.799 693 H GLY 592 H GLY 592 1.155 -13.885 11.415 694 HA2 GLY 592 HA2 GLY 592 1.140 -11.419 12.914 695 HA3 GLY 592 HA3 GLY 592 2.548 -12.405 12.525 696 H GLU 593 H GLU 593 3.155 -10.033 12.223 697 HA GLU 593 HA GLU 593 2.261 -8.709 9.931 698 HB2 GLU 593 HB2 GLU 593 4.823 -8.384 11.458 699 HB3 GLU 593 HB3 GLU 593 4.260 -7.285 10.203 700 HG2 GLU 593 HG2 GLU 593 2.219 -6.927 11.522 701 HG3 GLU 593 HG3 GLU 593 2.933 -7.874 12.827 702 HA PRO 594 HA PRO 594 4.283 -10.982 6.789 703 HB2 PRO 594 HB2 PRO 594 4.074 -9.095 4.836 704 HB3 PRO 594 HB3 PRO 594 2.732 -10.135 5.296 705 HG2 PRO 594 HG2 PRO 594 3.305 -7.314 6.026 706 HG3 PRO 594 HG3 PRO 594 1.749 -8.084 5.705 707 HD2 PRO 594 HD2 PRO 594 2.676 -7.513 8.189 708 HD3 PRO 594 HD3 PRO 594 1.566 -8.854 7.883 709 H ARG 595 H ARG 595 6.376 -11.186 6.556 710 HA ARG 595 HA ARG 595 8.001 -8.768 6.709 711 HB2 ARG 595 HB2 ARG 595 9.814 -10.163 7.626 712 HB3 ARG 595 HB3 ARG 595 8.385 -10.204 8.640 713 HG2 ARG 595 HG2 ARG 595 7.802 -12.404 7.666 714 HG3 ARG 595 HG3 ARG 595 9.299 -12.353 6.734 715 HD2 ARG 595 HD2 ARG 595 9.057 -12.349 9.743 716 HD3 ARG 595 HD3 ARG 595 9.578 -13.697 8.734 717 HE ARG 595 HE ARG 595 11.195 -11.446 8.256 718 HH11 ARG 595 HH11 ARG 595 10.678 -13.987 10.666 719 HH12 ARG 595 HH12 ARG 595 12.258 -13.860 11.314 720 HH21 ARG 595 HH21 ARG 595 13.350 -11.289 9.145 721 HH22 ARG 595 HH22 ARG 595 13.797 -12.335 10.416 722 H LEU 596 H LEU 596 9.058 -8.235 4.939 723 HA LEU 596 HA LEU 596 9.097 -9.831 2.620 724 HB2 LEU 596 HB2 LEU 596 9.366 -7.263 2.978 725 HB3 LEU 596 HB3 LEU 596 11.042 -7.628 3.302 726 HG LEU 596 HG LEU 596 10.675 -6.775 1.021 727 HD11 LEU 596 HD11 LEU 596 11.536 -9.641 1.043 728 HD12 LEU 596 HD12 LEU 596 12.558 -8.231 1.352 729 HD13 LEU 596 HD13 LEU 596 11.835 -8.474 -0.246 730 HD21 LEU 596 HD21 LEU 596 9.452 -8.026 -0.620 731 HD22 LEU 596 HD22 LEU 596 8.410 -7.705 0.790 732 HD23 LEU 596 HD23 LEU 596 9.136 -9.289 0.567 733 H VAL 597 H VAL 597 10.588 -11.321 2.072 734 HA VAL 597 HA VAL 597 12.213 -12.364 4.124 735 HB VAL 597 HB VAL 597 12.149 -13.070 1.175 736 HG11 VAL 597 HG11 VAL 597 13.343 -14.596 3.509 737 HG12 VAL 597 HG12 VAL 597 14.269 -13.798 2.237 738 HG13 VAL 597 HG13 VAL 597 13.235 -15.173 1.845 739 HG21 VAL 597 HG21 VAL 597 10.887 -14.315 3.590 740 HG22 VAL 597 HG22 VAL 597 10.732 -14.905 1.931 741 HG23 VAL 597 HG23 VAL 597 10.034 -13.344 2.394 742 H GLU 598 H GLU 598 13.788 -11.309 4.878 743 HA GLU 598 HA GLU 598 16.022 -10.392 3.282 744 HB2 GLU 598 HB2 GLU 598 14.258 -8.520 3.532 745 HB3 GLU 598 HB3 GLU 598 14.564 -8.609 5.256 746 HG2 GLU 598 HG2 GLU 598 15.833 -6.805 4.465 747 HG3 GLU 598 HG3 GLU 598 16.981 -8.119 4.716 748 H MET 599 H MET 599 17.852 -10.191 4.814 749 HA MET 599 HA MET 599 17.349 -11.812 7.201 750 HB2 MET 599 HB2 MET 599 18.960 -12.564 5.443 751 HB3 MET 599 HB3 MET 599 19.964 -11.183 5.859 752 HG2 MET 599 HG2 MET 599 20.188 -12.072 8.145 753 HG3 MET 599 HG3 MET 599 19.241 -13.479 7.661 754 HE1 MET 599 HE1 MET 599 23.353 -12.434 5.873 755 HE2 MET 599 HE2 MET 599 22.484 -11.409 7.017 756 HE3 MET 599 HE3 MET 599 21.875 -11.625 5.374 757 H SER 600 H SER 600 17.230 -8.715 6.699 758 HA SER 600 HA SER 600 19.160 -7.632 8.475 759 HB2 SER 600 HB2 SER 600 16.536 -6.432 7.570 760 HB3 SER 600 HB3 SER 600 17.935 -5.561 8.205 761 HG SER 600 HG SER 600 19.118 -6.272 6.396 762 H GLU 601 H GLU 601 19.096 -8.556 10.471 763 HA GLU 601 HA GLU 601 16.752 -8.046 12.148 764 HB2 GLU 601 HB2 GLU 601 16.963 -10.283 13.148 765 HB3 GLU 601 HB3 GLU 601 16.556 -10.381 11.440 766 HG2 GLU 601 HG2 GLU 601 18.771 -11.014 10.856 767 HG3 GLU 601 HG3 GLU 601 19.373 -10.629 12.464 768 H LYS 602 H LYS 602 17.381 -8.480 14.465 769 HA LYS 602 HA LYS 602 20.194 -8.435 15.108 770 HB2 LYS 602 HB2 LYS 602 18.222 -6.350 16.114 771 HB3 LYS 602 HB3 LYS 602 19.769 -6.665 16.867 772 HG2 LYS 602 HG2 LYS 602 19.348 -5.631 14.069 773 HG3 LYS 602 HG3 LYS 602 19.811 -4.670 15.474 774 HD2 LYS 602 HD2 LYS 602 21.861 -6.072 15.688 775 HD3 LYS 602 HD3 LYS 602 21.408 -6.893 14.191 776 HE2 LYS 602 HE2 LYS 602 22.995 -5.191 13.649 777 HE3 LYS 602 HE3 LYS 602 21.415 -4.672 13.065 778 HZ1 LYS 602 HZ1 LYS 602 23.017 -3.598 15.266 779 HZ2 LYS 602 HZ2 LYS 602 21.379 -3.576 15.461 780 HZ3 LYS 602 HZ3 LYS 602 22.058 -2.773 14.122 781 H LYS 603 H LYS 603 19.960 -10.452 15.915 782 HA LYS 603 HA LYS 603 18.091 -10.698 18.149 783 HB2 LYS 603 HB2 LYS 603 17.473 -12.137 16.209 784 HB3 LYS 603 HB3 LYS 603 19.035 -12.932 16.332 785 HG2 LYS 603 HG2 LYS 603 18.431 -13.693 18.604 786 HG3 LYS 603 HG3 LYS 603 16.845 -12.957 18.400 787 HD2 LYS 603 HD2 LYS 603 16.451 -14.413 16.442 788 HD3 LYS 603 HD3 LYS 603 18.015 -15.178 16.726 789 HE2 LYS 603 HE2 LYS 603 15.681 -15.161 18.645 790 HE3 LYS 603 HE3 LYS 603 16.179 -16.512 17.634 791 HZ1 LYS 603 HZ1 LYS 603 17.832 -15.300 19.803 792 HZ2 LYS 603 HZ2 LYS 603 18.242 -16.646 18.865 793 HZ3 LYS 603 HZ3 LYS 603 16.951 -16.723 19.908 794 H GLY 604 H GLY 604 19.484 -10.100 19.688 795 HA2 GLY 604 HA2 GLY 604 21.831 -11.829 20.069 796 HA3 GLY 604 HA3 GLY 604 21.767 -10.142 20.587 797 H GLY 605 H GLY 605 20.728 -9.614 22.416 798 HA2 GLY 605 HA2 GLY 605 18.830 -10.556 23.882 799 HA3 GLY 605 HA3 GLY 605 19.999 -11.854 24.135 800 H PHE 606 H PHE 606 21.681 -11.531 25.447 801 HA PHE 606 HA PHE 606 21.542 -9.089 26.967 802 HB2 PHE 606 HB2 PHE 606 23.055 -10.347 28.610 803 HB3 PHE 606 HB3 PHE 606 21.401 -10.903 28.455 804 HD1 PHE 606 HD1 PHE 606 20.914 -13.039 27.342 805 HD2 PHE 606 HD2 PHE 606 24.909 -11.717 27.966 806 HE1 PHE 606 HE1 PHE 606 21.725 -15.322 26.934 807 HE2 PHE 606 HE2 PHE 606 25.726 -13.984 27.552 808 HZ PHE 606 HZ PHE 606 24.135 -15.799 27.039 809 H THR 607 H THR 607 22.645 -7.538 26.219 810 HA THR 607 HA THR 607 25.080 -7.915 24.732 811 HB THR 607 HB THR 607 23.840 -5.332 25.724 812 HG1 THR 607 HG1 THR 607 23.065 -7.132 23.793 813 HG21 THR 607 HG21 THR 607 26.147 -5.122 24.883 814 HG22 THR 607 HG22 THR 607 25.004 -4.352 23.781 815 HG23 THR 607 HG23 THR 607 25.679 -5.933 23.389 816 H ILE 608 H ILE 608 24.152 -6.415 27.822 817 HA ILE 608 HA ILE 608 26.923 -6.674 28.727 818 HB ILE 608 HB ILE 608 24.818 -4.650 29.608 819 HG12 ILE 608 HG12 ILE 608 27.356 -4.193 28.017 820 HG13 ILE 608 HG13 ILE 608 25.724 -4.162 27.356 821 HG21 ILE 608 HG21 ILE 608 26.307 -5.259 31.438 822 HG22 ILE 608 HG22 ILE 608 26.619 -3.607 30.912 823 HG23 ILE 608 HG23 ILE 608 27.713 -4.904 30.438 824 HD11 ILE 608 HD11 ILE 608 25.204 -2.228 28.766 825 HD12 ILE 608 HD12 ILE 608 26.585 -1.918 27.714 826 HD13 ILE 608 HD13 ILE 608 26.840 -2.274 29.422 827 H THR 609 H THR 609 27.131 -7.833 30.606 828 HA THR 609 HA THR 609 24.813 -8.276 32.307 829 HB THR 609 HB THR 609 26.529 -10.641 31.427 830 HG1 THR 609 HG1 THR 609 24.469 -9.327 30.148 831 HG21 THR 609 HG21 THR 609 23.741 -10.456 32.604 832 HG22 THR 609 HG22 THR 609 25.198 -10.866 33.508 833 HG23 THR 609 HG23 THR 609 24.616 -11.945 32.239 834 H GLU 610 H GLU 610 27.003 -6.670 32.409 835 HA GLU 610 HA GLU 610 29.239 -7.609 33.917 836 HB2 GLU 610 HB2 GLU 610 29.286 -5.643 32.458 837 HB3 GLU 610 HB3 GLU 610 28.096 -4.854 33.470 838 HG2 GLU 610 HG2 GLU 610 29.736 -4.872 35.321 839 HG3 GLU 610 HG3 GLU 610 30.929 -5.544 34.202 840 H GLU 611 H GLU 611 26.276 -5.858 34.671 841 HA GLU 611 HA GLU 611 26.833 -6.373 37.486 842 HB2 GLU 611 HB2 GLU 611 26.835 -3.957 36.883 843 HB3 GLU 611 HB3 GLU 611 25.174 -4.122 36.334 844 HG2 GLU 611 HG2 GLU 611 25.348 -3.154 38.594 845 HG3 GLU 611 HG3 GLU 611 24.436 -4.663 38.560 846 H TYR 612 H TYR 612 25.234 -7.184 38.706 847 HA TYR 612 HA TYR 612 22.999 -8.137 37.157 848 HB2 TYR 612 HB2 TYR 612 22.824 -10.028 38.857 849 HB3 TYR 612 HB3 TYR 612 24.191 -10.083 37.761 850 HD1 TYR 612 HD2 TYR 612 26.464 -9.433 38.638 851 HD2 TYR 612 HD1 TYR 612 23.113 -9.996 41.186 852 HE1 TYR 612 HE2 TYR 612 27.970 -9.675 40.557 853 HE2 TYR 612 HE1 TYR 612 24.614 -10.242 43.113 854 HH TYR 612 HH TYR 612 26.881 -10.822 43.567 855 H ASP 613 H ASP 613 21.468 -6.848 37.368 856 HA ASP 613 HA ASP 613 20.823 -5.493 39.857 857 HB2 ASP 613 HB2 ASP 613 20.759 -4.369 37.594 858 HB3 ASP 613 HB3 ASP 613 19.404 -5.407 37.174 859 H ASP 614 H ASP 614 20.543 -8.387 39.165 860 HA ASP 614 HA ASP 614 18.200 -9.037 40.628 861 HB2 ASP 614 HB2 ASP 614 17.459 -8.873 38.129 862 HB3 ASP 614 HB3 ASP 614 18.599 -10.180 37.826 863 H LYS 615 H LYS 615 18.588 -11.869 40.125 864 HA LYS 615 HA LYS 615 21.294 -11.992 41.196 865 HB2 LYS 615 HB2 LYS 615 19.388 -13.435 42.116 866 HB3 LYS 615 HB3 LYS 615 19.517 -14.381 40.636 867 HG2 LYS 615 HG2 LYS 615 21.836 -14.925 41.166 868 HG3 LYS 615 HG3 LYS 615 21.727 -13.955 42.633 869 HD2 LYS 615 HD2 LYS 615 19.925 -15.449 43.429 870 HD3 LYS 615 HD3 LYS 615 20.165 -16.450 41.998 871 HE2 LYS 615 HE2 LYS 615 22.167 -15.887 44.178 872 HE3 LYS 615 HE3 LYS 615 21.323 -17.404 43.892 873 HZ1 LYS 615 HZ1 LYS 615 22.491 -17.512 41.703 874 HZ2 LYS 615 HZ2 LYS 615 23.507 -17.577 43.027 875 HZ3 LYS 615 HZ3 LYS 615 23.406 -16.160 42.165 876 H GLN 616 H GLN 616 19.537 -13.524 38.541 877 HA GLN 616 HA GLN 616 21.865 -13.044 36.864 878 HB2 GLN 616 HB2 GLN 616 20.136 -15.548 36.791 879 HB3 GLN 616 HB3 GLN 616 21.374 -15.154 35.609 880 HG2 GLN 616 HG2 GLN 616 23.058 -15.273 37.428 881 HG3 GLN 616 HG3 GLN 616 21.780 -15.798 38.521 882 HE21 GLN 616 HE21 GLN 616 24.184 -17.181 37.708 883 HE22 GLN 616 HE22 GLN 616 23.684 -18.683 37.044 884 HA PRO 617 HA PRO 617 18.125 -11.087 35.294 885 HB2 PRO 617 HB2 PRO 617 19.309 -8.849 34.341 886 HB3 PRO 617 HB3 PRO 617 18.865 -9.062 36.032 887 HG2 PRO 617 HG2 PRO 617 21.532 -9.153 34.757 888 HG3 PRO 617 HG3 PRO 617 21.090 -8.737 36.417 889 HD2 PRO 617 HD2 PRO 617 22.160 -11.191 35.517 890 HD3 PRO 617 HD3 PRO 617 21.478 -10.856 37.118 891 H LEU 618 H LEU 618 21.156 -11.429 33.532 892 HA LEU 618 HA LEU 618 21.713 -11.347 31.359 893 HB2 LEU 618 HB2 LEU 618 19.081 -12.827 31.036 894 HB3 LEU 618 HB3 LEU 618 20.251 -12.642 29.755 895 HG LEU 618 HG LEU 618 20.491 -14.820 30.549 896 HD11 LEU 618 HD11 LEU 618 22.590 -13.781 30.112 897 HD12 LEU 618 HD12 LEU 618 22.743 -14.954 31.415 898 HD13 LEU 618 HD13 LEU 618 22.706 -13.231 31.784 899 HD21 LEU 618 HD21 LEU 618 20.653 -13.758 33.370 900 HD22 LEU 618 HD22 LEU 618 20.865 -15.445 32.899 901 HD23 LEU 618 HD23 LEU 618 19.306 -14.655 32.670 902 H THR 619 H THR 619 21.517 -9.075 31.577 903 HA THR 619 HA THR 619 19.420 -7.466 31.158 904 HB THR 619 HB THR 619 22.220 -6.930 30.216 905 HG1 THR 619 HG1 THR 619 22.774 -6.682 32.333 906 HG21 THR 619 HG21 THR 619 20.209 -5.232 31.700 907 HG22 THR 619 HG22 THR 619 20.504 -5.157 29.968 908 HG23 THR 619 HG23 THR 619 21.785 -4.711 31.098 909 H SER 620 H SER 620 18.054 -7.661 29.466 910 HA SER 620 HA SER 620 18.985 -8.501 26.860 911 HB2 SER 620 HB2 SER 620 16.176 -7.968 27.804 912 HB3 SER 620 HB3 SER 620 16.673 -8.881 26.376 913 HG SER 620 HG SER 620 17.916 -9.885 28.536 914 H LYS 621 H LYS 621 19.731 -6.990 25.565 915 HA LYS 621 HA LYS 621 18.117 -4.624 25.030 916 HB2 LYS 621 HB2 LYS 621 20.974 -4.611 25.888 917 HB3 LYS 621 HB3 LYS 621 20.529 -3.531 24.584 918 HG2 LYS 621 HG2 LYS 621 20.473 -2.286 26.605 919 HG3 LYS 621 HG3 LYS 621 18.810 -2.531 26.105 920 HD2 LYS 621 HD2 LYS 621 18.595 -4.334 27.755 921 HD3 LYS 621 HD3 LYS 621 20.271 -4.081 28.245 922 HE2 LYS 621 HE2 LYS 621 19.705 -1.752 28.853 923 HE3 LYS 621 HE3 LYS 621 18.030 -2.073 28.423 924 HZ1 LYS 621 HZ1 LYS 621 18.289 -2.250 30.766 925 HZ2 LYS 621 HZ2 LYS 621 19.574 -3.315 30.637 926 HZ3 LYS 621 HZ3 LYS 621 18.020 -3.802 30.180 927 H GLU 622 H GLU 622 18.043 -4.036 22.933 928 HA GLU 622 HA GLU 622 19.940 -4.940 20.983 929 HB2 GLU 622 HB2 GLU 622 18.256 -5.992 19.526 930 HB3 GLU 622 HB3 GLU 622 18.347 -6.868 21.048 931 HG2 GLU 622 HG2 GLU 622 16.313 -5.820 21.818 932 HG3 GLU 622 HG3 GLU 622 16.261 -4.801 20.386 933 H GLU 623 H GLU 623 18.881 -4.001 18.756 934 HA GLU 623 HA GLU 623 17.081 -1.859 19.391 935 HB2 GLU 623 HB2 GLU 623 18.292 -0.138 18.236 936 HB3 GLU 623 HB3 GLU 623 19.433 -0.869 19.337 937 HG2 GLU 623 HG2 GLU 623 19.268 -1.553 16.418 938 HG3 GLU 623 HG3 GLU 623 20.291 -0.275 17.053 939 H GLU 624 H GLU 624 15.982 -1.121 17.409 940 HA GLU 624 HA GLU 624 16.209 -3.222 15.443 941 HB2 GLU 624 HB2 GLU 624 13.870 -3.069 14.897 942 HB3 GLU 624 HB3 GLU 624 13.998 -3.248 16.628 943 HG2 GLU 624 HG2 GLU 624 12.261 -1.715 16.308 944 HG3 GLU 624 HG3 GLU 624 13.642 -0.705 16.724 945 H GLU 625 H GLU 625 16.953 -2.695 13.632 946 HA GLU 625 HA GLU 625 16.760 0.104 12.758 947 HB2 GLU 625 HB2 GLU 625 18.812 -1.999 11.986 948 HB3 GLU 625 HB3 GLU 625 18.800 -0.327 11.440 949 HG2 GLU 625 HG2 GLU 625 19.097 0.398 13.787 950 HG3 GLU 625 HG3 GLU 625 19.218 -1.294 14.255 951 H ARG 626 H ARG 626 15.006 -2.206 12.683 952 HA ARG 626 HA ARG 626 15.005 -3.333 10.059 953 HB2 ARG 626 HB2 ARG 626 12.809 -3.382 12.124 954 HB3 ARG 626 HB3 ARG 626 13.007 -4.482 10.770 955 HG2 ARG 626 HG2 ARG 626 15.067 -5.353 11.819 956 HG3 ARG 626 HG3 ARG 626 14.800 -4.277 13.190 957 HD2 ARG 626 HD2 ARG 626 12.574 -5.378 13.516 958 HD3 ARG 626 HD3 ARG 626 13.032 -6.530 12.267 959 HE ARG 626 HE ARG 626 14.482 -6.198 14.813 960 HH11 ARG 626 HH11 ARG 626 13.355 -8.345 12.217 961 HH12 ARG 626 HH12 ARG 626 13.725 -9.774 13.071 962 HH21 ARG 626 HH21 ARG 626 14.978 -8.149 15.944 963 HH22 ARG 626 HH22 ARG 626 14.651 -9.668 15.236 964 H ARG 627 H ARG 627 13.276 -0.833 11.854 965 HA ARG 627 HA ARG 627 11.223 -0.294 10.120 966 HB2 ARG 627 HB2 ARG 627 11.776 0.642 12.500 967 HB3 ARG 627 HB3 ARG 627 12.576 1.929 11.615 968 HG2 ARG 627 HG2 ARG 627 9.688 1.188 11.203 969 HG3 ARG 627 HG3 ARG 627 10.213 2.417 12.349 970 HD2 ARG 627 HD2 ARG 627 11.016 3.785 10.590 971 HD3 ARG 627 HD3 ARG 627 10.879 2.471 9.427 972 HE ARG 627 HE ARG 627 8.366 2.777 10.337 973 HH11 ARG 627 HH11 ARG 627 10.702 5.087 9.022 974 HH12 ARG 627 HH12 ARG 627 9.551 6.006 8.173 975 HH21 ARG 627 HH21 ARG 627 6.767 4.034 9.132 976 HH22 ARG 627 HH22 ARG 627 7.268 5.402 8.254 977 H ILE 628 H ILE 628 14.554 0.748 9.922 978 HA ILE 628 HA ILE 628 14.341 2.755 7.976 979 HB ILE 628 HB ILE 628 16.628 0.776 8.343 980 HG12 ILE 628 HG12 ILE 628 16.209 3.508 9.593 981 HG13 ILE 628 HG13 ILE 628 16.015 1.973 10.427 982 HG21 ILE 628 HG21 ILE 628 18.041 2.530 7.342 983 HG22 ILE 628 HG22 ILE 628 16.614 3.533 7.088 984 HG23 ILE 628 HG23 ILE 628 16.780 2.006 6.223 985 HD11 ILE 628 HD11 ILE 628 18.578 3.043 9.266 986 HD12 ILE 628 HD12 ILE 628 18.390 1.503 10.103 987 HD13 ILE 628 HD13 ILE 628 18.137 3.014 10.975 988 H ALA 629 H ALA 629 14.317 -0.716 7.724 989 HA ALA 629 HA ALA 629 14.204 -0.642 4.820 990 HB1 ALA 629 HB1 ALA 629 14.175 -3.084 4.968 991 HB2 ALA 629 HB2 ALA 629 14.050 -2.981 6.724 992 HB3 ALA 629 HB3 ALA 629 15.511 -2.422 5.913 993 H GLU 630 H GLU 630 12.189 -1.310 7.632 994 HA GLU 630 HA GLU 630 9.931 -2.302 6.278 995 HB2 GLU 630 HB2 GLU 630 9.903 -0.977 8.980 996 HB3 GLU 630 HB3 GLU 630 8.645 -1.958 8.283 997 HG2 GLU 630 HG2 GLU 630 10.189 -3.885 8.235 998 HG3 GLU 630 HG3 GLU 630 11.380 -2.898 9.084 999 H MET 631 H MET 631 11.029 0.851 6.346 1000 HA MET 631 HA MET 631 8.561 2.229 6.167 1001 HB2 MET 631 HB2 MET 631 9.800 4.091 5.231 1002 HB3 MET 631 HB3 MET 631 10.736 3.380 6.534 1003 HG2 MET 631 HG2 MET 631 12.162 2.252 4.935 1004 HG3 MET 631 HG3 MET 631 11.183 2.865 3.603 1005 HE1 MET 631 HE1 MET 631 13.267 3.800 2.395 1006 HE2 MET 631 HE2 MET 631 14.298 3.168 3.676 1007 HE3 MET 631 HE3 MET 631 14.484 4.840 3.141 1008 H GLY 632 H GLY 632 10.103 0.101 3.992 1009 HA2 GLY 632 HA2 GLY 632 8.053 0.669 1.984 1010 HA3 GLY 632 HA3 GLY 632 9.747 0.583 1.500 1011 H ARG 633 H ARG 633 7.514 -1.293 3.535 1012 HA ARG 633 HA ARG 633 8.423 -3.777 2.248 1013 HB2 ARG 633 HB2 ARG 633 8.149 -3.192 5.191 1014 HB3 ARG 633 HB3 ARG 633 8.248 -4.818 4.576 1015 HG2 ARG 633 HG2 ARG 633 10.335 -2.679 4.368 1016 HG3 ARG 633 HG3 ARG 633 10.374 -4.085 5.440 1017 HD2 ARG 633 HD2 ARG 633 10.345 -5.491 3.343 1018 HD3 ARG 633 HD3 ARG 633 10.589 -3.981 2.454 1019 HE ARG 633 HE ARG 633 12.444 -4.302 4.552 1020 HH11 ARG 633 HH11 ARG 633 11.868 -5.148 1.131 1021 HH12 ARG 633 HH12 ARG 633 13.483 -5.586 0.843 1022 HH21 ARG 633 HH21 ARG 633 14.697 -4.877 4.092 1023 HH22 ARG 633 HH22 ARG 633 15.101 -5.493 2.566 1024 HA PRO 634 HA PRO 634 4.070 -4.916 2.256 1025 HB2 PRO 634 HB2 PRO 634 4.064 -7.462 3.213 1026 HB3 PRO 634 HB3 PRO 634 4.556 -7.041 1.566 1027 HG2 PRO 634 HG2 PRO 634 6.264 -7.571 3.974 1028 HG3 PRO 634 HG3 PRO 634 6.477 -8.131 2.316 1029 HD2 PRO 634 HD2 PRO 634 7.866 -6.076 3.254 1030 HD3 PRO 634 HD3 PRO 634 7.315 -6.101 1.575 1031 H ILE 635 H ILE 635 2.363 -4.682 3.540 1032 HA ILE 635 HA ILE 635 2.742 -5.040 6.381 1033 HB ILE 635 HB ILE 635 1.325 -3.017 6.795 1034 HG12 ILE 635 HG12 ILE 635 1.416 -1.234 4.895 1035 HG13 ILE 635 HG13 ILE 635 1.684 -2.591 3.816 1036 HG21 ILE 635 HG21 ILE 635 3.138 -1.371 6.386 1037 HG22 ILE 635 HG22 ILE 635 3.923 -2.591 5.371 1038 HG23 ILE 635 HG23 ILE 635 3.703 -2.892 7.095 1039 HD11 ILE 635 HD11 ILE 635 -0.738 -2.144 5.546 1040 HD12 ILE 635 HD12 ILE 635 -0.484 -3.515 4.467 1041 HD13 ILE 635 HD13 ILE 635 -0.631 -1.887 3.805 1042 H LEU 636 H LEU 636 0.599 -5.132 7.531 1043 HA LEU 636 HA LEU 636 -1.031 -6.868 5.899 1044 HB2 LEU 636 HB2 LEU 636 -2.069 -7.574 8.112 1045 HB3 LEU 636 HB3 LEU 636 -0.466 -8.131 7.719 1046 HG LEU 636 HG LEU 636 0.485 -6.458 9.298 1047 HD11 LEU 636 HD11 LEU 636 -0.964 -5.286 10.871 1048 HD12 LEU 636 HD12 LEU 636 -2.383 -5.868 9.994 1049 HD13 LEU 636 HD13 LEU 636 -1.256 -4.763 9.211 1050 HD21 LEU 636 HD21 LEU 636 0.028 -8.719 10.044 1051 HD22 LEU 636 HD22 LEU 636 -1.617 -8.249 10.468 1052 HD23 LEU 636 HD23 LEU 636 -0.251 -7.560 11.348 1053 H GLY 637 H GLY 637 -3.412 -7.002 6.719 1054 HA2 GLY 637 HA2 GLY 637 -4.544 -4.583 5.747 1055 HA3 GLY 637 HA3 GLY 637 -5.360 -6.056 6.266 1056 H GLU 638 H GLU 638 -6.794 -4.258 6.892 1057 HA GLU 638 HA GLU 638 -6.280 -2.627 9.140 1058 HB2 GLU 638 HB2 GLU 638 -8.001 -2.149 7.452 1059 HB3 GLU 638 HB3 GLU 638 -8.878 -3.590 7.932 1060 HG2 GLU 638 HG2 GLU 638 -9.309 -2.630 10.105 1061 HG3 GLU 638 HG3 GLU 638 -8.376 -1.198 9.680 1062 H HIS 639 H HIS 639 -7.783 -5.795 8.687 1063 HA HIS 639 HA HIS 639 -7.381 -6.307 11.529 1064 HB2 HIS 639 HB2 HIS 639 -9.843 -7.138 9.955 1065 HB3 HIS 639 HB3 HIS 639 -9.455 -7.676 11.579 1066 HD1 HIS 639 HD1 HIS 639 -9.838 -5.915 13.530 1067 HD2 HIS 639 HD2 HIS 639 -10.908 -4.620 9.729 1068 HE1 HIS 639 HE1 HIS 639 -11.248 -3.875 13.859 1069 H THR 640 H THR 640 -6.531 -8.251 11.945 1070 HA THR 640 HA THR 640 -6.489 -10.228 9.847 1071 HB THR 640 HB THR 640 -4.147 -10.795 10.539 1072 HG1 THR 640 HG1 THR 640 -3.784 -9.588 12.318 1073 HG21 THR 640 HG21 THR 640 -4.542 -8.156 9.133 1074 HG22 THR 640 HG22 THR 640 -4.695 -9.752 8.416 1075 HG23 THR 640 HG23 THR 640 -3.116 -9.199 8.992 1076 H LYS 641 H LYS 641 -7.954 -11.363 10.904 1077 HA LYS 641 HA LYS 641 -7.105 -12.904 13.164 1078 HB2 LYS 641 HB2 LYS 641 -7.916 -10.864 14.321 1079 HB3 LYS 641 HB3 LYS 641 -9.456 -11.010 13.495 1080 HG2 LYS 641 HG2 LYS 641 -9.815 -13.197 14.628 1081 HG3 LYS 641 HG3 LYS 641 -8.323 -12.941 15.528 1082 HD2 LYS 641 HD2 LYS 641 -10.723 -11.102 15.606 1083 HD3 LYS 641 HD3 LYS 641 -10.384 -12.349 16.800 1084 HE2 LYS 641 HE2 LYS 641 -8.576 -10.039 16.140 1085 HE3 LYS 641 HE3 LYS 641 -9.679 -10.079 17.515 1086 HZ1 LYS 641 HZ1 LYS 641 -7.362 -11.899 17.062 1087 HZ2 LYS 641 HZ2 LYS 641 -8.429 -11.990 18.371 1088 HZ3 LYS 641 HZ3 LYS 641 -7.449 -10.651 18.177 1089 H LEU 642 H LEU 642 -8.267 -14.743 13.298 1090 HA LEU 642 HA LEU 642 -10.653 -14.974 11.643 1091 HB2 LEU 642 HB2 LEU 642 -8.653 -15.870 10.518 1092 HB3 LEU 642 HB3 LEU 642 -8.406 -16.923 11.892 1093 HG LEU 642 HG LEU 642 -10.680 -17.891 11.394 1094 HD11 LEU 642 HD11 LEU 642 -11.555 -16.151 9.945 1095 HD12 LEU 642 HD12 LEU 642 -11.457 -17.681 9.079 1096 HD13 LEU 642 HD13 LEU 642 -10.254 -16.438 8.794 1097 HD21 LEU 642 HD21 LEU 642 -9.760 -19.249 9.571 1098 HD22 LEU 642 HD22 LEU 642 -8.728 -19.110 10.995 1099 HD23 LEU 642 HD23 LEU 642 -8.347 -18.179 9.544 1100 H GLU 643 H GLU 643 -12.191 -15.562 12.952 1101 HA GLU 643 HA GLU 643 -11.677 -16.950 15.458 1102 HB2 GLU 643 HB2 GLU 643 -13.236 -14.970 15.226 1103 HB3 GLU 643 HB3 GLU 643 -14.251 -15.962 14.206 1104 HG2 GLU 643 HG2 GLU 643 -14.679 -17.459 16.090 1105 HG3 GLU 643 HG3 GLU 643 -13.641 -16.461 17.111 1106 H VAL 644 H VAL 644 -11.379 -19.125 15.117 1107 HA VAL 644 HA VAL 644 -12.918 -20.446 13.007 1108 HB VAL 644 HB VAL 644 -10.637 -21.595 14.622 1109 HG11 VAL 644 HG11 VAL 644 -12.177 -23.213 13.625 1110 HG12 VAL 644 HG12 VAL 644 -10.567 -23.310 12.937 1111 HG13 VAL 644 HG13 VAL 644 -11.865 -22.522 12.028 1112 HG21 VAL 644 HG21 VAL 644 -10.567 -20.370 11.870 1113 HG22 VAL 644 HG22 VAL 644 -9.234 -21.232 12.643 1114 HG23 VAL 644 HG23 VAL 644 -9.817 -19.705 13.321 1115 H ILE 645 H ILE 645 -14.753 -21.096 13.737 1116 HA ILE 645 HA ILE 645 -15.113 -21.959 16.507 1117 HB ILE 645 HB ILE 645 -17.151 -21.789 14.268 1118 HG12 ILE 645 HG12 ILE 645 -16.600 -19.738 16.429 1119 HG13 ILE 645 HG13 ILE 645 -15.992 -19.612 14.783 1120 HG21 ILE 645 HG21 ILE 645 -17.464 -21.936 17.278 1121 HG22 ILE 645 HG22 ILE 645 -17.872 -23.206 16.112 1122 HG23 ILE 645 HG23 ILE 645 -18.783 -21.702 16.131 1123 HD11 ILE 645 HD11 ILE 645 -18.891 -19.668 15.597 1124 HD12 ILE 645 HD12 ILE 645 -18.256 -19.532 13.946 1125 HD13 ILE 645 HD13 ILE 645 -17.958 -18.247 15.107 1126 H ILE 646 H ILE 646 -15.195 -24.102 17.087 1127 HA ILE 646 HA ILE 646 -15.196 -26.017 14.864 1128 HB ILE 646 HB ILE 646 -14.296 -26.605 17.725 1129 HG12 ILE 646 HG12 ILE 646 -12.586 -26.139 15.274 1130 HG13 ILE 646 HG13 ILE 646 -12.811 -24.959 16.561 1131 HG21 ILE 646 HG21 ILE 646 -13.376 -28.623 16.778 1132 HG22 ILE 646 HG22 ILE 646 -14.035 -28.194 15.199 1133 HG23 ILE 646 HG23 ILE 646 -15.122 -28.530 16.546 1134 HD11 ILE 646 HD11 ILE 646 -10.728 -26.137 16.820 1135 HD12 ILE 646 HD12 ILE 646 -11.577 -27.686 16.852 1136 HD13 ILE 646 HD13 ILE 646 -11.814 -26.519 18.154 1137 H GLU 647 H GLU 647 -17.198 -26.565 14.506 1138 HA GLU 647 HA GLU 647 -18.915 -27.053 16.786 1139 HB2 GLU 647 HB2 GLU 647 -20.737 -27.235 15.017 1140 HB3 GLU 647 HB3 GLU 647 -20.023 -25.649 15.253 1141 HG2 GLU 647 HG2 GLU 647 -18.639 -25.982 13.296 1142 HG3 GLU 647 HG3 GLU 647 -19.364 -27.575 13.036 1143 H GLU 648 H GLU 648 -19.615 -28.991 17.336 1144 HA GLU 648 HA GLU 648 -18.027 -31.032 16.334 1145 HB2 GLU 648 HB2 GLU 648 -19.041 -32.476 18.082 1146 HB3 GLU 648 HB3 GLU 648 -18.140 -31.071 18.611 1147 HG2 GLU 648 HG2 GLU 648 -21.144 -31.191 18.447 1148 HG3 GLU 648 HG3 GLU 648 -20.246 -31.542 19.925 1149 H SER 649 H SER 649 -18.685 -33.069 15.533 1150 HA SER 649 HA SER 649 -21.178 -32.787 14.067 1151 HB2 SER 649 HB2 SER 649 -18.420 -32.991 13.001 1152 HB3 SER 649 HB3 SER 649 -19.879 -33.204 11.988 1153 HG SER 649 HG SER 649 -19.836 -30.957 13.563 1154 H TYR 650 H TYR 650 -20.564 -34.580 16.148 1155 HA TYR 650 HA TYR 650 -19.719 -37.126 15.387 1156 HB2 TYR 650 HB2 TYR 650 -21.584 -36.103 17.485 1157 HB3 TYR 650 HB3 TYR 650 -21.450 -37.833 17.203 1158 HD1 TYR 650 HD1 TYR 650 -19.296 -34.854 17.785 1159 HD2 TYR 650 HD2 TYR 650 -19.926 -38.979 18.277 1160 HE1 TYR 650 HE1 TYR 650 -17.243 -34.968 19.175 1161 HE2 TYR 650 HE2 TYR 650 -17.891 -39.151 19.677 1162 HH TYR 650 HH TYR 650 -16.176 -36.332 20.748 1163 H GLU 651 H GLU 651 -22.791 -35.573 15.077 1164 HA GLU 651 HA GLU 651 -24.134 -37.861 14.146 1165 HB2 GLU 651 HB2 GLU 651 -24.878 -34.958 13.900 1166 HB3 GLU 651 HB3 GLU 651 -25.943 -36.298 13.502 1167 HG2 GLU 651 HG2 GLU 651 -25.909 -37.028 15.797 1168 HG3 GLU 651 HG3 GLU 651 -24.786 -35.734 16.216 1169 H PHE 652 H PHE 652 -22.044 -35.637 12.722 1170 HA PHE 652 HA PHE 652 -21.326 -35.042 10.736 1171 HB2 PHE 652 HB2 PHE 652 -22.675 -37.578 9.779 1172 HB3 PHE 652 HB3 PHE 652 -21.689 -36.557 8.737 1173 HD1 PHE 652 HD1 PHE 652 -19.284 -36.324 9.162 1174 HD2 PHE 652 HD2 PHE 652 -21.685 -39.041 11.383 1175 HE1 PHE 652 HE1 PHE 652 -17.259 -37.489 9.912 1176 HE2 PHE 652 HE2 PHE 652 -19.661 -40.216 12.142 1177 HZ PHE 652 HZ PHE 652 -17.440 -39.437 11.403 1178 H LYS 653 H LYS 653 -22.620 -33.249 11.110 1179 HA LYS 653 HA LYS 653 -24.264 -32.668 8.837 1180 HB2 LYS 653 HB2 LYS 653 -26.108 -31.705 10.320 1181 HB3 LYS 653 HB3 LYS 653 -26.021 -33.459 10.248 1182 HG2 LYS 653 HG2 LYS 653 -24.860 -33.484 12.407 1183 HG3 LYS 653 HG3 LYS 653 -24.948 -31.729 12.464 1184 HD2 LYS 653 HD2 LYS 653 -26.687 -32.778 13.859 1185 HD3 LYS 653 HD3 LYS 653 -27.382 -31.833 12.545 1186 HE2 LYS 653 HE2 LYS 653 -27.879 -33.802 11.296 1187 HE3 LYS 653 HE3 LYS 653 -26.958 -34.810 12.409 1188 HZ1 LYS 653 HZ1 LYS 653 -29.413 -33.307 13.164 1189 HZ2 LYS 653 HZ2 LYS 653 -28.579 -34.481 14.091 1190 HZ3 LYS 653 HZ3 LYS 653 -29.372 -34.919 12.689 1191 H SER 654 H SER 654 -22.328 -31.443 8.438 1192 HA SER 654 HA SER 654 -22.424 -28.746 9.149 1193 HB2 SER 654 HB2 SER 654 -21.612 -29.596 11.361 1194 HB3 SER 654 HB3 SER 654 -20.248 -30.357 10.554 1195 HG SER 654 HG SER 654 -20.715 -27.731 11.230 1196 H THR 655 H THR 655 -19.808 -28.058 8.744 1197 HA THR 655 HA THR 655 -19.381 -28.898 6.027 1198 HB THR 655 HB THR 655 -19.109 -26.540 6.317 1199 HG1 THR 655 HG1 THR 655 -16.632 -27.845 5.958 1200 HG21 THR 655 HG21 THR 655 -17.467 -25.508 7.860 1201 HG22 THR 655 HG22 THR 655 -17.078 -27.109 8.492 1202 HG23 THR 655 HG23 THR 655 -18.692 -26.438 8.724 1203 H VAL 656 H VAL 656 -18.975 -31.030 6.552 1204 HA VAL 656 HA VAL 656 -16.669 -31.814 8.081 1205 HB VAL 656 HB VAL 656 -18.391 -33.511 6.232 1206 HG11 VAL 656 HG11 VAL 656 -16.599 -34.312 8.517 1207 HG12 VAL 656 HG12 VAL 656 -16.279 -34.569 6.804 1208 HG13 VAL 656 HG13 VAL 656 -17.625 -35.405 7.585 1209 HG21 VAL 656 HG21 VAL 656 -19.644 -34.172 8.238 1210 HG22 VAL 656 HG22 VAL 656 -19.780 -32.440 7.930 1211 HG23 VAL 656 HG23 VAL 656 -18.704 -33.028 9.197 1212 H ASP 657 H ASP 657 -17.391 -30.997 4.884 1213 HA ASP 657 HA ASP 657 -14.939 -32.152 3.789 1214 HB2 ASP 657 HB2 ASP 657 -17.074 -30.489 2.414 1215 HB3 ASP 657 HB3 ASP 657 -15.716 -31.264 1.620 Start of MODEL 12 1 H HIS 501 H HIS 501 1.550 -0.050 0.722 2 HA HIS 501 HA HIS 501 1.899 0.676 -1.563 3 HB2 HIS 501 HB2 HIS 501 4.262 1.322 -1.095 4 HB3 HIS 501 HB3 HIS 501 4.688 -0.376 -1.026 5 HD1 HIS 501 HD1 HIS 501 4.069 2.418 -3.382 6 HD2 HIS 501 HD2 HIS 501 4.801 -1.662 -3.535 7 HE1 HIS 501 HE1 HIS 501 4.747 1.937 -5.745 8 H ALA 502 H ALA 502 2.876 -2.059 0.292 9 HA ALA 502 HA ALA 502 2.688 -4.024 -1.705 10 HB1 ALA 502 HB1 ALA 502 2.421 -4.333 1.272 11 HB2 ALA 502 HB2 ALA 502 3.934 -4.345 0.361 12 HB3 ALA 502 HB3 ALA 502 2.741 -5.621 0.111 13 H GLY 503 H GLY 503 0.298 -3.065 0.841 14 HA2 GLY 503 HA2 GLY 503 -2.017 -3.073 -0.317 15 HA3 GLY 503 HA3 GLY 503 -1.578 -4.749 -0.639 16 H ILE 504 H ILE 504 -3.139 -5.768 0.496 17 HA ILE 504 HA ILE 504 -3.175 -5.323 3.378 18 HB ILE 504 HB ILE 504 -5.582 -5.917 1.609 19 HG12 ILE 504 HG12 ILE 504 -6.500 -3.753 2.650 20 HG13 ILE 504 HG13 ILE 504 -4.845 -3.399 3.110 21 HG21 ILE 504 HG21 ILE 504 -6.938 -5.759 3.600 22 HG22 ILE 504 HG22 ILE 504 -5.459 -5.676 4.571 23 HG23 ILE 504 HG23 ILE 504 -5.808 -7.115 3.605 24 HD11 ILE 504 HD11 ILE 504 -5.849 -3.788 0.297 25 HD12 ILE 504 HD12 ILE 504 -4.200 -3.423 0.743 26 HD13 ILE 504 HD13 ILE 504 -5.479 -2.240 1.057 27 H PHE 505 H PHE 505 -2.441 -7.156 4.299 28 HA PHE 505 HA PHE 505 -3.153 -9.750 3.121 29 HB2 PHE 505 HB2 PHE 505 -1.345 -8.990 5.418 30 HB3 PHE 505 HB3 PHE 505 -1.819 -10.646 5.101 31 HD1 PHE 505 HD2 PHE 505 0.200 -7.823 4.001 32 HD2 PHE 505 HD1 PHE 505 -0.919 -11.855 3.247 33 HE1 PHE 505 HE2 PHE 505 2.123 -8.068 2.518 34 HE2 PHE 505 HE1 PHE 505 1.020 -12.108 1.757 35 HZ PHE 505 HZ PHE 505 2.541 -10.205 1.397 36 H THR 506 H THR 506 -4.751 -10.968 4.043 37 HA THR 506 HA THR 506 -5.384 -10.785 6.756 38 HB THR 506 HB THR 506 -6.474 -8.631 5.994 39 HG1 THR 506 HG1 THR 506 -7.722 -9.076 7.631 40 HG21 THR 506 HG21 THR 506 -8.257 -10.512 4.420 41 HG22 THR 506 HG22 THR 506 -7.175 -9.295 3.741 42 HG23 THR 506 HG23 THR 506 -8.584 -8.800 4.686 43 H PHE 507 H PHE 507 -7.710 -11.874 6.939 44 HA PHE 507 HA PHE 507 -7.319 -14.416 5.636 45 HB2 PHE 507 HB2 PHE 507 -9.048 -13.421 7.859 46 HB3 PHE 507 HB3 PHE 507 -9.323 -15.014 7.137 47 HD1 PHE 507 HD1 PHE 507 -7.608 -16.717 7.342 48 HD2 PHE 507 HD2 PHE 507 -7.249 -12.981 9.299 49 HE1 PHE 507 HE1 PHE 507 -5.957 -17.691 8.837 50 HE2 PHE 507 HE2 PHE 507 -5.571 -13.929 10.820 51 HZ PHE 507 HZ PHE 507 -4.915 -16.273 10.603 52 H GLU 508 H GLU 508 -8.935 -15.455 4.423 53 HA GLU 508 HA GLU 508 -10.336 -13.801 2.632 54 HB2 GLU 508 HB2 GLU 508 -9.433 -16.068 2.176 55 HB3 GLU 508 HB3 GLU 508 -10.696 -16.738 3.198 56 HG2 GLU 508 HG2 GLU 508 -12.368 -15.752 1.687 57 HG3 GLU 508 HG3 GLU 508 -11.015 -15.211 0.675 58 H GLU 509 H GLU 509 -11.202 -15.422 5.574 59 HA GLU 509 HA GLU 509 -13.740 -14.040 5.539 60 HB2 GLU 509 HB2 GLU 509 -14.794 -16.040 6.588 61 HB3 GLU 509 HB3 GLU 509 -14.323 -16.316 4.927 62 HG2 GLU 509 HG2 GLU 509 -12.163 -17.309 5.980 63 HG3 GLU 509 HG3 GLU 509 -13.126 -17.362 7.456 64 HA PRO 510 HA PRO 510 -12.089 -12.916 9.469 65 HB2 PRO 510 HB2 PRO 510 -14.283 -11.806 10.587 66 HB3 PRO 510 HB3 PRO 510 -13.400 -11.033 9.264 67 HG2 PRO 510 HG2 PRO 510 -15.936 -12.617 9.177 68 HG3 PRO 510 HG3 PRO 510 -15.512 -11.134 8.299 69 HD2 PRO 510 HD2 PRO 510 -15.386 -13.661 7.173 70 HD3 PRO 510 HD3 PRO 510 -14.391 -12.280 6.663 71 H VAL 511 H VAL 511 -14.887 -14.962 9.227 72 HA VAL 511 HA VAL 511 -14.224 -16.287 11.746 73 HB VAL 511 HB VAL 511 -17.073 -15.562 10.947 74 HG11 VAL 511 HG11 VAL 511 -16.984 -17.657 12.094 75 HG12 VAL 511 HG12 VAL 511 -17.694 -16.447 13.165 76 HG13 VAL 511 HG13 VAL 511 -16.023 -16.962 13.390 77 HG21 VAL 511 HG21 VAL 511 -15.433 -14.399 13.211 78 HG22 VAL 511 HG22 VAL 511 -17.147 -14.111 12.928 79 HG23 VAL 511 HG23 VAL 511 -15.954 -13.558 11.753 80 H THR 512 H THR 512 -14.299 -18.477 11.429 81 HA THR 512 HA THR 512 -15.723 -19.327 9.059 82 HB THR 512 HB THR 512 -13.247 -19.228 8.621 83 HG1 THR 512 HG1 THR 512 -14.418 -20.505 7.422 84 HG21 THR 512 HG21 THR 512 -12.418 -19.911 10.817 85 HG22 THR 512 HG22 THR 512 -11.814 -20.996 9.562 86 HG23 THR 512 HG23 THR 512 -13.144 -21.503 10.605 87 H HIS 513 H HIS 513 -16.848 -21.163 9.260 88 HA HIS 513 HA HIS 513 -16.895 -22.414 11.918 89 HB2 HIS 513 HB2 HIS 513 -18.968 -22.372 9.715 90 HB3 HIS 513 HB3 HIS 513 -19.072 -23.441 11.103 91 HD1 HIS 513 HD1 HIS 513 -20.625 -22.570 12.793 92 HD2 HIS 513 HD2 HIS 513 -18.736 -19.522 10.691 93 HE1 HIS 513 HE1 HIS 513 -21.595 -20.410 13.661 94 H VAL 514 H VAL 514 -15.830 -24.240 12.059 95 HA VAL 514 HA VAL 514 -15.693 -25.900 9.662 96 HB VAL 514 HB VAL 514 -13.524 -26.742 10.334 97 HG11 VAL 514 HG11 VAL 514 -13.566 -23.739 10.410 98 HG12 VAL 514 HG12 VAL 514 -13.430 -24.764 8.980 99 HG13 VAL 514 HG13 VAL 514 -12.123 -24.715 10.165 100 HG21 VAL 514 HG21 VAL 514 -13.715 -24.921 12.747 101 HG22 VAL 514 HG22 VAL 514 -12.296 -25.866 12.295 102 HG23 VAL 514 HG23 VAL 514 -13.789 -26.683 12.769 103 H SER 515 H SER 515 -15.347 -28.220 10.287 104 HA SER 515 HA SER 515 -17.306 -28.804 12.355 105 HB2 SER 515 HB2 SER 515 -17.535 -29.759 10.024 106 HB3 SER 515 HB3 SER 515 -16.068 -30.645 10.339 107 HG SER 515 HG SER 515 -18.056 -31.854 10.803 108 H GLU 516 H GLU 516 -16.862 -30.236 13.947 109 HA GLU 516 HA GLU 516 -14.211 -30.619 14.832 110 HB2 GLU 516 HB2 GLU 516 -16.046 -30.618 16.425 111 HB3 GLU 516 HB3 GLU 516 -16.843 -31.920 15.581 112 HG2 GLU 516 HG2 GLU 516 -14.161 -32.547 16.618 113 HG3 GLU 516 HG3 GLU 516 -15.396 -32.226 17.831 114 H SER 517 H SER 517 -16.399 -32.375 12.824 115 HA SER 517 HA SER 517 -14.699 -34.740 12.719 116 HB2 SER 517 HB2 SER 517 -17.418 -34.239 11.544 117 HB3 SER 517 HB3 SER 517 -16.617 -35.796 11.738 118 HG SER 517 HG SER 517 -16.625 -34.711 14.146 119 H ILE 518 H ILE 518 -14.235 -32.015 11.254 120 HA ILE 518 HA ILE 518 -14.465 -32.827 8.474 121 HB ILE 518 HB ILE 518 -14.742 -30.414 9.038 122 HG12 ILE 518 HG12 ILE 518 -12.320 -30.962 7.332 123 HG13 ILE 518 HG13 ILE 518 -14.001 -30.948 6.791 124 HG21 ILE 518 HG21 ILE 518 -12.813 -29.045 9.648 125 HG22 ILE 518 HG22 ILE 518 -11.856 -30.516 9.889 126 HG23 ILE 518 HG23 ILE 518 -13.286 -30.199 10.887 127 HD11 ILE 518 HD11 ILE 518 -12.449 -28.616 7.859 128 HD12 ILE 518 HD12 ILE 518 -14.137 -28.561 7.357 129 HD13 ILE 518 HD13 ILE 518 -12.859 -28.890 6.163 130 H GLY 519 H GLY 519 -12.159 -32.921 11.011 131 HA2 GLY 519 HA2 GLY 519 -10.171 -34.210 10.999 132 HA3 GLY 519 HA3 GLY 519 -10.258 -34.210 9.241 133 H ILE 520 H ILE 520 -9.856 -32.211 8.157 134 HA ILE 520 HA ILE 520 -7.954 -30.517 9.613 135 HB ILE 520 HB ILE 520 -7.657 -31.544 6.793 136 HG12 ILE 520 HG12 ILE 520 -7.229 -33.367 8.413 137 HG13 ILE 520 HG13 ILE 520 -5.783 -32.923 7.517 138 HG21 ILE 520 HG21 ILE 520 -5.793 -29.905 8.525 139 HG22 ILE 520 HG22 ILE 520 -6.640 -29.357 7.081 140 HG23 ILE 520 HG23 ILE 520 -5.356 -30.564 6.952 141 HD11 ILE 520 HD11 ILE 520 -5.238 -33.327 9.818 142 HD12 ILE 520 HD12 ILE 520 -6.470 -32.192 10.338 143 HD13 ILE 520 HD13 ILE 520 -5.045 -31.604 9.477 144 H MET 521 H MET 521 -8.171 -28.402 9.017 145 HA MET 521 HA MET 521 -10.098 -27.820 6.884 146 HB2 MET 521 HB2 MET 521 -10.924 -25.928 8.165 147 HB3 MET 521 HB3 MET 521 -11.087 -27.404 9.096 148 HG2 MET 521 HG2 MET 521 -10.284 -25.937 10.752 149 HG3 MET 521 HG3 MET 521 -8.801 -26.585 10.101 150 HE1 MET 521 HE1 MET 521 -8.393 -22.620 10.875 151 HE2 MET 521 HE2 MET 521 -7.870 -24.195 11.445 152 HE3 MET 521 HE3 MET 521 -9.563 -23.705 11.628 153 H GLU 522 H GLU 522 -9.613 -26.078 5.530 154 HA GLU 522 HA GLU 522 -6.923 -24.969 5.822 155 HB2 GLU 522 HB2 GLU 522 -8.499 -25.748 3.384 156 HB3 GLU 522 HB3 GLU 522 -7.251 -24.529 3.287 157 HG2 GLU 522 HG2 GLU 522 -6.402 -26.650 2.540 158 HG3 GLU 522 HG3 GLU 522 -5.598 -26.171 4.026 159 H VAL 523 H VAL 523 -6.836 -22.868 6.024 160 HA VAL 523 HA VAL 523 -9.190 -21.275 5.232 161 HB VAL 523 HB VAL 523 -7.143 -20.577 7.374 162 HG11 VAL 523 HG11 VAL 523 -8.551 -18.695 7.876 163 HG12 VAL 523 HG12 VAL 523 -9.680 -19.149 6.604 164 HG13 VAL 523 HG13 VAL 523 -8.045 -18.613 6.189 165 HG21 VAL 523 HG21 VAL 523 -8.896 -20.973 8.957 166 HG22 VAL 523 HG22 VAL 523 -8.717 -22.411 7.951 167 HG23 VAL 523 HG23 VAL 523 -10.048 -21.293 7.666 168 H LYS 524 H LYS 524 -8.928 -19.801 3.745 169 HA LYS 524 HA LYS 524 -6.423 -19.569 2.311 170 HB2 LYS 524 HB2 LYS 524 -9.084 -18.209 1.909 171 HB3 LYS 524 HB3 LYS 524 -7.750 -18.283 0.766 172 HG2 LYS 524 HG2 LYS 524 -8.821 -20.888 1.684 173 HG3 LYS 524 HG3 LYS 524 -9.873 -19.877 0.685 174 HD2 LYS 524 HD2 LYS 524 -7.068 -20.452 -0.126 175 HD3 LYS 524 HD3 LYS 524 -8.389 -21.568 -0.503 176 HE2 LYS 524 HE2 LYS 524 -8.232 -18.657 -1.230 177 HE3 LYS 524 HE3 LYS 524 -8.011 -20.005 -2.359 178 HZ1 LYS 524 HZ1 LYS 524 -10.201 -19.305 -2.660 179 HZ2 LYS 524 HZ2 LYS 524 -10.458 -19.002 -1.044 180 HZ3 LYS 524 HZ3 LYS 524 -10.414 -20.600 -1.594 181 H VAL 525 H VAL 525 -5.024 -17.937 2.612 182 HA VAL 525 HA VAL 525 -5.928 -15.554 4.073 183 HB VAL 525 HB VAL 525 -3.082 -16.499 3.587 184 HG11 VAL 525 HG11 VAL 525 -2.464 -14.764 5.241 185 HG12 VAL 525 HG12 VAL 525 -4.150 -14.259 5.308 186 HG13 VAL 525 HG13 VAL 525 -3.223 -14.044 3.819 187 HG21 VAL 525 HG21 VAL 525 -4.263 -17.957 5.106 188 HG22 VAL 525 HG22 VAL 525 -4.759 -16.573 6.083 189 HG23 VAL 525 HG23 VAL 525 -3.054 -17.015 5.973 190 H LEU 526 H LEU 526 -6.241 -13.825 2.957 191 HA LEU 526 HA LEU 526 -5.930 -13.825 0.150 192 HB2 LEU 526 HB2 LEU 526 -6.790 -11.661 2.059 193 HB3 LEU 526 HB3 LEU 526 -6.804 -11.494 0.318 194 HG LEU 526 HG LEU 526 -8.470 -13.494 1.885 195 HD11 LEU 526 HD11 LEU 526 -10.350 -12.096 1.233 196 HD12 LEU 526 HD12 LEU 526 -9.237 -10.924 0.527 197 HD13 LEU 526 HD13 LEU 526 -9.213 -11.233 2.266 198 HD21 LEU 526 HD21 LEU 526 -8.399 -12.804 -1.052 199 HD22 LEU 526 HD22 LEU 526 -9.601 -13.827 -0.277 200 HD23 LEU 526 HD23 LEU 526 -7.916 -14.341 -0.331 201 H ARG 527 H ARG 527 -4.323 -13.299 -0.955 202 HA ARG 527 HA ARG 527 -1.883 -12.267 0.038 203 HB2 ARG 527 HB2 ARG 527 -2.048 -13.773 -1.929 204 HB3 ARG 527 HB3 ARG 527 -2.884 -12.518 -2.812 205 HG2 ARG 527 HG2 ARG 527 -0.584 -12.694 -3.571 206 HG3 ARG 527 HG3 ARG 527 -0.830 -11.141 -2.782 207 HD2 ARG 527 HD2 ARG 527 0.322 -11.910 -0.799 208 HD3 ARG 527 HD3 ARG 527 0.396 -13.554 -1.427 209 HE ARG 527 HE ARG 527 1.761 -12.445 -3.297 210 HH11 ARG 527 HH11 ARG 527 2.039 -11.610 0.119 211 HH12 ARG 527 HH12 ARG 527 3.632 -11.012 0.022 212 HH21 ARG 527 HH21 ARG 527 3.962 -11.665 -3.426 213 HH22 ARG 527 HH22 ARG 527 4.803 -11.062 -2.087 214 H THR 528 H THR 528 -1.032 -10.267 -0.167 215 HA THR 528 HA THR 528 -2.511 -7.964 -0.074 216 HB THR 528 HB THR 528 -0.206 -8.471 0.781 217 HG1 THR 528 HG1 THR 528 0.046 -6.222 -0.823 218 HG21 THR 528 HG21 THR 528 1.705 -8.154 -0.726 219 HG22 THR 528 HG22 THR 528 0.600 -8.081 -2.098 220 HG23 THR 528 HG23 THR 528 0.744 -9.567 -1.161 221 H SER 529 H SER 529 -3.061 -6.435 -1.514 222 HA SER 529 HA SER 529 -3.853 -7.113 -3.977 223 HB2 SER 529 HB2 SER 529 -4.629 -5.126 -2.696 224 HB3 SER 529 HB3 SER 529 -3.136 -4.304 -3.111 225 HG SER 529 HG SER 529 -4.026 -3.773 -4.887 226 H GLY 530 H GLY 530 -0.793 -5.764 -3.019 227 HA2 GLY 530 HA2 GLY 530 0.147 -5.963 -5.802 228 HA3 GLY 530 HA3 GLY 530 0.775 -4.803 -4.632 229 H ALA 531 H ALA 531 0.882 -8.026 -5.759 230 HA ALA 531 HA ALA 531 2.477 -8.924 -3.521 231 HB1 ALA 531 HB1 ALA 531 0.916 -10.490 -4.589 232 HB2 ALA 531 HB2 ALA 531 2.586 -11.046 -4.711 233 HB3 ALA 531 HB3 ALA 531 1.799 -10.328 -6.111 234 H ARG 532 H ARG 532 4.370 -7.930 -3.494 235 HA ARG 532 HA ARG 532 6.009 -8.093 -5.909 236 HB2 ARG 532 HB2 ARG 532 6.142 -5.931 -3.790 237 HB3 ARG 532 HB3 ARG 532 7.071 -6.000 -5.276 238 HG2 ARG 532 HG2 ARG 532 4.090 -5.594 -5.053 239 HG3 ARG 532 HG3 ARG 532 5.292 -4.367 -5.453 240 HD2 ARG 532 HD2 ARG 532 5.831 -5.523 -7.511 241 HD3 ARG 532 HD3 ARG 532 4.743 -6.846 -7.086 242 HE ARG 532 HE ARG 532 3.480 -4.289 -7.146 243 HH11 ARG 532 HH11 ARG 532 4.406 -7.073 -9.142 244 HH12 ARG 532 HH12 ARG 532 3.294 -6.758 -10.376 245 HH21 ARG 532 HH21 ARG 532 1.931 -3.848 -8.823 246 HH22 ARG 532 HH22 ARG 532 1.809 -4.872 -10.172 247 H GLY 533 H GLY 533 7.555 -9.511 -5.572 248 HA2 GLY 533 HA2 GLY 533 9.453 -10.384 -4.638 249 HA3 GLY 533 HA3 GLY 533 9.275 -9.263 -3.301 250 H ASN 534 H ASN 534 10.146 -11.399 -2.434 251 HA ASN 534 HA ASN 534 8.101 -13.364 -1.828 252 HB2 ASN 534 HB2 ASN 534 10.324 -14.169 -2.522 253 HB3 ASN 534 HB3 ASN 534 11.061 -13.292 -1.193 254 HD21 ASN 534 HD21 ASN 534 8.038 -15.108 -0.880 255 HD22 ASN 534 HD22 ASN 534 8.707 -16.302 0.153 256 H VAL 535 H VAL 535 7.047 -13.428 0.034 257 HA VAL 535 HA VAL 535 7.959 -11.772 2.266 258 HB VAL 535 HB VAL 535 5.143 -11.882 1.146 259 HG11 VAL 535 HG11 VAL 535 4.589 -10.146 2.807 260 HG12 VAL 535 HG12 VAL 535 6.209 -10.310 3.481 261 HG13 VAL 535 HG13 VAL 535 5.088 -11.669 3.540 262 HG21 VAL 535 HG21 VAL 535 7.159 -9.661 1.122 263 HG22 VAL 535 HG22 VAL 535 5.467 -9.489 0.609 264 HG23 VAL 535 HG23 VAL 535 6.568 -10.575 -0.259 265 H ILE 536 H ILE 536 7.690 -12.791 4.180 266 HA ILE 536 HA ILE 536 6.260 -15.335 4.127 267 HB ILE 536 HB ILE 536 8.459 -14.352 5.959 268 HG12 ILE 536 HG12 ILE 536 9.323 -15.115 3.812 269 HG13 ILE 536 HG13 ILE 536 9.723 -16.285 5.065 270 HG21 ILE 536 HG21 ILE 536 6.861 -15.600 7.228 271 HG22 ILE 536 HG22 ILE 536 8.324 -16.580 7.018 272 HG23 ILE 536 HG23 ILE 536 6.878 -16.888 6.038 273 HD11 ILE 536 HD11 ILE 536 7.745 -17.617 4.290 274 HD12 ILE 536 HD12 ILE 536 9.068 -17.485 3.146 275 HD13 ILE 536 HD13 ILE 536 7.630 -16.505 2.922 276 H VAL 537 H VAL 537 4.574 -15.616 5.453 277 HA VAL 537 HA VAL 537 4.026 -13.447 7.312 278 HB VAL 537 HB VAL 537 1.962 -14.979 5.704 279 HG11 VAL 537 HG11 VAL 537 0.318 -13.425 6.668 280 HG12 VAL 537 HG12 VAL 537 1.591 -12.708 7.658 281 HG13 VAL 537 HG13 VAL 537 1.114 -14.384 7.920 282 HG21 VAL 537 HG21 VAL 537 2.832 -12.112 5.554 283 HG22 VAL 537 HG22 VAL 537 1.550 -12.847 4.575 284 HG23 VAL 537 HG23 VAL 537 3.234 -13.372 4.398 285 HA PRO 538 HA PRO 538 4.125 -17.064 10.046 286 HB2 PRO 538 HB2 PRO 538 4.050 -15.610 12.341 287 HB3 PRO 538 HB3 PRO 538 5.536 -15.887 11.433 288 HG2 PRO 538 HG2 PRO 538 3.767 -13.488 11.488 289 HG3 PRO 538 HG3 PRO 538 5.533 -13.572 11.434 290 HD2 PRO 538 HD2 PRO 538 3.996 -13.040 9.276 291 HD3 PRO 538 HD3 PRO 538 5.570 -13.850 9.163 292 H TYR 539 H TYR 539 2.610 -17.983 11.499 293 HA TYR 539 HA TYR 539 0.201 -16.532 12.111 294 HB2 TYR 539 HB2 TYR 539 -1.339 -18.121 11.090 295 HB3 TYR 539 HB3 TYR 539 -0.267 -17.457 9.866 296 HD1 TYR 539 HD1 TYR 539 1.357 -18.847 8.758 297 HD2 TYR 539 HD2 TYR 539 -1.228 -20.476 11.700 298 HE1 TYR 539 HE1 TYR 539 1.881 -21.108 7.955 299 HE2 TYR 539 HE2 TYR 539 -0.709 -22.739 10.923 300 HH TYR 539 HH TYR 539 1.856 -23.447 8.919 301 H LYS 540 H LYS 540 -1.085 -17.611 13.644 302 HA LYS 540 HA LYS 540 -0.080 -20.046 14.780 303 HB2 LYS 540 HB2 LYS 540 0.227 -19.042 17.089 304 HB3 LYS 540 HB3 LYS 540 1.454 -18.644 15.906 305 HG2 LYS 540 HG2 LYS 540 1.034 -16.707 17.228 306 HG3 LYS 540 HG3 LYS 540 0.392 -16.422 15.617 307 HD2 LYS 540 HD2 LYS 540 -1.859 -16.860 16.421 308 HD3 LYS 540 HD3 LYS 540 -1.232 -17.246 18.022 309 HE2 LYS 540 HE2 LYS 540 -0.848 -14.609 16.655 310 HE3 LYS 540 HE3 LYS 540 -2.174 -14.927 17.780 311 HZ1 LYS 540 HZ1 LYS 540 0.745 -14.983 18.398 312 HZ2 LYS 540 HZ2 LYS 540 -0.459 -15.431 19.468 313 HZ3 LYS 540 HZ3 LYS 540 -0.372 -13.845 18.928 314 H THR 541 H THR 541 -1.466 -21.120 16.147 315 HA THR 541 HA THR 541 -4.185 -20.252 16.028 316 HB THR 541 HB THR 541 -4.490 -22.399 17.423 317 HG1 THR 541 HG1 THR 541 -2.328 -22.814 18.081 318 HG21 THR 541 HG21 THR 541 -5.028 -22.290 15.058 319 HG22 THR 541 HG22 THR 541 -4.275 -23.842 15.436 320 HG23 THR 541 HG23 THR 541 -3.336 -22.565 14.652 321 H ILE 542 H ILE 542 -5.296 -19.316 17.596 322 HA ILE 542 HA ILE 542 -3.916 -18.692 20.093 323 HB ILE 542 HB ILE 542 -6.414 -17.501 18.894 324 HG12 ILE 542 HG12 ILE 542 -3.615 -16.344 18.892 325 HG13 ILE 542 HG13 ILE 542 -4.427 -17.043 17.497 326 HG21 ILE 542 HG21 ILE 542 -6.069 -15.678 20.543 327 HG22 ILE 542 HG22 ILE 542 -4.686 -16.555 21.195 328 HG23 ILE 542 HG23 ILE 542 -6.303 -17.244 21.321 329 HD11 ILE 542 HD11 ILE 542 -5.345 -14.604 19.004 330 HD12 ILE 542 HD12 ILE 542 -6.099 -15.291 17.564 331 HD13 ILE 542 HD13 ILE 542 -4.476 -14.608 17.469 332 H GLU 543 H GLU 543 -4.539 -19.868 21.752 333 HA GLU 543 HA GLU 543 -6.888 -21.535 21.691 334 HB2 GLU 543 HB2 GLU 543 -4.888 -20.965 23.873 335 HB3 GLU 543 HB3 GLU 543 -6.176 -22.149 23.984 336 HG2 GLU 543 HG2 GLU 543 -5.191 -23.423 22.184 337 HG3 GLU 543 HG3 GLU 543 -3.916 -22.213 22.001 338 H GLY 544 H GLY 544 -8.488 -21.422 23.424 339 HA2 GLY 544 HA2 GLY 544 -8.780 -19.254 25.146 340 HA3 GLY 544 HA3 GLY 544 -9.627 -18.874 23.646 341 H THR 545 H THR 545 -11.471 -19.795 23.132 342 HA THR 545 HA THR 545 -12.952 -20.966 25.181 343 HB THR 545 HB THR 545 -13.749 -21.106 22.316 344 HG1 THR 545 HG1 THR 545 -13.636 -18.607 23.696 345 HG21 THR 545 HG21 THR 545 -15.789 -20.143 23.232 346 HG22 THR 545 HG22 THR 545 -14.979 -19.929 24.787 347 HG23 THR 545 HG23 THR 545 -15.314 -21.563 24.185 348 H ALA 546 H ALA 546 -11.154 -22.140 22.401 349 HA ALA 546 HA ALA 546 -11.786 -24.916 23.104 350 HB1 ALA 546 HB1 ALA 546 -10.958 -25.508 20.875 351 HB2 ALA 546 HB2 ALA 546 -10.541 -23.823 20.572 352 HB3 ALA 546 HB3 ALA 546 -12.230 -24.289 20.740 353 H ARG 547 H ARG 547 -9.947 -26.396 23.124 354 HA ARG 547 HA ARG 547 -7.617 -25.089 24.334 355 HB2 ARG 547 HB2 ARG 547 -8.586 -27.923 24.531 356 HB3 ARG 547 HB3 ARG 547 -7.165 -27.273 25.334 357 HG2 ARG 547 HG2 ARG 547 -8.457 -25.756 26.541 358 HG3 ARG 547 HG3 ARG 547 -9.960 -26.277 25.753 359 HD2 ARG 547 HD2 ARG 547 -9.478 -28.590 26.599 360 HD3 ARG 547 HD3 ARG 547 -8.162 -27.911 27.546 361 HE ARG 547 HE ARG 547 -10.337 -26.452 28.245 362 HH11 ARG 547 HH11 ARG 547 -9.471 -29.891 28.275 363 HH12 ARG 547 HH12 ARG 547 -10.527 -30.299 29.537 364 HH21 ARG 547 HH21 ARG 547 -11.814 -27.028 30.039 365 HH22 ARG 547 HH22 ARG 547 -11.882 -28.642 30.567 366 H GLY 548 H GLY 548 -5.605 -25.424 23.677 367 HA2 GLY 548 HA2 GLY 548 -5.307 -26.441 20.969 368 HA3 GLY 548 HA3 GLY 548 -4.089 -25.578 21.895 369 H GLY 549 H GLY 549 -2.504 -27.016 21.338 370 HA2 GLY 549 HA2 GLY 549 -1.079 -28.748 21.668 371 HA3 GLY 549 HA3 GLY 549 -1.936 -29.029 23.158 372 H GLY 550 H GLY 550 -4.067 -29.405 20.515 373 HA2 GLY 550 HA2 GLY 550 -4.594 -31.291 19.256 374 HA3 GLY 550 HA3 GLY 550 -3.359 -32.198 20.124 375 H GLU 551 H GLU 551 -5.312 -30.302 22.144 376 HA GLU 551 HA GLU 551 -6.563 -32.699 23.178 377 HB2 GLU 551 HB2 GLU 551 -5.501 -30.856 24.603 378 HB3 GLU 551 HB3 GLU 551 -6.897 -29.878 24.165 379 HG2 GLU 551 HG2 GLU 551 -8.383 -31.485 25.220 380 HG3 GLU 551 HG3 GLU 551 -7.009 -32.514 25.613 381 H ASP 552 H ASP 552 -7.644 -29.466 22.150 382 HA ASP 552 HA ASP 552 -10.291 -30.601 21.453 383 HB2 ASP 552 HB2 ASP 552 -10.008 -28.542 23.013 384 HB3 ASP 552 HB3 ASP 552 -9.549 -27.678 21.557 385 H PHE 553 H PHE 553 -7.646 -28.552 20.400 386 HA PHE 553 HA PHE 553 -8.071 -29.440 17.684 387 HB2 PHE 553 HB2 PHE 553 -7.781 -27.221 16.717 388 HB3 PHE 553 HB3 PHE 553 -9.137 -27.171 17.828 389 HD1 PHE 553 HD2 PHE 553 -5.702 -26.073 17.202 390 HD2 PHE 553 HD1 PHE 553 -9.023 -25.822 19.839 391 HE1 PHE 553 HE2 PHE 553 -4.673 -24.143 18.294 392 HE2 PHE 553 HE1 PHE 553 -7.999 -23.873 20.935 393 HZ PHE 553 HZ PHE 553 -5.820 -23.029 20.160 394 H GLU 554 H GLU 554 -6.148 -29.383 16.463 395 HA GLU 554 HA GLU 554 -3.804 -29.758 18.089 396 HB2 GLU 554 HB2 GLU 554 -4.721 -31.136 16.076 397 HB3 GLU 554 HB3 GLU 554 -4.017 -29.871 15.099 398 HG2 GLU 554 HG2 GLU 554 -2.465 -31.517 17.053 399 HG3 GLU 554 HG3 GLU 554 -2.697 -31.972 15.370 400 H ASP 555 H ASP 555 -2.567 -28.117 18.592 401 HA ASP 555 HA ASP 555 -2.912 -25.467 17.606 402 HB2 ASP 555 HB2 ASP 555 -2.390 -25.668 19.894 403 HB3 ASP 555 HB3 ASP 555 -1.045 -26.748 19.594 404 H THR 556 H THR 556 -1.930 -24.455 15.984 405 HA THR 556 HA THR 556 0.521 -25.617 14.993 406 HB THR 556 HB THR 556 -1.334 -26.534 13.633 407 HG1 THR 556 HG1 THR 556 -0.183 -26.465 11.919 408 HG21 THR 556 HG21 THR 556 -2.509 -25.067 12.019 409 HG22 THR 556 HG22 THR 556 -1.816 -23.663 12.828 410 HG23 THR 556 HG23 THR 556 -2.935 -24.716 13.691 411 H CYS 557 H CYS 557 1.881 -24.252 14.104 412 HA CYS 557 HA CYS 557 1.248 -21.476 13.666 413 HB2 CYS 557 HB2 CYS 557 3.071 -20.703 15.198 414 HB3 CYS 557 HB3 CYS 557 1.724 -21.431 16.058 415 HG CYS 557 HG CYS 557 3.024 -23.267 17.255 416 H GLY 558 H GLY 558 2.940 -20.468 12.370 417 HA2 GLY 558 HA2 GLY 558 5.334 -21.620 11.718 418 HA3 GLY 558 HA3 GLY 558 4.134 -22.330 10.634 419 H GLU 559 H GLU 559 5.399 -21.198 8.977 420 HA GLU 559 HA GLU 559 4.464 -18.444 8.729 421 HB2 GLU 559 HB2 GLU 559 7.228 -19.491 8.230 422 HB3 GLU 559 HB3 GLU 559 6.664 -17.899 7.732 423 HG2 GLU 559 HG2 GLU 559 6.317 -17.290 10.060 424 HG3 GLU 559 HG3 GLU 559 6.842 -18.896 10.565 425 H LEU 560 H LEU 560 3.558 -18.021 6.869 426 HA LEU 560 HA LEU 560 3.431 -20.056 4.777 427 HB2 LEU 560 HB2 LEU 560 2.031 -17.414 5.125 428 HB3 LEU 560 HB3 LEU 560 1.735 -18.549 3.831 429 HG LEU 560 HG LEU 560 1.207 -19.076 6.747 430 HD11 LEU 560 HD11 LEU 560 -0.272 -17.368 5.900 431 HD12 LEU 560 HD12 LEU 560 -1.148 -18.894 6.101 432 HD13 LEU 560 HD13 LEU 560 -0.656 -18.366 4.499 433 HD21 LEU 560 HD21 LEU 560 0.578 -20.670 4.261 434 HD22 LEU 560 HD22 LEU 560 -0.074 -21.007 5.859 435 HD23 LEU 560 HD23 LEU 560 1.660 -21.129 5.576 436 H GLU 561 H GLU 561 4.227 -19.738 2.762 437 HA GLU 561 HA GLU 561 5.948 -17.405 2.476 438 HB2 GLU 561 HB2 GLU 561 6.941 -19.701 2.254 439 HB3 GLU 561 HB3 GLU 561 5.945 -19.872 0.795 440 HG2 GLU 561 HG2 GLU 561 7.099 -17.822 -0.119 441 HG3 GLU 561 HG3 GLU 561 8.078 -17.835 1.299 442 H PHE 562 H PHE 562 5.222 -15.828 1.317 443 HA PHE 562 HA PHE 562 3.474 -16.416 -0.960 444 HB2 PHE 562 HB2 PHE 562 3.653 -13.960 0.782 445 HB3 PHE 562 HB3 PHE 562 2.734 -14.045 -0.708 446 HD1 PHE 562 HD1 PHE 562 0.748 -15.499 -0.829 447 HD2 PHE 562 HD2 PHE 562 2.820 -14.833 2.809 448 HE1 PHE 562 HE1 PHE 562 -1.236 -16.218 0.423 449 HE2 PHE 562 HE2 PHE 562 0.836 -15.567 4.073 450 HZ PHE 562 HZ PHE 562 -1.188 -16.252 2.883 451 H GLN 563 H GLN 563 3.940 -15.246 -2.851 452 HA GLN 563 HA GLN 563 6.418 -13.726 -2.936 453 HB2 GLN 563 HB2 GLN 563 5.859 -16.058 -4.765 454 HB3 GLN 563 HB3 GLN 563 7.198 -14.936 -4.902 455 HG2 GLN 563 HG2 GLN 563 7.989 -15.686 -2.671 456 HG3 GLN 563 HG3 GLN 563 6.745 -16.933 -2.711 457 HE21 GLN 563 HE21 GLN 563 9.661 -15.771 -4.140 458 HE22 GLN 563 HE22 GLN 563 10.121 -17.232 -4.904 459 H ASN 564 H ASN 564 6.629 -13.080 -5.479 460 HA ASN 564 HA ASN 564 4.278 -11.518 -5.858 461 HB2 ASN 564 HB2 ASN 564 5.379 -10.553 -7.832 462 HB3 ASN 564 HB3 ASN 564 6.471 -10.587 -6.457 463 HD21 ASN 564 HD21 ASN 564 5.789 -11.825 -9.602 464 HD22 ASN 564 HD22 ASN 564 7.293 -12.624 -9.843 465 H ASP 565 H ASP 565 5.577 -14.366 -7.353 466 HA ASP 565 HA ASP 565 3.476 -14.481 -9.309 467 HB2 ASP 565 HB2 ASP 565 5.697 -15.529 -9.731 468 HB3 ASP 565 HB3 ASP 565 5.350 -16.695 -8.459 469 H GLU 566 H GLU 566 4.141 -15.961 -6.205 470 HA GLU 566 HA GLU 566 2.056 -17.815 -6.098 471 HB2 GLU 566 HB2 GLU 566 3.549 -16.315 -4.002 472 HB3 GLU 566 HB3 GLU 566 2.398 -17.590 -3.638 473 HG2 GLU 566 HG2 GLU 566 4.937 -17.865 -5.225 474 HG3 GLU 566 HG3 GLU 566 4.689 -18.365 -3.548 475 H ILE 567 H ILE 567 0.099 -17.715 -4.954 476 HA ILE 567 HA ILE 567 -0.928 -15.016 -4.694 477 HB ILE 567 HB ILE 567 -3.240 -16.121 -5.138 478 HG12 ILE 567 HG12 ILE 567 -1.478 -18.035 -6.685 479 HG13 ILE 567 HG13 ILE 567 -2.250 -18.492 -5.182 480 HG21 ILE 567 HG21 ILE 567 -2.985 -15.677 -7.542 481 HG22 ILE 567 HG22 ILE 567 -1.235 -15.627 -7.330 482 HG23 ILE 567 HG23 ILE 567 -2.254 -14.420 -6.542 483 HD11 ILE 567 HD11 ILE 567 -4.418 -18.088 -6.189 484 HD12 ILE 567 HD12 ILE 567 -3.487 -19.294 -7.079 485 HD13 ILE 567 HD13 ILE 567 -3.636 -17.645 -7.708 486 H VAL 568 H VAL 568 -2.623 -17.936 -3.677 487 HA VAL 568 HA VAL 568 -2.802 -16.691 -1.040 488 HB VAL 568 HB VAL 568 -4.897 -16.860 -2.287 489 HG11 VAL 568 HG11 VAL 568 -4.488 -19.831 -2.207 490 HG12 VAL 568 HG12 VAL 568 -4.529 -18.809 -3.654 491 HG13 VAL 568 HG13 VAL 568 -5.982 -19.027 -2.667 492 HG21 VAL 568 HG21 VAL 568 -6.281 -17.960 -0.596 493 HG22 VAL 568 HG22 VAL 568 -5.041 -16.930 0.123 494 HG23 VAL 568 HG23 VAL 568 -4.834 -18.682 0.107 495 H LYS 569 H LYS 569 -2.480 -17.904 0.770 496 HA LYS 569 HA LYS 569 -1.537 -20.662 0.448 497 HB2 LYS 569 HB2 LYS 569 -0.877 -18.546 2.472 498 HB3 LYS 569 HB3 LYS 569 -0.526 -20.248 2.728 499 HG2 LYS 569 HG2 LYS 569 0.455 -19.159 0.218 500 HG3 LYS 569 HG3 LYS 569 1.192 -18.430 1.650 501 HD2 LYS 569 HD2 LYS 569 2.544 -20.275 0.922 502 HD3 LYS 569 HD3 LYS 569 1.703 -20.789 2.375 503 HE2 LYS 569 HE2 LYS 569 0.046 -21.955 0.982 504 HE3 LYS 569 HE3 LYS 569 0.915 -21.465 -0.471 505 HZ1 LYS 569 HZ1 LYS 569 2.853 -22.713 0.392 506 HZ2 LYS 569 HZ2 LYS 569 1.522 -23.698 0.115 507 HZ3 LYS 569 HZ3 LYS 569 1.911 -23.253 1.683 508 H THR 570 H THR 570 -2.018 -21.995 2.365 509 HA THR 570 HA THR 570 -4.533 -21.237 3.659 510 HB THR 570 HB THR 570 -4.948 -23.827 3.503 511 HG1 THR 570 HG1 THR 570 -3.361 -24.597 2.372 512 HG21 THR 570 HG21 THR 570 -6.334 -23.469 1.485 513 HG22 THR 570 HG22 THR 570 -5.551 -21.899 1.236 514 HG23 THR 570 HG23 THR 570 -6.530 -22.198 2.677 515 H ILE 571 H ILE 571 -4.720 -21.758 5.743 516 HA ILE 571 HA ILE 571 -2.503 -23.178 7.009 517 HB ILE 571 HB ILE 571 -4.849 -21.693 8.269 518 HG12 ILE 571 HG12 ILE 571 -2.970 -20.294 9.288 519 HG13 ILE 571 HG13 ILE 571 -1.916 -21.081 8.124 520 HG21 ILE 571 HG21 ILE 571 -4.247 -23.622 9.608 521 HG22 ILE 571 HG22 ILE 571 -3.861 -22.116 10.443 522 HG23 ILE 571 HG23 ILE 571 -2.578 -23.065 9.686 523 HD11 ILE 571 HD11 ILE 571 -2.631 -18.861 7.459 524 HD12 ILE 571 HD12 ILE 571 -4.311 -19.420 7.428 525 HD13 ILE 571 HD13 ILE 571 -3.120 -20.110 6.316 526 H SER 572 H SER 572 -2.688 -25.258 7.310 527 HA SER 572 HA SER 572 -5.313 -26.556 7.308 528 HB2 SER 572 HB2 SER 572 -2.501 -27.685 7.177 529 HB3 SER 572 HB3 SER 572 -3.981 -28.643 7.108 530 HG SER 572 HG SER 572 -4.514 -27.760 5.230 531 H VAL 573 H VAL 573 -6.229 -26.856 9.210 532 HA VAL 573 HA VAL 573 -4.504 -27.344 11.565 533 HB VAL 573 HB VAL 573 -7.218 -26.004 11.495 534 HG11 VAL 573 HG11 VAL 573 -7.068 -27.352 13.488 535 HG12 VAL 573 HG12 VAL 573 -6.965 -25.642 13.906 536 HG13 VAL 573 HG13 VAL 573 -5.501 -26.635 13.898 537 HG21 VAL 573 HG21 VAL 573 -4.498 -24.947 12.195 538 HG22 VAL 573 HG22 VAL 573 -6.002 -24.067 12.439 539 HG23 VAL 573 HG23 VAL 573 -5.494 -24.506 10.804 540 H LYS 574 H LYS 574 -4.820 -29.170 12.647 541 HA LYS 574 HA LYS 574 -6.891 -30.989 11.803 542 HB2 LYS 574 HB2 LYS 574 -4.717 -31.933 12.094 543 HB3 LYS 574 HB3 LYS 574 -4.528 -31.201 13.672 544 HG2 LYS 574 HG2 LYS 574 -4.880 -33.587 13.827 545 HG3 LYS 574 HG3 LYS 574 -6.214 -32.712 14.581 546 HD2 LYS 574 HD2 LYS 574 -7.580 -33.112 12.601 547 HD3 LYS 574 HD3 LYS 574 -6.226 -33.937 11.825 548 HE2 LYS 574 HE2 LYS 574 -7.515 -34.800 14.404 549 HE3 LYS 574 HE3 LYS 574 -7.891 -35.471 12.819 550 HZ1 LYS 574 HZ1 LYS 574 -5.203 -35.557 14.120 551 HZ2 LYS 574 HZ2 LYS 574 -5.605 -36.240 12.636 552 HZ3 LYS 574 HZ3 LYS 574 -6.306 -36.824 14.056 553 H VAL 575 H VAL 575 -8.774 -31.069 12.736 554 HA VAL 575 HA VAL 575 -9.118 -29.766 15.320 555 HB VAL 575 HB VAL 575 -11.262 -30.815 13.442 556 HG11 VAL 575 HG11 VAL 575 -12.046 -30.581 15.711 557 HG12 VAL 575 HG12 VAL 575 -12.727 -29.274 14.728 558 HG13 VAL 575 HG13 VAL 575 -11.387 -28.951 15.807 559 HG21 VAL 575 HG21 VAL 575 -10.204 -27.995 13.695 560 HG22 VAL 575 HG22 VAL 575 -11.598 -28.483 12.730 561 HG23 VAL 575 HG23 VAL 575 -9.985 -29.066 12.313 562 H ILE 576 H ILE 576 -9.468 -30.942 17.107 563 HA ILE 576 HA ILE 576 -9.199 -33.805 16.828 564 HB ILE 576 HB ILE 576 -9.209 -32.103 19.346 565 HG12 ILE 576 HG12 ILE 576 -7.420 -31.410 17.824 566 HG13 ILE 576 HG13 ILE 576 -6.778 -32.179 19.265 567 HG21 ILE 576 HG21 ILE 576 -8.192 -34.904 18.880 568 HG22 ILE 576 HG22 ILE 576 -9.621 -34.457 19.826 569 HG23 ILE 576 HG23 ILE 576 -8.008 -33.969 20.364 570 HD11 ILE 576 HD11 ILE 576 -6.400 -34.227 17.970 571 HD12 ILE 576 HD12 ILE 576 -5.551 -32.831 17.305 572 HD13 ILE 576 HD13 ILE 576 -7.030 -33.415 16.530 573 H ASP 577 H ASP 577 -10.580 -35.254 17.778 574 HA ASP 577 HA ASP 577 -13.355 -34.846 17.399 575 HB2 ASP 577 HB2 ASP 577 -12.078 -36.968 17.065 576 HB3 ASP 577 HB3 ASP 577 -11.881 -37.073 18.803 577 H ASP 578 H ASP 578 -15.019 -34.537 18.902 578 HA ASP 578 HA ASP 578 -14.239 -33.535 21.548 579 HB2 ASP 578 HB2 ASP 578 -15.821 -32.268 19.947 580 HB3 ASP 578 HB3 ASP 578 -17.004 -33.525 20.234 581 H GLU 579 H GLU 579 -16.600 -34.124 22.966 582 HA GLU 579 HA GLU 579 -16.319 -37.000 23.415 583 HB2 GLU 579 HB2 GLU 579 -17.744 -34.824 24.952 584 HB3 GLU 579 HB3 GLU 579 -17.757 -36.521 25.413 585 HG2 GLU 579 HG2 GLU 579 -15.265 -34.862 25.153 586 HG3 GLU 579 HG3 GLU 579 -16.129 -35.139 26.663 587 H GLU 580 H GLU 580 -18.605 -34.529 22.721 588 HA GLU 580 HA GLU 580 -20.115 -36.109 20.930 589 HB2 GLU 580 HB2 GLU 580 -21.399 -35.183 23.527 590 HB3 GLU 580 HB3 GLU 580 -22.345 -35.416 22.072 591 HG2 GLU 580 HG2 GLU 580 -21.692 -37.775 22.037 592 HG3 GLU 580 HG3 GLU 580 -20.759 -37.530 23.512 593 H TYR 581 H TYR 581 -20.599 -33.316 23.007 594 HA TYR 581 HA TYR 581 -19.656 -31.411 21.288 595 HB2 TYR 581 HB2 TYR 581 -21.827 -30.219 20.676 596 HB3 TYR 581 HB3 TYR 581 -21.512 -31.689 19.788 597 HD1 TYR 581 HD1 TYR 581 -22.826 -33.781 20.430 598 HD2 TYR 581 HD2 TYR 581 -23.849 -29.921 21.886 599 HE1 TYR 581 HE1 TYR 581 -25.090 -34.579 20.945 600 HE2 TYR 581 HE2 TYR 581 -26.101 -30.715 22.412 601 HH TYR 581 HH TYR 581 -27.602 -32.481 21.605 602 H GLU 582 H GLU 582 -18.750 -31.289 23.433 603 HA GLU 582 HA GLU 582 -20.089 -30.651 25.786 604 HB2 GLU 582 HB2 GLU 582 -17.673 -31.135 25.750 605 HB3 GLU 582 HB3 GLU 582 -17.389 -29.625 24.914 606 HG2 GLU 582 HG2 GLU 582 -18.227 -28.355 26.833 607 HG3 GLU 582 HG3 GLU 582 -18.528 -29.854 27.697 608 H LYS 583 H LYS 583 -18.489 -28.291 23.714 609 HA LYS 583 HA LYS 583 -20.532 -26.345 24.325 610 HB2 LYS 583 HB2 LYS 583 -18.806 -26.004 25.997 611 HB3 LYS 583 HB3 LYS 583 -17.557 -26.058 24.780 612 HG2 LYS 583 HG2 LYS 583 -17.937 -23.760 25.511 613 HG3 LYS 583 HG3 LYS 583 -18.356 -23.958 23.812 614 HD2 LYS 583 HD2 LYS 583 -20.750 -24.194 24.530 615 HD3 LYS 583 HD3 LYS 583 -20.235 -23.769 26.164 616 HE2 LYS 583 HE2 LYS 583 -19.346 -21.639 25.315 617 HE3 LYS 583 HE3 LYS 583 -19.866 -22.077 23.698 618 HZ1 LYS 583 HZ1 LYS 583 -21.465 -20.617 24.682 619 HZ2 LYS 583 HZ2 LYS 583 -21.655 -21.614 26.027 620 HZ3 LYS 583 HZ3 LYS 583 -22.162 -22.136 24.511 621 H ASN 584 H ASN 584 -20.724 -24.885 22.616 622 HA ASN 584 HA ASN 584 -19.369 -25.499 20.172 623 HB2 ASN 584 HB2 ASN 584 -21.670 -24.531 20.173 624 HB3 ASN 584 HB3 ASN 584 -21.036 -23.076 20.936 625 HD21 ASN 584 HD21 ASN 584 -21.280 -24.881 17.985 626 HD22 ASN 584 HD22 ASN 584 -20.667 -23.624 16.966 627 H LYS 585 H LYS 585 -17.282 -25.373 20.698 628 HA LYS 585 HA LYS 585 -16.275 -22.898 21.771 629 HB2 LYS 585 HB2 LYS 585 -14.053 -24.432 21.769 630 HB3 LYS 585 HB3 LYS 585 -15.189 -24.344 23.097 631 HG2 LYS 585 HG2 LYS 585 -14.573 -26.636 22.653 632 HG3 LYS 585 HG3 LYS 585 -16.278 -26.386 22.307 633 HD2 LYS 585 HD2 LYS 585 -15.678 -26.197 19.892 634 HD3 LYS 585 HD3 LYS 585 -14.019 -26.623 20.320 635 HE2 LYS 585 HE2 LYS 585 -16.458 -28.324 20.869 636 HE3 LYS 585 HE3 LYS 585 -15.303 -28.592 19.561 637 HZ1 LYS 585 HZ1 LYS 585 -14.938 -29.993 21.533 638 HZ2 LYS 585 HZ2 LYS 585 -14.593 -28.596 22.438 639 HZ3 LYS 585 HZ3 LYS 585 -13.611 -29.005 21.148 640 H THR 586 H THR 586 -14.141 -22.148 20.994 641 HA THR 586 HA THR 586 -13.793 -22.378 18.173 642 HB THR 586 HB THR 586 -15.709 -20.884 18.226 643 HG1 THR 586 HG1 THR 586 -13.729 -20.297 16.959 644 HG21 THR 586 HG21 THR 586 -14.178 -19.210 20.212 645 HG22 THR 586 HG22 THR 586 -15.652 -20.146 20.508 646 HG23 THR 586 HG23 THR 586 -15.695 -18.752 19.432 647 H PHE 587 H PHE 587 -11.879 -21.324 17.518 648 HA PHE 587 HA PHE 587 -10.271 -20.168 19.627 649 HB2 PHE 587 HB2 PHE 587 -8.284 -21.364 18.867 650 HB3 PHE 587 HB3 PHE 587 -9.509 -22.514 19.355 651 HD1 PHE 587 HD1 PHE 587 -10.774 -23.755 17.568 652 HD2 PHE 587 HD2 PHE 587 -7.375 -21.354 16.728 653 HE1 PHE 587 HE1 PHE 587 -10.459 -24.943 15.430 654 HE2 PHE 587 HE2 PHE 587 -7.064 -22.533 14.584 655 HZ PHE 587 HZ PHE 587 -8.608 -24.327 13.944 656 H PHE 588 H PHE 588 -8.305 -19.095 18.448 657 HA PHE 588 HA PHE 588 -9.545 -17.757 16.167 658 HB2 PHE 588 HB2 PHE 588 -7.888 -16.449 18.365 659 HB3 PHE 588 HB3 PHE 588 -8.560 -15.646 16.955 660 HD1 PHE 588 HD1 PHE 588 -9.401 -17.329 20.147 661 HD2 PHE 588 HD2 PHE 588 -10.817 -14.964 16.898 662 HE1 PHE 588 HE1 PHE 588 -11.490 -16.884 21.385 663 HE2 PHE 588 HE2 PHE 588 -12.899 -14.520 18.133 664 HZ PHE 588 HZ PHE 588 -13.234 -15.477 20.375 665 H LEU 589 H LEU 589 -8.140 -17.015 14.602 666 HA LEU 589 HA LEU 589 -5.435 -18.201 14.705 667 HB2 LEU 589 HB2 LEU 589 -7.434 -18.903 12.959 668 HB3 LEU 589 HB3 LEU 589 -6.680 -17.584 12.095 669 HG LEU 589 HG LEU 589 -5.812 -19.633 11.266 670 HD11 LEU 589 HD11 LEU 589 -3.751 -18.310 12.995 671 HD12 LEU 589 HD12 LEU 589 -4.166 -17.906 11.323 672 HD13 LEU 589 HD13 LEU 589 -3.415 -19.451 11.698 673 HD21 LEU 589 HD21 LEU 589 -4.628 -21.234 12.689 674 HD22 LEU 589 HD22 LEU 589 -6.340 -21.071 13.097 675 HD23 LEU 589 HD23 LEU 589 -5.118 -20.299 14.103 676 H GLU 590 H GLU 590 -3.893 -16.657 14.537 677 HA GLU 590 HA GLU 590 -4.679 -14.146 13.268 678 HB2 GLU 590 HB2 GLU 590 -4.465 -13.745 15.658 679 HB3 GLU 590 HB3 GLU 590 -2.846 -14.440 15.659 680 HG2 GLU 590 HG2 GLU 590 -2.107 -12.629 14.141 681 HG3 GLU 590 HG3 GLU 590 -3.717 -11.928 14.230 682 H ILE 591 H ILE 591 -3.380 -13.490 11.729 683 HA ILE 591 HA ILE 591 -0.920 -14.969 11.352 684 HB ILE 591 HB ILE 591 -0.846 -13.855 9.093 685 HG12 ILE 591 HG12 ILE 591 -3.684 -13.066 9.794 686 HG13 ILE 591 HG13 ILE 591 -2.329 -11.957 9.590 687 HG21 ILE 591 HG21 ILE 591 -1.576 -16.139 9.363 688 HG22 ILE 591 HG22 ILE 591 -2.502 -15.358 8.077 689 HG23 ILE 591 HG23 ILE 591 -3.219 -15.603 9.674 690 HD11 ILE 591 HD11 ILE 591 -3.779 -11.946 7.654 691 HD12 ILE 591 HD12 ILE 591 -3.578 -13.688 7.475 692 HD13 ILE 591 HD13 ILE 591 -2.199 -12.610 7.223 693 H GLY 592 H GLY 592 0.960 -14.006 11.382 694 HA2 GLY 592 HA2 GLY 592 1.004 -11.554 12.876 695 HA3 GLY 592 HA3 GLY 592 2.387 -12.576 12.522 696 H GLU 593 H GLU 593 2.801 -10.083 12.285 697 HA GLU 593 HA GLU 593 2.105 -8.760 9.997 698 HB2 GLU 593 HB2 GLU 593 4.640 -8.473 11.616 699 HB3 GLU 593 HB3 GLU 593 3.982 -7.276 10.509 700 HG2 GLU 593 HG2 GLU 593 3.346 -6.518 12.672 701 HG3 GLU 593 HG3 GLU 593 1.928 -7.295 11.940 702 HA PRO 594 HA PRO 594 4.295 -10.979 6.944 703 HB2 PRO 594 HB2 PRO 594 4.238 -9.085 4.967 704 HB3 PRO 594 HB3 PRO 594 2.877 -10.129 5.347 705 HG2 PRO 594 HG2 PRO 594 3.328 -7.295 5.994 706 HG3 PRO 594 HG3 PRO 594 1.807 -8.156 5.761 707 HD2 PRO 594 HD2 PRO 594 2.905 -7.396 8.195 708 HD3 PRO 594 HD3 PRO 594 1.640 -8.612 8.012 709 H ARG 595 H ARG 595 6.345 -11.280 6.847 710 HA ARG 595 HA ARG 595 8.096 -8.985 7.186 711 HB2 ARG 595 HB2 ARG 595 9.747 -10.600 8.075 712 HB3 ARG 595 HB3 ARG 595 8.256 -10.609 8.996 713 HG2 ARG 595 HG2 ARG 595 7.614 -12.622 7.530 714 HG3 ARG 595 HG3 ARG 595 9.330 -12.677 7.122 715 HD2 ARG 595 HD2 ARG 595 8.099 -12.905 9.862 716 HD3 ARG 595 HD3 ARG 595 8.885 -14.182 8.945 717 HE ARG 595 HE ARG 595 10.346 -11.799 9.847 718 HH11 ARG 595 HH11 ARG 595 9.995 -15.353 9.785 719 HH12 ARG 595 HH12 ARG 595 11.457 -15.616 10.578 720 HH21 ARG 595 HH21 ARG 595 12.322 -12.207 11.000 721 HH22 ARG 595 HH22 ARG 595 12.802 -13.834 11.286 722 H LEU 596 H LEU 596 9.091 -8.335 5.479 723 HA LEU 596 HA LEU 596 9.066 -9.639 3.013 724 HB2 LEU 596 HB2 LEU 596 9.302 -7.129 3.642 725 HB3 LEU 596 HB3 LEU 596 10.984 -7.497 3.899 726 HG LEU 596 HG LEU 596 10.375 -6.388 1.691 727 HD11 LEU 596 HD11 LEU 596 11.839 -9.007 1.548 728 HD12 LEU 596 HD12 LEU 596 12.532 -7.440 1.977 729 HD13 LEU 596 HD13 LEU 596 11.911 -7.717 0.348 730 HD21 LEU 596 HD21 LEU 596 9.394 -9.140 1.043 731 HD22 LEU 596 HD22 LEU 596 9.464 -7.759 -0.067 732 HD23 LEU 596 HD23 LEU 596 8.376 -7.743 1.334 733 H VAL 597 H VAL 597 10.512 -11.033 2.174 734 HA VAL 597 HA VAL 597 12.661 -11.949 3.886 735 HB VAL 597 HB VAL 597 12.015 -12.814 1.041 736 HG11 VAL 597 HG11 VAL 597 14.256 -13.468 1.793 737 HG12 VAL 597 HG12 VAL 597 13.200 -14.874 1.638 738 HG13 VAL 597 HG13 VAL 597 13.551 -14.212 3.232 739 HG21 VAL 597 HG21 VAL 597 11.055 -13.981 3.639 740 HG22 VAL 597 HG22 VAL 597 10.781 -14.679 2.039 741 HG23 VAL 597 HG23 VAL 597 10.064 -13.118 2.459 742 H GLU 598 H GLU 598 13.930 -10.202 4.004 743 HA GLU 598 HA GLU 598 14.484 -8.624 1.700 744 HB2 GLU 598 HB2 GLU 598 14.012 -7.618 3.874 745 HB3 GLU 598 HB3 GLU 598 15.466 -8.352 4.528 746 HG2 GLU 598 HG2 GLU 598 15.839 -6.032 4.007 747 HG3 GLU 598 HG3 GLU 598 16.822 -7.071 2.978 748 H MET 599 H MET 599 15.989 -8.919 0.395 749 HA MET 599 HA MET 599 18.452 -10.283 1.217 750 HB2 MET 599 HB2 MET 599 17.145 -11.536 -0.437 751 HB3 MET 599 HB3 MET 599 17.116 -10.140 -1.494 752 HG2 MET 599 HG2 MET 599 19.540 -10.300 -1.770 753 HG3 MET 599 HG3 MET 599 19.559 -11.715 -0.719 754 HE1 MET 599 HE1 MET 599 20.246 -13.153 -4.324 755 HE2 MET 599 HE2 MET 599 20.861 -12.995 -2.678 756 HE3 MET 599 HE3 MET 599 20.746 -11.574 -3.717 757 H SER 600 H SER 600 17.046 -7.342 0.062 758 HA SER 600 HA SER 600 19.435 -6.447 -1.311 759 HB2 SER 600 HB2 SER 600 16.820 -5.030 -0.811 760 HB3 SER 600 HB3 SER 600 18.090 -4.513 -1.923 761 HG SER 600 HG SER 600 16.169 -6.435 -2.169 762 H GLU 601 H GLU 601 18.486 -6.500 1.829 763 HA GLU 601 HA GLU 601 19.644 -3.899 2.527 764 HB2 GLU 601 HB2 GLU 601 17.530 -4.614 3.603 765 HB3 GLU 601 HB3 GLU 601 18.354 -6.014 4.260 766 HG2 GLU 601 HG2 GLU 601 19.786 -4.521 5.588 767 HG3 GLU 601 HG3 GLU 601 18.911 -3.135 4.939 768 H LYS 602 H LYS 602 21.543 -3.773 3.760 769 HA LYS 602 HA LYS 602 23.173 -6.145 3.798 770 HB2 LYS 602 HB2 LYS 602 24.185 -3.884 3.327 771 HB3 LYS 602 HB3 LYS 602 23.757 -3.393 4.957 772 HG2 LYS 602 HG2 LYS 602 25.245 -5.092 5.880 773 HG3 LYS 602 HG3 LYS 602 25.663 -5.622 4.251 774 HD2 LYS 602 HD2 LYS 602 26.603 -3.409 3.777 775 HD3 LYS 602 HD3 LYS 602 26.179 -2.874 5.402 776 HE2 LYS 602 HE2 LYS 602 27.649 -4.573 6.348 777 HE3 LYS 602 HE3 LYS 602 28.075 -5.130 4.731 778 HZ1 LYS 602 HZ1 LYS 602 29.761 -3.669 5.646 779 HZ2 LYS 602 HZ2 LYS 602 28.636 -2.435 5.860 780 HZ3 LYS 602 HZ3 LYS 602 29.046 -2.945 4.308 781 H LYS 603 H LYS 603 21.840 -7.361 5.015 782 HA LYS 603 HA LYS 603 20.866 -6.664 7.533 783 HB2 LYS 603 HB2 LYS 603 20.390 -9.153 7.746 784 HB3 LYS 603 HB3 LYS 603 19.655 -8.324 6.388 785 HG2 LYS 603 HG2 LYS 603 21.430 -9.191 4.909 786 HG3 LYS 603 HG3 LYS 603 22.122 -10.053 6.277 787 HD2 LYS 603 HD2 LYS 603 19.268 -10.517 5.451 788 HD3 LYS 603 HD3 LYS 603 20.577 -11.318 4.604 789 HE2 LYS 603 HE2 LYS 603 19.704 -12.808 6.285 790 HE3 LYS 603 HE3 LYS 603 21.315 -12.302 6.757 791 HZ1 LYS 603 HZ1 LYS 603 19.760 -12.357 8.587 792 HZ2 LYS 603 HZ2 LYS 603 18.777 -11.211 7.873 793 HZ3 LYS 603 HZ3 LYS 603 20.333 -10.803 8.382 794 H GLY 604 H GLY 604 21.838 -6.450 9.319 795 HA2 GLY 604 HA2 GLY 604 24.033 -8.243 10.040 796 HA3 GLY 604 HA3 GLY 604 24.299 -6.504 10.138 797 H GLY 605 H GLY 605 21.172 -7.680 10.695 798 HA2 GLY 605 HA2 GLY 605 21.558 -7.623 13.578 799 HA3 GLY 605 HA3 GLY 605 20.327 -6.593 12.850 800 H PHE 606 H PHE 606 20.789 -9.421 14.310 801 HA PHE 606 HA PHE 606 19.209 -11.181 12.749 802 HB2 PHE 606 HB2 PHE 606 20.913 -11.926 14.415 803 HB3 PHE 606 HB3 PHE 606 19.899 -11.294 15.698 804 HD1 PHE 606 HD2 PHE 606 20.100 -13.849 13.036 805 HD2 PHE 606 HD1 PHE 606 18.161 -12.588 16.596 806 HE1 PHE 606 HE2 PHE 606 18.993 -16.040 13.200 807 HE2 PHE 606 HE1 PHE 606 17.046 -14.782 16.772 808 HZ PHE 606 HZ PHE 606 17.465 -16.508 15.071 809 H THR 607 H THR 607 17.060 -11.055 12.522 810 HA THR 607 HA THR 607 15.542 -9.391 14.257 811 HB THR 607 HB THR 607 13.577 -10.241 12.820 812 HG1 THR 607 HG1 THR 607 15.090 -12.108 12.144 813 HG21 THR 607 HG21 THR 607 15.915 -8.902 11.440 814 HG22 THR 607 HG22 THR 607 14.679 -8.090 12.400 815 HG23 THR 607 HG23 THR 607 14.244 -8.871 10.878 816 H ILE 608 H ILE 608 15.744 -10.320 16.217 817 HA ILE 608 HA ILE 608 15.081 -13.068 16.650 818 HB ILE 608 HB ILE 608 16.833 -12.179 18.021 819 HG12 ILE 608 HG12 ILE 608 16.023 -12.552 20.356 820 HG13 ILE 608 HG13 ILE 608 14.378 -12.557 19.741 821 HG21 ILE 608 HG21 ILE 608 16.591 -10.370 19.608 822 HG22 ILE 608 HG22 ILE 608 14.975 -10.041 18.976 823 HG23 ILE 608 HG23 ILE 608 16.388 -9.850 17.937 824 HD11 ILE 608 HD11 ILE 608 15.208 -14.812 20.103 825 HD12 ILE 608 HD12 ILE 608 16.545 -14.504 18.993 826 HD13 ILE 608 HD13 ILE 608 14.887 -14.522 18.392 827 H THR 609 H THR 609 13.040 -13.331 16.025 828 HA THR 609 HA THR 609 11.064 -11.652 17.292 829 HB THR 609 HB THR 609 10.870 -11.580 14.903 830 HG1 THR 609 HG1 THR 609 8.810 -11.848 14.760 831 HG21 THR 609 HG21 THR 609 10.573 -14.594 14.916 832 HG22 THR 609 HG22 THR 609 11.946 -13.691 14.280 833 HG23 THR 609 HG23 THR 609 10.369 -13.556 13.503 834 H GLU 610 H GLU 610 10.804 -12.447 19.205 835 HA GLU 610 HA GLU 610 10.073 -15.278 19.522 836 HB2 GLU 610 HB2 GLU 610 10.615 -13.210 21.652 837 HB3 GLU 610 HB3 GLU 610 10.495 -14.942 21.853 838 HG2 GLU 610 HG2 GLU 610 12.582 -15.301 20.828 839 HG3 GLU 610 HG3 GLU 610 12.639 -13.640 20.223 840 H GLU 611 H GLU 611 9.320 -12.180 21.039 841 HA GLU 611 HA GLU 611 6.553 -12.222 20.504 842 HB2 GLU 611 HB2 GLU 611 6.792 -14.040 22.223 843 HB3 GLU 611 HB3 GLU 611 7.565 -12.898 23.296 844 HG2 GLU 611 HG2 GLU 611 4.777 -12.402 22.347 845 HG3 GLU 611 HG3 GLU 611 5.083 -13.578 23.618 846 H TYR 612 H TYR 612 6.706 -10.116 19.919 847 HA TYR 612 HA TYR 612 8.284 -8.238 21.485 848 HB2 TYR 612 HB2 TYR 612 6.673 -7.813 18.961 849 HB3 TYR 612 HB3 TYR 612 7.633 -6.577 19.749 850 HD1 TYR 612 HD2 TYR 612 10.174 -7.635 20.265 851 HD2 TYR 612 HD1 TYR 612 7.594 -8.590 17.021 852 HE1 TYR 612 HE2 TYR 612 12.112 -8.305 18.930 853 HE2 TYR 612 HE1 TYR 612 9.538 -9.271 15.675 854 HH TYR 612 HH TYR 612 12.517 -9.819 17.063 855 H ASP 613 H ASP 613 7.472 -6.457 22.522 856 HA ASP 613 HA ASP 613 4.967 -6.826 23.790 857 HB2 ASP 613 HB2 ASP 613 5.389 -4.766 24.995 858 HB3 ASP 613 HB3 ASP 613 6.907 -5.636 24.865 859 H ASP 614 H ASP 614 6.023 -4.622 21.236 860 HA ASP 614 HA ASP 614 3.208 -4.445 20.444 861 HB2 ASP 614 HB2 ASP 614 5.306 -2.257 20.057 862 HB3 ASP 614 HB3 ASP 614 3.723 -2.253 19.314 863 H LYS 615 H LYS 615 3.381 -6.172 19.094 864 HA LYS 615 HA LYS 615 5.571 -6.194 17.208 865 HB2 LYS 615 HB2 LYS 615 4.695 -8.321 16.410 866 HB3 LYS 615 HB3 LYS 615 4.812 -8.338 18.158 867 HG2 LYS 615 HG2 LYS 615 2.424 -8.056 18.360 868 HG3 LYS 615 HG3 LYS 615 2.270 -7.883 16.610 869 HD2 LYS 615 HD2 LYS 615 3.198 -10.156 16.340 870 HD3 LYS 615 HD3 LYS 615 3.242 -10.320 18.094 871 HE2 LYS 615 HE2 LYS 615 1.278 -11.410 17.141 872 HE3 LYS 615 HE3 LYS 615 0.819 -10.063 18.183 873 HZ1 LYS 615 HZ1 LYS 615 -0.360 -10.325 16.004 874 HZ2 LYS 615 HZ2 LYS 615 1.040 -9.678 15.236 875 HZ3 LYS 615 HZ3 LYS 615 0.200 -8.787 16.358 876 H GLN 616 H GLN 616 2.385 -5.112 17.412 877 HA GLN 616 HA GLN 616 1.653 -5.060 14.693 878 HB2 GLN 616 HB2 GLN 616 -0.095 -3.546 15.405 879 HB3 GLN 616 HB3 GLN 616 0.076 -4.811 16.611 880 HG2 GLN 616 HG2 GLN 616 1.458 -3.224 17.971 881 HG3 GLN 616 HG3 GLN 616 1.087 -1.976 16.791 882 HE21 GLN 616 HE21 GLN 616 -1.653 -3.034 16.423 883 HE22 GLN 616 HE22 GLN 616 -2.516 -2.539 17.820 884 HA PRO 617 HA PRO 617 3.941 -1.483 13.254 885 HB2 PRO 617 HB2 PRO 617 1.551 -0.401 11.949 886 HB3 PRO 617 HB3 PRO 617 3.037 -1.011 11.216 887 HG2 PRO 617 HG2 PRO 617 0.689 -2.333 11.033 888 HG3 PRO 617 HG3 PRO 617 2.256 -3.162 11.090 889 HD2 PRO 617 HD2 PRO 617 0.230 -2.778 13.240 890 HD3 PRO 617 HD3 PRO 617 1.239 -4.194 12.869 891 H LEU 618 H LEU 618 4.404 0.119 14.625 892 HA LEU 618 HA LEU 618 2.471 2.102 15.312 893 HB2 LEU 618 HB2 LEU 618 1.931 0.263 16.893 894 HB3 LEU 618 HB3 LEU 618 3.583 0.286 17.463 895 HG LEU 618 HG LEU 618 3.216 2.575 18.350 896 HD11 LEU 618 HD11 LEU 618 1.464 3.304 16.822 897 HD12 LEU 618 HD12 LEU 618 0.938 3.453 18.499 898 HD13 LEU 618 HD13 LEU 618 0.357 2.115 17.506 899 HD21 LEU 618 HD21 LEU 618 1.801 1.899 20.221 900 HD22 LEU 618 HD22 LEU 618 2.916 0.606 19.773 901 HD23 LEU 618 HD23 LEU 618 1.222 0.518 19.291 902 H THR 619 H THR 619 3.491 3.897 16.263 903 HA THR 619 HA THR 619 6.311 3.815 16.863 904 HB THR 619 HB THR 619 5.065 5.853 14.956 905 HG1 THR 619 HG1 THR 619 6.104 3.399 14.538 906 HG21 THR 619 HG21 THR 619 6.930 6.731 16.308 907 HG22 THR 619 HG22 THR 619 7.410 6.587 14.619 908 HG23 THR 619 HG23 THR 619 7.938 5.384 15.794 909 H SER 620 H SER 620 6.630 5.135 18.684 910 HA SER 620 HA SER 620 4.236 6.603 19.513 911 HB2 SER 620 HB2 SER 620 4.800 4.563 20.874 912 HB3 SER 620 HB3 SER 620 6.285 5.371 21.367 913 HG SER 620 HG SER 620 4.202 7.017 21.726 914 H LYS 621 H LYS 621 7.407 7.032 18.550 915 HA LYS 621 HA LYS 621 7.532 9.650 19.877 916 HB2 LYS 621 HB2 LYS 621 9.656 8.109 18.361 917 HB3 LYS 621 HB3 LYS 621 9.879 9.725 19.009 918 HG2 LYS 621 HG2 LYS 621 9.529 8.780 21.280 919 HG3 LYS 621 HG3 LYS 621 9.453 7.171 20.562 920 HD2 LYS 621 HD2 LYS 621 11.707 7.541 21.398 921 HD3 LYS 621 HD3 LYS 621 11.754 7.545 19.638 922 HE2 LYS 621 HE2 LYS 621 11.763 9.997 19.638 923 HE3 LYS 621 HE3 LYS 621 11.681 10.000 21.398 924 HZ1 LYS 621 HZ1 LYS 621 13.900 8.946 21.428 925 HZ2 LYS 621 HZ2 LYS 621 13.920 10.392 20.570 926 HZ3 LYS 621 HZ3 LYS 621 13.923 8.947 19.744 927 H GLU 622 H GLU 622 8.170 11.477 18.405 928 HA GLU 622 HA GLU 622 6.879 11.083 15.861 929 HB2 GLU 622 HB2 GLU 622 7.106 13.566 15.555 930 HB3 GLU 622 HB3 GLU 622 6.131 13.073 16.926 931 HG2 GLU 622 HG2 GLU 622 7.921 13.602 18.443 932 HG3 GLU 622 HG3 GLU 622 9.000 13.949 17.093 933 H GLU 623 H GLU 623 8.618 9.629 15.495 934 HA GLU 623 HA GLU 623 11.082 10.744 14.332 935 HB2 GLU 623 HB2 GLU 623 10.092 7.900 14.689 936 HB3 GLU 623 HB3 GLU 623 11.696 8.371 14.159 937 HG2 GLU 623 HG2 GLU 623 10.570 9.102 16.831 938 HG3 GLU 623 HG3 GLU 623 11.490 7.624 16.547 939 H GLU 624 H GLU 624 11.295 8.705 12.289 940 HA GLU 624 HA GLU 624 9.231 9.537 10.487 941 HB2 GLU 624 HB2 GLU 624 11.593 8.882 9.753 942 HB3 GLU 624 HB3 GLU 624 11.156 7.219 10.134 943 HG2 GLU 624 HG2 GLU 624 10.883 7.559 7.781 944 HG3 GLU 624 HG3 GLU 624 9.288 7.398 8.517 945 H GLU 625 H GLU 625 7.293 8.837 11.006 946 HA GLU 625 HA GLU 625 6.727 6.678 12.691 947 HB2 GLU 625 HB2 GLU 625 4.882 7.924 10.643 948 HB3 GLU 625 HB3 GLU 625 4.399 7.002 12.060 949 HG2 GLU 625 HG2 GLU 625 5.433 8.737 13.490 950 HG3 GLU 625 HG3 GLU 625 5.775 9.680 12.044 951 H ARG 626 H ARG 626 6.466 4.564 12.346 952 HA ARG 626 HA ARG 626 7.683 3.530 10.110 953 HB2 ARG 626 HB2 ARG 626 6.035 2.175 12.203 954 HB3 ARG 626 HB3 ARG 626 6.617 1.269 10.813 955 HG2 ARG 626 HG2 ARG 626 8.934 2.141 11.470 956 HG3 ARG 626 HG3 ARG 626 8.179 2.596 13.000 957 HD2 ARG 626 HD2 ARG 626 8.123 -0.190 11.828 958 HD3 ARG 626 HD3 ARG 626 9.294 0.360 13.016 959 HE ARG 626 HE ARG 626 7.403 0.715 14.529 960 HH11 ARG 626 HH11 ARG 626 6.724 -1.428 11.738 961 HH12 ARG 626 HH12 ARG 626 5.773 -2.485 12.646 962 HH21 ARG 626 HH21 ARG 626 6.077 -0.805 15.739 963 HH22 ARG 626 HH22 ARG 626 5.376 -2.141 14.969 964 H ARG 627 H ARG 627 4.263 3.908 10.627 965 HA ARG 627 HA ARG 627 3.229 2.502 8.475 966 HB2 ARG 627 HB2 ARG 627 2.258 4.210 10.391 967 HB3 ARG 627 HB3 ARG 627 2.027 5.155 8.937 968 HG2 ARG 627 HG2 ARG 627 0.886 2.415 9.481 969 HG3 ARG 627 HG3 ARG 627 0.010 3.935 9.555 970 HD2 ARG 627 HD2 ARG 627 0.523 4.227 7.119 971 HD3 ARG 627 HD3 ARG 627 1.180 2.587 7.133 972 HE ARG 627 HE ARG 627 -1.545 2.975 8.107 973 HH11 ARG 627 HH11 ARG 627 0.476 1.789 5.443 974 HH12 ARG 627 HH12 ARG 627 -0.779 0.925 4.710 975 HH21 ARG 627 HH21 ARG 627 -3.242 1.800 7.068 976 HH22 ARG 627 HH22 ARG 627 -2.923 0.924 5.634 977 H ILE 628 H ILE 628 5.011 5.517 8.418 978 HA ILE 628 HA ILE 628 4.183 6.318 5.773 979 HB ILE 628 HB ILE 628 6.437 7.317 7.535 980 HG12 ILE 628 HG12 ILE 628 3.679 8.483 7.115 981 HG13 ILE 628 HG13 ILE 628 4.165 7.559 8.533 982 HG21 ILE 628 HG21 ILE 628 6.785 7.879 5.176 983 HG22 ILE 628 HG22 ILE 628 6.417 9.318 6.126 984 HG23 ILE 628 HG23 ILE 628 5.173 8.598 5.105 985 HD11 ILE 628 HD11 ILE 628 5.820 9.267 9.060 986 HD12 ILE 628 HD12 ILE 628 4.198 9.957 8.956 987 HD13 ILE 628 HD13 ILE 628 5.339 10.167 7.626 988 H ALA 629 H ALA 629 7.109 5.008 7.296 989 HA ALA 629 HA ALA 629 8.522 4.850 4.773 990 HB1 ALA 629 HB1 ALA 629 10.411 4.056 6.102 991 HB2 ALA 629 HB2 ALA 629 9.369 3.927 7.519 992 HB3 ALA 629 HB3 ALA 629 9.707 5.507 6.817 993 H GLU 630 H GLU 630 6.688 2.754 6.804 994 HA GLU 630 HA GLU 630 7.744 0.370 5.866 995 HB2 GLU 630 HB2 GLU 630 5.217 0.879 7.394 996 HB3 GLU 630 HB3 GLU 630 5.677 -0.737 6.860 997 HG2 GLU 630 HG2 GLU 630 7.872 -0.387 8.047 998 HG3 GLU 630 HG3 GLU 630 7.179 1.082 8.725 999 H MET 631 H MET 631 5.890 2.440 4.181 1000 HA MET 631 HA MET 631 4.438 0.674 2.530 1001 HB2 MET 631 HB2 MET 631 4.566 2.376 0.784 1002 HB3 MET 631 HB3 MET 631 4.291 3.155 2.333 1003 HG2 MET 631 HG2 MET 631 6.630 3.780 2.467 1004 HG3 MET 631 HG3 MET 631 6.958 2.931 0.958 1005 HE1 MET 631 HE1 MET 631 8.124 5.061 -0.008 1006 HE2 MET 631 HE2 MET 631 7.811 5.929 1.497 1007 HE3 MET 631 HE3 MET 631 7.383 6.661 -0.049 1008 H GLY 632 H GLY 632 7.847 1.139 2.932 1009 HA2 GLY 632 HA2 GLY 632 8.633 -0.115 0.451 1010 HA3 GLY 632 HA3 GLY 632 9.684 0.391 1.762 1011 H ARG 633 H ARG 633 7.186 -1.391 3.065 1012 HA ARG 633 HA ARG 633 8.476 -3.965 2.613 1013 HB2 ARG 633 HB2 ARG 633 8.291 -4.549 5.019 1014 HB3 ARG 633 HB3 ARG 633 9.246 -3.093 4.851 1015 HG2 ARG 633 HG2 ARG 633 7.512 -1.732 5.634 1016 HG3 ARG 633 HG3 ARG 633 6.320 -3.008 5.446 1017 HD2 ARG 633 HD2 ARG 633 8.632 -3.178 7.359 1018 HD3 ARG 633 HD3 ARG 633 7.061 -2.516 7.804 1019 HE ARG 633 HE ARG 633 6.988 -5.143 6.635 1020 HH11 ARG 633 HH11 ARG 633 7.009 -3.275 9.684 1021 HH12 ARG 633 HH12 ARG 633 6.605 -4.625 10.639 1022 HH21 ARG 633 HH21 ARG 633 6.349 -6.941 7.984 1023 HH22 ARG 633 HH22 ARG 633 6.241 -6.740 9.663 1024 HA PRO 634 HA PRO 634 4.164 -5.026 2.383 1025 HB2 PRO 634 HB2 PRO 634 4.038 -7.567 3.202 1026 HB3 PRO 634 HB3 PRO 634 4.831 -7.081 1.686 1027 HG2 PRO 634 HG2 PRO 634 6.050 -7.776 4.333 1028 HG3 PRO 634 HG3 PRO 634 6.625 -8.213 2.723 1029 HD2 PRO 634 HD2 PRO 634 7.578 -6.147 4.239 1030 HD3 PRO 634 HD3 PRO 634 7.734 -6.231 2.476 1031 H ILE 635 H ILE 635 2.434 -4.663 3.631 1032 HA ILE 635 HA ILE 635 2.715 -5.059 6.497 1033 HB ILE 635 HB ILE 635 1.487 -3.097 6.948 1034 HG12 ILE 635 HG12 ILE 635 -0.166 -2.921 5.207 1035 HG13 ILE 635 HG13 ILE 635 0.772 -1.436 5.209 1036 HG21 ILE 635 HG21 ILE 635 3.619 -2.389 4.971 1037 HG22 ILE 635 HG22 ILE 635 3.809 -2.712 6.690 1038 HG23 ILE 635 HG23 ILE 635 2.923 -1.282 6.159 1039 HD11 ILE 635 HD11 ILE 635 0.318 -2.111 2.970 1040 HD12 ILE 635 HD12 ILE 635 0.933 -3.718 3.377 1041 HD13 ILE 635 HD13 ILE 635 2.063 -2.343 3.318 1042 H LEU 636 H LEU 636 0.571 -5.259 7.507 1043 HA LEU 636 HA LEU 636 -1.082 -6.666 5.633 1044 HB2 LEU 636 HB2 LEU 636 -2.133 -7.795 7.715 1045 HB3 LEU 636 HB3 LEU 636 -0.545 -8.292 7.195 1046 HG LEU 636 HG LEU 636 0.457 -6.943 9.027 1047 HD11 LEU 636 HD11 LEU 636 -0.925 -6.095 10.828 1048 HD12 LEU 636 HD12 LEU 636 -2.378 -6.519 9.916 1049 HD13 LEU 636 HD13 LEU 636 -1.274 -5.287 9.297 1050 HD21 LEU 636 HD21 LEU 636 -1.613 -8.924 9.922 1051 HD22 LEU 636 HD22 LEU 636 -0.183 -8.429 10.831 1052 HD23 LEU 636 HD23 LEU 636 -0.005 -9.318 9.318 1053 H GLY 637 H GLY 637 -3.527 -6.845 6.741 1054 HA2 GLY 637 HA2 GLY 637 -4.568 -4.244 6.173 1055 HA3 GLY 637 HA3 GLY 637 -5.473 -5.687 6.620 1056 H GLU 638 H GLU 638 -6.673 -3.914 7.742 1057 HA GLU 638 HA GLU 638 -5.553 -2.771 10.077 1058 HB2 GLU 638 HB2 GLU 638 -7.547 -1.892 8.851 1059 HB3 GLU 638 HB3 GLU 638 -8.466 -3.266 9.444 1060 HG2 GLU 638 HG2 GLU 638 -8.921 -1.285 10.761 1061 HG3 GLU 638 HG3 GLU 638 -8.108 -2.510 11.738 1062 H HIS 639 H HIS 639 -7.807 -5.490 9.589 1063 HA HIS 639 HA HIS 639 -6.745 -6.566 12.069 1064 HB2 HIS 639 HB2 HIS 639 -9.598 -6.613 11.137 1065 HB3 HIS 639 HB3 HIS 639 -8.975 -7.761 12.321 1066 HD1 HIS 639 HD1 HIS 639 -8.479 -6.868 14.688 1067 HD2 HIS 639 HD2 HIS 639 -9.813 -3.979 12.030 1068 HE1 HIS 639 HE1 HIS 639 -8.993 -4.832 16.072 1069 H THR 640 H THR 640 -5.953 -8.442 12.071 1070 HA THR 640 HA THR 640 -6.506 -10.220 9.852 1071 HB THR 640 HB THR 640 -4.155 -11.036 10.221 1072 HG1 THR 640 HG1 THR 640 -2.853 -9.905 11.545 1073 HG21 THR 640 HG21 THR 640 -4.902 -9.693 8.313 1074 HG22 THR 640 HG22 THR 640 -3.217 -9.384 8.716 1075 HG23 THR 640 HG23 THR 640 -4.473 -8.221 9.182 1076 H LYS 641 H LYS 641 -7.964 -11.388 10.944 1077 HA LYS 641 HA LYS 641 -6.981 -13.219 12.905 1078 HB2 LYS 641 HB2 LYS 641 -7.455 -11.237 14.306 1079 HB3 LYS 641 HB3 LYS 641 -9.117 -11.246 13.737 1080 HG2 LYS 641 HG2 LYS 641 -9.477 -13.412 14.802 1081 HG3 LYS 641 HG3 LYS 641 -7.798 -13.439 15.326 1082 HD2 LYS 641 HD2 LYS 641 -9.067 -12.757 17.208 1083 HD3 LYS 641 HD3 LYS 641 -8.272 -11.316 16.596 1084 HE2 LYS 641 HE2 LYS 641 -11.150 -12.081 16.064 1085 HE3 LYS 641 HE3 LYS 641 -10.636 -10.943 17.300 1086 HZ1 LYS 641 HZ1 LYS 641 -9.665 -9.617 15.350 1087 HZ2 LYS 641 HZ2 LYS 641 -11.316 -9.652 15.536 1088 HZ3 LYS 641 HZ3 LYS 641 -10.626 -10.601 14.350 1089 H LEU 642 H LEU 642 -8.303 -14.912 13.156 1090 HA LEU 642 HA LEU 642 -10.715 -15.041 11.493 1091 HB2 LEU 642 HB2 LEU 642 -8.777 -16.139 10.479 1092 HB3 LEU 642 HB3 LEU 642 -8.552 -17.038 11.962 1093 HG LEU 642 HG LEU 642 -10.817 -18.084 11.539 1094 HD11 LEU 642 HD11 LEU 642 -10.382 -16.889 8.839 1095 HD12 LEU 642 HD12 LEU 642 -11.684 -16.474 9.966 1096 HD13 LEU 642 HD13 LEU 642 -11.588 -18.094 9.265 1097 HD21 LEU 642 HD21 LEU 642 -9.872 -19.564 9.810 1098 HD22 LEU 642 HD22 LEU 642 -8.874 -19.313 11.239 1099 HD23 LEU 642 HD23 LEU 642 -8.463 -18.482 9.742 1100 H GLU 643 H GLU 643 -12.370 -15.673 12.715 1101 HA GLU 643 HA GLU 643 -11.872 -16.895 15.320 1102 HB2 GLU 643 HB2 GLU 643 -13.409 -14.907 15.040 1103 HB3 GLU 643 HB3 GLU 643 -14.428 -15.920 14.043 1104 HG2 GLU 643 HG2 GLU 643 -14.965 -17.321 15.910 1105 HG3 GLU 643 HG3 GLU 643 -13.807 -16.462 16.932 1106 H VAL 644 H VAL 644 -11.635 -19.081 15.123 1107 HA VAL 644 HA VAL 644 -13.107 -20.444 12.994 1108 HB VAL 644 HB VAL 644 -10.921 -21.567 14.754 1109 HG11 VAL 644 HG11 VAL 644 -10.801 -23.347 13.134 1110 HG12 VAL 644 HG12 VAL 644 -12.042 -22.574 12.150 1111 HG13 VAL 644 HG13 VAL 644 -12.449 -23.203 13.747 1112 HG21 VAL 644 HG21 VAL 644 -10.035 -19.737 13.415 1113 HG22 VAL 644 HG22 VAL 644 -10.708 -20.466 11.962 1114 HG23 VAL 644 HG23 VAL 644 -9.418 -21.285 12.836 1115 H ILE 645 H ILE 645 -14.981 -21.053 13.667 1116 HA ILE 645 HA ILE 645 -15.389 -21.849 16.425 1117 HB ILE 645 HB ILE 645 -17.350 -21.514 14.138 1118 HG12 ILE 645 HG12 ILE 645 -16.783 -19.691 16.477 1119 HG13 ILE 645 HG13 ILE 645 -16.132 -19.457 14.861 1120 HG21 ILE 645 HG21 ILE 645 -18.156 -23.054 15.876 1121 HG22 ILE 645 HG22 ILE 645 -19.062 -21.539 15.878 1122 HG23 ILE 645 HG23 ILE 645 -17.820 -21.826 17.106 1123 HD11 ILE 645 HD11 ILE 645 -19.046 -19.451 15.602 1124 HD12 ILE 645 HD12 ILE 645 -18.352 -19.207 13.988 1125 HD13 ILE 645 HD13 ILE 645 -18.034 -18.037 15.265 1126 H ILE 646 H ILE 646 -15.447 -23.926 17.032 1127 HA ILE 646 HA ILE 646 -15.353 -25.971 14.946 1128 HB ILE 646 HB ILE 646 -14.650 -26.229 17.894 1129 HG12 ILE 646 HG12 ILE 646 -12.780 -26.135 15.514 1130 HG13 ILE 646 HG13 ILE 646 -13.038 -24.801 16.639 1131 HG21 ILE 646 HG21 ILE 646 -14.323 -28.169 15.626 1132 HG22 ILE 646 HG22 ILE 646 -15.436 -28.306 16.987 1133 HG23 ILE 646 HG23 ILE 646 -13.698 -28.389 17.262 1134 HD11 ILE 646 HD11 ILE 646 -12.164 -26.163 18.465 1135 HD12 ILE 646 HD12 ILE 646 -10.991 -26.035 17.157 1136 HD13 ILE 646 HD13 ILE 646 -11.931 -27.512 17.358 1137 H GLU 647 H GLU 647 -17.405 -26.511 14.533 1138 HA GLU 647 HA GLU 647 -18.936 -27.366 16.855 1139 HB2 GLU 647 HB2 GLU 647 -21.010 -26.903 15.594 1140 HB3 GLU 647 HB3 GLU 647 -20.066 -25.457 15.879 1141 HG2 GLU 647 HG2 GLU 647 -19.297 -25.496 13.582 1142 HG3 GLU 647 HG3 GLU 647 -20.188 -26.997 13.301 1143 H GLU 648 H GLU 648 -20.185 -29.301 16.533 1144 HA GLU 648 HA GLU 648 -18.667 -30.926 14.774 1145 HB2 GLU 648 HB2 GLU 648 -19.816 -32.884 15.904 1146 HB3 GLU 648 HB3 GLU 648 -18.708 -31.938 16.870 1147 HG2 GLU 648 HG2 GLU 648 -20.587 -32.546 18.179 1148 HG3 GLU 648 HG3 GLU 648 -20.634 -30.806 17.906 1149 H SER 649 H SER 649 -19.291 -32.115 13.275 1150 HA SER 649 HA SER 649 -21.985 -32.395 12.412 1151 HB2 SER 649 HB2 SER 649 -19.901 -30.837 10.867 1152 HB3 SER 649 HB3 SER 649 -21.370 -31.471 10.101 1153 HG SER 649 HG SER 649 -21.673 -29.972 12.413 1154 H TYR 650 H TYR 650 -21.578 -34.501 12.797 1155 HA TYR 650 HA TYR 650 -19.155 -35.825 12.509 1156 HB2 TYR 650 HB2 TYR 650 -21.886 -37.074 12.401 1157 HB3 TYR 650 HB3 TYR 650 -20.378 -37.904 12.751 1158 HD1 TYR 650 HD1 TYR 650 -19.047 -36.221 14.611 1159 HD2 TYR 650 HD2 TYR 650 -23.151 -37.069 14.245 1160 HE1 TYR 650 HE1 TYR 650 -19.325 -35.744 17.025 1161 HE2 TYR 650 HE2 TYR 650 -23.489 -36.603 16.663 1162 HH TYR 650 HH TYR 650 -21.110 -35.072 18.562 1163 H GLU 651 H GLU 651 -21.892 -35.810 10.321 1164 HA GLU 651 HA GLU 651 -20.704 -37.609 8.555 1165 HB2 GLU 651 HB2 GLU 651 -22.881 -35.595 8.079 1166 HB3 GLU 651 HB3 GLU 651 -22.482 -36.918 7.002 1167 HG2 GLU 651 HG2 GLU 651 -23.184 -38.524 8.575 1168 HG3 GLU 651 HG3 GLU 651 -23.332 -37.306 9.847 1169 H PHE 652 H PHE 652 -20.727 -34.212 8.987 1170 HA PHE 652 HA PHE 652 -20.112 -32.381 7.900 1171 HB2 PHE 652 HB2 PHE 652 -17.826 -33.320 8.401 1172 HB3 PHE 652 HB3 PHE 652 -17.827 -34.071 6.809 1173 HD1 PHE 652 HD1 PHE 652 -18.262 -30.751 8.413 1174 HD2 PHE 652 HD2 PHE 652 -16.853 -32.907 5.038 1175 HE1 PHE 652 HE1 PHE 652 -17.355 -28.666 7.469 1176 HE2 PHE 652 HE2 PHE 652 -15.950 -30.821 4.083 1177 HZ PHE 652 HZ PHE 652 -16.196 -28.705 5.300 1178 H LYS 653 H LYS 653 -22.064 -32.793 6.848 1179 HA LYS 653 HA LYS 653 -22.054 -33.818 4.193 1180 HB2 LYS 653 HB2 LYS 653 -23.995 -33.876 5.789 1181 HB3 LYS 653 HB3 LYS 653 -24.175 -32.146 5.559 1182 HG2 LYS 653 HG2 LYS 653 -24.609 -32.523 3.166 1183 HG3 LYS 653 HG3 LYS 653 -24.450 -34.258 3.423 1184 HD2 LYS 653 HD2 LYS 653 -26.491 -32.477 4.753 1185 HD3 LYS 653 HD3 LYS 653 -26.808 -33.523 3.370 1186 HE2 LYS 653 HE2 LYS 653 -26.290 -35.490 4.724 1187 HE3 LYS 653 HE3 LYS 653 -25.880 -34.467 6.095 1188 HZ1 LYS 653 HZ1 LYS 653 -28.549 -34.664 4.827 1189 HZ2 LYS 653 HZ2 LYS 653 -28.152 -33.680 6.141 1190 HZ3 LYS 653 HZ3 LYS 653 -28.097 -35.367 6.304 1191 H SER 654 H SER 654 -22.989 -30.560 5.372 1192 HA SER 654 HA SER 654 -22.668 -28.480 4.531 1193 HB2 SER 654 HB2 SER 654 -19.974 -29.648 3.792 1194 HB3 SER 654 HB3 SER 654 -20.335 -27.943 4.087 1195 HG SER 654 HG SER 654 -21.213 -29.250 6.173 1196 H THR 655 H THR 655 -24.005 -30.188 2.731 1197 HA THR 655 HA THR 655 -22.837 -29.873 0.133 1198 HB THR 655 HB THR 655 -25.548 -30.971 0.901 1199 HG1 THR 655 HG1 THR 655 -24.554 -32.954 0.902 1200 HG21 THR 655 HG21 THR 655 -23.853 -31.341 -1.584 1201 HG22 THR 655 HG22 THR 655 -25.324 -30.376 -1.482 1202 HG23 THR 655 HG23 THR 655 -25.401 -32.124 -1.279 1203 H VAL 656 H VAL 656 -22.989 -27.966 -0.792 1204 HA VAL 656 HA VAL 656 -25.200 -26.208 -0.216 1205 HB VAL 656 HB VAL 656 -24.020 -24.580 -1.705 1206 HG11 VAL 656 HG11 VAL 656 -22.305 -25.809 0.452 1207 HG12 VAL 656 HG12 VAL 656 -23.547 -24.576 0.681 1208 HG13 VAL 656 HG13 VAL 656 -22.088 -24.198 -0.232 1209 HG21 VAL 656 HG21 VAL 656 -21.953 -26.769 -1.906 1210 HG22 VAL 656 HG22 VAL 656 -21.723 -25.117 -2.453 1211 HG23 VAL 656 HG23 VAL 656 -22.939 -26.139 -3.223 1212 H ASP 657 H ASP 657 -26.740 -25.611 -1.671 1213 HA ASP 657 HA ASP 657 -26.948 -27.322 -4.052 1214 HB2 ASP 657 HB2 ASP 657 -29.129 -26.002 -2.400 1215 HB3 ASP 657 HB3 ASP 657 -29.424 -26.794 -3.939 Start of MODEL 13 1 H HIS 501 H HIS 501 4.492 0.600 -0.699 2 HA HIS 501 HA HIS 501 2.838 -0.470 1.394 3 HB2 HIS 501 HB2 HIS 501 1.624 1.554 0.696 4 HB3 HIS 501 HB3 HIS 501 1.752 1.072 -0.987 5 HD1 HIS 501 HD1 HIS 501 -0.288 0.481 2.089 6 HD2 HIS 501 HD2 HIS 501 0.011 -0.985 -1.773 7 HE1 HIS 501 HE1 HIS 501 -2.341 -0.928 1.721 8 H ALA 502 H ALA 502 2.626 -2.499 1.050 9 HA ALA 502 HA ALA 502 3.231 -3.686 -1.554 10 HB1 ALA 502 HB1 ALA 502 2.684 -4.943 1.136 11 HB2 ALA 502 HB2 ALA 502 4.271 -4.677 0.421 12 HB3 ALA 502 HB3 ALA 502 3.154 -5.828 -0.316 13 H GLY 503 H GLY 503 0.723 -4.153 0.956 14 HA2 GLY 503 HA2 GLY 503 -1.478 -3.643 -0.508 15 HA3 GLY 503 HA3 GLY 503 -1.096 -5.340 -0.825 16 H ILE 504 H ILE 504 -3.051 -5.911 0.354 17 HA ILE 504 HA ILE 504 -2.818 -5.457 3.220 18 HB ILE 504 HB ILE 504 -5.257 -5.856 1.465 19 HG12 ILE 504 HG12 ILE 504 -5.970 -3.637 2.586 20 HG13 ILE 504 HG13 ILE 504 -4.280 -3.477 3.035 21 HG21 ILE 504 HG21 ILE 504 -5.185 -5.716 4.437 22 HG22 ILE 504 HG22 ILE 504 -5.633 -7.091 3.417 23 HG23 ILE 504 HG23 ILE 504 -6.637 -5.636 3.430 24 HD11 ILE 504 HD11 ILE 504 -5.352 -3.680 0.226 25 HD12 ILE 504 HD12 ILE 504 -3.657 -3.506 0.669 26 HD13 ILE 504 HD13 ILE 504 -4.798 -2.206 1.027 27 H PHE 505 H PHE 505 -1.941 -7.308 4.073 28 HA PHE 505 HA PHE 505 -2.958 -9.893 3.182 29 HB2 PHE 505 HB2 PHE 505 -0.834 -9.102 5.173 30 HB3 PHE 505 HB3 PHE 505 -1.535 -10.706 5.224 31 HD1 PHE 505 HD1 PHE 505 -1.531 -11.950 2.889 32 HD2 PHE 505 HD2 PHE 505 1.091 -8.795 3.982 33 HE1 PHE 505 HE1 PHE 505 0.105 -12.747 1.240 34 HE2 PHE 505 HE2 PHE 505 2.726 -9.577 2.329 35 HZ PHE 505 HZ PHE 505 2.238 -11.557 0.953 36 H THR 506 H THR 506 -4.680 -10.797 4.078 37 HA THR 506 HA THR 506 -5.227 -10.545 6.838 38 HB THR 506 HB THR 506 -6.143 -8.348 6.043 39 HG1 THR 506 HG1 THR 506 -7.418 -8.806 7.700 40 HG21 THR 506 HG21 THR 506 -6.776 -9.021 3.756 41 HG22 THR 506 HG22 THR 506 -8.140 -8.298 4.611 42 HG23 THR 506 HG23 THR 506 -8.046 -10.049 4.421 43 H PHE 507 H PHE 507 -7.443 -11.679 7.255 44 HA PHE 507 HA PHE 507 -7.275 -14.165 5.848 45 HB2 PHE 507 HB2 PHE 507 -8.986 -13.165 8.103 46 HB3 PHE 507 HB3 PHE 507 -9.249 -14.744 7.362 47 HD1 PHE 507 HD1 PHE 507 -7.545 -16.452 7.525 48 HD2 PHE 507 HD2 PHE 507 -7.181 -12.768 9.596 49 HE1 PHE 507 HE1 PHE 507 -5.893 -17.467 8.993 50 HE2 PHE 507 HE2 PHE 507 -5.503 -13.763 11.084 51 HZ PHE 507 HZ PHE 507 -4.848 -16.116 10.791 52 H GLU 508 H GLU 508 -8.851 -15.099 4.540 53 HA GLU 508 HA GLU 508 -10.221 -13.391 2.798 54 HB2 GLU 508 HB2 GLU 508 -9.368 -15.709 2.358 55 HB3 GLU 508 HB3 GLU 508 -10.691 -16.322 3.328 56 HG2 GLU 508 HG2 GLU 508 -12.276 -15.341 1.745 57 HG3 GLU 508 HG3 GLU 508 -10.896 -14.774 0.789 58 H GLU 509 H GLU 509 -11.123 -14.990 5.742 59 HA GLU 509 HA GLU 509 -13.653 -13.588 5.737 60 HB2 GLU 509 HB2 GLU 509 -14.737 -15.635 6.692 61 HB3 GLU 509 HB3 GLU 509 -14.268 -15.800 5.014 62 HG2 GLU 509 HG2 GLU 509 -12.137 -16.914 5.948 63 HG3 GLU 509 HG3 GLU 509 -13.058 -17.033 7.451 64 HA PRO 510 HA PRO 510 -12.139 -12.675 9.822 65 HB2 PRO 510 HB2 PRO 510 -14.334 -11.604 10.933 66 HB3 PRO 510 HB3 PRO 510 -13.475 -10.794 9.619 67 HG2 PRO 510 HG2 PRO 510 -15.981 -12.434 9.508 68 HG3 PRO 510 HG3 PRO 510 -15.604 -10.913 8.682 69 HD2 PRO 510 HD2 PRO 510 -15.413 -13.397 7.478 70 HD3 PRO 510 HD3 PRO 510 -14.475 -11.967 6.995 71 H VAL 511 H VAL 511 -14.846 -14.803 9.385 72 HA VAL 511 HA VAL 511 -14.299 -16.163 11.910 73 HB VAL 511 HB VAL 511 -17.133 -15.512 10.987 74 HG11 VAL 511 HG11 VAL 511 -16.955 -17.604 12.157 75 HG12 VAL 511 HG12 VAL 511 -17.853 -16.421 13.103 76 HG13 VAL 511 HG13 VAL 511 -16.182 -16.798 13.522 77 HG21 VAL 511 HG21 VAL 511 -17.350 -14.041 12.936 78 HG22 VAL 511 HG22 VAL 511 -16.108 -13.455 11.828 79 HG23 VAL 511 HG23 VAL 511 -15.645 -14.281 13.313 80 H THR 512 H THR 512 -14.380 -18.362 11.548 81 HA THR 512 HA THR 512 -15.723 -19.231 9.131 82 HB THR 512 HB THR 512 -13.223 -19.054 8.749 83 HG1 THR 512 HG1 THR 512 -14.230 -20.293 7.450 84 HG21 THR 512 HG21 THR 512 -12.456 -19.792 10.963 85 HG22 THR 512 HG22 THR 512 -11.781 -20.815 9.691 86 HG23 THR 512 HG23 THR 512 -13.132 -21.392 10.669 87 H HIS 513 H HIS 513 -16.710 -21.203 9.283 88 HA HIS 513 HA HIS 513 -16.859 -22.307 11.980 89 HB2 HIS 513 HB2 HIS 513 -19.116 -23.220 11.229 90 HB3 HIS 513 HB3 HIS 513 -19.028 -21.478 11.415 91 HD1 HIS 513 HD1 HIS 513 -19.591 -20.081 9.355 92 HD2 HIS 513 HD2 HIS 513 -19.212 -24.127 8.521 93 HE1 HIS 513 HE1 HIS 513 -20.374 -20.387 6.962 94 H VAL 514 H VAL 514 -16.163 -24.275 12.314 95 HA VAL 514 HA VAL 514 -15.812 -25.998 9.986 96 HB VAL 514 HB VAL 514 -13.710 -26.850 10.836 97 HG11 VAL 514 HG11 VAL 514 -13.712 -23.839 10.791 98 HG12 VAL 514 HG12 VAL 514 -13.534 -24.914 9.405 99 HG13 VAL 514 HG13 VAL 514 -12.278 -24.847 10.642 100 HG21 VAL 514 HG21 VAL 514 -14.037 -24.917 13.131 101 HG22 VAL 514 HG22 VAL 514 -12.598 -25.885 12.802 102 HG23 VAL 514 HG23 VAL 514 -14.115 -26.677 13.226 103 H SER 515 H SER 515 -15.619 -28.329 10.667 104 HA SER 515 HA SER 515 -17.789 -28.829 12.544 105 HB2 SER 515 HB2 SER 515 -17.710 -29.820 10.187 106 HB3 SER 515 HB3 SER 515 -16.358 -30.770 10.752 107 HG SER 515 HG SER 515 -19.014 -30.859 11.644 108 H GLU 516 H GLU 516 -17.578 -30.322 14.218 109 HA GLU 516 HA GLU 516 -15.171 -30.542 15.616 110 HB2 GLU 516 HB2 GLU 516 -17.277 -30.862 16.754 111 HB3 GLU 516 HB3 GLU 516 -17.712 -32.275 15.848 112 HG2 GLU 516 HG2 GLU 516 -15.639 -33.364 16.870 113 HG3 GLU 516 HG3 GLU 516 -15.552 -31.957 17.923 114 H SER 517 H SER 517 -16.527 -32.579 13.083 115 HA SER 517 HA SER 517 -13.980 -33.964 13.091 116 HB2 SER 517 HB2 SER 517 -15.712 -35.467 14.076 117 HB3 SER 517 HB3 SER 517 -16.631 -35.343 12.579 118 HG SER 517 HG SER 517 -14.180 -36.634 13.086 119 H ILE 518 H ILE 518 -13.854 -32.004 11.607 120 HA ILE 518 HA ILE 518 -14.571 -32.727 8.865 121 HB ILE 518 HB ILE 518 -14.922 -30.388 9.419 122 HG12 ILE 518 HG12 ILE 518 -12.461 -30.664 7.662 123 HG13 ILE 518 HG13 ILE 518 -14.132 -30.780 7.121 124 HG21 ILE 518 HG21 ILE 518 -12.043 -30.297 10.253 125 HG22 ILE 518 HG22 ILE 518 -13.485 -30.134 11.284 126 HG23 ILE 518 HG23 ILE 518 -13.107 -28.892 10.095 127 HD11 ILE 518 HD11 ILE 518 -12.748 -28.383 8.240 128 HD12 ILE 518 HD12 ILE 518 -14.437 -28.422 7.708 129 HD13 ILE 518 HD13 ILE 518 -13.120 -28.677 6.544 130 H GLY 519 H GLY 519 -11.947 -32.761 11.088 131 HA2 GLY 519 HA2 GLY 519 -9.992 -34.031 10.798 132 HA3 GLY 519 HA3 GLY 519 -10.242 -33.937 9.057 133 H ILE 520 H ILE 520 -9.919 -31.883 8.058 134 HA ILE 520 HA ILE 520 -7.904 -30.246 9.421 135 HB ILE 520 HB ILE 520 -7.752 -31.233 6.564 136 HG12 ILE 520 HG12 ILE 520 -7.033 -32.984 8.173 137 HG13 ILE 520 HG13 ILE 520 -5.708 -32.437 7.158 138 HG21 ILE 520 HG21 ILE 520 -5.921 -29.349 8.048 139 HG22 ILE 520 HG22 ILE 520 -6.942 -28.983 6.667 140 HG23 ILE 520 HG23 ILE 520 -5.555 -30.057 6.473 141 HD11 ILE 520 HD11 ILE 520 -6.218 -31.646 10.011 142 HD12 ILE 520 HD12 ILE 520 -4.903 -31.042 9.007 143 HD13 ILE 520 HD13 ILE 520 -4.972 -32.753 9.432 144 H MET 521 H MET 521 -8.462 -28.205 9.240 145 HA MET 521 HA MET 521 -10.343 -27.522 7.106 146 HB2 MET 521 HB2 MET 521 -11.253 -25.817 8.506 147 HB3 MET 521 HB3 MET 521 -11.178 -27.282 9.465 148 HG2 MET 521 HG2 MET 521 -10.365 -25.767 11.019 149 HG3 MET 521 HG3 MET 521 -8.887 -26.203 10.195 150 HE1 MET 521 HE1 MET 521 -8.103 -23.819 11.418 151 HE2 MET 521 HE2 MET 521 -9.772 -23.448 11.843 152 HE3 MET 521 HE3 MET 521 -8.805 -22.266 10.959 153 H GLU 522 H GLU 522 -9.940 -25.612 5.968 154 HA GLU 522 HA GLU 522 -7.245 -24.541 6.310 155 HB2 GLU 522 HB2 GLU 522 -8.519 -25.547 3.808 156 HB3 GLU 522 HB3 GLU 522 -7.308 -24.278 3.735 157 HG2 GLU 522 HG2 GLU 522 -5.690 -25.651 4.725 158 HG3 GLU 522 HG3 GLU 522 -6.852 -26.942 5.063 159 H VAL 523 H VAL 523 -7.043 -22.482 6.292 160 HA VAL 523 HA VAL 523 -9.370 -20.836 5.552 161 HB VAL 523 HB VAL 523 -7.093 -20.041 7.381 162 HG11 VAL 523 HG11 VAL 523 -8.502 -18.258 8.060 163 HG12 VAL 523 HG12 VAL 523 -9.835 -18.859 7.087 164 HG13 VAL 523 HG13 VAL 523 -8.378 -18.224 6.297 165 HG21 VAL 523 HG21 VAL 523 -8.288 -21.954 8.322 166 HG22 VAL 523 HG22 VAL 523 -9.809 -21.071 8.168 167 HG23 VAL 523 HG23 VAL 523 -8.547 -20.484 9.252 168 H LYS 524 H LYS 524 -9.071 -19.450 3.937 169 HA LYS 524 HA LYS 524 -6.529 -19.413 2.547 170 HB2 LYS 524 HB2 LYS 524 -9.148 -18.033 1.911 171 HB3 LYS 524 HB3 LYS 524 -7.755 -18.246 0.852 172 HG2 LYS 524 HG2 LYS 524 -8.963 -20.726 1.912 173 HG3 LYS 524 HG3 LYS 524 -9.905 -19.782 0.750 174 HD2 LYS 524 HD2 LYS 524 -7.055 -20.489 0.242 175 HD3 LYS 524 HD3 LYS 524 -8.372 -21.585 -0.184 176 HE2 LYS 524 HE2 LYS 524 -8.106 -18.724 -1.081 177 HE3 LYS 524 HE3 LYS 524 -7.714 -20.140 -2.067 178 HZ1 LYS 524 HZ1 LYS 524 -10.386 -19.292 -1.073 179 HZ2 LYS 524 HZ2 LYS 524 -10.091 -20.789 -1.782 180 HZ3 LYS 524 HZ3 LYS 524 -9.868 -19.397 -2.678 181 H VAL 525 H VAL 525 -5.163 -17.683 2.605 182 HA VAL 525 HA VAL 525 -6.051 -15.325 4.104 183 HB VAL 525 HB VAL 525 -3.218 -16.221 3.538 184 HG11 VAL 525 HG11 VAL 525 -4.263 -14.086 5.386 185 HG12 VAL 525 HG12 VAL 525 -3.406 -13.809 3.870 186 HG13 VAL 525 HG13 VAL 525 -2.573 -14.563 5.233 187 HG21 VAL 525 HG21 VAL 525 -4.832 -16.492 6.061 188 HG22 VAL 525 HG22 VAL 525 -3.107 -16.843 5.903 189 HG23 VAL 525 HG23 VAL 525 -4.286 -17.798 5.005 190 H LEU 526 H LEU 526 -6.184 -13.468 3.080 191 HA LEU 526 HA LEU 526 -5.920 -13.394 0.246 192 HB2 LEU 526 HB2 LEU 526 -6.603 -11.271 2.271 193 HB3 LEU 526 HB3 LEU 526 -6.606 -11.003 0.541 194 HG LEU 526 HG LEU 526 -8.392 -13.019 1.926 195 HD11 LEU 526 HD11 LEU 526 -8.998 -10.235 0.943 196 HD12 LEU 526 HD12 LEU 526 -8.928 -10.746 2.630 197 HD13 LEU 526 HD13 LEU 526 -10.170 -11.397 1.565 198 HD21 LEU 526 HD21 LEU 526 -9.588 -13.005 -0.194 199 HD22 LEU 526 HD22 LEU 526 -7.911 -13.497 -0.433 200 HD23 LEU 526 HD23 LEU 526 -8.422 -11.864 -0.856 201 H ARG 527 H ARG 527 -4.315 -12.795 -0.865 202 HA ARG 527 HA ARG 527 -1.811 -12.050 0.307 203 HB2 ARG 527 HB2 ARG 527 -1.975 -13.667 -1.532 204 HB3 ARG 527 HB3 ARG 527 -2.718 -12.452 -2.549 205 HG2 ARG 527 HG2 ARG 527 -0.643 -11.187 -2.583 206 HG3 ARG 527 HG3 ARG 527 0.101 -12.363 -1.498 207 HD2 ARG 527 HD2 ARG 527 0.729 -12.742 -3.844 208 HD3 ARG 527 HD3 ARG 527 -0.151 -14.104 -3.162 209 HE ARG 527 HE ARG 527 -2.127 -12.759 -4.333 210 HH11 ARG 527 HH11 ARG 527 1.046 -13.698 -5.572 211 HH12 ARG 527 HH12 ARG 527 0.529 -13.817 -7.196 212 HH21 ARG 527 HH21 ARG 527 -2.835 -12.982 -6.544 213 HH22 ARG 527 HH22 ARG 527 -1.717 -13.411 -7.752 214 H THR 528 H THR 528 -0.568 -10.143 -0.517 215 HA THR 528 HA THR 528 -1.889 -7.734 -0.257 216 HB THR 528 HB THR 528 0.300 -6.886 -1.316 217 HG1 THR 528 HG1 THR 528 1.544 -8.325 -2.079 218 HG21 THR 528 HG21 THR 528 -0.120 -6.882 1.089 219 HG22 THR 528 HG22 THR 528 1.548 -7.335 0.745 220 HG23 THR 528 HG23 THR 528 0.372 -8.571 1.182 221 H SER 529 H SER 529 -2.517 -6.215 -1.700 222 HA SER 529 HA SER 529 -3.483 -6.880 -4.170 223 HB2 SER 529 HB2 SER 529 -4.171 -4.919 -2.801 224 HB3 SER 529 HB3 SER 529 -2.633 -4.157 -3.165 225 HG SER 529 HG SER 529 -4.434 -3.504 -4.507 226 H GLY 530 H GLY 530 -0.370 -5.529 -3.192 227 HA2 GLY 530 HA2 GLY 530 0.599 -5.972 -5.910 228 HA3 GLY 530 HA3 GLY 530 1.313 -4.847 -4.747 229 H ALA 531 H ALA 531 1.223 -8.071 -5.848 230 HA ALA 531 HA ALA 531 2.746 -8.998 -3.554 231 HB1 ALA 531 HB1 ALA 531 1.002 -10.475 -4.479 232 HB2 ALA 531 HB2 ALA 531 2.604 -11.194 -4.622 233 HB3 ALA 531 HB3 ALA 531 1.834 -10.472 -6.036 234 H ARG 532 H ARG 532 4.749 -8.187 -3.642 235 HA ARG 532 HA ARG 532 6.157 -8.434 -6.205 236 HB2 ARG 532 HB2 ARG 532 6.703 -6.323 -4.112 237 HB3 ARG 532 HB3 ARG 532 7.372 -6.417 -5.730 238 HG2 ARG 532 HG2 ARG 532 4.516 -5.805 -4.990 239 HG3 ARG 532 HG3 ARG 532 5.715 -4.674 -5.618 240 HD2 ARG 532 HD2 ARG 532 5.757 -5.838 -7.733 241 HD3 ARG 532 HD3 ARG 532 4.696 -7.099 -7.098 242 HE ARG 532 HE ARG 532 3.739 -4.367 -7.072 243 HH11 ARG 532 HH11 ARG 532 3.516 -7.608 -8.554 244 HH12 ARG 532 HH12 ARG 532 2.089 -7.249 -9.395 245 HH21 ARG 532 HH21 ARG 532 1.778 -3.938 -8.209 246 HH22 ARG 532 HH22 ARG 532 1.066 -5.136 -9.190 247 H GLY 533 H GLY 533 7.307 -10.230 -5.870 248 HA2 GLY 533 HA2 GLY 533 9.382 -11.130 -5.235 249 HA3 GLY 533 HA3 GLY 533 9.431 -10.004 -3.883 250 H ASN 534 H ASN 534 9.961 -11.637 -2.443 251 HA ASN 534 HA ASN 534 7.835 -13.579 -1.901 252 HB2 ASN 534 HB2 ASN 534 9.969 -14.640 -2.546 253 HB3 ASN 534 HB3 ASN 534 10.793 -13.761 -1.268 254 HD21 ASN 534 HD21 ASN 534 7.616 -15.265 -0.866 255 HD22 ASN 534 HD22 ASN 534 8.170 -16.448 0.242 256 H VAL 535 H VAL 535 6.798 -13.462 -0.054 257 HA VAL 535 HA VAL 535 7.879 -11.841 2.126 258 HB VAL 535 HB VAL 535 5.011 -11.885 1.127 259 HG11 VAL 535 HG11 VAL 535 6.260 -10.352 3.402 260 HG12 VAL 535 HG12 VAL 535 5.038 -11.615 3.529 261 HG13 VAL 535 HG13 VAL 535 4.642 -10.072 2.780 262 HG21 VAL 535 HG21 VAL 535 5.387 -9.506 0.556 263 HG22 VAL 535 HG22 VAL 535 6.410 -10.626 -0.358 264 HG23 VAL 535 HG23 VAL 535 7.094 -9.724 0.989 265 H ILE 536 H ILE 536 7.566 -12.743 4.087 266 HA ILE 536 HA ILE 536 6.147 -15.308 4.135 267 HB ILE 536 HB ILE 536 8.338 -14.289 5.958 268 HG12 ILE 536 HG12 ILE 536 9.190 -15.046 3.812 269 HG13 ILE 536 HG13 ILE 536 9.646 -16.182 5.080 270 HG21 ILE 536 HG21 ILE 536 6.831 -16.863 6.028 271 HG22 ILE 536 HG22 ILE 536 6.711 -15.559 7.198 272 HG23 ILE 536 HG23 ILE 536 8.222 -16.480 7.048 273 HD11 ILE 536 HD11 ILE 536 7.759 -17.618 4.353 274 HD12 ILE 536 HD12 ILE 536 8.991 -17.368 3.112 275 HD13 ILE 536 HD13 ILE 536 7.477 -16.489 3.029 276 H VAL 537 H VAL 537 4.469 -15.546 5.437 277 HA VAL 537 HA VAL 537 3.894 -13.333 7.244 278 HB VAL 537 HB VAL 537 1.819 -15.049 5.850 279 HG11 VAL 537 HG11 VAL 537 1.043 -14.140 7.963 280 HG12 VAL 537 HG12 VAL 537 0.215 -13.358 6.615 281 HG13 VAL 537 HG13 VAL 537 1.517 -12.518 7.456 282 HG21 VAL 537 HG21 VAL 537 2.995 -13.700 4.224 283 HG22 VAL 537 HG22 VAL 537 2.728 -12.257 5.193 284 HG23 VAL 537 HG23 VAL 537 1.354 -13.079 4.440 285 HA PRO 538 HA PRO 538 4.110 -16.917 10.058 286 HB2 PRO 538 HB2 PRO 538 4.157 -15.462 12.341 287 HB3 PRO 538 HB3 PRO 538 5.593 -15.751 11.357 288 HG2 PRO 538 HG2 PRO 538 3.846 -13.331 11.502 289 HG3 PRO 538 HG3 PRO 538 5.609 -13.425 11.360 290 HD2 PRO 538 HD2 PRO 538 3.954 -12.898 9.261 291 HD3 PRO 538 HD3 PRO 538 5.528 -13.695 9.084 292 H TYR 539 H TYR 539 2.633 -17.851 11.497 293 HA TYR 539 HA TYR 539 0.255 -16.373 12.207 294 HB2 TYR 539 HB2 TYR 539 -1.319 -17.956 11.233 295 HB3 TYR 539 HB3 TYR 539 -0.265 -17.277 9.994 296 HD1 TYR 539 HD2 TYR 539 -1.085 -20.337 11.884 297 HD2 TYR 539 HD1 TYR 539 1.246 -18.640 8.769 298 HE1 TYR 539 HE2 TYR 539 -0.534 -22.583 11.103 299 HE2 TYR 539 HE1 TYR 539 1.812 -20.880 7.964 300 HH TYR 539 HH TYR 539 1.955 -23.089 8.742 301 H LYS 540 H LYS 540 -1.107 -17.596 13.675 302 HA LYS 540 HA LYS 540 0.025 -19.968 14.899 303 HB2 LYS 540 HB2 LYS 540 0.581 -19.058 16.987 304 HB3 LYS 540 HB3 LYS 540 1.242 -17.910 15.833 305 HG2 LYS 540 HG2 LYS 540 -0.700 -16.484 16.139 306 HG3 LYS 540 HG3 LYS 540 -1.346 -17.631 17.309 307 HD2 LYS 540 HD2 LYS 540 0.936 -17.312 18.472 308 HD3 LYS 540 HD3 LYS 540 1.003 -15.833 17.509 309 HE2 LYS 540 HE2 LYS 540 -0.014 -15.215 19.546 310 HE3 LYS 540 HE3 LYS 540 -1.290 -15.355 18.314 311 HZ1 LYS 540 HZ1 LYS 540 -1.958 -16.417 20.413 312 HZ2 LYS 540 HZ2 LYS 540 -0.640 -17.433 20.322 313 HZ3 LYS 540 HZ3 LYS 540 -1.844 -17.578 19.192 314 H THR 541 H THR 541 -1.384 -20.809 16.529 315 HA THR 541 HA THR 541 -4.107 -19.985 16.177 316 HB THR 541 HB THR 541 -4.495 -21.944 17.796 317 HG1 THR 541 HG1 THR 541 -1.943 -21.920 18.075 318 HG21 THR 541 HG21 THR 541 -4.253 -23.584 15.945 319 HG22 THR 541 HG22 THR 541 -3.292 -22.374 15.082 320 HG23 THR 541 HG23 THR 541 -4.986 -22.061 15.429 321 H ILE 542 H ILE 542 -5.458 -19.331 17.828 322 HA ILE 542 HA ILE 542 -4.172 -18.365 20.281 323 HB ILE 542 HB ILE 542 -6.471 -17.252 18.695 324 HG12 ILE 542 HG12 ILE 542 -3.760 -16.028 19.237 325 HG13 ILE 542 HG13 ILE 542 -4.255 -16.775 17.723 326 HG21 ILE 542 HG21 ILE 542 -5.282 -16.266 21.292 327 HG22 ILE 542 HG22 ILE 542 -6.902 -16.928 21.068 328 HG23 ILE 542 HG23 ILE 542 -6.475 -15.374 20.348 329 HD11 ILE 542 HD11 ILE 542 -4.329 -14.340 17.649 330 HD12 ILE 542 HD12 ILE 542 -5.540 -14.341 18.944 331 HD13 ILE 542 HD13 ILE 542 -5.906 -15.070 17.377 332 H GLU 543 H GLU 543 -4.784 -19.746 21.792 333 HA GLU 543 HA GLU 543 -7.017 -21.425 21.692 334 HB2 GLU 543 HB2 GLU 543 -5.550 -20.599 24.199 335 HB3 GLU 543 HB3 GLU 543 -6.437 -22.087 23.922 336 HG2 GLU 543 HG2 GLU 543 -4.291 -22.852 23.703 337 HG3 GLU 543 HG3 GLU 543 -4.630 -22.430 22.033 338 H GLY 544 H GLY 544 -9.016 -20.755 21.757 339 HA2 GLY 544 HA2 GLY 544 -9.762 -18.451 23.425 340 HA3 GLY 544 HA3 GLY 544 -10.741 -19.133 22.126 341 H THR 545 H THR 545 -12.351 -20.475 22.669 342 HA THR 545 HA THR 545 -12.482 -21.454 25.409 343 HB THR 545 HB THR 545 -14.809 -22.136 24.779 344 HG1 THR 545 HG1 THR 545 -15.606 -21.434 22.768 345 HG21 THR 545 HG21 THR 545 -15.746 -19.890 24.520 346 HG22 THR 545 HG22 THR 545 -14.154 -19.288 24.053 347 HG23 THR 545 HG23 THR 545 -14.420 -19.893 25.689 348 H ALA 546 H ALA 546 -10.918 -22.288 22.905 349 HA ALA 546 HA ALA 546 -11.444 -25.139 23.104 350 HB1 ALA 546 HB1 ALA 546 -11.974 -24.120 20.881 351 HB2 ALA 546 HB2 ALA 546 -10.773 -25.404 20.837 352 HB3 ALA 546 HB3 ALA 546 -10.260 -23.721 20.727 353 H ARG 547 H ARG 547 -9.746 -26.376 23.561 354 HA ARG 547 HA ARG 547 -7.346 -25.183 24.572 355 HB2 ARG 547 HB2 ARG 547 -8.396 -27.977 24.444 356 HB3 ARG 547 HB3 ARG 547 -6.872 -27.533 25.210 357 HG2 ARG 547 HG2 ARG 547 -7.882 -26.288 26.808 358 HG3 ARG 547 HG3 ARG 547 -9.424 -26.186 25.950 359 HD2 ARG 547 HD2 ARG 547 -8.214 -28.677 27.096 360 HD3 ARG 547 HD3 ARG 547 -9.561 -27.772 27.822 361 HE ARG 547 HE ARG 547 -10.293 -28.335 25.217 362 HH11 ARG 547 HH11 ARG 547 -9.580 -30.279 28.075 363 HH12 ARG 547 HH12 ARG 547 -10.567 -31.584 27.620 364 HH21 ARG 547 HH21 ARG 547 -11.624 -30.113 24.548 365 HH22 ARG 547 HH22 ARG 547 -11.761 -31.495 25.532 366 H GLY 548 H GLY 548 -5.408 -25.366 23.739 367 HA2 GLY 548 HA2 GLY 548 -5.251 -26.034 20.903 368 HA3 GLY 548 HA3 GLY 548 -4.048 -25.149 21.823 369 H GLY 549 H GLY 549 -2.573 -26.470 20.682 370 HA2 GLY 549 HA2 GLY 549 -0.873 -28.040 20.841 371 HA3 GLY 549 HA3 GLY 549 -1.672 -28.697 22.254 372 H GLY 550 H GLY 550 -3.940 -29.513 21.381 373 HA2 GLY 550 HA2 GLY 550 -4.447 -31.016 19.240 374 HA3 GLY 550 HA3 GLY 550 -3.211 -31.980 20.057 375 H GLU 551 H GLU 551 -5.780 -29.955 21.382 376 HA GLU 551 HA GLU 551 -6.723 -32.361 22.744 377 HB2 GLU 551 HB2 GLU 551 -5.470 -30.549 24.086 378 HB3 GLU 551 HB3 GLU 551 -6.936 -29.605 23.899 379 HG2 GLU 551 HG2 GLU 551 -8.167 -30.991 25.265 380 HG3 GLU 551 HG3 GLU 551 -7.101 -32.372 24.995 381 H ASP 552 H ASP 552 -7.957 -29.022 22.083 382 HA ASP 552 HA ASP 552 -10.404 -30.342 21.102 383 HB2 ASP 552 HB2 ASP 552 -9.862 -27.382 21.569 384 HB3 ASP 552 HB3 ASP 552 -11.329 -28.005 20.848 385 H PHE 553 H PHE 553 -7.876 -28.116 20.238 386 HA PHE 553 HA PHE 553 -8.157 -29.050 17.507 387 HB2 PHE 553 HB2 PHE 553 -7.696 -26.837 16.612 388 HB3 PHE 553 HB3 PHE 553 -9.109 -26.737 17.647 389 HD1 PHE 553 HD1 PHE 553 -8.952 -25.590 19.821 390 HD2 PHE 553 HD2 PHE 553 -5.684 -25.687 17.117 391 HE1 PHE 553 HE1 PHE 553 -7.901 -23.713 21.016 392 HE2 PHE 553 HE2 PHE 553 -4.626 -23.837 18.309 393 HZ PHE 553 HZ PHE 553 -5.735 -22.832 20.258 394 H GLU 554 H GLU 554 -6.154 -28.979 16.396 395 HA GLU 554 HA GLU 554 -3.908 -29.527 18.129 396 HB2 GLU 554 HB2 GLU 554 -4.648 -30.704 15.996 397 HB3 GLU 554 HB3 GLU 554 -3.886 -29.357 15.138 398 HG2 GLU 554 HG2 GLU 554 -1.835 -30.025 16.655 399 HG3 GLU 554 HG3 GLU 554 -2.784 -31.523 16.761 400 H ASP 555 H ASP 555 -2.358 -28.121 18.584 401 HA ASP 555 HA ASP 555 -2.415 -25.351 17.950 402 HB2 ASP 555 HB2 ASP 555 -1.076 -26.114 19.850 403 HB3 ASP 555 HB3 ASP 555 -0.051 -27.065 18.792 404 H THR 556 H THR 556 -1.797 -24.259 16.168 405 HA THR 556 HA THR 556 0.217 -25.527 14.578 406 HB THR 556 HB THR 556 -1.935 -25.962 13.369 407 HG1 THR 556 HG1 THR 556 -0.974 -25.628 11.498 408 HG21 THR 556 HG21 THR 556 -2.934 -24.009 12.159 409 HG22 THR 556 HG22 THR 556 -2.043 -22.953 13.261 410 HG23 THR 556 HG23 THR 556 -3.267 -24.066 13.886 411 H CYS 557 H CYS 557 1.583 -24.237 13.634 412 HA CYS 557 HA CYS 557 1.388 -21.411 13.803 413 HB2 CYS 557 HB2 CYS 557 3.589 -21.379 15.146 414 HB3 CYS 557 HB3 CYS 557 2.099 -21.680 16.039 415 HG CYS 557 HG CYS 557 2.553 -24.188 16.685 416 H GLY 558 H GLY 558 3.364 -20.475 12.679 417 HA2 GLY 558 HA2 GLY 558 5.438 -21.624 11.635 418 HA3 GLY 558 HA3 GLY 558 4.157 -22.332 10.653 419 H GLU 559 H GLU 559 5.315 -21.180 8.956 420 HA GLU 559 HA GLU 559 4.384 -18.424 8.796 421 HB2 GLU 559 HB2 GLU 559 7.124 -19.423 8.058 422 HB3 GLU 559 HB3 GLU 559 6.508 -17.811 7.723 423 HG2 GLU 559 HG2 GLU 559 6.353 -17.405 10.149 424 HG3 GLU 559 HG3 GLU 559 7.028 -19.009 10.440 425 H LEU 560 H LEU 560 3.473 -17.928 6.931 426 HA LEU 560 HA LEU 560 3.313 -19.953 4.824 427 HB2 LEU 560 HB2 LEU 560 1.808 -17.396 5.293 428 HB3 LEU 560 HB3 LEU 560 1.577 -18.443 3.909 429 HG LEU 560 HG LEU 560 1.026 -19.161 6.776 430 HD11 LEU 560 HD11 LEU 560 -1.301 -19.169 6.063 431 HD12 LEU 560 HD12 LEU 560 -0.818 -18.547 4.486 432 HD13 LEU 560 HD13 LEU 560 -0.565 -17.575 5.935 433 HD21 LEU 560 HD21 LEU 560 0.729 -20.745 4.222 434 HD22 LEU 560 HD22 LEU 560 -0.090 -21.156 5.717 435 HD23 LEU 560 HD23 LEU 560 1.672 -21.164 5.652 436 H GLU 561 H GLU 561 3.990 -19.605 2.800 437 HA GLU 561 HA GLU 561 5.739 -17.303 2.515 438 HB2 GLU 561 HB2 GLU 561 6.678 -19.652 2.436 439 HB3 GLU 561 HB3 GLU 561 5.795 -19.845 0.911 440 HG2 GLU 561 HG2 GLU 561 7.110 -17.974 -0.027 441 HG3 GLU 561 HG3 GLU 561 7.887 -17.794 1.508 442 H PHE 562 H PHE 562 4.898 -15.743 1.371 443 HA PHE 562 HA PHE 562 3.129 -16.399 -0.867 444 HB2 PHE 562 HB2 PHE 562 3.240 -13.979 0.927 445 HB3 PHE 562 HB3 PHE 562 2.433 -13.952 -0.632 446 HD1 PHE 562 HD2 PHE 562 2.383 -15.403 2.751 447 HD2 PHE 562 HD1 PHE 562 0.328 -14.964 -0.945 448 HE1 PHE 562 HE2 PHE 562 0.334 -16.270 3.788 449 HE2 PHE 562 HE1 PHE 562 -1.724 -15.828 0.090 450 HZ PHE 562 HZ PHE 562 -1.718 -16.488 2.446 451 H GLN 563 H GLN 563 3.462 -15.254 -2.788 452 HA GLN 563 HA GLN 563 5.858 -13.665 -3.007 453 HB2 GLN 563 HB2 GLN 563 5.410 -16.179 -4.630 454 HB3 GLN 563 HB3 GLN 563 6.630 -14.969 -4.963 455 HG2 GLN 563 HG2 GLN 563 7.591 -15.464 -2.748 456 HG3 GLN 563 HG3 GLN 563 6.432 -16.768 -2.592 457 HE21 GLN 563 HE21 GLN 563 9.239 -15.659 -4.370 458 HE22 GLN 563 HE22 GLN 563 9.619 -17.210 -4.992 459 H ASN 564 H ASN 564 6.032 -13.128 -5.401 460 HA ASN 564 HA ASN 564 3.631 -12.047 -6.350 461 HB2 ASN 564 HB2 ASN 564 4.938 -11.529 -8.425 462 HB3 ASN 564 HB3 ASN 564 5.729 -10.987 -6.957 463 HD21 ASN 564 HD21 ASN 564 6.883 -11.432 -9.523 464 HD22 ASN 564 HD22 ASN 564 8.097 -12.644 -9.334 465 H ASP 565 H ASP 565 5.426 -14.942 -6.816 466 HA ASP 565 HA ASP 565 3.891 -16.100 -8.947 467 HB2 ASP 565 HB2 ASP 565 6.193 -16.789 -8.561 468 HB3 ASP 565 HB3 ASP 565 5.782 -17.344 -6.943 469 H GLU 566 H GLU 566 4.085 -16.779 -5.430 470 HA GLU 566 HA GLU 566 2.055 -18.695 -5.316 471 HB2 GLU 566 HB2 GLU 566 3.273 -16.921 -3.227 472 HB3 GLU 566 HB3 GLU 566 2.025 -18.128 -2.932 473 HG2 GLU 566 HG2 GLU 566 4.698 -18.766 -4.140 474 HG3 GLU 566 HG3 GLU 566 4.372 -18.841 -2.409 475 H ILE 567 H ILE 567 0.043 -18.513 -5.377 476 HA ILE 567 HA ILE 567 -1.267 -15.953 -5.499 477 HB ILE 567 HB ILE 567 -3.369 -17.450 -5.774 478 HG12 ILE 567 HG12 ILE 567 -1.380 -19.518 -6.643 479 HG13 ILE 567 HG13 ILE 567 -1.899 -19.520 -4.973 480 HG21 ILE 567 HG21 ILE 567 -2.852 -17.759 -8.161 481 HG22 ILE 567 HG22 ILE 567 -1.154 -17.419 -7.821 482 HG23 ILE 567 HG23 ILE 567 -2.372 -16.167 -7.572 483 HD11 ILE 567 HD11 ILE 567 -4.158 -19.773 -5.661 484 HD12 ILE 567 HD12 ILE 567 -3.154 -21.069 -6.326 485 HD13 ILE 567 HD13 ILE 567 -3.695 -19.735 -7.367 486 H VAL 568 H VAL 568 -2.009 -18.872 -3.508 487 HA VAL 568 HA VAL 568 -2.544 -17.070 -1.307 488 HB VAL 568 HB VAL 568 -4.678 -17.525 -2.580 489 HG11 VAL 568 HG11 VAL 568 -5.775 -19.678 -2.260 490 HG12 VAL 568 HG12 VAL 568 -4.260 -20.336 -1.641 491 HG13 VAL 568 HG13 VAL 568 -4.358 -19.760 -3.311 492 HG21 VAL 568 HG21 VAL 568 -6.051 -18.047 -0.605 493 HG22 VAL 568 HG22 VAL 568 -4.806 -16.844 -0.264 494 HG23 VAL 568 HG23 VAL 568 -4.592 -18.514 0.265 495 H LYS 569 H LYS 569 -2.552 -18.223 0.740 496 HA LYS 569 HA LYS 569 -1.593 -20.965 0.639 497 HB2 LYS 569 HB2 LYS 569 -0.820 -18.734 2.492 498 HB3 LYS 569 HB3 LYS 569 -0.446 -20.436 2.762 499 HG2 LYS 569 HG2 LYS 569 0.322 -19.387 0.197 500 HG3 LYS 569 HG3 LYS 569 1.190 -18.631 1.542 501 HD2 LYS 569 HD2 LYS 569 2.512 -20.491 0.770 502 HD3 LYS 569 HD3 LYS 569 1.725 -21.053 2.226 503 HE2 LYS 569 HE2 LYS 569 1.635 -22.780 0.514 504 HE3 LYS 569 HE3 LYS 569 0.030 -22.171 0.888 505 HZ1 LYS 569 HZ1 LYS 569 0.458 -22.492 -1.529 506 HZ2 LYS 569 HZ2 LYS 569 1.608 -21.281 -1.507 507 HZ3 LYS 569 HZ3 LYS 569 -0.005 -20.926 -1.166 508 H THR 570 H THR 570 -2.189 -22.112 2.481 509 HA THR 570 HA THR 570 -4.582 -21.094 3.852 510 HB THR 570 HB THR 570 -5.202 -23.652 3.899 511 HG1 THR 570 HG1 THR 570 -4.534 -24.819 2.273 512 HG21 THR 570 HG21 THR 570 -6.593 -23.400 1.932 513 HG22 THR 570 HG22 THR 570 -5.703 -21.943 1.447 514 HG23 THR 570 HG23 THR 570 -6.655 -21.967 2.944 515 H ILE 571 H ILE 571 -4.797 -21.600 5.952 516 HA ILE 571 HA ILE 571 -2.549 -22.977 7.199 517 HB ILE 571 HB ILE 571 -4.864 -21.469 8.498 518 HG12 ILE 571 HG12 ILE 571 -2.948 -20.060 9.439 519 HG13 ILE 571 HG13 ILE 571 -1.942 -20.846 8.232 520 HG21 ILE 571 HG21 ILE 571 -2.542 -22.830 9.845 521 HG22 ILE 571 HG22 ILE 571 -4.215 -23.369 9.864 522 HG23 ILE 571 HG23 ILE 571 -3.770 -21.848 10.647 523 HD11 ILE 571 HD11 ILE 571 -2.652 -18.671 7.543 524 HD12 ILE 571 HD12 ILE 571 -4.351 -19.147 7.685 525 HD13 ILE 571 HD13 ILE 571 -3.302 -19.916 6.481 526 H SER 572 H SER 572 -2.726 -25.038 7.514 527 HA SER 572 HA SER 572 -5.317 -26.336 7.432 528 HB2 SER 572 HB2 SER 572 -3.842 -28.382 7.397 529 HB3 SER 572 HB3 SER 572 -3.595 -27.283 6.042 530 HG SER 572 HG SER 572 -2.056 -27.479 8.394 531 H VAL 573 H VAL 573 -6.333 -26.572 9.313 532 HA VAL 573 HA VAL 573 -4.663 -26.961 11.699 533 HB VAL 573 HB VAL 573 -7.453 -25.764 11.657 534 HG11 VAL 573 HG11 VAL 573 -5.512 -26.092 13.949 535 HG12 VAL 573 HG12 VAL 573 -7.009 -27.003 13.709 536 HG13 VAL 573 HG13 VAL 573 -7.067 -25.270 14.021 537 HG21 VAL 573 HG21 VAL 573 -5.890 -24.179 10.748 538 HG22 VAL 573 HG22 VAL 573 -4.774 -24.481 12.072 539 HG23 VAL 573 HG23 VAL 573 -6.304 -23.674 12.392 540 H LYS 574 H LYS 574 -4.770 -28.843 12.519 541 HA LYS 574 HA LYS 574 -6.704 -30.768 11.737 542 HB2 LYS 574 HB2 LYS 574 -4.383 -31.390 12.188 543 HB3 LYS 574 HB3 LYS 574 -4.521 -30.805 13.830 544 HG2 LYS 574 HG2 LYS 574 -4.594 -33.211 13.772 545 HG3 LYS 574 HG3 LYS 574 -6.151 -32.578 14.313 546 HD2 LYS 574 HD2 LYS 574 -7.055 -32.870 12.099 547 HD3 LYS 574 HD3 LYS 574 -5.461 -33.374 11.520 548 HE2 LYS 574 HE2 LYS 574 -6.942 -35.300 11.801 549 HE3 LYS 574 HE3 LYS 574 -5.591 -35.379 12.920 550 HZ1 LYS 574 HZ1 LYS 574 -8.286 -34.369 13.670 551 HZ2 LYS 574 HZ2 LYS 574 -6.992 -34.790 14.706 552 HZ3 LYS 574 HZ3 LYS 574 -7.781 -35.965 13.803 553 H VAL 575 H VAL 575 -8.658 -30.693 12.508 554 HA VAL 575 HA VAL 575 -9.165 -29.666 15.161 555 HB VAL 575 HB VAL 575 -11.100 -31.037 13.239 556 HG11 VAL 575 HG11 VAL 575 -11.849 -31.051 15.576 557 HG12 VAL 575 HG12 VAL 575 -12.859 -29.984 14.602 558 HG13 VAL 575 HG13 VAL 575 -11.641 -29.303 15.664 559 HG21 VAL 575 HG21 VAL 575 -10.192 -29.006 12.228 560 HG22 VAL 575 HG22 VAL 575 -10.618 -28.084 13.667 561 HG23 VAL 575 HG23 VAL 575 -11.887 -28.786 12.662 562 H ILE 576 H ILE 576 -9.282 -30.953 16.913 563 HA ILE 576 HA ILE 576 -8.224 -33.530 16.561 564 HB ILE 576 HB ILE 576 -9.254 -32.221 19.045 565 HG12 ILE 576 HG12 ILE 576 -7.436 -30.988 18.098 566 HG13 ILE 576 HG13 ILE 576 -6.837 -31.849 19.504 567 HG21 ILE 576 HG21 ILE 576 -7.527 -34.697 18.800 568 HG22 ILE 576 HG22 ILE 576 -9.210 -34.664 19.327 569 HG23 ILE 576 HG23 ILE 576 -7.963 -33.887 20.305 570 HD11 ILE 576 HD11 ILE 576 -5.215 -31.940 17.685 571 HD12 ILE 576 HD12 ILE 576 -6.422 -32.623 16.615 572 HD13 ILE 576 HD13 ILE 576 -5.859 -33.551 18.004 573 H ASP 577 H ASP 577 -9.011 -35.252 16.426 574 HA ASP 577 HA ASP 577 -11.931 -35.644 16.507 575 HB2 ASP 577 HB2 ASP 577 -11.086 -35.636 14.219 576 HB3 ASP 577 HB3 ASP 577 -9.849 -36.806 14.653 577 H ASP 578 H ASP 578 -12.267 -36.816 18.293 578 HA ASP 578 HA ASP 578 -11.034 -39.355 18.450 579 HB2 ASP 578 HB2 ASP 578 -9.423 -37.794 19.680 580 HB3 ASP 578 HB3 ASP 578 -10.714 -37.566 20.863 581 H GLU 579 H GLU 579 -12.166 -40.654 20.098 582 HA GLU 579 HA GLU 579 -14.902 -39.924 19.991 583 HB2 GLU 579 HB2 GLU 579 -13.513 -42.367 21.030 584 HB3 GLU 579 HB3 GLU 579 -15.251 -42.140 21.177 585 HG2 GLU 579 HG2 GLU 579 -13.743 -42.078 18.576 586 HG3 GLU 579 HG3 GLU 579 -14.564 -43.497 19.221 587 H GLU 580 H GLU 580 -14.677 -38.079 21.136 588 HA GLU 580 HA GLU 580 -15.529 -38.405 23.883 589 HB2 GLU 580 HB2 GLU 580 -13.562 -36.339 22.835 590 HB3 GLU 580 HB3 GLU 580 -14.420 -36.166 24.357 591 HG2 GLU 580 HG2 GLU 580 -13.318 -38.178 25.206 592 HG3 GLU 580 HG3 GLU 580 -12.470 -38.355 23.670 593 H TYR 581 H TYR 581 -17.400 -37.280 24.133 594 HA TYR 581 HA TYR 581 -18.380 -36.049 21.705 595 HB2 TYR 581 HB2 TYR 581 -19.904 -36.695 24.240 596 HB3 TYR 581 HB3 TYR 581 -20.608 -36.153 22.722 597 HD1 TYR 581 HD2 TYR 581 -19.599 -37.721 20.648 598 HD2 TYR 581 HD1 TYR 581 -20.268 -38.914 24.670 599 HE1 TYR 581 HE2 TYR 581 -19.775 -40.058 19.919 600 HE2 TYR 581 HE1 TYR 581 -20.439 -41.247 23.962 601 HH TYR 581 HH TYR 581 -20.998 -42.507 21.909 602 H GLU 582 H GLU 582 -17.551 -34.108 21.590 603 HA GLU 582 HA GLU 582 -17.704 -32.392 23.919 604 HB2 GLU 582 HB2 GLU 582 -16.013 -32.399 21.471 605 HB3 GLU 582 HB3 GLU 582 -16.111 -30.945 22.479 606 HG2 GLU 582 HG2 GLU 582 -15.122 -33.685 23.252 607 HG3 GLU 582 HG3 GLU 582 -14.166 -32.213 23.085 608 H LYS 583 H LYS 583 -17.526 -29.922 22.389 609 HA LYS 583 HA LYS 583 -20.094 -29.784 21.076 610 HB2 LYS 583 HB2 LYS 583 -20.188 -29.614 23.732 611 HB3 LYS 583 HB3 LYS 583 -19.588 -28.002 23.433 612 HG2 LYS 583 HG2 LYS 583 -21.984 -27.959 23.719 613 HG3 LYS 583 HG3 LYS 583 -21.589 -27.518 22.065 614 HD2 LYS 583 HD2 LYS 583 -23.510 -29.051 22.195 615 HD3 LYS 583 HD3 LYS 583 -22.172 -29.755 21.297 616 HE2 LYS 583 HE2 LYS 583 -23.218 -31.387 22.796 617 HE3 LYS 583 HE3 LYS 583 -21.548 -31.092 23.248 618 HZ1 LYS 583 HZ1 LYS 583 -23.936 -29.918 24.580 619 HZ2 LYS 583 HZ2 LYS 583 -22.316 -29.702 25.071 620 HZ3 LYS 583 HZ3 LYS 583 -23.025 -31.215 25.136 621 H ASN 584 H ASN 584 -20.335 -27.120 20.948 622 HA ASN 584 HA ASN 584 -18.523 -26.158 19.119 623 HB2 ASN 584 HB2 ASN 584 -20.783 -25.280 19.411 624 HB3 ASN 584 HB3 ASN 584 -20.359 -24.640 20.980 625 HD21 ASN 584 HD21 ASN 584 -21.428 -23.406 18.531 626 HD22 ASN 584 HD22 ASN 584 -20.384 -22.084 18.185 627 H LYS 585 H LYS 585 -16.523 -25.697 19.286 628 HA LYS 585 HA LYS 585 -15.372 -24.422 21.707 629 HB2 LYS 585 HB2 LYS 585 -13.941 -26.142 19.656 630 HB3 LYS 585 HB3 LYS 585 -13.297 -25.530 21.162 631 HG2 LYS 585 HG2 LYS 585 -15.486 -27.570 20.978 632 HG3 LYS 585 HG3 LYS 585 -13.777 -27.955 21.130 633 HD2 LYS 585 HD2 LYS 585 -13.748 -26.675 23.257 634 HD3 LYS 585 HD3 LYS 585 -15.498 -26.460 23.112 635 HE2 LYS 585 HE2 LYS 585 -15.847 -28.841 23.148 636 HE3 LYS 585 HE3 LYS 585 -14.111 -29.138 23.120 637 HZ1 LYS 585 HZ1 LYS 585 -14.949 -29.464 25.267 638 HZ2 LYS 585 HZ2 LYS 585 -15.698 -27.961 25.330 639 HZ3 LYS 585 HZ3 LYS 585 -13.999 -28.066 25.348 640 H THR 586 H THR 586 -14.384 -22.388 21.137 641 HA THR 586 HA THR 586 -13.792 -22.152 18.317 642 HB THR 586 HB THR 586 -15.958 -21.042 18.599 643 HG1 THR 586 HG1 THR 586 -14.146 -20.096 17.277 644 HG21 THR 586 HG21 THR 586 -16.237 -19.061 19.912 645 HG22 THR 586 HG22 THR 586 -14.576 -19.183 20.515 646 HG23 THR 586 HG23 THR 586 -15.775 -20.419 20.946 647 H PHE 587 H PHE 587 -12.034 -21.050 17.758 648 HA PHE 587 HA PHE 587 -10.493 -19.785 19.858 649 HB2 PHE 587 HB2 PHE 587 -8.461 -20.943 19.188 650 HB3 PHE 587 HB3 PHE 587 -9.669 -22.130 19.634 651 HD1 PHE 587 HD1 PHE 587 -10.794 -23.462 17.825 652 HD2 PHE 587 HD2 PHE 587 -7.516 -20.878 17.051 653 HE1 PHE 587 HE1 PHE 587 -10.381 -24.614 15.680 654 HE2 PHE 587 HE2 PHE 587 -7.105 -22.021 14.916 655 HZ PHE 587 HZ PHE 587 -8.544 -23.895 14.235 656 H PHE 588 H PHE 588 -8.413 -18.871 18.491 657 HA PHE 588 HA PHE 588 -9.628 -17.601 16.169 658 HB2 PHE 588 HB2 PHE 588 -7.949 -16.201 18.291 659 HB3 PHE 588 HB3 PHE 588 -8.483 -15.494 16.779 660 HD1 PHE 588 HD1 PHE 588 -9.476 -16.593 20.120 661 HD2 PHE 588 HD2 PHE 588 -10.758 -14.794 16.490 662 HE1 PHE 588 HE1 PHE 588 -11.523 -15.806 21.237 663 HE2 PHE 588 HE2 PHE 588 -12.795 -14.002 17.594 664 HZ PHE 588 HZ PHE 588 -13.187 -14.508 19.972 665 H LEU 589 H LEU 589 -8.139 -16.909 14.640 666 HA LEU 589 HA LEU 589 -5.479 -18.173 14.821 667 HB2 LEU 589 HB2 LEU 589 -7.445 -18.901 13.072 668 HB3 LEU 589 HB3 LEU 589 -6.724 -17.585 12.185 669 HG LEU 589 HG LEU 589 -5.818 -19.635 11.378 670 HD11 LEU 589 HD11 LEU 589 -4.218 -17.877 11.373 671 HD12 LEU 589 HD12 LEU 589 -3.420 -19.403 11.778 672 HD13 LEU 589 HD13 LEU 589 -3.777 -18.233 13.046 673 HD21 LEU 589 HD21 LEU 589 -5.117 -20.224 14.228 674 HD22 LEU 589 HD22 LEU 589 -4.526 -21.146 12.846 675 HD23 LEU 589 HD23 LEU 589 -6.262 -21.090 13.204 676 H GLU 590 H GLU 590 -3.853 -16.678 14.475 677 HA GLU 590 HA GLU 590 -4.681 -14.174 13.245 678 HB2 GLU 590 HB2 GLU 590 -4.605 -13.870 15.692 679 HB3 GLU 590 HB3 GLU 590 -2.894 -14.307 15.671 680 HG2 GLU 590 HG2 GLU 590 -2.560 -12.415 14.056 681 HG3 GLU 590 HG3 GLU 590 -4.216 -11.936 14.397 682 H ILE 591 H ILE 591 -3.306 -13.382 11.864 683 HA ILE 591 HA ILE 591 -0.783 -14.759 11.487 684 HB ILE 591 HB ILE 591 -0.740 -13.585 9.263 685 HG12 ILE 591 HG12 ILE 591 -3.583 -12.842 10.013 686 HG13 ILE 591 HG13 ILE 591 -2.249 -11.721 9.771 687 HG21 ILE 591 HG21 ILE 591 -2.390 -15.080 8.202 688 HG22 ILE 591 HG22 ILE 591 -3.075 -15.403 9.800 689 HG23 ILE 591 HG23 ILE 591 -1.429 -15.888 9.444 690 HD11 ILE 591 HD11 ILE 591 -2.174 -12.360 7.400 691 HD12 ILE 591 HD12 ILE 591 -3.758 -11.734 7.881 692 HD13 ILE 591 HD13 ILE 591 -3.522 -13.468 7.686 693 H GLY 592 H GLY 592 1.070 -13.688 11.565 694 HA2 GLY 592 HA2 GLY 592 1.026 -11.231 13.117 695 HA3 GLY 592 HA3 GLY 592 2.447 -12.192 12.731 696 H GLU 593 H GLU 593 3.145 -9.841 12.406 697 HA GLU 593 HA GLU 593 2.246 -8.610 10.034 698 HB2 GLU 593 HB2 GLU 593 4.671 -8.057 11.732 699 HB3 GLU 593 HB3 GLU 593 4.208 -7.082 10.341 700 HG2 GLU 593 HG2 GLU 593 2.072 -6.590 11.394 701 HG3 GLU 593 HG3 GLU 593 2.533 -7.548 12.796 702 HA PRO 594 HA PRO 594 4.406 -11.005 7.102 703 HB2 PRO 594 HB2 PRO 594 4.252 -9.182 5.042 704 HB3 PRO 594 HB3 PRO 594 2.967 -10.306 5.461 705 HG2 PRO 594 HG2 PRO 594 3.264 -7.427 6.089 706 HG3 PRO 594 HG3 PRO 594 1.783 -8.336 5.794 707 HD2 PRO 594 HD2 PRO 594 2.619 -7.544 8.239 708 HD3 PRO 594 HD3 PRO 594 1.611 -8.974 7.992 709 H ARG 595 H ARG 595 6.426 -11.234 6.534 710 HA ARG 595 HA ARG 595 8.236 -8.959 6.916 711 HB2 ARG 595 HB2 ARG 595 9.944 -10.623 7.552 712 HB3 ARG 595 HB3 ARG 595 8.543 -10.702 8.605 713 HG2 ARG 595 HG2 ARG 595 7.733 -12.610 7.164 714 HG3 ARG 595 HG3 ARG 595 9.330 -12.581 6.414 715 HD2 ARG 595 HD2 ARG 595 8.762 -13.014 9.339 716 HD3 ARG 595 HD3 ARG 595 9.146 -14.277 8.182 717 HE ARG 595 HE ARG 595 11.153 -12.287 8.228 718 HH11 ARG 595 HH11 ARG 595 9.965 -15.219 9.934 719 HH12 ARG 595 HH12 ARG 595 11.396 -15.450 10.795 720 HH21 ARG 595 HH21 ARG 595 13.186 -12.679 9.428 721 HH22 ARG 595 HH22 ARG 595 13.256 -13.993 10.486 722 H LEU 596 H LEU 596 9.345 -8.301 5.188 723 HA LEU 596 HA LEU 596 9.107 -9.584 2.672 724 HB2 LEU 596 HB2 LEU 596 9.453 -7.056 3.330 725 HB3 LEU 596 HB3 LEU 596 11.137 -7.496 3.429 726 HG LEU 596 HG LEU 596 10.488 -6.370 1.301 727 HD11 LEU 596 HD11 LEU 596 11.503 -9.178 0.950 728 HD12 LEU 596 HD12 LEU 596 12.478 -7.759 1.327 729 HD13 LEU 596 HD13 LEU 596 11.645 -7.871 -0.225 730 HD21 LEU 596 HD21 LEU 596 9.152 -7.514 -0.332 731 HD22 LEU 596 HD22 LEU 596 8.257 -7.426 1.211 732 HD23 LEU 596 HD23 LEU 596 9.040 -8.919 0.729 733 H VAL 597 H VAL 597 10.480 -11.080 1.881 734 HA VAL 597 HA VAL 597 12.462 -12.124 3.676 735 HB VAL 597 HB VAL 597 11.809 -12.980 0.838 736 HG11 VAL 597 HG11 VAL 597 13.384 -14.382 3.001 737 HG12 VAL 597 HG12 VAL 597 14.057 -13.696 1.520 738 HG13 VAL 597 HG13 VAL 597 12.952 -15.071 1.437 739 HG21 VAL 597 HG21 VAL 597 9.922 -13.207 2.346 740 HG22 VAL 597 HG22 VAL 597 10.947 -14.076 3.492 741 HG23 VAL 597 HG23 VAL 597 10.577 -14.793 1.924 742 H GLU 598 H GLU 598 14.491 -11.655 3.760 743 HA GLU 598 HA GLU 598 16.338 -10.565 3.592 744 HB2 GLU 598 HB2 GLU 598 16.510 -11.892 1.591 745 HB3 GLU 598 HB3 GLU 598 15.816 -10.599 0.625 746 HG2 GLU 598 HG2 GLU 598 17.727 -9.164 1.127 747 HG3 GLU 598 HG3 GLU 598 18.407 -10.411 2.170 748 H MET 599 H MET 599 15.705 -8.961 4.738 749 HA MET 599 HA MET 599 14.026 -6.828 3.957 750 HB2 MET 599 HB2 MET 599 14.224 -7.612 6.264 751 HB3 MET 599 HB3 MET 599 15.906 -7.128 6.304 752 HG2 MET 599 HG2 MET 599 14.556 -5.539 7.496 753 HG3 MET 599 HG3 MET 599 15.224 -4.787 6.049 754 HE1 MET 599 HE1 MET 599 11.802 -2.988 6.457 755 HE2 MET 599 HE2 MET 599 13.548 -2.795 6.307 756 HE3 MET 599 HE3 MET 599 12.862 -3.536 7.753 757 H SER 600 H SER 600 17.482 -7.215 4.148 758 HA SER 600 HA SER 600 17.840 -4.667 2.763 759 HB2 SER 600 HB2 SER 600 18.444 -4.430 5.189 760 HB3 SER 600 HB3 SER 600 19.562 -5.774 5.020 761 HG SER 600 HG SER 600 19.714 -3.193 3.862 762 H GLU 601 H GLU 601 20.322 -4.810 1.899 763 HA GLU 601 HA GLU 601 20.371 -7.132 0.236 764 HB2 GLU 601 HB2 GLU 601 21.271 -4.963 -0.540 765 HB3 GLU 601 HB3 GLU 601 22.518 -5.049 0.694 766 HG2 GLU 601 HG2 GLU 601 23.556 -6.897 -0.374 767 HG3 GLU 601 HG3 GLU 601 22.219 -7.074 -1.507 768 H LYS 602 H LYS 602 21.783 -6.233 3.201 769 HA LYS 602 HA LYS 602 23.145 -8.814 3.306 770 HB2 LYS 602 HB2 LYS 602 24.519 -8.006 5.159 771 HB3 LYS 602 HB3 LYS 602 24.683 -6.908 3.813 772 HG2 LYS 602 HG2 LYS 602 22.949 -6.400 6.241 773 HG3 LYS 602 HG3 LYS 602 24.603 -5.836 6.069 774 HD2 LYS 602 HD2 LYS 602 22.243 -5.039 4.341 775 HD3 LYS 602 HD3 LYS 602 23.000 -4.064 5.588 776 HE2 LYS 602 HE2 LYS 602 24.341 -5.003 3.045 777 HE3 LYS 602 HE3 LYS 602 23.706 -3.391 3.339 778 HZ1 LYS 602 HZ1 LYS 602 25.316 -3.159 5.153 779 HZ2 LYS 602 HZ2 LYS 602 26.038 -3.386 3.676 780 HZ3 LYS 602 HZ3 LYS 602 25.994 -4.662 4.777 781 H LYS 603 H LYS 603 22.999 -9.792 5.618 782 HA LYS 603 HA LYS 603 20.178 -9.912 6.074 783 HB2 LYS 603 HB2 LYS 603 22.365 -11.445 7.503 784 HB3 LYS 603 HB3 LYS 603 20.638 -11.802 7.498 785 HG2 LYS 603 HG2 LYS 603 20.744 -12.172 5.060 786 HG3 LYS 603 HG3 LYS 603 22.484 -11.934 5.125 787 HD2 LYS 603 HD2 LYS 603 22.061 -14.287 5.102 788 HD3 LYS 603 HD3 LYS 603 22.603 -13.851 6.721 789 HE2 LYS 603 HE2 LYS 603 20.357 -13.914 7.562 790 HE3 LYS 603 HE3 LYS 603 19.706 -14.140 5.939 791 HZ1 LYS 603 HZ1 LYS 603 19.783 -16.182 7.212 792 HZ2 LYS 603 HZ2 LYS 603 21.460 -16.096 7.351 793 HZ3 LYS 603 HZ3 LYS 603 20.728 -16.290 5.840 794 H GLY 604 H GLY 604 19.463 -8.173 7.010 795 HA2 GLY 604 HA2 GLY 604 20.836 -6.673 8.984 796 HA3 GLY 604 HA3 GLY 604 19.172 -6.451 8.468 797 H GLY 605 H GLY 605 20.620 -6.576 11.106 798 HA2 GLY 605 HA2 GLY 605 19.369 -7.023 13.123 799 HA3 GLY 605 HA3 GLY 605 18.810 -8.519 12.366 800 H PHE 606 H PHE 606 19.625 -9.998 13.680 801 HA PHE 606 HA PHE 606 21.018 -11.340 14.726 802 HB2 PHE 606 HB2 PHE 606 22.930 -10.452 12.570 803 HB3 PHE 606 HB3 PHE 606 23.268 -11.759 13.704 804 HD1 PHE 606 HD2 PHE 606 21.994 -13.821 13.632 805 HD2 PHE 606 HD1 PHE 606 21.383 -10.738 10.769 806 HE1 PHE 606 HE2 PHE 606 20.797 -15.400 12.192 807 HE2 PHE 606 HE1 PHE 606 20.176 -12.320 9.327 808 HZ PHE 606 HZ PHE 606 19.890 -14.651 10.036 809 H THR 607 H THR 607 20.928 -10.328 16.588 810 HA THR 607 HA THR 607 23.395 -9.326 17.593 811 HB THR 607 HB THR 607 22.270 -7.244 16.816 812 HG1 THR 607 HG1 THR 607 23.404 -6.968 18.671 813 HG21 THR 607 HG21 THR 607 19.948 -8.025 16.834 814 HG22 THR 607 HG22 THR 607 20.109 -6.536 17.761 815 HG23 THR 607 HG23 THR 607 19.969 -8.083 18.597 816 H ILE 608 H ILE 608 23.009 -9.185 20.089 817 HA ILE 608 HA ILE 608 21.732 -11.627 20.766 818 HB ILE 608 HB ILE 608 23.855 -10.845 21.830 819 HG12 ILE 608 HG12 ILE 608 22.500 -12.620 22.958 820 HG13 ILE 608 HG13 ILE 608 23.523 -11.714 24.055 821 HG21 ILE 608 HG21 ILE 608 23.879 -9.261 23.685 822 HG22 ILE 608 HG22 ILE 608 22.200 -8.858 23.331 823 HG23 ILE 608 HG23 ILE 608 23.450 -8.521 22.140 824 HD11 ILE 608 HD11 ILE 608 21.367 -12.210 25.033 825 HD12 ILE 608 HD12 ILE 608 20.551 -11.383 23.704 826 HD13 ILE 608 HD13 ILE 608 21.564 -10.472 24.825 827 H THR 609 H THR 609 19.636 -11.652 20.489 828 HA THR 609 HA THR 609 17.928 -10.189 22.325 829 HB THR 609 HB THR 609 17.527 -10.227 19.304 830 HG1 THR 609 HG1 THR 609 18.786 -8.533 20.966 831 HG21 THR 609 HG21 THR 609 15.577 -8.805 19.726 832 HG22 THR 609 HG22 THR 609 15.879 -8.877 21.456 833 HG23 THR 609 HG23 THR 609 15.402 -10.336 20.586 834 H GLU 610 H GLU 610 16.624 -11.773 23.206 835 HA GLU 610 HA GLU 610 15.871 -13.996 21.481 836 HB2 GLU 610 HB2 GLU 610 17.798 -14.821 22.680 837 HB3 GLU 610 HB3 GLU 610 17.094 -14.335 24.217 838 HG2 GLU 610 HG2 GLU 610 15.233 -15.924 23.816 839 HG3 GLU 610 HG3 GLU 610 16.059 -16.458 22.356 840 H GLU 611 H GLU 611 13.757 -13.807 21.401 841 HA GLU 611 HA GLU 611 12.305 -13.629 23.927 842 HB2 GLU 611 HB2 GLU 611 11.324 -13.295 21.076 843 HB3 GLU 611 HB3 GLU 611 10.270 -13.309 22.479 844 HG2 GLU 611 HG2 GLU 611 12.395 -11.278 21.833 845 HG3 GLU 611 HG3 GLU 611 10.649 -11.043 21.790 846 H TYR 612 H TYR 612 11.821 -15.487 24.753 847 HA TYR 612 HA TYR 612 12.154 -17.867 23.125 848 HB2 TYR 612 HB2 TYR 612 12.170 -19.094 25.259 849 HB3 TYR 612 HB3 TYR 612 13.357 -17.800 25.230 850 HD1 TYR 612 HD2 TYR 612 10.218 -18.980 26.699 851 HD2 TYR 612 HD1 TYR 612 13.111 -15.865 26.709 852 HE1 TYR 612 HE2 TYR 612 9.287 -18.130 28.798 853 HE2 TYR 612 HE1 TYR 612 12.179 -15.013 28.820 854 HH TYR 612 HH TYR 612 10.022 -16.825 30.685 855 H ASP 613 H ASP 613 9.629 -16.005 24.362 856 HA ASP 613 HA ASP 613 7.736 -18.206 24.443 857 HB2 ASP 613 HB2 ASP 613 7.484 -16.568 26.178 858 HB3 ASP 613 HB3 ASP 613 7.441 -15.258 25.008 859 H ASP 614 H ASP 614 6.779 -18.880 22.661 860 HA ASP 614 HA ASP 614 6.472 -16.968 20.488 861 HB2 ASP 614 HB2 ASP 614 7.638 -19.113 19.965 862 HB3 ASP 614 HB3 ASP 614 6.152 -19.982 20.335 863 H LYS 615 H LYS 615 4.886 -16.056 21.863 864 HA LYS 615 HA LYS 615 2.314 -16.924 20.906 865 HB2 LYS 615 HB2 LYS 615 2.587 -17.821 23.288 866 HB3 LYS 615 HB3 LYS 615 2.721 -16.163 23.821 867 HG2 LYS 615 HG2 LYS 615 0.287 -17.095 22.316 868 HG3 LYS 615 HG3 LYS 615 0.435 -17.393 24.036 869 HD2 LYS 615 HD2 LYS 615 0.575 -14.657 22.751 870 HD3 LYS 615 HD3 LYS 615 -0.891 -15.353 23.439 871 HE2 LYS 615 HE2 LYS 615 0.245 -15.514 25.630 872 HE3 LYS 615 HE3 LYS 615 1.676 -14.775 24.919 873 HZ1 LYS 615 HZ1 LYS 615 0.400 -12.770 24.507 874 HZ2 LYS 615 HZ2 LYS 615 0.311 -13.177 26.136 875 HZ3 LYS 615 HZ3 LYS 615 -0.989 -13.485 25.128 876 H GLN 616 H GLN 616 2.514 -15.362 19.514 877 HA GLN 616 HA GLN 616 1.986 -13.355 18.648 878 HB2 GLN 616 HB2 GLN 616 0.463 -12.853 20.524 879 HB3 GLN 616 HB3 GLN 616 1.819 -12.340 21.509 880 HG2 GLN 616 HG2 GLN 616 0.569 -10.438 20.643 881 HG3 GLN 616 HG3 GLN 616 2.214 -10.467 20.005 882 HE21 GLN 616 HE21 GLN 616 -1.134 -11.037 19.277 883 HE22 GLN 616 HE22 GLN 616 -0.976 -10.997 17.569 884 HA PRO 617 HA PRO 617 6.412 -12.466 18.640 885 HB2 PRO 617 HB2 PRO 617 5.674 -11.490 15.942 886 HB3 PRO 617 HB3 PRO 617 6.927 -12.648 16.402 887 HG2 PRO 617 HG2 PRO 617 4.700 -13.453 15.182 888 HG3 PRO 617 HG3 PRO 617 5.436 -14.421 16.475 889 HD2 PRO 617 HD2 PRO 617 3.080 -12.580 16.602 890 HD3 PRO 617 HD3 PRO 617 3.291 -14.195 17.320 891 H LEU 618 H LEU 618 6.771 -10.724 19.800 892 HA LEU 618 HA LEU 618 5.303 -8.317 19.431 893 HB2 LEU 618 HB2 LEU 618 6.782 -7.387 21.212 894 HB3 LEU 618 HB3 LEU 618 5.905 -8.825 21.667 895 HG LEU 618 HG LEU 618 8.077 -10.110 21.266 896 HD11 LEU 618 HD11 LEU 618 9.271 -7.350 21.292 897 HD12 LEU 618 HD12 LEU 618 9.285 -8.481 19.943 898 HD13 LEU 618 HD13 LEU 618 10.168 -8.863 21.423 899 HD21 LEU 618 HD21 LEU 618 7.229 -9.632 23.471 900 HD22 LEU 618 HD22 LEU 618 7.980 -8.034 23.432 901 HD23 LEU 618 HD23 LEU 618 8.987 -9.483 23.436 902 H THR 619 H THR 619 6.152 -6.269 18.898 903 HA THR 619 HA THR 619 8.373 -6.510 17.039 904 HB THR 619 HB THR 619 6.420 -5.849 15.823 905 HG1 THR 619 HG1 THR 619 8.388 -4.715 15.377 906 HG21 THR 619 HG21 THR 619 6.063 -3.607 17.825 907 HG22 THR 619 HG22 THR 619 5.019 -5.015 17.654 908 HG23 THR 619 HG23 THR 619 5.104 -3.818 16.362 909 H SER 620 H SER 620 10.161 -5.406 17.375 910 HA SER 620 HA SER 620 10.452 -3.958 19.829 911 HB2 SER 620 HB2 SER 620 12.421 -4.407 17.571 912 HB3 SER 620 HB3 SER 620 12.805 -3.960 19.236 913 HG SER 620 HG SER 620 12.394 -5.948 19.906 914 H LYS 621 H LYS 621 9.694 -1.900 19.839 915 HA LYS 621 HA LYS 621 9.950 -0.394 17.351 916 HB2 LYS 621 HB2 LYS 621 7.945 0.023 19.559 917 HB3 LYS 621 HB3 LYS 621 8.077 0.988 18.092 918 HG2 LYS 621 HG2 LYS 621 7.654 -1.079 16.771 919 HG3 LYS 621 HG3 LYS 621 7.375 -1.927 18.289 920 HD2 LYS 621 HD2 LYS 621 5.260 -1.309 17.384 921 HD3 LYS 621 HD3 LYS 621 5.574 -0.288 18.788 922 HE2 LYS 621 HE2 LYS 621 6.273 1.536 17.329 923 HE3 LYS 621 HE3 LYS 621 6.034 0.514 15.916 924 HZ1 LYS 621 HZ1 LYS 621 3.930 1.375 17.817 925 HZ2 LYS 621 HZ2 LYS 621 3.680 0.401 16.460 926 HZ3 LYS 621 HZ3 LYS 621 4.170 1.991 16.267 927 H GLU 622 H GLU 622 11.684 0.656 17.418 928 HA GLU 622 HA GLU 622 12.190 2.626 19.502 929 HB2 GLU 622 HB2 GLU 622 14.159 0.674 18.263 930 HB3 GLU 622 HB3 GLU 622 14.598 1.998 19.328 931 HG2 GLU 622 HG2 GLU 622 13.624 0.923 21.194 932 HG3 GLU 622 HG3 GLU 622 12.792 -0.245 20.168 933 H GLU 623 H GLU 623 12.934 4.513 18.418 934 HA GLU 623 HA GLU 623 12.591 4.485 15.576 935 HB2 GLU 623 HB2 GLU 623 12.741 6.562 17.601 936 HB3 GLU 623 HB3 GLU 623 13.683 6.976 16.182 937 HG2 GLU 623 HG2 GLU 623 11.399 7.850 16.072 938 HG3 GLU 623 HG3 GLU 623 11.754 6.735 14.764 939 H GLU 624 H GLU 624 14.209 2.907 15.339 940 HA GLU 624 HA GLU 624 16.974 3.887 15.152 941 HB2 GLU 624 HB2 GLU 624 15.872 1.131 14.574 942 HB3 GLU 624 HB3 GLU 624 17.550 1.564 14.817 943 HG2 GLU 624 HG2 GLU 624 15.404 1.672 16.914 944 HG3 GLU 624 HG3 GLU 624 16.593 0.379 16.740 945 H GLU 625 H GLU 625 18.036 3.085 12.991 946 HA GLU 625 HA GLU 625 16.440 4.026 10.853 947 HB2 GLU 625 HB2 GLU 625 18.298 3.352 9.352 948 HB3 GLU 625 HB3 GLU 625 18.838 4.324 10.707 949 HG2 GLU 625 HG2 GLU 625 19.612 2.294 11.829 950 HG3 GLU 625 HG3 GLU 625 19.106 1.343 10.430 951 H ARG 626 H ARG 626 16.942 0.970 12.247 952 HA ARG 626 HA ARG 626 15.852 -0.678 10.256 953 HB2 ARG 626 HB2 ARG 626 16.981 -1.725 12.042 954 HB3 ARG 626 HB3 ARG 626 16.044 -0.882 13.258 955 HG2 ARG 626 HG2 ARG 626 15.509 -3.270 13.133 956 HG3 ARG 626 HG3 ARG 626 14.120 -2.259 12.769 957 HD2 ARG 626 HD2 ARG 626 14.455 -2.662 10.375 958 HD3 ARG 626 HD3 ARG 626 15.856 -3.674 10.748 959 HE ARG 626 HE ARG 626 14.483 -5.363 11.291 960 HH11 ARG 626 HH11 ARG 626 12.484 -2.390 11.249 961 HH12 ARG 626 HH12 ARG 626 11.036 -3.191 11.632 962 HH21 ARG 626 HH21 ARG 626 12.392 -6.458 11.770 963 HH22 ARG 626 HH22 ARG 626 10.981 -5.534 11.913 964 H ARG 627 H ARG 627 14.293 1.272 12.778 965 HA ARG 627 HA ARG 627 11.684 0.383 12.061 966 HB2 ARG 627 HB2 ARG 627 12.534 1.433 14.320 967 HB3 ARG 627 HB3 ARG 627 12.216 2.955 13.514 968 HG2 ARG 627 HG2 ARG 627 10.122 0.813 13.808 969 HG3 ARG 627 HG3 ARG 627 10.410 2.056 15.021 970 HD2 ARG 627 HD2 ARG 627 9.751 3.767 13.552 971 HD3 ARG 627 HD3 ARG 627 9.841 2.708 12.147 972 HE ARG 627 HE ARG 627 7.940 1.509 13.084 973 HH11 ARG 627 HH11 ARG 627 8.509 4.758 14.419 974 HH12 ARG 627 HH12 ARG 627 6.874 5.182 14.510 975 HH21 ARG 627 HH21 ARG 627 5.659 2.094 13.198 976 HH22 ARG 627 HH22 ARG 627 5.195 3.631 13.771 977 H ILE 628 H ILE 628 13.756 3.096 11.248 978 HA ILE 628 HA ILE 628 11.934 4.560 9.705 979 HB ILE 628 HB ILE 628 14.931 4.224 9.343 980 HG12 ILE 628 HG12 ILE 628 13.314 6.427 10.652 981 HG13 ILE 628 HG13 ILE 628 14.255 5.205 11.493 982 HG21 ILE 628 HG21 ILE 628 13.112 6.260 8.074 983 HG22 ILE 628 HG22 ILE 628 13.972 4.969 7.241 984 HG23 ILE 628 HG23 ILE 628 14.873 6.286 7.999 985 HD11 ILE 628 HD11 ILE 628 15.347 7.341 9.674 986 HD12 ILE 628 HD12 ILE 628 16.307 6.130 10.522 987 HD13 ILE 628 HD13 ILE 628 15.406 7.343 11.434 988 H ALA 629 H ALA 629 14.099 1.936 8.815 989 HA ALA 629 HA ALA 629 13.291 1.761 6.121 990 HB1 ALA 629 HB1 ALA 629 14.574 -0.306 6.088 991 HB2 ALA 629 HB2 ALA 629 14.644 -0.299 7.847 992 HB3 ALA 629 HB3 ALA 629 15.455 0.968 6.931 993 H GLU 630 H GLU 630 11.703 0.695 9.001 994 HA GLU 630 HA GLU 630 10.587 -1.617 7.782 995 HB2 GLU 630 HB2 GLU 630 9.277 -2.061 9.726 996 HB3 GLU 630 HB3 GLU 630 10.851 -1.519 10.264 997 HG2 GLU 630 HG2 GLU 630 9.930 0.653 10.809 998 HG3 GLU 630 HG3 GLU 630 8.357 0.147 10.198 999 H MET 631 H MET 631 9.883 1.589 7.471 1000 HA MET 631 HA MET 631 7.133 1.501 6.881 1001 HB2 MET 631 HB2 MET 631 7.501 3.473 5.464 1002 HB3 MET 631 HB3 MET 631 8.413 3.643 6.955 1003 HG2 MET 631 HG2 MET 631 10.445 2.955 5.756 1004 HG3 MET 631 HG3 MET 631 9.511 2.835 4.270 1005 HE1 MET 631 HE1 MET 631 12.181 4.505 4.581 1006 HE2 MET 631 HE2 MET 631 11.763 5.980 3.711 1007 HE3 MET 631 HE3 MET 631 11.270 4.413 3.074 1008 H GLY 632 H GLY 632 9.956 0.394 5.163 1009 HA2 GLY 632 HA2 GLY 632 8.437 -0.178 2.749 1010 HA3 GLY 632 HA3 GLY 632 10.180 -0.318 2.953 1011 H ARG 633 H ARG 633 7.372 -1.621 4.615 1012 HA ARG 633 HA ARG 633 8.399 -4.302 4.038 1013 HB2 ARG 633 HB2 ARG 633 6.983 -3.424 6.570 1014 HB3 ARG 633 HB3 ARG 633 7.419 -5.074 6.179 1015 HG2 ARG 633 HG2 ARG 633 9.793 -4.412 6.237 1016 HG3 ARG 633 HG3 ARG 633 9.284 -2.793 6.727 1017 HD2 ARG 633 HD2 ARG 633 9.854 -3.947 8.724 1018 HD3 ARG 633 HD3 ARG 633 8.093 -3.872 8.663 1019 HE ARG 633 HE ARG 633 9.302 -6.247 7.577 1020 HH11 ARG 633 HH11 ARG 633 7.652 -4.797 10.360 1021 HH12 ARG 633 HH12 ARG 633 7.483 -6.245 11.212 1022 HH21 ARG 633 HH21 ARG 633 9.094 -8.267 8.782 1023 HH22 ARG 633 HH22 ARG 633 8.282 -8.267 10.278 1024 HA PRO 634 HA PRO 634 4.253 -4.974 2.540 1025 HB2 PRO 634 HB2 PRO 634 4.031 -7.625 3.327 1026 HB3 PRO 634 HB3 PRO 634 4.778 -7.106 1.814 1027 HG2 PRO 634 HG2 PRO 634 6.073 -7.903 4.381 1028 HG3 PRO 634 HG3 PRO 634 6.608 -8.185 2.724 1029 HD2 PRO 634 HD2 PRO 634 7.673 -6.296 4.303 1030 HD3 PRO 634 HD3 PRO 634 7.551 -6.100 2.545 1031 H ILE 635 H ILE 635 2.219 -4.906 3.587 1032 HA ILE 635 HA ILE 635 2.415 -5.282 6.436 1033 HB ILE 635 HB ILE 635 0.948 -3.299 6.814 1034 HG12 ILE 635 HG12 ILE 635 1.227 -1.437 5.009 1035 HG13 ILE 635 HG13 ILE 635 1.569 -2.753 3.901 1036 HG21 ILE 635 HG21 ILE 635 2.787 -1.670 6.676 1037 HG22 ILE 635 HG22 ILE 635 3.654 -2.807 5.638 1038 HG23 ILE 635 HG23 ILE 635 3.303 -3.240 7.313 1039 HD11 ILE 635 HD11 ILE 635 -0.979 -2.352 5.451 1040 HD12 ILE 635 HD12 ILE 635 -0.653 -3.674 4.330 1041 HD13 ILE 635 HD13 ILE 635 -0.734 -2.014 3.738 1042 H LEU 636 H LEU 636 0.335 -5.323 7.524 1043 HA LEU 636 HA LEU 636 -1.368 -7.043 5.963 1044 HB2 LEU 636 HB2 LEU 636 -2.326 -7.618 8.274 1045 HB3 LEU 636 HB3 LEU 636 -0.782 -8.278 7.797 1046 HG LEU 636 HG LEU 636 0.367 -6.636 9.257 1047 HD11 LEU 636 HD11 LEU 636 -0.893 -5.294 10.856 1048 HD12 LEU 636 HD12 LEU 636 -2.403 -5.803 10.095 1049 HD13 LEU 636 HD13 LEU 636 -1.253 -4.813 9.195 1050 HD21 LEU 636 HD21 LEU 636 -0.340 -7.600 11.386 1051 HD22 LEU 636 HD22 LEU 636 -0.225 -8.821 10.111 1052 HD23 LEU 636 HD23 LEU 636 -1.803 -8.198 10.599 1053 H GLY 637 H GLY 637 -3.711 -6.995 6.852 1054 HA2 GLY 637 HA2 GLY 637 -4.712 -4.454 6.020 1055 HA3 GLY 637 HA3 GLY 637 -5.633 -5.871 6.515 1056 H GLU 638 H GLU 638 -6.950 -4.086 7.383 1057 HA GLU 638 HA GLU 638 -5.991 -2.598 9.630 1058 HB2 GLU 638 HB2 GLU 638 -7.721 -1.752 8.079 1059 HB3 GLU 638 HB3 GLU 638 -8.805 -3.025 8.609 1060 HG2 GLU 638 HG2 GLU 638 -9.339 -0.885 9.633 1061 HG3 GLU 638 HG3 GLU 638 -8.872 -2.088 10.831 1062 H HIS 639 H HIS 639 -7.615 -5.614 9.100 1063 HA HIS 639 HA HIS 639 -7.260 -6.162 11.902 1064 HB2 HIS 639 HB2 HIS 639 -9.454 -7.242 12.166 1065 HB3 HIS 639 HB3 HIS 639 -9.664 -5.562 11.708 1066 HD1 HIS 639 HD1 HIS 639 -10.893 -8.869 10.920 1067 HD2 HIS 639 HD2 HIS 639 -10.263 -5.339 8.811 1068 HE1 HIS 639 HE1 HIS 639 -12.230 -9.076 8.808 1069 H THR 640 H THR 640 -6.408 -8.105 12.246 1070 HA THR 640 HA THR 640 -6.660 -10.074 10.148 1071 HB THR 640 HB THR 640 -4.292 -10.799 10.635 1072 HG1 THR 640 HG1 THR 640 -3.230 -9.717 12.060 1073 HG21 THR 640 HG21 THR 640 -4.609 -8.098 9.336 1074 HG22 THR 640 HG22 THR 640 -4.992 -9.644 8.596 1075 HG23 THR 640 HG23 THR 640 -3.314 -9.271 9.026 1076 H LYS 641 H LYS 641 -8.092 -11.180 11.252 1077 HA LYS 641 HA LYS 641 -7.131 -12.927 13.274 1078 HB2 LYS 641 HB2 LYS 641 -7.678 -10.902 14.644 1079 HB3 LYS 641 HB3 LYS 641 -9.342 -11.006 14.085 1080 HG2 LYS 641 HG2 LYS 641 -9.490 -13.262 15.103 1081 HG3 LYS 641 HG3 LYS 641 -7.869 -13.045 15.743 1082 HD2 LYS 641 HD2 LYS 641 -10.187 -11.218 16.385 1083 HD3 LYS 641 HD3 LYS 641 -9.770 -12.619 17.357 1084 HE2 LYS 641 HE2 LYS 641 -8.844 -10.747 18.460 1085 HE3 LYS 641 HE3 LYS 641 -7.497 -11.556 17.678 1086 HZ1 LYS 641 HZ1 LYS 641 -8.880 -9.147 16.597 1087 HZ2 LYS 641 HZ2 LYS 641 -7.491 -9.817 15.963 1088 HZ3 LYS 641 HZ3 LYS 641 -7.463 -9.098 17.465 1089 H LEU 642 H LEU 642 -8.361 -14.692 13.365 1090 HA LEU 642 HA LEU 642 -10.807 -14.755 11.740 1091 HB2 LEU 642 HB2 LEU 642 -8.912 -15.811 10.663 1092 HB3 LEU 642 HB3 LEU 642 -8.616 -16.753 12.108 1093 HG LEU 642 HG LEU 642 -10.946 -17.738 11.722 1094 HD11 LEU 642 HD11 LEU 642 -11.703 -17.760 9.443 1095 HD12 LEU 642 HD12 LEU 642 -10.429 -16.632 8.996 1096 HD13 LEU 642 HD13 LEU 642 -11.716 -16.116 10.092 1097 HD21 LEU 642 HD21 LEU 642 -8.603 -18.225 9.948 1098 HD22 LEU 642 HD22 LEU 642 -10.008 -19.289 10.063 1099 HD23 LEU 642 HD23 LEU 642 -8.988 -19.017 11.477 1100 H GLU 643 H GLU 643 -12.487 -15.432 12.942 1101 HA GLU 643 HA GLU 643 -11.985 -16.773 15.486 1102 HB2 GLU 643 HB2 GLU 643 -13.619 -14.859 15.371 1103 HB3 GLU 643 HB3 GLU 643 -14.587 -15.814 14.270 1104 HG2 GLU 643 HG2 GLU 643 -14.969 -17.477 15.999 1105 HG3 GLU 643 HG3 GLU 643 -13.960 -16.562 17.116 1106 H VAL 644 H VAL 644 -11.770 -18.925 15.297 1107 HA VAL 644 HA VAL 644 -13.205 -20.301 13.146 1108 HB VAL 644 HB VAL 644 -11.043 -21.381 14.965 1109 HG11 VAL 644 HG11 VAL 644 -10.941 -23.245 13.428 1110 HG12 VAL 644 HG12 VAL 644 -12.182 -22.513 12.412 1111 HG13 VAL 644 HG13 VAL 644 -12.586 -23.063 14.039 1112 HG21 VAL 644 HG21 VAL 644 -10.824 -20.433 12.107 1113 HG22 VAL 644 HG22 VAL 644 -9.540 -21.189 13.036 1114 HG23 VAL 644 HG23 VAL 644 -10.165 -19.608 13.513 1115 H ILE 645 H ILE 645 -15.080 -21.072 13.736 1116 HA ILE 645 HA ILE 645 -15.505 -21.866 16.520 1117 HB ILE 645 HB ILE 645 -17.497 -21.461 14.284 1118 HG12 ILE 645 HG12 ILE 645 -16.872 -19.598 16.565 1119 HG13 ILE 645 HG13 ILE 645 -16.218 -19.411 14.943 1120 HG21 ILE 645 HG21 ILE 645 -18.298 -22.950 16.039 1121 HG22 ILE 645 HG22 ILE 645 -19.160 -21.413 16.084 1122 HG23 ILE 645 HG23 ILE 645 -17.889 -21.746 17.263 1123 HD11 ILE 645 HD11 ILE 645 -19.131 -19.372 15.675 1124 HD12 ILE 645 HD12 ILE 645 -18.434 -19.184 14.056 1125 HD13 ILE 645 HD13 ILE 645 -18.119 -17.970 15.291 1126 H ILE 646 H ILE 646 -15.158 -23.977 16.852 1127 HA ILE 646 HA ILE 646 -15.584 -25.934 14.723 1128 HB ILE 646 HB ILE 646 -14.632 -26.426 17.580 1129 HG12 ILE 646 HG12 ILE 646 -12.866 -26.122 15.140 1130 HG13 ILE 646 HG13 ILE 646 -13.070 -24.872 16.361 1131 HG21 ILE 646 HG21 ILE 646 -14.433 -28.106 15.110 1132 HG22 ILE 646 HG22 ILE 646 -15.511 -28.361 16.482 1133 HG23 ILE 646 HG23 ILE 646 -13.767 -28.505 16.693 1134 HD11 ILE 646 HD11 ILE 646 -11.010 -26.174 16.690 1135 HD12 ILE 646 HD12 ILE 646 -11.979 -27.636 16.876 1136 HD13 ILE 646 HD13 ILE 646 -12.123 -26.327 18.043 1137 H GLU 647 H GLU 647 -17.735 -26.453 14.618 1138 HA GLU 647 HA GLU 647 -18.956 -26.916 17.206 1139 HB2 GLU 647 HB2 GLU 647 -21.175 -26.279 16.300 1140 HB3 GLU 647 HB3 GLU 647 -20.033 -24.958 16.305 1141 HG2 GLU 647 HG2 GLU 647 -21.139 -24.696 14.297 1142 HG3 GLU 647 HG3 GLU 647 -19.677 -25.555 13.822 1143 H GLU 648 H GLU 648 -20.493 -28.573 17.385 1144 HA GLU 648 HA GLU 648 -19.446 -30.799 15.978 1145 HB2 GLU 648 HB2 GLU 648 -19.702 -30.986 18.275 1146 HB3 GLU 648 HB3 GLU 648 -21.420 -30.561 18.268 1147 HG2 GLU 648 HG2 GLU 648 -20.132 -33.102 17.219 1148 HG3 GLU 648 HG3 GLU 648 -20.927 -32.919 18.778 1149 H SER 649 H SER 649 -20.064 -31.427 14.229 1150 HA SER 649 HA SER 649 -22.844 -31.739 13.532 1151 HB2 SER 649 HB2 SER 649 -21.933 -31.022 11.132 1152 HB3 SER 649 HB3 SER 649 -22.469 -29.795 12.282 1153 HG SER 649 HG SER 649 -20.556 -29.077 12.430 1154 H TYR 650 H TYR 650 -20.892 -33.338 14.654 1155 HA TYR 650 HA TYR 650 -19.637 -35.065 12.665 1156 HB2 TYR 650 HB2 TYR 650 -18.029 -34.707 14.224 1157 HB3 TYR 650 HB3 TYR 650 -19.185 -34.178 15.429 1158 HD1 TYR 650 HD2 TYR 650 -17.556 -37.105 13.955 1159 HD2 TYR 650 HD1 TYR 650 -19.976 -35.631 17.076 1160 HE1 TYR 650 HE2 TYR 650 -17.257 -39.243 15.180 1161 HE2 TYR 650 HE1 TYR 650 -19.721 -37.717 18.326 1162 HH TYR 650 HH TYR 650 -17.394 -40.064 17.583 1163 H GLU 651 H GLU 651 -22.026 -34.951 15.245 1164 HA GLU 651 HA GLU 651 -22.412 -37.753 15.405 1165 HB2 GLU 651 HB2 GLU 651 -22.882 -36.004 17.180 1166 HB3 GLU 651 HB3 GLU 651 -24.308 -35.567 16.260 1167 HG2 GLU 651 HG2 GLU 651 -24.948 -36.993 18.059 1168 HG3 GLU 651 HG3 GLU 651 -25.140 -37.875 16.546 1169 H PHE 652 H PHE 652 -23.703 -35.180 13.521 1170 HA PHE 652 HA PHE 652 -26.022 -36.499 12.565 1171 HB2 PHE 652 HB2 PHE 652 -25.872 -34.059 12.568 1172 HB3 PHE 652 HB3 PHE 652 -24.527 -34.118 11.437 1173 HD1 PHE 652 HD1 PHE 652 -28.094 -35.113 11.787 1174 HD2 PHE 652 HD2 PHE 652 -24.957 -33.934 9.165 1175 HE1 PHE 652 HE1 PHE 652 -29.692 -35.009 9.919 1176 HE2 PHE 652 HE2 PHE 652 -26.545 -33.834 7.298 1177 HZ PHE 652 HZ PHE 652 -28.917 -34.376 7.673 1178 H LYS 653 H LYS 653 -22.669 -36.536 11.547 1179 HA LYS 653 HA LYS 653 -23.518 -38.242 9.365 1180 HB2 LYS 653 HB2 LYS 653 -21.468 -36.051 9.187 1181 HB3 LYS 653 HB3 LYS 653 -21.530 -37.370 8.032 1182 HG2 LYS 653 HG2 LYS 653 -23.978 -35.728 8.540 1183 HG3 LYS 653 HG3 LYS 653 -22.707 -35.097 7.497 1184 HD2 LYS 653 HD2 LYS 653 -24.450 -36.162 6.177 1185 HD3 LYS 653 HD3 LYS 653 -22.958 -37.073 6.033 1186 HE2 LYS 653 HE2 LYS 653 -23.825 -38.735 7.584 1187 HE3 LYS 653 HE3 LYS 653 -25.316 -37.795 7.799 1188 HZ1 LYS 653 HZ1 LYS 653 -25.728 -38.181 5.397 1189 HZ2 LYS 653 HZ2 LYS 653 -25.621 -39.614 6.289 1190 HZ3 LYS 653 HZ3 LYS 653 -24.338 -39.140 5.336 1191 H SER 654 H SER 654 -23.049 -40.113 10.104 1192 HA SER 654 HA SER 654 -20.351 -40.663 11.100 1193 HB2 SER 654 HB2 SER 654 -22.307 -41.144 12.615 1194 HB3 SER 654 HB3 SER 654 -22.896 -42.275 11.405 1195 HG SER 654 HG SER 654 -20.555 -42.366 12.934 1196 H THR 655 H THR 655 -19.136 -42.076 9.909 1197 HA THR 655 HA THR 655 -20.479 -43.359 7.674 1198 HB THR 655 HB THR 655 -18.139 -43.301 6.593 1199 HG1 THR 655 HG1 THR 655 -17.761 -41.106 8.386 1200 HG21 THR 655 HG21 THR 655 -20.015 -41.924 5.798 1201 HG22 THR 655 HG22 THR 655 -18.506 -41.017 5.710 1202 HG23 THR 655 HG23 THR 655 -19.647 -40.706 7.017 1203 H VAL 656 H VAL 656 -17.272 -43.778 9.110 1204 HA VAL 656 HA VAL 656 -18.032 -46.487 9.913 1205 HB VAL 656 HB VAL 656 -15.830 -47.384 9.156 1206 HG11 VAL 656 HG11 VAL 656 -16.339 -47.524 6.764 1207 HG12 VAL 656 HG12 VAL 656 -17.500 -46.209 6.941 1208 HG13 VAL 656 HG13 VAL 656 -17.779 -47.746 7.758 1209 HG21 VAL 656 HG21 VAL 656 -14.552 -45.313 9.079 1210 HG22 VAL 656 HG22 VAL 656 -15.546 -44.726 7.748 1211 HG23 VAL 656 HG23 VAL 656 -14.494 -46.125 7.514 1212 H ASP 657 H ASP 657 -16.870 -47.330 11.653 1213 HA ASP 657 HA ASP 657 -15.428 -45.302 13.229 1214 HB2 ASP 657 HB2 ASP 657 -17.384 -46.171 14.384 1215 HB3 ASP 657 HB3 ASP 657 -16.863 -47.827 14.093 Start of MODEL 14 1 H HIS 501 H HIS 501 2.574 1.102 -1.832 2 HA HIS 501 HA HIS 501 3.757 0.048 0.381 3 HB2 HIS 501 HB2 HIS 501 0.735 0.247 0.505 4 HB3 HIS 501 HB3 HIS 501 1.684 -0.888 1.458 5 HD1 HIS 501 HD1 HIS 501 0.972 2.807 1.134 6 HD2 HIS 501 HD2 HIS 501 2.897 0.155 3.686 7 HE1 HIS 501 HE1 HIS 501 1.557 4.124 3.199 8 H ALA 502 H ALA 502 3.655 -2.213 0.240 9 HA ALA 502 HA ALA 502 3.423 -3.245 -2.363 10 HB1 ALA 502 HB1 ALA 502 3.378 -4.736 0.237 11 HB2 ALA 502 HB2 ALA 502 4.848 -4.240 -0.601 12 HB3 ALA 502 HB3 ALA 502 3.767 -5.433 -1.334 13 H GLY 503 H GLY 503 1.374 -3.949 0.506 14 HA2 GLY 503 HA2 GLY 503 -1.044 -3.597 -0.714 15 HA3 GLY 503 HA3 GLY 503 -0.575 -5.265 -1.030 16 H ILE 504 H ILE 504 -2.333 -5.963 0.260 17 HA ILE 504 HA ILE 504 -2.058 -5.430 3.137 18 HB ILE 504 HB ILE 504 -4.579 -5.505 1.472 19 HG12 ILE 504 HG12 ILE 504 -5.022 -3.288 2.733 20 HG13 ILE 504 HG13 ILE 504 -3.308 -3.327 3.114 21 HG21 ILE 504 HG21 ILE 504 -5.035 -6.792 3.397 22 HG22 ILE 504 HG22 ILE 504 -5.894 -5.255 3.489 23 HG23 ILE 504 HG23 ILE 504 -4.432 -5.513 4.455 24 HD11 ILE 504 HD11 ILE 504 -2.800 -3.340 0.724 25 HD12 ILE 504 HD12 ILE 504 -3.743 -1.922 1.203 26 HD13 ILE 504 HD13 ILE 504 -4.522 -3.270 0.365 27 H PHE 505 H PHE 505 -1.819 -7.251 4.256 28 HA PHE 505 HA PHE 505 -2.961 -9.754 3.227 29 HB2 PHE 505 HB2 PHE 505 -0.867 -9.208 5.327 30 HB3 PHE 505 HB3 PHE 505 -1.660 -10.769 5.198 31 HD1 PHE 505 HD1 PHE 505 -1.397 -12.092 3.126 32 HD2 PHE 505 HD2 PHE 505 0.892 -8.603 3.902 33 HE1 PHE 505 HE1 PHE 505 0.251 -12.819 1.464 34 HE2 PHE 505 HE2 PHE 505 2.554 -9.322 2.231 35 HZ PHE 505 HZ PHE 505 2.217 -11.450 1.005 36 H THR 506 H THR 506 -4.665 -10.704 4.234 37 HA THR 506 HA THR 506 -5.300 -10.361 6.947 38 HB THR 506 HB THR 506 -6.083 -8.111 6.141 39 HG1 THR 506 HG1 THR 506 -7.406 -8.526 7.756 40 HG21 THR 506 HG21 THR 506 -7.994 -9.718 4.435 41 HG22 THR 506 HG22 THR 506 -6.675 -8.712 3.835 42 HG23 THR 506 HG23 THR 506 -8.052 -7.968 4.655 43 H PHE 507 H PHE 507 -7.596 -11.431 7.309 44 HA PHE 507 HA PHE 507 -7.502 -13.878 5.821 45 HB2 PHE 507 HB2 PHE 507 -9.143 -12.942 8.145 46 HB3 PHE 507 HB3 PHE 507 -9.524 -14.432 7.296 47 HD1 PHE 507 HD2 PHE 507 -8.062 -16.309 7.363 48 HD2 PHE 507 HD1 PHE 507 -7.161 -12.773 9.533 49 HE1 PHE 507 HE2 PHE 507 -6.440 -17.556 8.673 50 HE2 PHE 507 HE1 PHE 507 -5.514 -14.007 10.867 51 HZ PHE 507 HZ PHE 507 -5.139 -16.398 10.444 52 H GLU 508 H GLU 508 -9.140 -14.786 4.613 53 HA GLU 508 HA GLU 508 -10.523 -13.015 2.909 54 HB2 GLU 508 HB2 GLU 508 -9.575 -15.412 2.539 55 HB3 GLU 508 HB3 GLU 508 -11.066 -15.963 3.268 56 HG2 GLU 508 HG2 GLU 508 -10.952 -14.244 0.809 57 HG3 GLU 508 HG3 GLU 508 -10.965 -16.000 0.768 58 H GLU 509 H GLU 509 -11.382 -14.887 5.749 59 HA GLU 509 HA GLU 509 -13.937 -13.501 5.852 60 HB2 GLU 509 HB2 GLU 509 -14.924 -15.572 6.850 61 HB3 GLU 509 HB3 GLU 509 -14.526 -15.747 5.159 62 HG2 GLU 509 HG2 GLU 509 -12.335 -16.803 6.009 63 HG3 GLU 509 HG3 GLU 509 -13.155 -16.896 7.564 64 HA PRO 510 HA PRO 510 -12.351 -12.579 9.863 65 HB2 PRO 510 HB2 PRO 510 -14.557 -11.646 11.075 66 HB3 PRO 510 HB3 PRO 510 -13.769 -10.760 9.764 67 HG2 PRO 510 HG2 PRO 510 -16.208 -12.490 9.688 68 HG3 PRO 510 HG3 PRO 510 -15.912 -10.946 8.871 69 HD2 PRO 510 HD2 PRO 510 -15.686 -13.406 7.649 70 HD3 PRO 510 HD3 PRO 510 -14.817 -11.949 7.130 71 H VAL 511 H VAL 511 -15.100 -14.735 9.580 72 HA VAL 511 HA VAL 511 -14.323 -16.124 12.035 73 HB VAL 511 HB VAL 511 -17.222 -15.442 11.383 74 HG11 VAL 511 HG11 VAL 511 -16.071 -16.822 13.787 75 HG12 VAL 511 HG12 VAL 511 -16.990 -17.564 12.487 76 HG13 VAL 511 HG13 VAL 511 -17.766 -16.390 13.549 77 HG21 VAL 511 HG21 VAL 511 -15.516 -14.280 13.593 78 HG22 VAL 511 HG22 VAL 511 -17.244 -14.007 13.376 79 HG23 VAL 511 HG23 VAL 511 -16.098 -13.425 12.169 80 H THR 512 H THR 512 -14.429 -18.297 11.694 81 HA THR 512 HA THR 512 -15.985 -19.203 9.409 82 HB THR 512 HB THR 512 -13.520 -18.931 8.841 83 HG1 THR 512 HG1 THR 512 -14.588 -20.141 7.571 84 HG21 THR 512 HG21 THR 512 -11.961 -20.687 9.605 85 HG22 THR 512 HG22 THR 512 -13.213 -21.326 10.668 86 HG23 THR 512 HG23 THR 512 -12.552 -19.724 10.962 87 H HIS 513 H HIS 513 -16.999 -21.147 9.777 88 HA HIS 513 HA HIS 513 -16.373 -22.404 12.335 89 HB2 HIS 513 HB2 HIS 513 -18.697 -23.134 12.587 90 HB3 HIS 513 HB3 HIS 513 -18.673 -21.399 12.355 91 HD1 HIS 513 HD1 HIS 513 -20.836 -23.930 11.627 92 HD2 HIS 513 HD2 HIS 513 -18.961 -21.138 9.173 93 HE1 HIS 513 HE1 HIS 513 -22.227 -23.781 9.540 94 H VAL 514 H VAL 514 -15.838 -24.460 12.306 95 HA VAL 514 HA VAL 514 -15.790 -25.714 9.660 96 HB VAL 514 HB VAL 514 -13.672 -26.799 10.248 97 HG11 VAL 514 HG11 VAL 514 -13.494 -24.694 9.100 98 HG12 VAL 514 HG12 VAL 514 -12.192 -24.803 10.289 99 HG13 VAL 514 HG13 VAL 514 -13.604 -23.809 10.619 100 HG21 VAL 514 HG21 VAL 514 -13.943 -26.970 12.668 101 HG22 VAL 514 HG22 VAL 514 -13.817 -25.217 12.825 102 HG23 VAL 514 HG23 VAL 514 -12.424 -26.158 12.285 103 H SER 515 H SER 515 -15.408 -28.154 9.870 104 HA SER 515 HA SER 515 -17.450 -29.219 11.531 105 HB2 SER 515 HB2 SER 515 -15.655 -30.126 9.342 106 HB3 SER 515 HB3 SER 515 -16.785 -31.243 10.101 107 HG SER 515 HG SER 515 -17.903 -28.868 9.229 108 H GLU 516 H GLU 516 -16.974 -30.805 13.068 109 HA GLU 516 HA GLU 516 -14.430 -30.748 14.322 110 HB2 GLU 516 HB2 GLU 516 -16.362 -30.961 15.714 111 HB3 GLU 516 HB3 GLU 516 -16.940 -32.265 14.678 112 HG2 GLU 516 HG2 GLU 516 -14.471 -32.908 16.052 113 HG3 GLU 516 HG3 GLU 516 -15.846 -32.605 17.122 114 H SER 517 H SER 517 -16.109 -33.082 12.334 115 HA SER 517 HA SER 517 -13.822 -34.893 12.491 116 HB2 SER 517 HB2 SER 517 -16.291 -35.558 12.821 117 HB3 SER 517 HB3 SER 517 -16.434 -35.360 11.084 118 HG SER 517 HG SER 517 -14.639 -37.053 12.442 119 H ILE 518 H ILE 518 -13.090 -32.705 11.137 120 HA ILE 518 HA ILE 518 -13.572 -33.218 8.295 121 HB ILE 518 HB ILE 518 -14.114 -31.003 9.089 122 HG12 ILE 518 HG12 ILE 518 -11.734 -31.015 7.243 123 HG13 ILE 518 HG13 ILE 518 -13.427 -31.187 6.780 124 HG21 ILE 518 HG21 ILE 518 -11.202 -30.632 9.779 125 HG22 ILE 518 HG22 ILE 518 -12.551 -30.813 10.911 126 HG23 ILE 518 HG23 ILE 518 -12.490 -29.410 9.854 127 HD11 ILE 518 HD11 ILE 518 -12.120 -28.783 7.983 128 HD12 ILE 518 HD12 ILE 518 -13.840 -28.909 7.623 129 HD13 ILE 518 HD13 ILE 518 -12.643 -28.945 6.302 130 H GLY 519 H GLY 519 -11.189 -33.457 10.725 131 HA2 GLY 519 HA2 GLY 519 -9.094 -34.378 10.575 132 HA3 GLY 519 HA3 GLY 519 -9.217 -34.315 8.817 133 H ILE 520 H ILE 520 -9.184 -32.108 7.876 134 HA ILE 520 HA ILE 520 -7.374 -30.343 9.337 135 HB ILE 520 HB ILE 520 -7.035 -31.290 6.478 136 HG12 ILE 520 HG12 ILE 520 -6.175 -32.942 8.084 137 HG13 ILE 520 HG13 ILE 520 -4.863 -32.210 7.171 138 HG21 ILE 520 HG21 ILE 520 -6.497 -28.959 6.591 139 HG22 ILE 520 HG22 ILE 520 -5.003 -29.880 6.411 140 HG23 ILE 520 HG23 ILE 520 -5.455 -29.219 7.985 141 HD11 ILE 520 HD11 ILE 520 -5.662 -31.529 9.991 142 HD12 ILE 520 HD12 ILE 520 -4.347 -30.776 9.089 143 HD13 ILE 520 HD13 ILE 520 -4.268 -32.489 9.503 144 H MET 521 H MET 521 -8.124 -28.346 9.210 145 HA MET 521 HA MET 521 -10.028 -27.756 7.063 146 HB2 MET 521 HB2 MET 521 -11.033 -26.086 8.469 147 HB3 MET 521 HB3 MET 521 -10.876 -27.542 9.430 148 HG2 MET 521 HG2 MET 521 -10.211 -25.922 10.953 149 HG3 MET 521 HG3 MET 521 -8.684 -26.384 10.230 150 HE1 MET 521 HE1 MET 521 -7.958 -23.938 11.413 151 HE2 MET 521 HE2 MET 521 -9.658 -23.622 11.751 152 HE3 MET 521 HE3 MET 521 -8.693 -22.413 10.899 153 H GLU 522 H GLU 522 -9.793 -25.743 5.975 154 HA GLU 522 HA GLU 522 -7.139 -24.528 6.190 155 HB2 GLU 522 HB2 GLU 522 -8.451 -25.662 3.760 156 HB3 GLU 522 HB3 GLU 522 -7.326 -24.326 3.619 157 HG2 GLU 522 HG2 GLU 522 -5.582 -25.609 4.560 158 HG3 GLU 522 HG3 GLU 522 -6.666 -26.961 4.914 159 H VAL 523 H VAL 523 -7.264 -22.464 6.433 160 HA VAL 523 HA VAL 523 -9.590 -21.009 5.366 161 HB VAL 523 HB VAL 523 -7.711 -20.214 7.602 162 HG11 VAL 523 HG11 VAL 523 -9.328 -18.384 7.993 163 HG12 VAL 523 HG12 VAL 523 -10.241 -18.900 6.575 164 HG13 VAL 523 HG13 VAL 523 -8.593 -18.289 6.397 165 HG21 VAL 523 HG21 VAL 523 -9.567 -20.645 9.103 166 HG22 VAL 523 HG22 VAL 523 -9.185 -22.091 8.178 167 HG23 VAL 523 HG23 VAL 523 -10.586 -21.110 7.740 168 H LYS 524 H LYS 524 -9.201 -19.479 3.867 169 HA LYS 524 HA LYS 524 -6.506 -19.309 2.858 170 HB2 LYS 524 HB2 LYS 524 -9.041 -18.154 1.747 171 HB3 LYS 524 HB3 LYS 524 -7.489 -18.305 0.932 172 HG2 LYS 524 HG2 LYS 524 -7.925 -20.892 1.605 173 HG3 LYS 524 HG3 LYS 524 -9.581 -20.301 1.415 174 HD2 LYS 524 HD2 LYS 524 -7.405 -20.000 -0.606 175 HD3 LYS 524 HD3 LYS 524 -8.653 -21.245 -0.639 176 HE2 LYS 524 HE2 LYS 524 -9.226 -18.346 -0.506 177 HE3 LYS 524 HE3 LYS 524 -9.030 -19.183 -2.065 178 HZ1 LYS 524 HZ1 LYS 524 -11.104 -19.751 0.027 179 HZ2 LYS 524 HZ2 LYS 524 -10.937 -20.596 -1.411 180 HZ3 LYS 524 HZ3 LYS 524 -11.373 -19.000 -1.448 181 H VAL 525 H VAL 525 -5.257 -17.599 2.921 182 HA VAL 525 HA VAL 525 -6.247 -15.193 4.279 183 HB VAL 525 HB VAL 525 -3.402 -16.103 3.806 184 HG11 VAL 525 HG11 VAL 525 -3.576 -13.674 4.002 185 HG12 VAL 525 HG12 VAL 525 -2.784 -14.357 5.425 186 HG13 VAL 525 HG13 VAL 525 -4.473 -13.854 5.511 187 HG21 VAL 525 HG21 VAL 525 -4.536 -17.573 5.308 188 HG22 VAL 525 HG22 VAL 525 -5.073 -16.210 6.297 189 HG23 VAL 525 HG23 VAL 525 -3.352 -16.609 6.187 190 H LEU 526 H LEU 526 -6.400 -13.377 3.154 191 HA LEU 526 HA LEU 526 -6.063 -13.386 0.355 192 HB2 LEU 526 HB2 LEU 526 -6.614 -11.151 2.299 193 HB3 LEU 526 HB3 LEU 526 -6.637 -10.971 0.557 194 HG LEU 526 HG LEU 526 -8.476 -12.803 2.099 195 HD11 LEU 526 HD11 LEU 526 -10.200 -11.135 1.603 196 HD12 LEU 526 HD12 LEU 526 -8.960 -10.063 0.944 197 HD13 LEU 526 HD13 LEU 526 -8.936 -10.502 2.654 198 HD21 LEU 526 HD21 LEU 526 -9.731 -12.842 -0.032 199 HD22 LEU 526 HD22 LEU 526 -8.127 -13.547 -0.179 200 HD23 LEU 526 HD23 LEU 526 -8.434 -11.920 -0.790 201 H ARG 527 H ARG 527 -4.397 -12.955 -0.730 202 HA ARG 527 HA ARG 527 -1.876 -12.385 0.457 203 HB2 ARG 527 HB2 ARG 527 -2.096 -13.890 -1.501 204 HB3 ARG 527 HB3 ARG 527 -2.696 -12.553 -2.465 205 HG2 ARG 527 HG2 ARG 527 -0.541 -11.438 -2.305 206 HG3 ARG 527 HG3 ARG 527 0.066 -12.718 -1.257 207 HD2 ARG 527 HD2 ARG 527 0.881 -12.986 -3.520 208 HD3 ARG 527 HD3 ARG 527 -0.181 -14.316 -3.078 209 HE ARG 527 HE ARG 527 -1.915 -12.820 -4.337 210 HH11 ARG 527 HH11 ARG 527 1.479 -13.256 -5.307 211 HH12 ARG 527 HH12 ARG 527 1.152 -13.185 -6.974 212 HH21 ARG 527 HH21 ARG 527 -2.341 -12.728 -6.624 213 HH22 ARG 527 HH22 ARG 527 -1.081 -12.904 -7.748 214 H THR 528 H THR 528 -0.557 -10.603 -0.105 215 HA THR 528 HA THR 528 -1.608 -8.072 0.137 216 HB THR 528 HB THR 528 0.703 -8.481 0.668 217 HG1 THR 528 HG1 THR 528 1.517 -7.047 -1.410 218 HG21 THR 528 HG21 THR 528 2.374 -9.057 -1.001 219 HG22 THR 528 HG22 THR 528 1.079 -9.181 -2.207 220 HG23 THR 528 HG23 THR 528 1.130 -10.312 -0.848 221 H SER 529 H SER 529 -2.499 -6.686 -1.234 222 HA SER 529 HA SER 529 -3.489 -7.124 -3.672 223 HB2 SER 529 HB2 SER 529 -2.499 -4.499 -2.551 224 HB3 SER 529 HB3 SER 529 -3.909 -4.765 -3.600 225 HG SER 529 HG SER 529 -4.885 -4.850 -1.780 226 H GLY 530 H GLY 530 -0.270 -6.026 -2.823 227 HA2 GLY 530 HA2 GLY 530 0.549 -6.272 -5.631 228 HA3 GLY 530 HA3 GLY 530 1.175 -5.011 -4.565 229 H ALA 531 H ALA 531 1.236 -8.330 -5.365 230 HA ALA 531 HA ALA 531 3.042 -8.983 -3.213 231 HB1 ALA 531 HB1 ALA 531 1.387 -10.620 -3.965 232 HB2 ALA 531 HB2 ALA 531 3.031 -11.222 -4.186 233 HB3 ALA 531 HB3 ALA 531 2.115 -10.621 -5.569 234 H ARG 532 H ARG 532 4.973 -8.085 -3.410 235 HA ARG 532 HA ARG 532 6.305 -8.356 -6.000 236 HB2 ARG 532 HB2 ARG 532 6.755 -6.197 -3.923 237 HB3 ARG 532 HB3 ARG 532 7.562 -6.317 -5.478 238 HG2 ARG 532 HG2 ARG 532 4.626 -5.806 -5.020 239 HG3 ARG 532 HG3 ARG 532 5.818 -4.625 -5.560 240 HD2 ARG 532 HD2 ARG 532 6.163 -5.863 -7.607 241 HD3 ARG 532 HD3 ARG 532 5.083 -7.137 -7.045 242 HE ARG 532 HE ARG 532 4.246 -4.393 -7.670 243 HH11 ARG 532 HH11 ARG 532 3.492 -7.867 -7.441 244 HH12 ARG 532 HH12 ARG 532 2.038 -7.723 -8.309 245 HH21 ARG 532 HH21 ARG 532 2.231 -4.244 -8.838 246 HH22 ARG 532 HH22 ARG 532 1.304 -5.652 -9.104 247 H GLY 533 H GLY 533 7.553 -10.078 -5.810 248 HA2 GLY 533 HA2 GLY 533 9.600 -11.000 -5.199 249 HA3 GLY 533 HA3 GLY 533 9.586 -10.024 -3.737 250 H ASN 534 H ASN 534 9.852 -11.514 -2.227 251 HA ASN 534 HA ASN 534 7.821 -13.608 -1.996 252 HB2 ASN 534 HB2 ASN 534 9.963 -14.597 -2.683 253 HB3 ASN 534 HB3 ASN 534 10.773 -13.806 -1.339 254 HD21 ASN 534 HD21 ASN 534 7.595 -15.356 -1.124 255 HD22 ASN 534 HD22 ASN 534 8.129 -16.614 -0.093 256 H VAL 535 H VAL 535 6.808 -13.641 -0.059 257 HA VAL 535 HA VAL 535 7.881 -11.998 2.110 258 HB VAL 535 HB VAL 535 5.029 -12.006 1.082 259 HG11 VAL 535 HG11 VAL 535 5.107 -11.770 3.471 260 HG12 VAL 535 HG12 VAL 535 4.628 -10.241 2.719 261 HG13 VAL 535 HG13 VAL 535 6.274 -10.456 3.334 262 HG21 VAL 535 HG21 VAL 535 7.137 -9.871 0.971 263 HG22 VAL 535 HG22 VAL 535 5.441 -9.643 0.504 264 HG23 VAL 535 HG23 VAL 535 6.476 -10.768 -0.391 265 H ILE 536 H ILE 536 7.524 -12.874 4.101 266 HA ILE 536 HA ILE 536 6.019 -15.396 4.212 267 HB ILE 536 HB ILE 536 8.224 -14.363 6.021 268 HG12 ILE 536 HG12 ILE 536 9.053 -15.242 3.896 269 HG13 ILE 536 HG13 ILE 536 9.513 -16.287 5.238 270 HG21 ILE 536 HG21 ILE 536 8.045 -16.482 7.208 271 HG22 ILE 536 HG22 ILE 536 6.676 -16.905 6.168 272 HG23 ILE 536 HG23 ILE 536 6.541 -15.545 7.279 273 HD11 ILE 536 HD11 ILE 536 8.833 -17.612 3.349 274 HD12 ILE 536 HD12 ILE 536 7.321 -16.719 3.247 275 HD13 ILE 536 HD13 ILE 536 7.622 -17.762 4.635 276 H VAL 537 H VAL 537 4.336 -15.548 5.605 277 HA VAL 537 HA VAL 537 3.874 -13.253 7.338 278 HB VAL 537 HB VAL 537 1.718 -14.869 5.940 279 HG11 VAL 537 HG11 VAL 537 0.961 -14.019 8.087 280 HG12 VAL 537 HG12 VAL 537 0.159 -13.165 6.770 281 HG13 VAL 537 HG13 VAL 537 1.481 -12.393 7.646 282 HG21 VAL 537 HG21 VAL 537 1.311 -12.836 4.610 283 HG22 VAL 537 HG22 VAL 537 2.946 -13.481 4.382 284 HG23 VAL 537 HG23 VAL 537 2.693 -12.078 5.410 285 HA PRO 538 HA PRO 538 3.947 -16.749 10.265 286 HB2 PRO 538 HB2 PRO 538 4.008 -15.230 12.507 287 HB3 PRO 538 HB3 PRO 538 5.441 -15.564 11.540 288 HG2 PRO 538 HG2 PRO 538 3.721 -13.121 11.592 289 HG3 PRO 538 HG3 PRO 538 5.485 -13.241 11.483 290 HD2 PRO 538 HD2 PRO 538 3.887 -12.758 9.335 291 HD3 PRO 538 HD3 PRO 538 5.441 -13.603 9.216 292 H TYR 539 H TYR 539 2.467 -17.617 11.748 293 HA TYR 539 HA TYR 539 0.104 -16.118 12.441 294 HB2 TYR 539 HB2 TYR 539 -1.509 -17.642 11.461 295 HB3 TYR 539 HB3 TYR 539 -0.420 -17.049 10.214 296 HD1 TYR 539 HD2 TYR 539 -1.216 -20.017 12.293 297 HD2 TYR 539 HD1 TYR 539 0.835 -18.504 8.898 298 HE1 TYR 539 HE2 TYR 539 -0.806 -22.312 11.529 299 HE2 TYR 539 HE1 TYR 539 1.233 -20.798 8.120 300 HH TYR 539 HH TYR 539 1.322 -23.014 8.929 301 H LYS 540 H LYS 540 -1.258 -17.312 13.933 302 HA LYS 540 HA LYS 540 -0.133 -19.708 15.141 303 HB2 LYS 540 HB2 LYS 540 0.157 -18.746 17.329 304 HB3 LYS 540 HB3 LYS 540 1.143 -17.853 16.182 305 HG2 LYS 540 HG2 LYS 540 -0.611 -16.107 16.097 306 HG3 LYS 540 HG3 LYS 540 -1.502 -16.989 17.338 307 HD2 LYS 540 HD2 LYS 540 0.468 -16.797 18.804 308 HD3 LYS 540 HD3 LYS 540 1.247 -15.793 17.585 309 HE2 LYS 540 HE2 LYS 540 -0.731 -14.246 17.751 310 HE3 LYS 540 HE3 LYS 540 -1.276 -15.219 19.107 311 HZ1 LYS 540 HZ1 LYS 540 0.836 -14.708 20.250 312 HZ2 LYS 540 HZ2 LYS 540 -0.029 -13.311 19.896 313 HZ3 LYS 540 HZ3 LYS 540 1.284 -13.728 18.959 314 H THR 541 H THR 541 -1.548 -20.795 16.442 315 HA THR 541 HA THR 541 -4.287 -20.047 16.288 316 HB THR 541 HB THR 541 -4.373 -22.240 17.703 317 HG1 THR 541 HG1 THR 541 -2.208 -22.717 18.152 318 HG21 THR 541 HG21 THR 541 -5.120 -22.075 15.383 319 HG22 THR 541 HG22 THR 541 -4.223 -23.580 15.615 320 HG23 THR 541 HG23 THR 541 -3.447 -22.190 14.846 321 H ILE 542 H ILE 542 -5.434 -19.160 17.889 322 HA ILE 542 HA ILE 542 -4.162 -18.656 20.501 323 HB ILE 542 HB ILE 542 -6.454 -17.230 19.152 324 HG12 ILE 542 HG12 ILE 542 -3.620 -16.223 19.461 325 HG13 ILE 542 HG13 ILE 542 -4.244 -16.945 17.982 326 HG21 ILE 542 HG21 ILE 542 -6.517 -17.068 21.591 327 HG22 ILE 542 HG22 ILE 542 -6.101 -15.503 20.893 328 HG23 ILE 542 HG23 ILE 542 -4.844 -16.506 21.613 329 HD11 ILE 542 HD11 ILE 542 -5.856 -15.167 17.758 330 HD12 ILE 542 HD12 ILE 542 -4.232 -14.497 17.905 331 HD13 ILE 542 HD13 ILE 542 -5.333 -14.455 19.285 332 H GLU 543 H GLU 543 -4.960 -20.028 21.993 333 HA GLU 543 HA GLU 543 -7.293 -21.570 21.607 334 HB2 GLU 543 HB2 GLU 543 -6.121 -21.097 24.335 335 HB3 GLU 543 HB3 GLU 543 -6.898 -22.537 23.710 336 HG2 GLU 543 HG2 GLU 543 -4.694 -23.232 23.733 337 HG3 GLU 543 HG3 GLU 543 -4.819 -22.550 22.114 338 H GLY 544 H GLY 544 -9.204 -20.614 21.502 339 HA2 GLY 544 HA2 GLY 544 -9.946 -18.455 23.302 340 HA3 GLY 544 HA3 GLY 544 -10.977 -19.168 22.055 341 H THR 545 H THR 545 -12.350 -20.764 22.584 342 HA THR 545 HA THR 545 -12.350 -21.658 25.346 343 HB THR 545 HB THR 545 -14.568 -22.676 24.691 344 HG1 THR 545 HG1 THR 545 -15.397 -21.858 22.700 345 HG21 THR 545 HG21 THR 545 -15.766 -20.535 24.512 346 HG22 THR 545 HG22 THR 545 -14.256 -19.728 24.093 347 HG23 THR 545 HG23 THR 545 -14.461 -20.437 25.695 348 H ALA 546 H ALA 546 -11.673 -22.572 22.130 349 HA ALA 546 HA ALA 546 -11.448 -25.393 22.581 350 HB1 ALA 546 HB1 ALA 546 -10.574 -25.505 20.355 351 HB2 ALA 546 HB2 ALA 546 -10.120 -23.816 20.398 352 HB3 ALA 546 HB3 ALA 546 -11.825 -24.251 20.303 353 H ARG 547 H ARG 547 -9.712 -26.438 23.376 354 HA ARG 547 HA ARG 547 -7.545 -24.711 24.317 355 HB2 ARG 547 HB2 ARG 547 -8.718 -27.226 25.342 356 HB3 ARG 547 HB3 ARG 547 -7.263 -26.543 25.998 357 HG2 ARG 547 HG2 ARG 547 -8.526 -24.462 26.541 358 HG3 ARG 547 HG3 ARG 547 -9.984 -25.220 25.904 359 HD2 ARG 547 HD2 ARG 547 -9.839 -26.946 27.609 360 HD3 ARG 547 HD3 ARG 547 -8.351 -26.227 28.224 361 HE ARG 547 HE ARG 547 -10.287 -24.259 28.217 362 HH11 ARG 547 HH11 ARG 547 -9.807 -27.368 29.810 363 HH12 ARG 547 HH12 ARG 547 -10.549 -26.918 31.262 364 HH21 ARG 547 HH21 ARG 547 -11.331 -23.617 30.171 365 HH22 ARG 547 HH22 ARG 547 -11.445 -24.689 31.491 366 H GLY 548 H GLY 548 -5.517 -25.432 24.527 367 HA2 GLY 548 HA2 GLY 548 -3.629 -26.581 24.322 368 HA3 GLY 548 HA3 GLY 548 -4.623 -28.000 24.119 369 H GLY 549 H GLY 549 -2.583 -28.311 23.016 370 HA2 GLY 549 HA2 GLY 549 -2.882 -27.682 20.163 371 HA3 GLY 549 HA3 GLY 549 -1.330 -28.041 20.938 372 H GLY 550 H GLY 550 -4.528 -29.383 20.461 373 HA2 GLY 550 HA2 GLY 550 -4.469 -31.632 19.407 374 HA3 GLY 550 HA3 GLY 550 -3.339 -32.060 20.693 375 H GLU 551 H GLU 551 -5.583 -29.878 21.916 376 HA GLU 551 HA GLU 551 -6.970 -32.107 23.124 377 HB2 GLU 551 HB2 GLU 551 -6.044 -30.269 24.600 378 HB3 GLU 551 HB3 GLU 551 -7.240 -29.168 23.959 379 HG2 GLU 551 HG2 GLU 551 -9.019 -30.468 24.820 380 HG3 GLU 551 HG3 GLU 551 -7.918 -31.757 25.291 381 H ASP 552 H ASP 552 -8.267 -28.914 22.142 382 HA ASP 552 HA ASP 552 -10.550 -30.395 21.016 383 HB2 ASP 552 HB2 ASP 552 -10.151 -27.403 21.285 384 HB3 ASP 552 HB3 ASP 552 -11.601 -28.171 20.661 385 H PHE 553 H PHE 553 -7.900 -28.367 20.153 386 HA PHE 553 HA PHE 553 -8.231 -29.168 17.385 387 HB2 PHE 553 HB2 PHE 553 -7.787 -26.944 16.555 388 HB3 PHE 553 HB3 PHE 553 -9.109 -26.792 17.701 389 HD1 PHE 553 HD2 PHE 553 -8.625 -25.850 19.987 390 HD2 PHE 553 HD1 PHE 553 -5.758 -25.812 16.862 391 HE1 PHE 553 HE2 PHE 553 -7.346 -24.129 21.183 392 HE2 PHE 553 HE1 PHE 553 -4.473 -24.115 18.048 393 HZ PHE 553 HZ PHE 553 -5.258 -23.254 20.210 394 H GLU 554 H GLU 554 -6.157 -29.122 16.329 395 HA GLU 554 HA GLU 554 -3.977 -29.521 18.208 396 HB2 GLU 554 HB2 GLU 554 -4.634 -30.866 15.996 397 HB3 GLU 554 HB3 GLU 554 -3.623 -29.614 15.278 398 HG2 GLU 554 HG2 GLU 554 -1.951 -30.300 17.144 399 HG3 GLU 554 HG3 GLU 554 -2.962 -31.734 17.172 400 H ASP 555 H ASP 555 -2.222 -28.117 18.307 401 HA ASP 555 HA ASP 555 -2.770 -25.391 17.560 402 HB2 ASP 555 HB2 ASP 555 -1.693 -25.919 19.716 403 HB3 ASP 555 HB3 ASP 555 -0.314 -26.594 18.864 404 H THR 556 H THR 556 -1.753 -24.149 16.054 405 HA THR 556 HA THR 556 0.495 -25.259 14.729 406 HB THR 556 HB THR 556 -1.380 -26.067 13.366 407 HG1 THR 556 HG1 THR 556 0.731 -24.823 12.463 408 HG21 THR 556 HG21 THR 556 -3.049 -24.383 13.701 409 HG22 THR 556 HG22 THR 556 -2.658 -24.409 11.967 410 HG23 THR 556 HG23 THR 556 -1.975 -23.166 13.025 411 H CYS 557 H CYS 557 1.814 -23.880 14.348 412 HA CYS 557 HA CYS 557 1.284 -21.084 14.105 413 HB2 CYS 557 HB2 CYS 557 2.921 -20.519 16.005 414 HB3 CYS 557 HB3 CYS 557 1.312 -21.044 16.471 415 HG CYS 557 HG CYS 557 1.951 -23.261 17.650 416 H GLY 558 H GLY 558 2.490 -20.412 12.567 417 HA2 GLY 558 HA2 GLY 558 5.191 -21.085 12.284 418 HA3 GLY 558 HA3 GLY 558 4.189 -22.031 11.181 419 H GLU 559 H GLU 559 4.640 -21.071 9.277 420 HA GLU 559 HA GLU 559 3.889 -18.274 9.015 421 HB2 GLU 559 HB2 GLU 559 6.575 -19.395 8.259 422 HB3 GLU 559 HB3 GLU 559 5.969 -17.818 7.770 423 HG2 GLU 559 HG2 GLU 559 6.013 -17.045 10.035 424 HG3 GLU 559 HG3 GLU 559 6.403 -18.660 10.631 425 H LEU 560 H LEU 560 3.253 -17.737 6.994 426 HA LEU 560 HA LEU 560 2.966 -19.893 5.003 427 HB2 LEU 560 HB2 LEU 560 1.526 -17.270 5.341 428 HB3 LEU 560 HB3 LEU 560 1.265 -18.392 4.024 429 HG LEU 560 HG LEU 560 0.713 -18.947 6.926 430 HD11 LEU 560 HD11 LEU 560 -0.827 -17.323 6.004 431 HD12 LEU 560 HD12 LEU 560 -1.627 -18.872 6.254 432 HD13 LEU 560 HD13 LEU 560 -1.150 -18.381 4.633 433 HD21 LEU 560 HD21 LEU 560 -0.442 -20.962 6.013 434 HD22 LEU 560 HD22 LEU 560 1.305 -20.978 5.826 435 HD23 LEU 560 HD23 LEU 560 0.291 -20.610 4.439 436 H GLU 561 H GLU 561 3.673 -19.539 2.926 437 HA GLU 561 HA GLU 561 5.435 -17.230 2.639 438 HB2 GLU 561 HB2 GLU 561 6.417 -19.571 2.535 439 HB3 GLU 561 HB3 GLU 561 5.503 -19.753 1.032 440 HG2 GLU 561 HG2 GLU 561 6.691 -17.753 0.141 441 HG3 GLU 561 HG3 GLU 561 7.606 -17.700 1.605 442 H PHE 562 H PHE 562 4.780 -15.730 1.330 443 HA PHE 562 HA PHE 562 2.978 -16.443 -0.865 444 HB2 PHE 562 HB2 PHE 562 3.167 -13.882 0.727 445 HB3 PHE 562 HB3 PHE 562 2.278 -14.024 -0.781 446 HD1 PHE 562 HD1 PHE 562 2.390 -15.055 2.752 447 HD2 PHE 562 HD2 PHE 562 0.153 -15.079 -0.865 448 HE1 PHE 562 HE1 PHE 562 0.384 -15.741 3.996 449 HE2 PHE 562 HE2 PHE 562 -1.852 -15.770 0.372 450 HZ PHE 562 HZ PHE 562 -1.736 -16.100 2.803 451 H GLN 563 H GLN 563 3.407 -15.483 -2.838 452 HA GLN 563 HA GLN 563 5.913 -14.005 -3.085 453 HB2 GLN 563 HB2 GLN 563 5.222 -16.382 -4.842 454 HB3 GLN 563 HB3 GLN 563 6.613 -15.337 -4.990 455 HG2 GLN 563 HG2 GLN 563 7.418 -16.112 -2.820 456 HG3 GLN 563 HG3 GLN 563 6.034 -17.206 -2.719 457 HE21 GLN 563 HE21 GLN 563 9.010 -16.497 -4.298 458 HE22 GLN 563 HE22 GLN 563 9.179 -18.019 -5.071 459 H ASN 564 H ASN 564 6.115 -13.417 -5.475 460 HA ASN 564 HA ASN 564 3.907 -11.806 -6.207 461 HB2 ASN 564 HB2 ASN 564 5.251 -11.262 -8.215 462 HB3 ASN 564 HB3 ASN 564 6.187 -11.113 -6.736 463 HD21 ASN 564 HD21 ASN 564 7.113 -11.466 -9.470 464 HD22 ASN 564 HD22 ASN 564 8.052 -12.919 -9.471 465 H ASP 565 H ASP 565 5.163 -14.842 -7.308 466 HA ASP 565 HA ASP 565 3.143 -15.117 -9.398 467 HB2 ASP 565 HB2 ASP 565 5.541 -15.802 -9.705 468 HB3 ASP 565 HB3 ASP 565 5.243 -17.117 -8.575 469 H GLU 566 H GLU 566 3.397 -15.867 -6.151 470 HA GLU 566 HA GLU 566 2.078 -18.373 -5.970 471 HB2 GLU 566 HB2 GLU 566 3.357 -16.600 -4.259 472 HB3 GLU 566 HB3 GLU 566 1.693 -16.570 -3.721 473 HG2 GLU 566 HG2 GLU 566 3.264 -19.084 -4.091 474 HG3 GLU 566 HG3 GLU 566 3.220 -18.196 -2.572 475 H ILE 567 H ILE 567 -0.056 -18.481 -4.724 476 HA ILE 567 HA ILE 567 -1.855 -16.446 -5.774 477 HB ILE 567 HB ILE 567 -3.659 -18.313 -5.608 478 HG12 ILE 567 HG12 ILE 567 -1.252 -20.070 -6.107 479 HG13 ILE 567 HG13 ILE 567 -1.983 -19.971 -4.521 480 HG21 ILE 567 HG21 ILE 567 -1.574 -18.294 -7.776 481 HG22 ILE 567 HG22 ILE 567 -2.979 -17.237 -7.659 482 HG23 ILE 567 HG23 ILE 567 -3.197 -18.967 -7.927 483 HD11 ILE 567 HD11 ILE 567 -2.742 -21.912 -5.731 484 HD12 ILE 567 HD12 ILE 567 -3.346 -20.880 -7.042 485 HD13 ILE 567 HD13 ILE 567 -4.053 -20.777 -5.419 486 H VAL 568 H VAL 568 -2.515 -18.984 -3.367 487 HA VAL 568 HA VAL 568 -2.866 -16.930 -1.371 488 HB VAL 568 HB VAL 568 -5.037 -17.161 -2.531 489 HG11 VAL 568 HG11 VAL 568 -6.372 -19.192 -2.352 490 HG12 VAL 568 HG12 VAL 568 -5.006 -20.011 -1.602 491 HG13 VAL 568 HG13 VAL 568 -4.889 -19.460 -3.276 492 HG21 VAL 568 HG21 VAL 568 -6.458 -17.522 -0.589 493 HG22 VAL 568 HG22 VAL 568 -5.042 -16.553 -0.174 494 HG23 VAL 568 HG23 VAL 568 -5.108 -18.254 0.276 495 H LYS 569 H LYS 569 -2.762 -17.818 0.744 496 HA LYS 569 HA LYS 569 -1.898 -20.608 0.829 497 HB2 LYS 569 HB2 LYS 569 -1.181 -18.284 2.565 498 HB3 LYS 569 HB3 LYS 569 -0.849 -19.962 2.983 499 HG2 LYS 569 HG2 LYS 569 0.046 -19.038 0.372 500 HG3 LYS 569 HG3 LYS 569 0.904 -18.347 1.753 501 HD2 LYS 569 HD2 LYS 569 2.123 -20.280 1.005 502 HD3 LYS 569 HD3 LYS 569 1.281 -20.757 2.459 503 HE2 LYS 569 HE2 LYS 569 1.191 -22.472 0.661 504 HE3 LYS 569 HE3 LYS 569 -0.395 -21.935 1.193 505 HZ1 LYS 569 HZ1 LYS 569 -0.715 -20.739 -0.797 506 HZ2 LYS 569 HZ2 LYS 569 0.041 -22.130 -1.344 507 HZ3 LYS 569 HZ3 LYS 569 0.896 -20.692 -1.157 508 H THR 570 H THR 570 -2.458 -21.768 2.634 509 HA THR 570 HA THR 570 -4.887 -20.857 3.987 510 HB THR 570 HB THR 570 -5.331 -23.449 4.029 511 HG1 THR 570 HG1 THR 570 -4.500 -24.563 2.383 512 HG21 THR 570 HG21 THR 570 -6.660 -23.249 1.991 513 HG22 THR 570 HG22 THR 570 -5.831 -21.730 1.596 514 HG23 THR 570 HG23 THR 570 -6.836 -21.856 3.047 515 H ILE 571 H ILE 571 -5.093 -21.419 6.102 516 HA ILE 571 HA ILE 571 -2.728 -22.597 7.335 517 HB ILE 571 HB ILE 571 -5.170 -21.320 8.644 518 HG12 ILE 571 HG12 ILE 571 -3.425 -19.773 9.651 519 HG13 ILE 571 HG13 ILE 571 -2.283 -20.489 8.523 520 HG21 ILE 571 HG21 ILE 571 -4.109 -21.697 10.806 521 HG22 ILE 571 HG22 ILE 571 -2.762 -22.503 10.007 522 HG23 ILE 571 HG23 ILE 571 -4.364 -23.228 9.958 523 HD11 ILE 571 HD11 ILE 571 -3.092 -18.371 7.760 524 HD12 ILE 571 HD12 ILE 571 -4.759 -18.969 7.803 525 HD13 ILE 571 HD13 ILE 571 -3.588 -19.673 6.677 526 H SER 572 H SER 572 -2.712 -24.668 7.555 527 HA SER 572 HA SER 572 -5.199 -26.166 7.427 528 HB2 SER 572 HB2 SER 572 -2.303 -27.075 7.387 529 HB3 SER 572 HB3 SER 572 -3.711 -28.091 7.092 530 HG SER 572 HG SER 572 -3.741 -27.433 5.133 531 H VAL 573 H VAL 573 -6.141 -26.574 9.296 532 HA VAL 573 HA VAL 573 -4.437 -26.990 11.672 533 HB VAL 573 HB VAL 573 -7.274 -25.896 11.650 534 HG11 VAL 573 HG11 VAL 573 -6.842 -27.235 13.645 535 HG12 VAL 573 HG12 VAL 573 -7.013 -25.525 14.030 536 HG13 VAL 573 HG13 VAL 573 -5.410 -26.257 13.998 537 HG21 VAL 573 HG21 VAL 573 -4.656 -24.543 12.222 538 HG22 VAL 573 HG22 VAL 573 -6.233 -23.839 12.546 539 HG23 VAL 573 HG23 VAL 573 -5.765 -24.221 10.884 540 H LYS 574 H LYS 574 -4.637 -28.862 12.696 541 HA LYS 574 HA LYS 574 -6.459 -30.849 11.716 542 HB2 LYS 574 HB2 LYS 574 -4.230 -31.517 12.261 543 HB3 LYS 574 HB3 LYS 574 -4.312 -30.756 13.833 544 HG2 LYS 574 HG2 LYS 574 -4.459 -33.060 14.211 545 HG3 LYS 574 HG3 LYS 574 -6.096 -32.447 14.402 546 HD2 LYS 574 HD2 LYS 574 -6.642 -33.194 12.149 547 HD3 LYS 574 HD3 LYS 574 -4.986 -33.790 11.950 548 HE2 LYS 574 HE2 LYS 574 -5.331 -35.228 13.926 549 HE3 LYS 574 HE3 LYS 574 -7.019 -34.728 13.956 550 HZ1 LYS 574 HZ1 LYS 574 -6.760 -36.823 12.875 551 HZ2 LYS 574 HZ2 LYS 574 -5.645 -36.197 11.789 552 HZ3 LYS 574 HZ3 LYS 574 -7.263 -35.702 11.724 553 H VAL 575 H VAL 575 -8.440 -30.897 12.468 554 HA VAL 575 HA VAL 575 -9.008 -29.694 15.056 555 HB VAL 575 HB VAL 575 -10.947 -30.919 13.049 556 HG11 VAL 575 HG11 VAL 575 -12.667 -29.674 14.302 557 HG12 VAL 575 HG12 VAL 575 -11.446 -29.149 15.447 558 HG13 VAL 575 HG13 VAL 575 -11.845 -30.863 15.312 559 HG21 VAL 575 HG21 VAL 575 -11.512 -28.610 12.417 560 HG22 VAL 575 HG22 VAL 575 -9.824 -28.986 12.067 561 HG23 VAL 575 HG23 VAL 575 -10.235 -28.014 13.477 562 H ILE 576 H ILE 576 -9.370 -30.953 16.826 563 HA ILE 576 HA ILE 576 -8.709 -33.712 16.485 564 HB ILE 576 HB ILE 576 -9.551 -32.276 18.983 565 HG12 ILE 576 HG12 ILE 576 -7.584 -31.188 18.062 566 HG13 ILE 576 HG13 ILE 576 -7.129 -32.077 19.500 567 HG21 ILE 576 HG21 ILE 576 -8.394 -34.086 20.183 568 HG22 ILE 576 HG22 ILE 576 -8.081 -34.888 18.636 569 HG23 ILE 576 HG23 ILE 576 -9.739 -34.688 19.207 570 HD11 ILE 576 HD11 ILE 576 -6.166 -33.845 18.092 571 HD12 ILE 576 HD12 ILE 576 -5.449 -32.273 17.714 572 HD13 ILE 576 HD13 ILE 576 -6.666 -32.964 16.651 573 H ASP 577 H ASP 577 -9.955 -35.222 16.304 574 HA ASP 577 HA ASP 577 -12.809 -34.897 15.905 575 HB2 ASP 577 HB2 ASP 577 -11.291 -36.284 14.435 576 HB3 ASP 577 HB3 ASP 577 -11.056 -37.379 15.778 577 H ASP 578 H ASP 578 -14.257 -35.153 17.546 578 HA ASP 578 HA ASP 578 -14.035 -37.177 19.532 579 HB2 ASP 578 HB2 ASP 578 -12.376 -35.529 20.447 580 HB3 ASP 578 HB3 ASP 578 -13.676 -34.349 20.569 581 H GLU 579 H GLU 579 -15.939 -37.373 20.797 582 HA GLU 579 HA GLU 579 -18.139 -35.641 19.883 583 HB2 GLU 579 HB2 GLU 579 -19.557 -37.678 19.779 584 HB3 GLU 579 HB3 GLU 579 -18.254 -37.667 18.602 585 HG2 GLU 579 HG2 GLU 579 -16.961 -39.194 19.960 586 HG3 GLU 579 HG3 GLU 579 -18.186 -39.142 21.224 587 H GLU 580 H GLU 580 -16.518 -36.026 22.596 588 HA GLU 580 HA GLU 580 -18.879 -36.740 24.160 589 HB2 GLU 580 HB2 GLU 580 -17.255 -38.484 24.314 590 HB3 GLU 580 HB3 GLU 580 -16.004 -37.343 24.768 591 HG2 GLU 580 HG2 GLU 580 -16.794 -38.649 26.684 592 HG3 GLU 580 HG3 GLU 580 -17.112 -36.934 26.890 593 H TYR 581 H TYR 581 -19.726 -35.253 25.233 594 HA TYR 581 HA TYR 581 -20.142 -33.945 26.933 595 HB2 TYR 581 HB2 TYR 581 -18.347 -35.099 28.128 596 HB3 TYR 581 HB3 TYR 581 -17.204 -33.889 27.568 597 HD1 TYR 581 HD2 TYR 581 -20.566 -33.931 29.189 598 HD2 TYR 581 HD1 TYR 581 -16.654 -32.282 29.167 599 HE1 TYR 581 HE2 TYR 581 -21.127 -32.551 31.136 600 HE2 TYR 581 HE1 TYR 581 -17.223 -30.909 31.118 601 HH TYR 581 HH TYR 581 -19.307 -29.991 32.208 602 H GLU 582 H GLU 582 -17.528 -32.680 24.978 603 HA GLU 582 HA GLU 582 -18.016 -30.035 25.873 604 HB2 GLU 582 HB2 GLU 582 -16.538 -30.981 23.444 605 HB3 GLU 582 HB3 GLU 582 -16.494 -29.330 24.067 606 HG2 GLU 582 HG2 GLU 582 -15.474 -31.825 25.410 607 HG3 GLU 582 HG3 GLU 582 -14.498 -30.511 24.755 608 H LYS 583 H LYS 583 -18.858 -28.317 24.761 609 HA LYS 583 HA LYS 583 -21.203 -29.102 23.208 610 HB2 LYS 583 HB2 LYS 583 -21.533 -27.901 25.299 611 HB3 LYS 583 HB3 LYS 583 -20.600 -26.547 24.687 612 HG2 LYS 583 HG2 LYS 583 -22.302 -26.209 22.923 613 HG3 LYS 583 HG3 LYS 583 -23.250 -27.520 23.626 614 HD2 LYS 583 HD2 LYS 583 -22.470 -24.961 25.033 615 HD3 LYS 583 HD3 LYS 583 -24.058 -25.327 24.366 616 HE2 LYS 583 HE2 LYS 583 -24.336 -27.161 25.929 617 HE3 LYS 583 HE3 LYS 583 -22.705 -26.924 26.546 618 HZ1 LYS 583 HZ1 LYS 583 -24.385 -25.965 27.970 619 HZ2 LYS 583 HZ2 LYS 583 -24.897 -24.940 26.744 620 HZ3 LYS 583 HZ3 LYS 583 -23.332 -24.798 27.390 621 H ASN 584 H ASN 584 -18.945 -26.297 23.259 622 HA ASN 584 HA ASN 584 -18.684 -26.450 20.391 623 HB2 ASN 584 HB2 ASN 584 -20.788 -25.110 20.701 624 HB3 ASN 584 HB3 ASN 584 -19.862 -23.973 21.667 625 HD21 ASN 584 HD21 ASN 584 -20.404 -25.200 18.468 626 HD22 ASN 584 HD22 ASN 584 -19.613 -23.928 17.620 627 H LYS 585 H LYS 585 -16.757 -25.659 19.791 628 HA LYS 585 HA LYS 585 -15.290 -24.124 21.799 629 HB2 LYS 585 HB2 LYS 585 -14.233 -26.440 20.168 630 HB3 LYS 585 HB3 LYS 585 -13.244 -25.363 21.139 631 HG2 LYS 585 HG2 LYS 585 -15.379 -27.218 22.153 632 HG3 LYS 585 HG3 LYS 585 -13.633 -27.424 22.321 633 HD2 LYS 585 HD2 LYS 585 -13.533 -25.335 23.624 634 HD3 LYS 585 HD3 LYS 585 -15.284 -25.184 23.484 635 HE2 LYS 585 HE2 LYS 585 -14.830 -26.097 25.594 636 HE3 LYS 585 HE3 LYS 585 -15.477 -27.391 24.595 637 HZ1 LYS 585 HZ1 LYS 585 -13.681 -28.225 25.810 638 HZ2 LYS 585 HZ2 LYS 585 -12.671 -26.962 25.411 639 HZ3 LYS 585 HZ3 LYS 585 -13.076 -28.107 24.227 640 H THR 586 H THR 586 -14.125 -22.501 21.043 641 HA THR 586 HA THR 586 -13.719 -22.307 18.194 642 HB THR 586 HB THR 586 -15.839 -21.153 18.529 643 HG1 THR 586 HG1 THR 586 -14.012 -20.143 17.267 644 HG21 THR 586 HG21 THR 586 -14.438 -19.447 20.573 645 HG22 THR 586 HG22 THR 586 -15.647 -20.699 20.894 646 HG23 THR 586 HG23 THR 586 -16.100 -19.254 19.986 647 H PHE 587 H PHE 587 -11.930 -21.130 17.653 648 HA PHE 587 HA PHE 587 -10.378 -19.947 19.798 649 HB2 PHE 587 HB2 PHE 587 -8.320 -21.035 19.027 650 HB3 PHE 587 HB3 PHE 587 -9.483 -22.236 19.534 651 HD1 PHE 587 HD1 PHE 587 -10.661 -23.602 17.769 652 HD2 PHE 587 HD2 PHE 587 -7.445 -20.975 16.853 653 HE1 PHE 587 HE1 PHE 587 -10.301 -24.773 15.621 654 HE2 PHE 587 HE2 PHE 587 -7.097 -22.144 14.717 655 HZ PHE 587 HZ PHE 587 -8.523 -24.040 14.110 656 H PHE 588 H PHE 588 -8.370 -18.860 18.591 657 HA PHE 588 HA PHE 588 -9.569 -17.548 16.267 658 HB2 PHE 588 HB2 PHE 588 -7.861 -16.211 18.409 659 HB3 PHE 588 HB3 PHE 588 -8.503 -15.448 16.968 660 HD1 PHE 588 HD2 PHE 588 -9.347 -16.866 20.243 661 HD2 PHE 588 HD1 PHE 588 -10.764 -14.715 16.860 662 HE1 PHE 588 HE2 PHE 588 -11.380 -16.259 21.490 663 HE2 PHE 588 HE1 PHE 588 -12.796 -14.097 18.104 664 HZ PHE 588 HZ PHE 588 -13.104 -14.868 20.416 665 H LEU 589 H LEU 589 -8.087 -16.708 14.805 666 HA LEU 589 HA LEU 589 -5.445 -18.009 14.856 667 HB2 LEU 589 HB2 LEU 589 -7.462 -18.705 13.138 668 HB3 LEU 589 HB3 LEU 589 -6.727 -17.382 12.259 669 HG LEU 589 HG LEU 589 -5.832 -19.401 11.408 670 HD11 LEU 589 HD11 LEU 589 -3.446 -19.232 11.847 671 HD12 LEU 589 HD12 LEU 589 -3.778 -18.172 13.215 672 HD13 LEU 589 HD13 LEU 589 -4.178 -17.651 11.582 673 HD21 LEU 589 HD21 LEU 589 -6.399 -20.884 13.175 674 HD22 LEU 589 HD22 LEU 589 -5.243 -20.120 14.253 675 HD23 LEU 589 HD23 LEU 589 -4.668 -21.035 12.854 676 H GLU 590 H GLU 590 -3.938 -16.444 14.791 677 HA GLU 590 HA GLU 590 -4.747 -13.906 13.591 678 HB2 GLU 590 HB2 GLU 590 -4.573 -13.655 16.004 679 HB3 GLU 590 HB3 GLU 590 -2.941 -14.311 15.981 680 HG2 GLU 590 HG2 GLU 590 -2.193 -12.386 14.675 681 HG3 GLU 590 HG3 GLU 590 -3.833 -11.747 14.675 682 H ILE 591 H ILE 591 -3.400 -13.078 12.131 683 HA ILE 591 HA ILE 591 -0.916 -14.521 11.685 684 HB ILE 591 HB ILE 591 -0.926 -13.554 9.382 685 HG12 ILE 591 HG12 ILE 591 -3.726 -12.662 10.090 686 HG13 ILE 591 HG13 ILE 591 -2.342 -11.605 9.802 687 HG21 ILE 591 HG21 ILE 591 -2.678 -15.009 8.456 688 HG22 ILE 591 HG22 ILE 591 -3.330 -15.219 10.084 689 HG23 ILE 591 HG23 ILE 591 -1.717 -15.804 9.700 690 HD11 ILE 591 HD11 ILE 591 -3.659 -13.414 7.804 691 HD12 ILE 591 HD12 ILE 591 -2.267 -12.374 7.479 692 HD13 ILE 591 HD13 ILE 591 -3.831 -11.660 7.890 693 H GLY 592 H GLY 592 0.926 -13.449 11.625 694 HA2 GLY 592 HA2 GLY 592 0.892 -10.887 12.977 695 HA3 GLY 592 HA3 GLY 592 2.296 -11.899 12.672 696 H GLU 593 H GLU 593 2.892 -9.544 12.215 697 HA GLU 593 HA GLU 593 2.162 -8.404 9.772 698 HB2 GLU 593 HB2 GLU 593 4.638 -8.049 11.439 699 HB3 GLU 593 HB3 GLU 593 4.254 -7.070 10.031 700 HG2 GLU 593 HG2 GLU 593 2.239 -6.305 11.078 701 HG3 GLU 593 HG3 GLU 593 2.550 -7.313 12.490 702 HA PRO 594 HA PRO 594 4.340 -10.945 6.941 703 HB2 PRO 594 HB2 PRO 594 4.415 -9.170 4.856 704 HB3 PRO 594 HB3 PRO 594 2.988 -10.121 5.262 705 HG2 PRO 594 HG2 PRO 594 3.617 -7.286 5.870 706 HG3 PRO 594 HG3 PRO 594 2.061 -8.014 5.463 707 HD2 PRO 594 HD2 PRO 594 2.807 -7.321 7.973 708 HD3 PRO 594 HD3 PRO 594 1.658 -8.625 7.646 709 H ARG 595 H ARG 595 6.398 -11.252 6.448 710 HA ARG 595 HA ARG 595 8.272 -9.042 6.869 711 HB2 ARG 595 HB2 ARG 595 9.926 -10.796 7.615 712 HB3 ARG 595 HB3 ARG 595 8.547 -10.621 8.688 713 HG2 ARG 595 HG2 ARG 595 7.520 -12.611 7.580 714 HG3 ARG 595 HG3 ARG 595 9.017 -12.751 6.651 715 HD2 ARG 595 HD2 ARG 595 8.905 -12.851 9.661 716 HD3 ARG 595 HD3 ARG 595 8.846 -14.281 8.639 717 HE ARG 595 HE ARG 595 11.106 -12.427 8.439 718 HH11 ARG 595 HH11 ARG 595 9.894 -15.732 9.283 719 HH12 ARG 595 HH12 ARG 595 11.459 -16.365 9.341 720 HH21 ARG 595 HH21 ARG 595 13.189 -13.361 8.640 721 HH22 ARG 595 HH22 ARG 595 13.396 -15.012 9.044 722 H LEU 596 H LEU 596 9.351 -8.462 5.108 723 HA LEU 596 HA LEU 596 9.134 -9.838 2.676 724 HB2 LEU 596 HB2 LEU 596 9.543 -7.313 3.204 725 HB3 LEU 596 HB3 LEU 596 11.208 -7.789 3.429 726 HG LEU 596 HG LEU 596 10.672 -6.737 1.209 727 HD11 LEU 596 HD11 LEU 596 12.682 -8.068 1.456 728 HD12 LEU 596 HD12 LEU 596 11.964 -8.287 -0.143 729 HD13 LEU 596 HD13 LEU 596 11.767 -9.532 1.092 730 HD21 LEU 596 HD21 LEU 596 9.295 -9.348 0.712 731 HD22 LEU 596 HD22 LEU 596 9.497 -8.024 -0.450 732 HD23 LEU 596 HD23 LEU 596 8.497 -7.814 1.002 733 H VAL 597 H VAL 597 10.486 -11.360 1.846 734 HA VAL 597 HA VAL 597 12.350 -12.555 3.667 735 HB VAL 597 HB VAL 597 11.701 -13.317 0.803 736 HG11 VAL 597 HG11 VAL 597 13.210 -14.853 2.930 737 HG12 VAL 597 HG12 VAL 597 13.927 -14.144 1.483 738 HG13 VAL 597 HG13 VAL 597 12.765 -15.467 1.340 739 HG21 VAL 597 HG21 VAL 597 10.392 -15.096 1.846 740 HG22 VAL 597 HG22 VAL 597 9.813 -13.495 2.331 741 HG23 VAL 597 HG23 VAL 597 10.814 -14.449 3.431 742 H GLU 598 H GLU 598 14.259 -11.885 3.952 743 HA GLU 598 HA GLU 598 15.562 -10.114 2.190 744 HB2 GLU 598 HB2 GLU 598 16.207 -11.351 4.806 745 HB3 GLU 598 HB3 GLU 598 17.496 -10.599 3.871 746 HG2 GLU 598 HG2 GLU 598 14.940 -9.173 4.442 747 HG3 GLU 598 HG3 GLU 598 16.278 -9.176 5.598 748 H MET 599 H MET 599 16.160 -10.827 0.359 749 HA MET 599 HA MET 599 17.358 -13.339 -0.200 750 HB2 MET 599 HB2 MET 599 16.196 -11.929 -1.896 751 HB3 MET 599 HB3 MET 599 17.466 -10.733 -1.755 752 HG2 MET 599 HG2 MET 599 17.770 -12.050 -3.752 753 HG3 MET 599 HG3 MET 599 19.086 -12.352 -2.621 754 HE1 MET 599 HE1 MET 599 15.597 -15.311 -3.361 755 HE2 MET 599 HE2 MET 599 15.744 -13.756 -4.179 756 HE3 MET 599 HE3 MET 599 15.388 -13.817 -2.451 757 H SER 600 H SER 600 18.465 -10.228 0.814 758 HA SER 600 HA SER 600 21.252 -10.993 0.725 759 HB2 SER 600 HB2 SER 600 20.636 -8.617 0.285 760 HB3 SER 600 HB3 SER 600 19.873 -8.523 1.867 761 HG SER 600 HG SER 600 21.794 -7.638 2.091 762 H GLU 601 H GLU 601 21.202 -12.805 2.063 763 HA GLU 601 HA GLU 601 19.954 -12.695 4.630 764 HB2 GLU 601 HB2 GLU 601 19.998 -14.770 3.283 765 HB3 GLU 601 HB3 GLU 601 21.746 -14.820 3.439 766 HG2 GLU 601 HG2 GLU 601 21.501 -15.039 5.877 767 HG3 GLU 601 HG3 GLU 601 19.752 -15.057 5.682 768 H LYS 602 H LYS 602 20.913 -12.229 6.517 769 HA LYS 602 HA LYS 602 23.784 -11.713 6.464 770 HB2 LYS 602 HB2 LYS 602 23.506 -10.551 8.585 771 HB3 LYS 602 HB3 LYS 602 22.326 -9.941 7.444 772 HG2 LYS 602 HG2 LYS 602 20.568 -11.188 8.536 773 HG3 LYS 602 HG3 LYS 602 21.742 -11.960 9.611 774 HD2 LYS 602 HD2 LYS 602 22.348 -9.765 10.511 775 HD3 LYS 602 HD3 LYS 602 21.172 -9.006 9.448 776 HE2 LYS 602 HE2 LYS 602 19.367 -10.248 10.587 777 HE3 LYS 602 HE3 LYS 602 20.559 -10.986 11.654 778 HZ1 LYS 602 HZ1 LYS 602 19.470 -9.076 12.710 779 HZ2 LYS 602 HZ2 LYS 602 19.991 -8.073 11.463 780 HZ3 LYS 602 HZ3 LYS 602 21.116 -8.768 12.485 781 H LYS 603 H LYS 603 25.013 -12.525 8.396 782 HA LYS 603 HA LYS 603 24.280 -15.294 8.696 783 HB2 LYS 603 HB2 LYS 603 26.798 -13.813 9.440 784 HB3 LYS 603 HB3 LYS 603 26.539 -15.517 9.788 785 HG2 LYS 603 HG2 LYS 603 26.274 -15.959 7.393 786 HG3 LYS 603 HG3 LYS 603 26.545 -14.246 7.068 787 HD2 LYS 603 HD2 LYS 603 28.786 -14.388 7.940 788 HD3 LYS 603 HD3 LYS 603 28.524 -16.065 8.432 789 HE2 LYS 603 HE2 LYS 603 29.795 -15.927 6.341 790 HE3 LYS 603 HE3 LYS 603 28.239 -16.714 6.105 791 HZ1 LYS 603 HZ1 LYS 603 27.377 -14.637 5.204 792 HZ2 LYS 603 HZ2 LYS 603 28.706 -15.165 4.341 793 HZ3 LYS 603 HZ3 LYS 603 28.872 -13.887 5.419 794 H GLY 604 H GLY 604 22.637 -15.320 9.986 795 HA2 GLY 604 HA2 GLY 604 23.115 -14.465 12.757 796 HA3 GLY 604 HA3 GLY 604 21.536 -14.378 11.977 797 H GLY 605 H GLY 605 21.291 -16.686 10.715 798 HA2 GLY 605 HA2 GLY 605 20.947 -18.924 10.913 799 HA3 GLY 605 HA3 GLY 605 22.083 -18.925 12.259 800 H PHE 606 H PHE 606 21.279 -18.100 14.273 801 HA PHE 606 HA PHE 606 18.809 -19.404 14.854 802 HB2 PHE 606 HB2 PHE 606 20.712 -17.945 16.688 803 HB3 PHE 606 HB3 PHE 606 19.295 -18.840 17.217 804 HD1 PHE 606 HD2 PHE 606 19.192 -21.329 16.456 805 HD2 PHE 606 HD1 PHE 606 22.757 -19.010 16.597 806 HE1 PHE 606 HE2 PHE 606 20.525 -23.392 16.542 807 HE2 PHE 606 HE1 PHE 606 24.097 -21.068 16.683 808 HZ PHE 606 HZ PHE 606 22.977 -23.263 16.657 809 H THR 607 H THR 607 17.051 -18.409 14.334 810 HA THR 607 HA THR 607 16.685 -15.653 15.197 811 HB THR 607 HB THR 607 14.901 -17.368 13.416 812 HG1 THR 607 HG1 THR 607 17.154 -15.887 12.906 813 HG21 THR 607 HG21 THR 607 13.717 -15.540 14.581 814 HG22 THR 607 HG22 THR 607 13.817 -15.226 12.849 815 HG23 THR 607 HG23 THR 607 14.896 -14.385 13.961 816 H ILE 608 H ILE 608 16.361 -15.936 17.319 817 HA ILE 608 HA ILE 608 14.956 -18.145 18.396 818 HB ILE 608 HB ILE 608 15.765 -15.546 19.746 819 HG12 ILE 608 HG12 ILE 608 17.153 -18.240 19.705 820 HG13 ILE 608 HG13 ILE 608 17.671 -16.821 18.804 821 HG21 ILE 608 HG21 ILE 608 14.958 -18.195 20.953 822 HG22 ILE 608 HG22 ILE 608 13.996 -16.720 20.971 823 HG23 ILE 608 HG23 ILE 608 15.528 -16.786 21.847 824 HD11 ILE 608 HD11 ILE 608 18.082 -15.645 20.908 825 HD12 ILE 608 HD12 ILE 608 19.012 -17.140 20.805 826 HD13 ILE 608 HD13 ILE 608 17.558 -17.070 21.804 827 H THR 609 H THR 609 12.896 -18.390 18.235 828 HA THR 609 HA THR 609 11.115 -16.150 17.882 829 HB THR 609 HB THR 609 10.544 -19.128 17.875 830 HG1 THR 609 HG1 THR 609 10.773 -17.520 15.573 831 HG21 THR 609 HG21 THR 609 8.541 -18.480 16.581 832 HG22 THR 609 HG22 THR 609 8.991 -16.782 16.732 833 HG23 THR 609 HG23 THR 609 8.541 -17.702 18.165 834 H GLU 610 H GLU 610 11.844 -18.713 20.225 835 HA GLU 610 HA GLU 610 9.785 -17.688 21.993 836 HB2 GLU 610 HB2 GLU 610 10.070 -20.158 21.828 837 HB3 GLU 610 HB3 GLU 610 11.715 -19.994 22.425 838 HG2 GLU 610 HG2 GLU 610 10.087 -20.732 24.142 839 HG3 GLU 610 HG3 GLU 610 10.939 -19.247 24.560 840 H GLU 611 H GLU 611 10.535 -15.745 22.410 841 HA GLU 611 HA GLU 611 13.179 -15.533 23.654 842 HB2 GLU 611 HB2 GLU 611 12.983 -14.458 21.469 843 HB3 GLU 611 HB3 GLU 611 11.625 -13.512 22.041 844 HG2 GLU 611 HG2 GLU 611 13.693 -12.230 21.893 845 HG3 GLU 611 HG3 GLU 611 13.051 -12.284 23.529 846 H TYR 612 H TYR 612 9.777 -14.450 23.869 847 HA TYR 612 HA TYR 612 10.083 -14.000 26.694 848 HB2 TYR 612 HB2 TYR 612 10.918 -11.890 25.442 849 HB3 TYR 612 HB3 TYR 612 9.259 -11.674 24.925 850 HD1 TYR 612 HD2 TYR 612 11.379 -11.943 27.974 851 HD2 TYR 612 HD1 TYR 612 7.791 -10.451 26.272 852 HE1 TYR 612 HE2 TYR 612 10.952 -10.655 30.026 853 HE2 TYR 612 HE1 TYR 612 7.351 -9.153 28.317 854 HH TYR 612 HH TYR 612 7.990 -9.281 30.751 855 H ASP 613 H ASP 613 7.831 -13.335 27.559 856 HA ASP 613 HA ASP 613 5.727 -14.905 26.390 857 HB2 ASP 613 HB2 ASP 613 5.519 -12.692 28.449 858 HB3 ASP 613 HB3 ASP 613 4.207 -13.774 28.013 859 H ASP 614 H ASP 614 6.479 -11.559 26.469 860 HA ASP 614 HA ASP 614 4.380 -10.902 24.542 861 HB2 ASP 614 HB2 ASP 614 4.839 -9.547 26.706 862 HB3 ASP 614 HB3 ASP 614 6.312 -9.005 25.919 863 H LYS 615 H LYS 615 5.979 -8.677 23.455 864 HA LYS 615 HA LYS 615 7.321 -10.142 21.405 865 HB2 LYS 615 HB2 LYS 615 7.088 -7.189 21.925 866 HB3 LYS 615 HB3 LYS 615 7.769 -7.887 20.472 867 HG2 LYS 615 HG2 LYS 615 4.930 -8.184 21.431 868 HG3 LYS 615 HG3 LYS 615 5.482 -7.163 20.105 869 HD2 LYS 615 HD2 LYS 615 6.318 -9.252 18.980 870 HD3 LYS 615 HD3 LYS 615 5.518 -10.173 20.249 871 HE2 LYS 615 HE2 LYS 615 4.101 -10.044 18.276 872 HE3 LYS 615 HE3 LYS 615 3.366 -9.180 19.626 873 HZ1 LYS 615 HZ1 LYS 615 4.082 -7.105 18.686 874 HZ2 LYS 615 HZ2 LYS 615 3.239 -7.932 17.495 875 HZ3 LYS 615 HZ3 LYS 615 4.920 -7.872 17.454 876 H GLN 616 H GLN 616 9.531 -9.155 20.641 877 HA GLN 616 HA GLN 616 11.297 -9.385 22.965 878 HB2 GLN 616 HB2 GLN 616 12.985 -10.241 21.393 879 HB3 GLN 616 HB3 GLN 616 11.534 -11.232 21.402 880 HG2 GLN 616 HG2 GLN 616 10.810 -10.155 19.326 881 HG3 GLN 616 HG3 GLN 616 12.293 -9.197 19.317 882 HE21 GLN 616 HE21 GLN 616 14.259 -10.264 18.939 883 HE22 GLN 616 HE22 GLN 616 14.290 -11.785 18.115 884 HA PRO 617 HA PRO 617 12.731 -5.276 22.030 885 HB2 PRO 617 HB2 PRO 617 15.157 -5.348 23.277 886 HB3 PRO 617 HB3 PRO 617 13.632 -5.180 24.153 887 HG2 PRO 617 HG2 PRO 617 15.329 -7.602 23.750 888 HG3 PRO 617 HG3 PRO 617 14.426 -7.091 25.186 889 HD2 PRO 617 HD2 PRO 617 13.558 -9.021 23.458 890 HD3 PRO 617 HD3 PRO 617 12.469 -8.010 24.428 891 H LEU 618 H LEU 618 13.156 -5.039 19.934 892 HA LEU 618 HA LEU 618 15.200 -6.521 18.562 893 HB2 LEU 618 HB2 LEU 618 13.459 -4.228 17.688 894 HB3 LEU 618 HB3 LEU 618 14.492 -5.148 16.624 895 HG LEU 618 HG LEU 618 12.085 -6.207 18.109 896 HD11 LEU 618 HD11 LEU 618 11.475 -4.723 16.298 897 HD12 LEU 618 HD12 LEU 618 11.103 -6.395 15.871 898 HD13 LEU 618 HD13 LEU 618 12.529 -5.607 15.197 899 HD21 LEU 618 HD21 LEU 618 13.781 -7.929 17.848 900 HD22 LEU 618 HD22 LEU 618 13.907 -7.564 16.126 901 HD23 LEU 618 HD23 LEU 618 12.412 -8.228 16.783 902 H THR 619 H THR 619 16.976 -5.573 17.453 903 HA THR 619 HA THR 619 18.093 -3.242 18.815 904 HB THR 619 HB THR 619 19.565 -5.234 18.692 905 HG1 THR 619 HG1 THR 619 20.279 -2.945 17.224 906 HG21 THR 619 HG21 THR 619 20.444 -6.000 16.507 907 HG22 THR 619 HG22 THR 619 19.293 -4.924 15.703 908 HG23 THR 619 HG23 THR 619 18.711 -6.270 16.679 909 H SER 620 H SER 620 16.005 -3.530 16.638 910 HA SER 620 HA SER 620 17.083 -2.006 14.443 911 HB2 SER 620 HB2 SER 620 14.252 -2.897 15.027 912 HB3 SER 620 HB3 SER 620 14.892 -2.361 13.470 913 HG SER 620 HG SER 620 16.399 -4.123 13.667 914 H LYS 621 H LYS 621 16.618 -1.065 17.407 915 HA LYS 621 HA LYS 621 14.656 0.995 17.363 916 HB2 LYS 621 HB2 LYS 621 17.177 0.876 19.046 917 HB3 LYS 621 HB3 LYS 621 15.782 1.889 19.337 918 HG2 LYS 621 HG2 LYS 621 14.425 -0.126 19.756 919 HG3 LYS 621 HG3 LYS 621 15.868 -1.112 19.514 920 HD2 LYS 621 HD2 LYS 621 16.982 -0.042 21.360 921 HD3 LYS 621 HD3 LYS 621 15.640 1.083 21.557 922 HE2 LYS 621 HE2 LYS 621 14.175 -0.808 22.128 923 HE3 LYS 621 HE3 LYS 621 15.550 -1.900 21.976 924 HZ1 LYS 621 HZ1 LYS 621 15.130 -1.266 24.281 925 HZ2 LYS 621 HZ2 LYS 621 15.371 0.356 23.918 926 HZ3 LYS 621 HZ3 LYS 621 16.644 -0.727 23.789 927 H GLU 622 H GLU 622 18.151 0.969 16.996 928 HA GLU 622 HA GLU 622 18.177 3.633 15.892 929 HB2 GLU 622 HB2 GLU 622 20.048 2.822 17.320 930 HB3 GLU 622 HB3 GLU 622 20.353 1.538 16.164 931 HG2 GLU 622 HG2 GLU 622 21.969 3.331 15.935 932 HG3 GLU 622 HG3 GLU 622 20.975 3.180 14.488 933 H GLU 623 H GLU 623 17.506 3.858 13.889 934 HA GLU 623 HA GLU 623 17.909 1.663 11.978 935 HB2 GLU 623 HB2 GLU 623 15.717 2.300 11.016 936 HB3 GLU 623 HB3 GLU 623 15.602 1.629 12.639 937 HG2 GLU 623 HG2 GLU 623 15.274 3.830 13.576 938 HG3 GLU 623 HG3 GLU 623 15.560 4.578 12.010 939 H GLU 624 H GLU 624 17.651 2.463 9.694 940 HA GLU 624 HA GLU 624 18.524 5.240 9.452 941 HB2 GLU 624 HB2 GLU 624 19.216 2.906 7.652 942 HB3 GLU 624 HB3 GLU 624 19.599 4.580 7.298 943 HG2 GLU 624 HG2 GLU 624 21.037 4.651 9.291 944 HG3 GLU 624 HG3 GLU 624 20.667 2.953 9.597 945 H GLU 625 H GLU 625 16.383 5.902 9.377 946 HA GLU 625 HA GLU 625 14.404 6.526 8.462 947 HB2 GLU 625 HB2 GLU 625 15.634 5.750 5.807 948 HB3 GLU 625 HB3 GLU 625 14.316 6.875 6.070 949 HG2 GLU 625 HG2 GLU 625 17.204 7.250 6.828 950 HG3 GLU 625 HG3 GLU 625 16.325 8.071 5.549 951 H ARG 626 H ARG 626 14.716 3.771 9.279 952 HA ARG 626 HA ARG 626 13.681 1.955 7.366 953 HB2 ARG 626 HB2 ARG 626 15.020 1.166 9.228 954 HB3 ARG 626 HB3 ARG 626 13.811 1.734 10.367 955 HG2 ARG 626 HG2 ARG 626 12.230 0.070 9.545 956 HG3 ARG 626 HG3 ARG 626 13.411 -0.475 8.355 957 HD2 ARG 626 HD2 ARG 626 14.893 -1.218 10.055 958 HD3 ARG 626 HD3 ARG 626 13.909 -0.498 11.328 959 HE ARG 626 HE ARG 626 12.174 -2.203 10.340 960 HH11 ARG 626 HH11 ARG 626 15.640 -2.776 10.870 961 HH12 ARG 626 HH12 ARG 626 15.424 -4.423 11.266 962 HH21 ARG 626 HH21 ARG 626 11.925 -4.458 10.932 963 HH22 ARG 626 HH22 ARG 626 13.292 -5.388 11.338 964 H ARG 627 H ARG 627 12.114 3.899 9.866 965 HA ARG 627 HA ARG 627 9.588 2.737 9.436 966 HB2 ARG 627 HB2 ARG 627 10.212 4.168 11.422 967 HB3 ARG 627 HB3 ARG 627 10.118 5.571 10.371 968 HG2 ARG 627 HG2 ARG 627 7.775 3.729 10.719 969 HG3 ARG 627 HG3 ARG 627 8.137 5.024 11.861 970 HD2 ARG 627 HD2 ARG 627 7.621 6.682 10.341 971 HD3 ARG 627 HD3 ARG 627 7.984 5.668 8.945 972 HE ARG 627 HE ARG 627 5.859 4.457 9.981 973 HH11 ARG 627 HH11 ARG 627 6.434 7.856 9.164 974 HH12 ARG 627 HH12 ARG 627 4.816 8.184 8.716 975 HH21 ARG 627 HH21 ARG 627 3.619 4.912 9.359 976 HH22 ARG 627 HH22 ARG 627 3.187 6.473 8.837 977 H ILE 628 H ILE 628 11.249 5.375 7.768 978 HA ILE 628 HA ILE 628 8.995 6.080 6.185 979 HB ILE 628 HB ILE 628 11.950 6.354 5.487 980 HG12 ILE 628 HG12 ILE 628 10.002 8.349 6.671 981 HG13 ILE 628 HG13 ILE 628 11.346 7.587 7.508 982 HG21 ILE 628 HG21 ILE 628 10.546 6.440 3.481 983 HG22 ILE 628 HG22 ILE 628 11.240 8.022 3.834 984 HG23 ILE 628 HG23 ILE 628 9.550 7.697 4.219 985 HD11 ILE 628 HD11 ILE 628 11.570 9.487 5.181 986 HD12 ILE 628 HD12 ILE 628 12.919 8.741 6.040 987 HD13 ILE 628 HD13 ILE 628 11.861 9.879 6.875 988 H ALA 629 H ALA 629 11.470 3.683 5.965 989 HA ALA 629 HA ALA 629 10.880 2.730 3.386 990 HB1 ALA 629 HB1 ALA 629 12.258 0.822 3.955 991 HB2 ALA 629 HB2 ALA 629 12.192 1.259 5.660 992 HB3 ALA 629 HB3 ALA 629 13.017 2.313 4.514 993 H GLU 630 H GLU 630 9.043 2.415 6.294 994 HA GLU 630 HA GLU 630 8.150 -0.224 6.006 995 HB2 GLU 630 HB2 GLU 630 6.410 0.189 7.571 996 HB3 GLU 630 HB3 GLU 630 7.762 1.204 8.048 997 HG2 GLU 630 HG2 GLU 630 6.716 3.133 7.186 998 HG3 GLU 630 HG3 GLU 630 5.455 2.147 6.435 999 H MET 631 H MET 631 7.285 2.640 4.352 1000 HA MET 631 HA MET 631 4.812 1.666 3.332 1001 HB2 MET 631 HB2 MET 631 4.810 3.633 1.850 1002 HB3 MET 631 HB3 MET 631 5.045 4.035 3.534 1003 HG2 MET 631 HG2 MET 631 6.424 5.430 2.256 1004 HG3 MET 631 HG3 MET 631 7.476 4.281 3.069 1005 HE1 MET 631 HE1 MET 631 9.507 4.911 1.516 1006 HE2 MET 631 HE2 MET 631 8.487 6.126 0.747 1007 HE3 MET 631 HE3 MET 631 9.411 4.997 -0.245 1008 H GLY 632 H GLY 632 7.918 0.830 2.617 1009 HA2 GLY 632 HA2 GLY 632 7.192 0.077 -0.126 1010 HA3 GLY 632 HA3 GLY 632 8.838 0.206 0.492 1011 H ARG 633 H ARG 633 7.051 -1.126 2.884 1012 HA ARG 633 HA ARG 633 8.132 -3.802 2.329 1013 HB2 ARG 633 HB2 ARG 633 6.619 -2.895 4.773 1014 HB3 ARG 633 HB3 ARG 633 7.647 -4.285 4.617 1015 HG2 ARG 633 HG2 ARG 633 9.603 -2.804 4.506 1016 HG3 ARG 633 HG3 ARG 633 8.506 -1.424 4.701 1017 HD2 ARG 633 HD2 ARG 633 7.635 -2.574 6.784 1018 HD3 ARG 633 HD3 ARG 633 8.990 -3.687 6.639 1019 HE ARG 633 HE ARG 633 10.252 -1.380 6.659 1020 HH11 ARG 633 HH11 ARG 633 7.734 -2.699 8.779 1021 HH12 ARG 633 HH12 ARG 633 8.020 -1.628 10.058 1022 HH21 ARG 633 HH21 ARG 633 10.635 0.158 8.460 1023 HH22 ARG 633 HH22 ARG 633 9.706 0.008 9.886 1024 HA PRO 634 HA PRO 634 3.870 -5.352 1.918 1025 HB2 PRO 634 HB2 PRO 634 4.124 -7.801 3.054 1026 HB3 PRO 634 HB3 PRO 634 4.767 -7.470 1.441 1027 HG2 PRO 634 HG2 PRO 634 6.214 -7.542 4.069 1028 HG3 PRO 634 HG3 PRO 634 6.721 -8.224 2.522 1029 HD2 PRO 634 HD2 PRO 634 7.661 -5.879 3.438 1030 HD3 PRO 634 HD3 PRO 634 7.427 -6.181 1.709 1031 H ILE 635 H ILE 635 2.155 -4.907 3.257 1032 HA ILE 635 HA ILE 635 2.735 -5.038 6.089 1033 HB ILE 635 HB ILE 635 1.415 -2.957 6.465 1034 HG12 ILE 635 HG12 ILE 635 1.300 -1.355 4.405 1035 HG13 ILE 635 HG13 ILE 635 1.397 -2.815 3.440 1036 HG21 ILE 635 HG21 ILE 635 3.165 -1.380 5.719 1037 HG22 ILE 635 HG22 ILE 635 3.819 -2.670 4.700 1038 HG23 ILE 635 HG23 ILE 635 3.818 -2.852 6.454 1039 HD11 ILE 635 HD11 ILE 635 -0.682 -3.609 4.469 1040 HD12 ILE 635 HD12 ILE 635 -0.887 -2.059 3.655 1041 HD13 ILE 635 HD13 ILE 635 -0.772 -2.122 5.415 1042 H LEU 636 H LEU 636 0.680 -4.951 7.411 1043 HA LEU 636 HA LEU 636 -1.173 -6.699 6.035 1044 HB2 LEU 636 HB2 LEU 636 -2.017 -7.305 8.354 1045 HB3 LEU 636 HB3 LEU 636 -0.485 -7.949 7.838 1046 HG LEU 636 HG LEU 636 0.692 -6.382 9.330 1047 HD11 LEU 636 HD11 LEU 636 -0.525 -5.001 10.925 1048 HD12 LEU 636 HD12 LEU 636 -2.055 -5.461 10.178 1049 HD13 LEU 636 HD13 LEU 636 -0.888 -4.499 9.273 1050 HD21 LEU 636 HD21 LEU 636 -0.004 -8.547 10.145 1051 HD22 LEU 636 HD22 LEU 636 -1.555 -7.863 10.630 1052 HD23 LEU 636 HD23 LEU 636 -0.070 -7.338 11.436 1053 H GLY 637 H GLY 637 -3.438 -6.664 6.847 1054 HA2 GLY 637 HA2 GLY 637 -4.423 -4.087 6.165 1055 HA3 GLY 637 HA3 GLY 637 -5.354 -5.537 6.526 1056 H GLU 638 H GLU 638 -6.718 -3.899 7.531 1057 HA GLU 638 HA GLU 638 -5.895 -2.455 9.814 1058 HB2 GLU 638 HB2 GLU 638 -7.782 -1.859 8.320 1059 HB3 GLU 638 HB3 GLU 638 -8.661 -3.253 8.921 1060 HG2 GLU 638 HG2 GLU 638 -8.737 -2.281 11.135 1061 HG3 GLU 638 HG3 GLU 638 -7.777 -0.910 10.583 1062 H HIS 639 H HIS 639 -7.701 -5.480 9.379 1063 HA HIS 639 HA HIS 639 -7.048 -6.166 12.157 1064 HB2 HIS 639 HB2 HIS 639 -9.623 -6.796 10.674 1065 HB3 HIS 639 HB3 HIS 639 -9.160 -7.545 12.191 1066 HD1 HIS 639 HD1 HIS 639 -9.660 -6.189 14.355 1067 HD2 HIS 639 HD2 HIS 639 -10.352 -4.073 10.841 1068 HE1 HIS 639 HE1 HIS 639 -10.869 -4.107 15.019 1069 H THR 640 H THR 640 -6.078 -8.118 12.391 1070 HA THR 640 HA THR 640 -6.346 -9.958 10.187 1071 HB THR 640 HB THR 640 -4.000 -10.703 10.564 1072 HG1 THR 640 HG1 THR 640 -2.710 -9.695 11.845 1073 HG21 THR 640 HG21 THR 640 -4.647 -9.409 8.639 1074 HG22 THR 640 HG22 THR 640 -3.001 -8.999 9.128 1075 HG23 THR 640 HG23 THR 640 -4.344 -7.906 9.508 1076 H LYS 641 H LYS 641 -7.799 -11.084 11.235 1077 HA LYS 641 HA LYS 641 -6.918 -12.915 13.218 1078 HB2 LYS 641 HB2 LYS 641 -7.267 -10.910 14.649 1079 HB3 LYS 641 HB3 LYS 641 -8.922 -10.819 14.073 1080 HG2 LYS 641 HG2 LYS 641 -9.476 -12.892 15.157 1081 HG3 LYS 641 HG3 LYS 641 -7.797 -13.154 15.601 1082 HD2 LYS 641 HD2 LYS 641 -8.978 -12.400 17.551 1083 HD3 LYS 641 HD3 LYS 641 -7.915 -11.107 17.031 1084 HE2 LYS 641 HE2 LYS 641 -10.860 -11.218 16.353 1085 HE3 LYS 641 HE3 LYS 641 -10.239 -10.430 17.793 1086 HZ1 LYS 641 HZ1 LYS 641 -8.932 -8.948 16.267 1087 HZ2 LYS 641 HZ2 LYS 641 -10.582 -8.799 16.136 1088 HZ3 LYS 641 HZ3 LYS 641 -9.757 -9.627 14.956 1089 H LEU 642 H LEU 642 -8.240 -14.603 13.371 1090 HA LEU 642 HA LEU 642 -10.748 -14.589 11.841 1091 HB2 LEU 642 HB2 LEU 642 -8.923 -15.702 10.666 1092 HB3 LEU 642 HB3 LEU 642 -8.620 -16.679 12.087 1093 HG LEU 642 HG LEU 642 -10.979 -17.606 11.775 1094 HD11 LEU 642 HD11 LEU 642 -10.643 -16.318 9.101 1095 HD12 LEU 642 HD12 LEU 642 -11.847 -15.913 10.324 1096 HD13 LEU 642 HD13 LEU 642 -11.874 -17.497 9.545 1097 HD21 LEU 642 HD21 LEU 642 -8.788 -18.058 9.795 1098 HD22 LEU 642 HD22 LEU 642 -10.213 -19.086 9.993 1099 HD23 LEU 642 HD23 LEU 642 -9.059 -18.912 11.318 1100 H GLU 643 H GLU 643 -12.365 -15.655 12.872 1101 HA GLU 643 HA GLU 643 -11.796 -16.828 15.504 1102 HB2 GLU 643 HB2 GLU 643 -13.333 -14.841 15.294 1103 HB3 GLU 643 HB3 GLU 643 -14.393 -15.850 14.339 1104 HG2 GLU 643 HG2 GLU 643 -14.798 -17.289 16.220 1105 HG3 GLU 643 HG3 GLU 643 -13.626 -16.393 17.191 1106 H VAL 644 H VAL 644 -11.679 -18.997 15.318 1107 HA VAL 644 HA VAL 644 -13.181 -20.335 13.184 1108 HB VAL 644 HB VAL 644 -10.929 -21.424 14.880 1109 HG11 VAL 644 HG11 VAL 644 -10.856 -23.230 13.291 1110 HG12 VAL 644 HG12 VAL 644 -12.172 -22.506 12.361 1111 HG13 VAL 644 HG13 VAL 644 -12.470 -23.109 13.997 1112 HG21 VAL 644 HG21 VAL 644 -10.871 -20.396 12.053 1113 HG22 VAL 644 HG22 VAL 644 -9.528 -21.176 12.888 1114 HG23 VAL 644 HG23 VAL 644 -10.134 -19.614 13.451 1115 H ILE 645 H ILE 645 -14.990 -21.205 13.807 1116 HA ILE 645 HA ILE 645 -15.388 -22.135 16.580 1117 HB ILE 645 HB ILE 645 -17.381 -21.764 14.335 1118 HG12 ILE 645 HG12 ILE 645 -16.896 -19.893 16.642 1119 HG13 ILE 645 HG13 ILE 645 -16.204 -19.650 15.045 1120 HG21 ILE 645 HG21 ILE 645 -19.053 -21.824 16.128 1121 HG22 ILE 645 HG22 ILE 645 -17.767 -22.107 17.303 1122 HG23 ILE 645 HG23 ILE 645 -18.110 -23.314 16.066 1123 HD11 ILE 645 HD11 ILE 645 -18.199 -18.300 15.378 1124 HD12 ILE 645 HD12 ILE 645 -19.144 -19.771 15.671 1125 HD13 ILE 645 HD13 ILE 645 -18.407 -19.483 14.091 1126 H ILE 646 H ILE 646 -15.475 -24.250 16.982 1127 HA ILE 646 HA ILE 646 -15.442 -26.092 14.710 1128 HB ILE 646 HB ILE 646 -14.663 -26.628 17.609 1129 HG12 ILE 646 HG12 ILE 646 -12.832 -26.289 15.220 1130 HG13 ILE 646 HG13 ILE 646 -13.118 -25.033 16.420 1131 HG21 ILE 646 HG21 ILE 646 -14.334 -28.302 15.134 1132 HG22 ILE 646 HG22 ILE 646 -15.463 -28.594 16.455 1133 HG23 ILE 646 HG23 ILE 646 -13.724 -28.700 16.741 1134 HD11 ILE 646 HD11 ILE 646 -12.184 -26.454 18.152 1135 HD12 ILE 646 HD12 ILE 646 -11.030 -26.243 16.837 1136 HD13 ILE 646 HD13 ILE 646 -11.938 -27.748 16.984 1137 H GLU 647 H GLU 647 -17.406 -26.791 14.310 1138 HA GLU 647 HA GLU 647 -19.170 -27.474 16.568 1139 HB2 GLU 647 HB2 GLU 647 -19.930 -27.065 13.660 1140 HB3 GLU 647 HB3 GLU 647 -21.040 -27.316 15.000 1141 HG2 GLU 647 HG2 GLU 647 -20.259 -25.189 15.992 1142 HG3 GLU 647 HG3 GLU 647 -19.260 -24.932 14.565 1143 H GLU 648 H GLU 648 -20.276 -29.670 16.399 1144 HA GLU 648 HA GLU 648 -18.275 -31.342 15.416 1145 HB2 GLU 648 HB2 GLU 648 -19.417 -33.171 16.603 1146 HB3 GLU 648 HB3 GLU 648 -18.845 -31.871 17.628 1147 HG2 GLU 648 HG2 GLU 648 -20.959 -32.585 18.451 1148 HG3 GLU 648 HG3 GLU 648 -21.172 -31.014 17.682 1149 H SER 649 H SER 649 -19.139 -33.569 14.601 1150 HA SER 649 HA SER 649 -21.294 -33.008 12.750 1151 HB2 SER 649 HB2 SER 649 -18.477 -33.592 12.063 1152 HB3 SER 649 HB3 SER 649 -19.788 -33.679 10.832 1153 HG SER 649 HG SER 649 -19.863 -31.408 12.226 1154 H TYR 650 H TYR 650 -20.563 -34.962 14.992 1155 HA TYR 650 HA TYR 650 -20.902 -37.434 13.474 1156 HB2 TYR 650 HB2 TYR 650 -20.075 -36.968 16.308 1157 HB3 TYR 650 HB3 TYR 650 -20.803 -38.500 15.860 1158 HD1 TYR 650 HD1 TYR 650 -18.063 -36.206 14.899 1159 HD2 TYR 650 HD2 TYR 650 -19.485 -40.193 14.982 1160 HE1 TYR 650 HE1 TYR 650 -15.896 -36.999 14.096 1161 HE2 TYR 650 HE2 TYR 650 -17.310 -40.993 14.167 1162 HH TYR 650 HH TYR 650 -14.593 -38.832 14.006 1163 H GLU 651 H GLU 651 -22.383 -35.856 16.262 1164 HA GLU 651 HA GLU 651 -24.613 -37.690 16.072 1165 HB2 GLU 651 HB2 GLU 651 -23.652 -36.790 18.254 1166 HB3 GLU 651 HB3 GLU 651 -24.359 -35.240 17.823 1167 HG2 GLU 651 HG2 GLU 651 -25.825 -36.360 19.339 1168 HG3 GLU 651 HG3 GLU 651 -26.578 -36.339 17.742 1169 H PHE 652 H PHE 652 -23.907 -34.273 15.779 1170 HA PHE 652 HA PHE 652 -25.354 -32.554 15.238 1171 HB2 PHE 652 HB2 PHE 652 -23.402 -32.883 13.748 1172 HB3 PHE 652 HB3 PHE 652 -24.412 -33.791 12.641 1173 HD1 PHE 652 HD2 PHE 652 -24.073 -30.464 14.245 1174 HD2 PHE 652 HD1 PHE 652 -25.503 -32.690 10.919 1175 HE1 PHE 652 HE2 PHE 652 -24.617 -28.371 13.083 1176 HE2 PHE 652 HE1 PHE 652 -26.045 -30.602 9.746 1177 HZ PHE 652 HZ PHE 652 -25.608 -28.444 10.825 1178 H LYS 653 H LYS 653 -27.381 -33.724 16.018 1179 HA LYS 653 HA LYS 653 -29.233 -33.917 13.722 1180 HB2 LYS 653 HB2 LYS 653 -30.780 -35.189 15.127 1181 HB3 LYS 653 HB3 LYS 653 -29.218 -35.979 15.093 1182 HG2 LYS 653 HG2 LYS 653 -28.742 -34.973 17.319 1183 HG3 LYS 653 HG3 LYS 653 -30.380 -34.332 17.327 1184 HD2 LYS 653 HD2 LYS 653 -29.721 -37.274 17.095 1185 HD3 LYS 653 HD3 LYS 653 -30.042 -36.473 18.616 1186 HE2 LYS 653 HE2 LYS 653 -32.036 -37.627 17.921 1187 HE3 LYS 653 HE3 LYS 653 -32.331 -35.907 17.778 1188 HZ1 LYS 653 HZ1 LYS 653 -31.628 -37.701 15.505 1189 HZ2 LYS 653 HZ2 LYS 653 -32.183 -36.097 15.376 1190 HZ3 LYS 653 HZ3 LYS 653 -33.184 -37.294 15.941 1191 H SER 654 H SER 654 -28.039 -32.004 15.791 1192 HA SER 654 HA SER 654 -29.739 -29.899 15.342 1193 HB2 SER 654 HB2 SER 654 -30.044 -29.356 17.809 1194 HB3 SER 654 HB3 SER 654 -30.953 -30.786 17.338 1195 HG SER 654 HG SER 654 -29.326 -30.611 19.298 1196 H THR 655 H THR 655 -28.284 -28.180 17.082 1197 HA THR 655 HA THR 655 -25.672 -28.656 15.993 1198 HB THR 655 HB THR 655 -26.486 -26.532 18.002 1199 HG1 THR 655 HG1 THR 655 -27.445 -26.906 15.581 1200 HG21 THR 655 HG21 THR 655 -24.309 -26.645 15.902 1201 HG22 THR 655 HG22 THR 655 -24.067 -26.824 17.641 1202 HG23 THR 655 HG23 THR 655 -24.639 -25.290 16.979 1203 H VAL 656 H VAL 656 -24.267 -30.002 16.937 1204 HA VAL 656 HA VAL 656 -23.050 -31.126 18.235 1205 HB VAL 656 HB VAL 656 -22.420 -29.074 19.449 1206 HG11 VAL 656 HG11 VAL 656 -24.493 -29.820 21.479 1207 HG12 VAL 656 HG12 VAL 656 -24.482 -28.382 20.456 1208 HG13 VAL 656 HG13 VAL 656 -23.248 -28.591 21.701 1209 HG21 VAL 656 HG21 VAL 656 -21.445 -30.119 21.444 1210 HG22 VAL 656 HG22 VAL 656 -21.269 -31.117 20.004 1211 HG23 VAL 656 HG23 VAL 656 -22.498 -31.512 21.206 1212 H ASP 657 H ASP 657 -26.246 -30.935 19.301 1213 HA ASP 657 HA ASP 657 -25.888 -33.590 20.503 1214 HB2 ASP 657 HB2 ASP 657 -27.045 -32.052 21.981 1215 HB3 ASP 657 HB3 ASP 657 -28.221 -31.685 20.722 Start of MODEL 15 1 H HIS 501 H HIS 501 1.857 0.026 2.502 2 HA HIS 501 HA HIS 501 1.423 0.620 0.313 3 HB2 HIS 501 HB2 HIS 501 4.376 -0.074 0.167 4 HB3 HIS 501 HB3 HIS 501 3.506 0.832 -1.057 5 HD1 HIS 501 HD1 HIS 501 4.013 3.253 -0.868 6 HD2 HIS 501 HD2 HIS 501 3.962 1.364 2.824 7 HE1 HIS 501 HE1 HIS 501 4.546 5.041 0.833 8 H ALA 502 H ALA 502 2.594 -2.326 1.033 9 HA ALA 502 HA ALA 502 2.649 -3.593 -1.539 10 HB1 ALA 502 HB1 ALA 502 2.856 -5.689 -0.309 11 HB2 ALA 502 HB2 ALA 502 2.418 -4.845 1.186 12 HB3 ALA 502 HB3 ALA 502 3.914 -4.440 0.358 13 H GLY 503 H GLY 503 0.118 -3.133 0.850 14 HA2 GLY 503 HA2 GLY 503 -2.081 -3.088 -0.405 15 HA3 GLY 503 HA3 GLY 503 -1.654 -4.738 -0.839 16 H ILE 504 H ILE 504 -3.344 -5.756 0.245 17 HA ILE 504 HA ILE 504 -3.373 -5.334 3.135 18 HB ILE 504 HB ILE 504 -5.704 -6.029 1.318 19 HG12 ILE 504 HG12 ILE 504 -6.654 -3.832 2.340 20 HG13 ILE 504 HG13 ILE 504 -4.969 -3.476 2.707 21 HG21 ILE 504 HG21 ILE 504 -7.125 -5.848 3.246 22 HG22 ILE 504 HG22 ILE 504 -5.696 -5.646 4.268 23 HG23 ILE 504 HG23 ILE 504 -5.947 -7.158 3.378 24 HD11 ILE 504 HD11 ILE 504 -6.112 -3.971 -0.041 25 HD12 ILE 504 HD12 ILE 504 -4.427 -3.627 0.330 26 HD13 ILE 504 HD13 ILE 504 -5.661 -2.403 0.641 27 H PHE 505 H PHE 505 -2.340 -7.091 3.935 28 HA PHE 505 HA PHE 505 -3.068 -9.772 2.988 29 HB2 PHE 505 HB2 PHE 505 -1.075 -8.751 4.987 30 HB3 PHE 505 HB3 PHE 505 -1.720 -10.365 5.216 31 HD1 PHE 505 HD2 PHE 505 -1.582 -11.912 3.124 32 HD2 PHE 505 HD1 PHE 505 0.822 -8.466 3.726 33 HE1 PHE 505 HE2 PHE 505 0.098 -12.825 1.585 34 HE2 PHE 505 HE1 PHE 505 2.515 -9.376 2.193 35 HZ PHE 505 HZ PHE 505 2.150 -11.559 1.121 36 H THR 506 H THR 506 -4.648 -10.949 3.919 37 HA THR 506 HA THR 506 -5.386 -10.615 6.605 38 HB THR 506 HB THR 506 -6.419 -8.521 5.702 39 HG1 THR 506 HG1 THR 506 -7.712 -9.023 7.309 40 HG21 THR 506 HG21 THR 506 -6.884 -9.287 3.412 41 HG22 THR 506 HG22 THR 506 -8.355 -8.677 4.175 42 HG23 THR 506 HG23 THR 506 -8.088 -10.416 4.034 43 H PHE 507 H PHE 507 -7.473 -11.830 6.973 44 HA PHE 507 HA PHE 507 -7.260 -14.369 5.670 45 HB2 PHE 507 HB2 PHE 507 -8.943 -13.263 7.885 46 HB3 PHE 507 HB3 PHE 507 -9.278 -14.858 7.199 47 HD1 PHE 507 HD1 PHE 507 -7.571 -16.587 7.353 48 HD2 PHE 507 HD2 PHE 507 -7.181 -12.892 9.381 49 HE1 PHE 507 HE1 PHE 507 -5.955 -17.615 8.848 50 HE2 PHE 507 HE2 PHE 507 -5.527 -13.892 10.904 51 HZ PHE 507 HZ PHE 507 -4.905 -16.255 10.649 52 H GLU 508 H GLU 508 -8.862 -15.378 4.424 53 HA GLU 508 HA GLU 508 -10.238 -13.734 2.621 54 HB2 GLU 508 HB2 GLU 508 -9.357 -16.057 2.244 55 HB3 GLU 508 HB3 GLU 508 -10.699 -16.654 3.204 56 HG2 GLU 508 HG2 GLU 508 -12.256 -15.675 1.587 57 HG3 GLU 508 HG3 GLU 508 -10.846 -15.136 0.654 58 H GLU 509 H GLU 509 -11.148 -15.302 5.586 59 HA GLU 509 HA GLU 509 -13.687 -13.921 5.543 60 HB2 GLU 509 HB2 GLU 509 -14.745 -15.943 6.593 61 HB3 GLU 509 HB3 GLU 509 -14.308 -16.183 4.917 62 HG2 GLU 509 HG2 GLU 509 -12.139 -17.226 5.889 63 HG3 GLU 509 HG3 GLU 509 -13.055 -17.280 7.394 64 HA PRO 510 HA PRO 510 -12.049 -12.777 9.493 65 HB2 PRO 510 HB2 PRO 510 -14.285 -11.794 10.667 66 HB3 PRO 510 HB3 PRO 510 -13.440 -10.939 9.374 67 HG2 PRO 510 HG2 PRO 510 -15.901 -12.635 9.231 68 HG3 PRO 510 HG3 PRO 510 -15.554 -11.098 8.415 69 HD2 PRO 510 HD2 PRO 510 -15.316 -13.550 7.179 70 HD3 PRO 510 HD3 PRO 510 -14.345 -12.125 6.741 71 H VAL 511 H VAL 511 -14.809 -14.920 9.272 72 HA VAL 511 HA VAL 511 -14.029 -16.211 11.776 73 HB VAL 511 HB VAL 511 -16.934 -15.614 11.034 74 HG11 VAL 511 HG11 VAL 511 -15.808 -16.854 13.530 75 HG12 VAL 511 HG12 VAL 511 -16.611 -17.713 12.228 76 HG13 VAL 511 HG13 VAL 511 -17.512 -16.538 13.194 77 HG21 VAL 511 HG21 VAL 511 -15.808 -13.574 11.797 78 HG22 VAL 511 HG22 VAL 511 -15.310 -14.406 13.274 79 HG23 VAL 511 HG23 VAL 511 -17.019 -14.124 12.952 80 H THR 512 H THR 512 -14.186 -18.427 11.583 81 HA THR 512 HA THR 512 -15.538 -19.381 9.197 82 HB THR 512 HB THR 512 -13.027 -19.187 8.837 83 HG1 THR 512 HG1 THR 512 -14.091 -20.409 7.576 84 HG21 THR 512 HG21 THR 512 -12.951 -21.517 10.760 85 HG22 THR 512 HG22 THR 512 -12.279 -19.918 11.062 86 HG23 THR 512 HG23 THR 512 -11.590 -20.939 9.795 87 H HIS 513 H HIS 513 -16.610 -21.306 9.471 88 HA HIS 513 HA HIS 513 -16.516 -22.412 12.174 89 HB2 HIS 513 HB2 HIS 513 -18.785 -23.275 11.845 90 HB3 HIS 513 HB3 HIS 513 -18.770 -21.554 11.517 91 HD1 HIS 513 HD1 HIS 513 -20.118 -24.608 10.209 92 HD2 HIS 513 HD2 HIS 513 -18.598 -21.119 8.539 93 HE1 HIS 513 HE1 HIS 513 -21.017 -24.509 7.866 94 H VAL 514 H VAL 514 -15.865 -24.441 12.435 95 HA VAL 514 HA VAL 514 -15.383 -25.962 9.986 96 HB VAL 514 HB VAL 514 -13.344 -26.891 10.956 97 HG11 VAL 514 HG11 VAL 514 -13.410 -23.885 11.061 98 HG12 VAL 514 HG12 VAL 514 -13.052 -24.886 9.656 99 HG13 VAL 514 HG13 VAL 514 -11.934 -24.836 11.020 100 HG21 VAL 514 HG21 VAL 514 -12.404 -26.043 13.072 101 HG22 VAL 514 HG22 VAL 514 -13.955 -26.844 13.330 102 HG23 VAL 514 HG23 VAL 514 -13.861 -25.084 13.329 103 H SER 515 H SER 515 -15.602 -28.217 10.172 104 HA SER 515 HA SER 515 -17.669 -28.958 12.013 105 HB2 SER 515 HB2 SER 515 -17.503 -29.659 9.547 106 HB3 SER 515 HB3 SER 515 -16.235 -30.736 10.069 107 HG SER 515 HG SER 515 -18.348 -31.708 9.994 108 H GLU 516 H GLU 516 -17.535 -31.009 13.100 109 HA GLU 516 HA GLU 516 -15.084 -31.379 14.591 110 HB2 GLU 516 HB2 GLU 516 -17.498 -31.194 15.529 111 HB3 GLU 516 HB3 GLU 516 -17.778 -32.764 14.838 112 HG2 GLU 516 HG2 GLU 516 -15.691 -32.229 16.948 113 HG3 GLU 516 HG3 GLU 516 -17.345 -32.700 17.300 114 H SER 517 H SER 517 -16.574 -32.476 11.781 115 HA SER 517 HA SER 517 -15.114 -35.020 11.856 116 HB2 SER 517 HB2 SER 517 -17.694 -34.372 10.415 117 HB3 SER 517 HB3 SER 517 -16.896 -35.948 10.459 118 HG SER 517 HG SER 517 -17.084 -35.758 12.795 119 H ILE 518 H ILE 518 -14.253 -32.290 10.914 120 HA ILE 518 HA ILE 518 -14.197 -32.571 8.017 121 HB ILE 518 HB ILE 518 -14.612 -30.323 8.912 122 HG12 ILE 518 HG12 ILE 518 -11.945 -30.574 7.513 123 HG13 ILE 518 HG13 ILE 518 -13.525 -30.457 6.746 124 HG21 ILE 518 HG21 ILE 518 -11.876 -30.526 10.133 125 HG22 ILE 518 HG22 ILE 518 -13.433 -30.449 10.992 126 HG23 ILE 518 HG23 ILE 518 -12.869 -29.061 10.068 127 HD11 ILE 518 HD11 ILE 518 -12.339 -28.358 6.617 128 HD12 ILE 518 HD12 ILE 518 -12.167 -28.348 8.376 129 HD13 ILE 518 HD13 ILE 518 -13.765 -28.190 7.654 130 H GLY 519 H GLY 519 -12.015 -32.924 10.742 131 HA2 GLY 519 HA2 GLY 519 -10.006 -34.130 10.707 132 HA3 GLY 519 HA3 GLY 519 -10.045 -34.067 8.950 133 H ILE 520 H ILE 520 -9.646 -32.014 7.965 134 HA ILE 520 HA ILE 520 -7.725 -30.411 9.523 135 HB ILE 520 HB ILE 520 -7.462 -31.293 6.658 136 HG12 ILE 520 HG12 ILE 520 -6.874 -33.100 8.234 137 HG13 ILE 520 HG13 ILE 520 -5.477 -32.566 7.308 138 HG21 ILE 520 HG21 ILE 520 -6.594 -29.064 6.880 139 HG22 ILE 520 HG22 ILE 520 -5.233 -30.171 6.694 140 HG23 ILE 520 HG23 ILE 520 -5.640 -29.525 8.286 141 HD11 ILE 520 HD11 ILE 520 -4.726 -31.265 9.253 142 HD12 ILE 520 HD12 ILE 520 -4.884 -32.985 9.606 143 HD13 ILE 520 HD13 ILE 520 -6.118 -31.856 10.163 144 H MET 521 H MET 521 -8.297 -28.373 9.492 145 HA MET 521 HA MET 521 -10.086 -27.532 7.348 146 HB2 MET 521 HB2 MET 521 -10.896 -25.786 8.759 147 HB3 MET 521 HB3 MET 521 -10.869 -27.246 9.719 148 HG2 MET 521 HG2 MET 521 -10.067 -25.666 11.210 149 HG3 MET 521 HG3 MET 521 -8.592 -26.335 10.529 150 HE1 MET 521 HE1 MET 521 -9.282 -23.427 11.971 151 HE2 MET 521 HE2 MET 521 -8.136 -22.375 11.127 152 HE3 MET 521 HE3 MET 521 -7.616 -23.957 11.715 153 H GLU 522 H GLU 522 -9.678 -25.586 6.231 154 HA GLU 522 HA GLU 522 -6.992 -24.534 6.446 155 HB2 GLU 522 HB2 GLU 522 -8.296 -25.679 4.018 156 HB3 GLU 522 HB3 GLU 522 -7.148 -24.360 3.861 157 HG2 GLU 522 HG2 GLU 522 -5.446 -25.672 4.889 158 HG3 GLU 522 HG3 GLU 522 -6.571 -27.006 5.170 159 H VAL 523 H VAL 523 -6.960 -22.494 6.422 160 HA VAL 523 HA VAL 523 -9.335 -21.010 5.543 161 HB VAL 523 HB VAL 523 -7.203 -20.123 7.502 162 HG11 VAL 523 HG11 VAL 523 -8.394 -18.319 6.299 163 HG12 VAL 523 HG12 VAL 523 -8.675 -18.338 8.036 164 HG13 VAL 523 HG13 VAL 523 -9.922 -18.947 6.947 165 HG21 VAL 523 HG21 VAL 523 -8.777 -20.572 9.258 166 HG22 VAL 523 HG22 VAL 523 -8.513 -22.044 8.325 167 HG23 VAL 523 HG23 VAL 523 -9.985 -21.101 8.089 168 H LYS 524 H LYS 524 -9.056 -19.731 3.882 169 HA LYS 524 HA LYS 524 -6.562 -19.602 2.466 170 HB2 LYS 524 HB2 LYS 524 -9.266 -18.328 1.925 171 HB3 LYS 524 HB3 LYS 524 -7.897 -18.411 0.829 172 HG2 LYS 524 HG2 LYS 524 -8.944 -20.921 1.976 173 HG3 LYS 524 HG3 LYS 524 -9.841 -20.113 0.688 174 HD2 LYS 524 HD2 LYS 524 -6.939 -20.351 0.291 175 HD3 LYS 524 HD3 LYS 524 -7.856 -21.857 0.253 176 HE2 LYS 524 HE2 LYS 524 -7.594 -20.789 -1.929 177 HE3 LYS 524 HE3 LYS 524 -9.278 -21.050 -1.411 178 HZ1 LYS 524 HZ1 LYS 524 -9.015 -18.968 -2.523 179 HZ2 LYS 524 HZ2 LYS 524 -7.821 -18.423 -1.528 180 HZ3 LYS 524 HZ3 LYS 524 -9.405 -18.603 -0.937 181 H VAL 525 H VAL 525 -5.161 -17.974 2.543 182 HA VAL 525 HA VAL 525 -5.955 -15.516 3.952 183 HB VAL 525 HB VAL 525 -3.141 -16.582 3.578 184 HG11 VAL 525 HG11 VAL 525 -4.171 -14.290 5.258 185 HG12 VAL 525 HG12 VAL 525 -3.242 -14.119 3.770 186 HG13 VAL 525 HG13 VAL 525 -2.494 -14.837 5.201 187 HG21 VAL 525 HG21 VAL 525 -4.889 -16.571 6.027 188 HG22 VAL 525 HG22 VAL 525 -3.197 -17.066 5.975 189 HG23 VAL 525 HG23 VAL 525 -4.412 -17.984 5.091 190 H LEU 526 H LEU 526 -5.966 -13.715 2.895 191 HA LEU 526 HA LEU 526 -5.638 -13.789 0.056 192 HB2 LEU 526 HB2 LEU 526 -6.559 -11.635 1.939 193 HB3 LEU 526 HB3 LEU 526 -6.571 -11.488 0.197 194 HG LEU 526 HG LEU 526 -8.192 -13.547 1.741 195 HD11 LEU 526 HD11 LEU 526 -9.010 -10.939 0.501 196 HD12 LEU 526 HD12 LEU 526 -8.977 -11.322 2.226 197 HD13 LEU 526 HD13 LEU 526 -10.099 -12.159 1.156 198 HD21 LEU 526 HD21 LEU 526 -8.229 -12.720 -1.162 199 HD22 LEU 526 HD22 LEU 526 -9.338 -13.850 -0.391 200 HD23 LEU 526 HD23 LEU 526 -7.630 -14.253 -0.528 201 H ARG 527 H ARG 527 -4.065 -13.058 -1.057 202 HA ARG 527 HA ARG 527 -1.624 -12.011 0.046 203 HB2 ARG 527 HB2 ARG 527 -1.644 -13.587 -1.852 204 HB3 ARG 527 HB3 ARG 527 -2.569 -12.453 -2.804 205 HG2 ARG 527 HG2 ARG 527 -0.246 -12.541 -3.547 206 HG3 ARG 527 HG3 ARG 527 -0.622 -10.948 -2.900 207 HD2 ARG 527 HD2 ARG 527 0.577 -11.392 -0.896 208 HD3 ARG 527 HD3 ARG 527 0.709 -13.105 -1.272 209 HE ARG 527 HE ARG 527 2.144 -12.403 -3.188 210 HH11 ARG 527 HH11 ARG 527 1.958 -10.082 -0.516 211 HH12 ARG 527 HH12 ARG 527 3.598 -9.649 -0.564 212 HH21 ARG 527 HH21 ARG 527 4.371 -11.744 -3.300 213 HH22 ARG 527 HH22 ARG 527 5.060 -10.631 -2.229 214 H THR 528 H THR 528 -0.747 -9.942 -0.450 215 HA THR 528 HA THR 528 -2.411 -7.768 -0.358 216 HB THR 528 HB THR 528 -0.259 -6.592 -1.149 217 HG1 THR 528 HG1 THR 528 1.098 -7.940 -1.917 218 HG21 THR 528 HG21 THR 528 -0.265 -8.300 1.337 219 HG22 THR 528 HG22 THR 528 -0.972 -6.688 1.181 220 HG23 THR 528 HG23 THR 528 0.773 -6.903 1.055 221 H SER 529 H SER 529 -3.099 -6.332 -1.858 222 HA SER 529 HA SER 529 -3.756 -7.021 -4.395 223 HB2 SER 529 HB2 SER 529 -4.759 -5.192 -3.056 224 HB3 SER 529 HB3 SER 529 -3.312 -4.233 -3.283 225 HG SER 529 HG SER 529 -4.697 -5.250 -5.498 226 H GLY 530 H GLY 530 -0.751 -5.586 -3.214 227 HA2 GLY 530 HA2 GLY 530 0.315 -5.741 -5.929 228 HA3 GLY 530 HA3 GLY 530 0.971 -4.738 -4.631 229 H ALA 531 H ALA 531 0.909 -7.883 -6.009 230 HA ALA 531 HA ALA 531 2.316 -9.006 -3.745 231 HB1 ALA 531 HB1 ALA 531 1.720 -10.247 -6.442 232 HB2 ALA 531 HB2 ALA 531 0.750 -10.449 -4.983 233 HB3 ALA 531 HB3 ALA 531 2.398 -11.076 -5.044 234 H ARG 532 H ARG 532 4.238 -8.112 -3.534 235 HA ARG 532 HA ARG 532 5.994 -8.132 -5.877 236 HB2 ARG 532 HB2 ARG 532 6.066 -6.242 -3.514 237 HB3 ARG 532 HB3 ARG 532 7.166 -6.215 -4.882 238 HG2 ARG 532 HG2 ARG 532 4.196 -5.715 -5.012 239 HG3 ARG 532 HG3 ARG 532 5.453 -4.477 -5.048 240 HD2 ARG 532 HD2 ARG 532 6.269 -5.251 -7.138 241 HD3 ARG 532 HD3 ARG 532 5.293 -6.716 -7.062 242 HE ARG 532 HE ARG 532 3.919 -4.155 -7.102 243 HH11 ARG 532 HH11 ARG 532 4.934 -7.018 -8.918 244 HH12 ARG 532 HH12 ARG 532 3.734 -6.855 -10.108 245 HH21 ARG 532 HH21 ARG 532 2.278 -3.945 -8.727 246 HH22 ARG 532 HH22 ARG 532 2.146 -5.077 -9.978 247 H GLY 533 H GLY 533 7.380 -9.711 -5.722 248 HA2 GLY 533 HA2 GLY 533 9.205 -10.843 -4.973 249 HA3 GLY 533 HA3 GLY 533 9.294 -9.709 -3.638 250 H ASN 534 H ASN 534 10.048 -11.722 -2.652 251 HA ASN 534 HA ASN 534 7.981 -13.600 -1.881 252 HB2 ASN 534 HB2 ASN 534 10.153 -14.490 -2.584 253 HB3 ASN 534 HB3 ASN 534 10.953 -13.549 -1.337 254 HD21 ASN 534 HD21 ASN 534 7.897 -15.286 -0.833 255 HD22 ASN 534 HD22 ASN 534 8.589 -16.407 0.267 256 H VAL 535 H VAL 535 6.953 -13.475 -0.036 257 HA VAL 535 HA VAL 535 7.978 -11.782 2.113 258 HB VAL 535 HB VAL 535 5.138 -11.824 1.031 259 HG11 VAL 535 HG11 VAL 535 5.114 -11.476 3.403 260 HG12 VAL 535 HG12 VAL 535 4.750 -9.938 2.593 261 HG13 VAL 535 HG13 VAL 535 6.344 -10.226 3.267 262 HG21 VAL 535 HG21 VAL 535 7.228 -9.676 0.892 263 HG22 VAL 535 HG22 VAL 535 5.546 -9.495 0.354 264 HG23 VAL 535 HG23 VAL 535 6.630 -10.653 -0.445 265 H ILE 536 H ILE 536 7.702 -12.741 4.061 266 HA ILE 536 HA ILE 536 6.212 -15.267 4.089 267 HB ILE 536 HB ILE 536 8.482 -14.356 5.870 268 HG12 ILE 536 HG12 ILE 536 9.262 -15.128 3.680 269 HG13 ILE 536 HG13 ILE 536 9.691 -16.303 4.918 270 HG21 ILE 536 HG21 ILE 536 6.877 -15.578 7.174 271 HG22 ILE 536 HG22 ILE 536 8.311 -16.596 6.927 272 HG23 ILE 536 HG23 ILE 536 6.840 -16.864 5.978 273 HD11 ILE 536 HD11 ILE 536 7.686 -17.624 4.207 274 HD12 ILE 536 HD12 ILE 536 8.950 -17.475 2.993 275 HD13 ILE 536 HD13 ILE 536 7.500 -16.495 2.863 276 H VAL 537 H VAL 537 4.514 -15.490 5.387 277 HA VAL 537 HA VAL 537 4.077 -13.378 7.339 278 HB VAL 537 HB VAL 537 1.919 -14.869 5.816 279 HG11 VAL 537 HG11 VAL 537 0.375 -13.232 6.792 280 HG12 VAL 537 HG12 VAL 537 1.710 -12.519 7.694 281 HG13 VAL 537 HG13 VAL 537 1.194 -14.171 8.043 282 HG21 VAL 537 HG21 VAL 537 1.534 -12.746 4.641 283 HG22 VAL 537 HG22 VAL 537 3.180 -13.361 4.390 284 HG23 VAL 537 HG23 VAL 537 2.898 -12.051 5.528 285 HA PRO 538 HA PRO 538 4.148 -17.105 9.951 286 HB2 PRO 538 HB2 PRO 538 4.349 -15.790 12.289 287 HB3 PRO 538 HB3 PRO 538 5.729 -16.048 11.214 288 HG2 PRO 538 HG2 PRO 538 4.048 -13.610 11.594 289 HG3 PRO 538 HG3 PRO 538 5.801 -13.732 11.389 290 HD2 PRO 538 HD2 PRO 538 4.094 -13.040 9.379 291 HD3 PRO 538 HD3 PRO 538 5.648 -13.850 9.107 292 H TYR 539 H TYR 539 2.717 -18.010 11.495 293 HA TYR 539 HA TYR 539 0.437 -16.451 12.357 294 HB2 TYR 539 HB2 TYR 539 -1.244 -17.988 11.481 295 HB3 TYR 539 HB3 TYR 539 -0.271 -17.321 10.177 296 HD1 TYR 539 HD2 TYR 539 -0.984 -20.384 12.117 297 HD2 TYR 539 HD1 TYR 539 1.060 -18.702 8.796 298 HE1 TYR 539 HE2 TYR 539 -0.567 -22.638 11.243 299 HE2 TYR 539 HE1 TYR 539 1.473 -20.953 7.913 300 HH TYR 539 HH TYR 539 1.636 -23.194 8.714 301 H LYS 540 H LYS 540 -0.897 -17.620 13.857 302 HA LYS 540 HA LYS 540 0.113 -20.080 14.995 303 HB2 LYS 540 HB2 LYS 540 0.451 -19.229 17.241 304 HB3 LYS 540 HB3 LYS 540 1.533 -18.408 16.125 305 HG2 LYS 540 HG2 LYS 540 0.143 -16.464 16.129 306 HG3 LYS 540 HG3 LYS 540 -1.074 -17.290 17.097 307 HD2 LYS 540 HD2 LYS 540 0.575 -17.505 18.921 308 HD3 LYS 540 HD3 LYS 540 1.731 -16.588 17.947 309 HE2 LYS 540 HE2 LYS 540 -0.986 -15.638 18.700 310 HE3 LYS 540 HE3 LYS 540 0.469 -15.224 19.628 311 HZ1 LYS 540 HZ1 LYS 540 0.056 -14.602 16.744 312 HZ2 LYS 540 HZ2 LYS 540 1.314 -14.045 17.700 313 HZ3 LYS 540 HZ3 LYS 540 -0.256 -13.501 17.948 314 H THR 541 H THR 541 -1.405 -21.123 16.288 315 HA THR 541 HA THR 541 -4.110 -20.174 16.107 316 HB THR 541 HB THR 541 -4.496 -22.251 17.513 317 HG1 THR 541 HG1 THR 541 -2.287 -22.279 18.255 318 HG21 THR 541 HG21 THR 541 -4.152 -23.795 15.628 319 HG22 THR 541 HG22 THR 541 -3.095 -22.608 14.856 320 HG23 THR 541 HG23 THR 541 -4.808 -22.250 15.089 321 H ILE 542 H ILE 542 -5.205 -19.209 17.720 322 HA ILE 542 HA ILE 542 -3.800 -18.705 20.238 323 HB ILE 542 HB ILE 542 -6.160 -17.352 18.935 324 HG12 ILE 542 HG12 ILE 542 -3.360 -16.296 19.352 325 HG13 ILE 542 HG13 ILE 542 -3.966 -16.961 17.835 326 HG21 ILE 542 HG21 ILE 542 -5.941 -15.636 20.714 327 HG22 ILE 542 HG22 ILE 542 -4.696 -16.621 21.482 328 HG23 ILE 542 HG23 ILE 542 -6.345 -17.226 21.365 329 HD11 ILE 542 HD11 ILE 542 -5.587 -15.198 17.679 330 HD12 ILE 542 HD12 ILE 542 -3.966 -14.518 17.886 331 HD13 ILE 542 HD13 ILE 542 -5.090 -14.563 19.248 332 H GLU 543 H GLU 543 -4.501 -19.926 21.896 333 HA GLU 543 HA GLU 543 -6.868 -21.521 21.628 334 HB2 GLU 543 HB2 GLU 543 -4.914 -21.197 23.918 335 HB3 GLU 543 HB3 GLU 543 -6.267 -22.319 23.938 336 HG2 GLU 543 HG2 GLU 543 -5.338 -23.488 22.007 337 HG3 GLU 543 HG3 GLU 543 -3.981 -22.364 21.973 338 H GLY 544 H GLY 544 -8.774 -21.300 22.675 339 HA2 GLY 544 HA2 GLY 544 -9.170 -18.905 24.330 340 HA3 GLY 544 HA3 GLY 544 -10.164 -19.110 22.889 341 H THR 545 H THR 545 -11.991 -20.357 23.016 342 HA THR 545 HA THR 545 -12.463 -21.629 25.568 343 HB THR 545 HB THR 545 -14.786 -22.005 24.596 344 HG1 THR 545 HG1 THR 545 -15.198 -20.550 22.789 345 HG21 THR 545 HG21 THR 545 -15.452 -19.658 24.858 346 HG22 THR 545 HG22 THR 545 -13.762 -19.172 24.700 347 HG23 THR 545 HG23 THR 545 -14.276 -20.138 26.086 348 H ALA 546 H ALA 546 -11.242 -22.321 22.621 349 HA ALA 546 HA ALA 546 -11.636 -25.186 22.989 350 HB1 ALA 546 HB1 ALA 546 -12.343 -24.387 20.771 351 HB2 ALA 546 HB2 ALA 546 -10.905 -25.396 20.624 352 HB3 ALA 546 HB3 ALA 546 -10.764 -23.642 20.531 353 H ARG 547 H ARG 547 -9.760 -26.377 23.377 354 HA ARG 547 HA ARG 547 -7.346 -24.770 23.734 355 HB2 ARG 547 HB2 ARG 547 -8.396 -27.148 25.167 356 HB3 ARG 547 HB3 ARG 547 -6.703 -26.690 25.274 357 HG2 ARG 547 HG2 ARG 547 -7.129 -24.844 26.505 358 HG3 ARG 547 HG3 ARG 547 -8.666 -24.534 25.694 359 HD2 ARG 547 HD2 ARG 547 -8.144 -26.700 27.684 360 HD3 ARG 547 HD3 ARG 547 -8.966 -25.166 28.032 361 HE ARG 547 HE ARG 547 -9.920 -27.419 26.490 362 HH11 ARG 547 HH11 ARG 547 -10.610 -24.219 27.862 363 HH12 ARG 547 HH12 ARG 547 -12.198 -24.122 27.268 364 HH21 ARG 547 HH21 ARG 547 -12.059 -27.261 25.601 365 HH22 ARG 547 HH22 ARG 547 -13.049 -25.883 25.891 366 H GLY 548 H GLY 548 -5.347 -25.587 23.271 367 HA2 GLY 548 HA2 GLY 548 -5.315 -27.307 20.923 368 HA3 GLY 548 HA3 GLY 548 -4.004 -26.284 21.510 369 H GLY 549 H GLY 549 -2.436 -27.887 21.487 370 HA2 GLY 549 HA2 GLY 549 -1.212 -29.598 22.354 371 HA3 GLY 549 HA3 GLY 549 -2.212 -29.473 23.794 372 H GLY 550 H GLY 550 -3.506 -30.114 20.655 373 HA2 GLY 550 HA2 GLY 550 -4.513 -31.971 19.747 374 HA3 GLY 550 HA3 GLY 550 -3.637 -32.932 20.918 375 H GLU 551 H GLU 551 -5.683 -30.365 22.120 376 HA GLU 551 HA GLU 551 -7.334 -32.396 23.374 377 HB2 GLU 551 HB2 GLU 551 -6.417 -30.497 24.709 378 HB3 GLU 551 HB3 GLU 551 -7.438 -29.406 23.793 379 HG2 GLU 551 HG2 GLU 551 -9.421 -30.515 24.596 380 HG3 GLU 551 HG3 GLU 551 -8.436 -31.684 25.479 381 H ASP 552 H ASP 552 -8.353 -29.218 22.144 382 HA ASP 552 HA ASP 552 -10.690 -30.554 20.990 383 HB2 ASP 552 HB2 ASP 552 -10.122 -27.589 21.313 384 HB3 ASP 552 HB3 ASP 552 -11.604 -28.268 20.658 385 H PHE 553 H PHE 553 -7.910 -28.671 20.221 386 HA PHE 553 HA PHE 553 -8.113 -29.626 17.514 387 HB2 PHE 553 HB2 PHE 553 -7.661 -27.460 16.503 388 HB3 PHE 553 HB3 PHE 553 -9.126 -27.346 17.461 389 HD1 PHE 553 HD1 PHE 553 -9.040 -26.164 19.671 390 HD2 PHE 553 HD2 PHE 553 -5.796 -26.104 16.933 391 HE1 PHE 553 HE1 PHE 553 -8.103 -24.204 20.821 392 HE2 PHE 553 HE2 PHE 553 -4.854 -24.159 18.081 393 HZ PHE 553 HZ PHE 553 -6.004 -23.199 20.022 394 H GLU 554 H GLU 554 -6.080 -29.488 16.449 395 HA GLU 554 HA GLU 554 -3.870 -29.811 18.270 396 HB2 GLU 554 HB2 GLU 554 -4.637 -31.221 16.163 397 HB3 GLU 554 HB3 GLU 554 -3.825 -29.955 15.273 398 HG2 GLU 554 HG2 GLU 554 -2.518 -31.590 17.387 399 HG3 GLU 554 HG3 GLU 554 -2.533 -32.064 15.701 400 H ASP 555 H ASP 555 -2.827 -27.969 18.774 401 HA ASP 555 HA ASP 555 -3.353 -25.589 17.259 402 HB2 ASP 555 HB2 ASP 555 -2.276 -24.322 18.996 403 HB3 ASP 555 HB3 ASP 555 -3.318 -25.506 19.753 404 H THR 556 H THR 556 -2.080 -24.528 15.956 405 HA THR 556 HA THR 556 0.479 -25.792 15.389 406 HB THR 556 HB THR 556 -1.291 -26.695 13.887 407 HG1 THR 556 HG1 THR 556 0.658 -26.696 13.034 408 HG21 THR 556 HG21 THR 556 -1.515 -23.846 12.895 409 HG22 THR 556 HG22 THR 556 -2.754 -24.732 13.775 410 HG23 THR 556 HG23 THR 556 -2.285 -25.251 12.158 411 H CYS 557 H CYS 557 1.860 -24.445 14.053 412 HA CYS 557 HA CYS 557 1.271 -21.651 13.811 413 HB2 CYS 557 HB2 CYS 557 3.364 -21.026 15.033 414 HB3 CYS 557 HB3 CYS 557 2.132 -21.704 16.087 415 HG CYS 557 HG CYS 557 4.914 -23.336 14.933 416 H GLY 558 H GLY 558 3.061 -20.634 12.493 417 HA2 GLY 558 HA2 GLY 558 5.192 -21.918 11.458 418 HA3 GLY 558 HA3 GLY 558 3.835 -22.461 10.476 419 H GLU 559 H GLU 559 5.117 -21.347 8.856 420 HA GLU 559 HA GLU 559 4.351 -18.524 8.695 421 HB2 GLU 559 HB2 GLU 559 6.988 -19.822 8.088 422 HB3 GLU 559 HB3 GLU 559 6.551 -18.235 7.460 423 HG2 GLU 559 HG2 GLU 559 6.538 -17.294 9.595 424 HG3 GLU 559 HG3 GLU 559 6.501 -18.865 10.386 425 H LEU 560 H LEU 560 3.533 -17.937 6.789 426 HA LEU 560 HA LEU 560 3.268 -20.014 4.734 427 HB2 LEU 560 HB2 LEU 560 1.691 -17.503 5.250 428 HB3 LEU 560 HB3 LEU 560 1.441 -18.560 3.877 429 HG LEU 560 HG LEU 560 1.043 -19.303 6.765 430 HD11 LEU 560 HD11 LEU 560 -0.642 -17.755 5.983 431 HD12 LEU 560 HD12 LEU 560 -1.319 -19.367 6.213 432 HD13 LEU 560 HD13 LEU 560 -0.964 -18.786 4.587 433 HD21 LEU 560 HD21 LEU 560 1.713 -21.264 5.581 434 HD22 LEU 560 HD22 LEU 560 0.704 -20.868 4.213 435 HD23 LEU 560 HD23 LEU 560 -0.046 -21.349 5.743 436 H GLU 561 H GLU 561 4.095 -19.731 2.787 437 HA GLU 561 HA GLU 561 5.787 -17.403 2.478 438 HB2 GLU 561 HB2 GLU 561 6.690 -19.704 2.257 439 HB3 GLU 561 HB3 GLU 561 5.657 -19.890 0.821 440 HG2 GLU 561 HG2 GLU 561 6.894 -17.885 -0.137 441 HG3 GLU 561 HG3 GLU 561 7.914 -17.977 1.256 442 H PHE 562 H PHE 562 5.083 -15.787 1.315 443 HA PHE 562 HA PHE 562 3.279 -16.352 -0.913 444 HB2 PHE 562 HB2 PHE 562 3.518 -13.898 0.825 445 HB3 PHE 562 HB3 PHE 562 2.578 -13.960 -0.659 446 HD1 PHE 562 HD1 PHE 562 0.573 -15.350 -0.779 447 HD2 PHE 562 HD2 PHE 562 2.729 -14.884 2.844 448 HE1 PHE 562 HE1 PHE 562 -1.395 -16.121 0.486 449 HE2 PHE 562 HE2 PHE 562 0.776 -15.659 4.117 450 HZ PHE 562 HZ PHE 562 -1.286 -16.275 2.942 451 H GLN 563 H GLN 563 3.710 -15.207 -2.824 452 HA GLN 563 HA GLN 563 6.253 -13.807 -2.965 453 HB2 GLN 563 HB2 GLN 563 5.565 -16.138 -4.766 454 HB3 GLN 563 HB3 GLN 563 6.982 -15.103 -4.868 455 HG2 GLN 563 HG2 GLN 563 7.718 -15.901 -2.665 456 HG3 GLN 563 HG3 GLN 563 6.352 -17.013 -2.637 457 HE21 GLN 563 HE21 GLN 563 9.361 -16.226 -4.109 458 HE22 GLN 563 HE22 GLN 563 9.640 -17.748 -4.832 459 H ASN 564 H ASN 564 6.384 -13.332 -5.631 460 HA ASN 564 HA ASN 564 3.943 -11.877 -6.021 461 HB2 ASN 564 HB2 ASN 564 4.957 -10.967 -8.094 462 HB3 ASN 564 HB3 ASN 564 6.003 -10.742 -6.706 463 HD21 ASN 564 HD21 ASN 564 5.588 -12.310 -9.786 464 HD22 ASN 564 HD22 ASN 564 7.185 -12.917 -9.890 465 H ASP 565 H ASP 565 5.438 -14.735 -7.105 466 HA ASP 565 HA ASP 565 3.409 -15.277 -9.088 467 HB2 ASP 565 HB2 ASP 565 5.704 -16.130 -9.387 468 HB3 ASP 565 HB3 ASP 565 5.508 -17.131 -7.952 469 H GLU 566 H GLU 566 3.982 -16.159 -5.713 470 HA GLU 566 HA GLU 566 1.845 -18.047 -5.652 471 HB2 GLU 566 HB2 GLU 566 3.576 -16.779 -3.572 472 HB3 GLU 566 HB3 GLU 566 2.196 -17.770 -3.140 473 HG2 GLU 566 HG2 GLU 566 4.600 -18.607 -4.732 474 HG3 GLU 566 HG3 GLU 566 4.216 -19.033 -3.059 475 H ILE 567 H ILE 567 -0.136 -17.798 -4.746 476 HA ILE 567 HA ILE 567 -0.988 -15.034 -4.368 477 HB ILE 567 HB ILE 567 -3.334 -16.029 -4.923 478 HG12 ILE 567 HG12 ILE 567 -1.663 -17.885 -6.620 479 HG13 ILE 567 HG13 ILE 567 -2.330 -18.419 -5.091 480 HG21 ILE 567 HG21 ILE 567 -3.011 -15.461 -7.298 481 HG22 ILE 567 HG22 ILE 567 -1.267 -15.431 -7.021 482 HG23 ILE 567 HG23 ILE 567 -2.312 -14.278 -6.194 483 HD11 ILE 567 HD11 ILE 567 -4.536 -17.968 -5.883 484 HD12 ILE 567 HD12 ILE 567 -3.697 -19.102 -6.950 485 HD13 ILE 567 HD13 ILE 567 -3.911 -17.408 -7.439 486 H VAL 568 H VAL 568 -2.513 -18.158 -3.487 487 HA VAL 568 HA VAL 568 -2.979 -16.886 -0.896 488 HB VAL 568 HB VAL 568 -5.017 -17.195 -2.241 489 HG11 VAL 568 HG11 VAL 568 -4.425 -20.120 -1.998 490 HG12 VAL 568 HG12 VAL 568 -4.558 -19.179 -3.499 491 HG13 VAL 568 HG13 VAL 568 -5.975 -19.442 -2.463 492 HG21 VAL 568 HG21 VAL 568 -5.233 -17.140 0.154 493 HG22 VAL 568 HG22 VAL 568 -4.912 -18.870 0.246 494 HG23 VAL 568 HG23 VAL 568 -6.388 -18.289 -0.523 495 H LYS 569 H LYS 569 -2.653 -17.997 0.922 496 HA LYS 569 HA LYS 569 -1.696 -20.744 0.711 497 HB2 LYS 569 HB2 LYS 569 -0.905 -18.529 2.564 498 HB3 LYS 569 HB3 LYS 569 -0.507 -20.221 2.851 499 HG2 LYS 569 HG2 LYS 569 0.177 -19.159 0.236 500 HG3 LYS 569 HG3 LYS 569 1.099 -18.467 1.577 501 HD2 LYS 569 HD2 LYS 569 2.319 -20.333 0.693 502 HD3 LYS 569 HD3 LYS 569 1.608 -20.840 2.204 503 HE2 LYS 569 HE2 LYS 569 1.380 -22.607 0.506 504 HE3 LYS 569 HE3 LYS 569 -0.195 -22.005 0.994 505 HZ1 LYS 569 HZ1 LYS 569 -0.334 -20.733 -1.082 506 HZ2 LYS 569 HZ2 LYS 569 0.047 -22.338 -1.429 507 HZ3 LYS 569 HZ3 LYS 569 1.250 -21.183 -1.476 508 H THR 570 H THR 570 -2.006 -21.852 2.858 509 HA THR 570 HA THR 570 -4.523 -21.044 4.124 510 HB THR 570 HB THR 570 -5.009 -23.620 4.166 511 HG1 THR 570 HG1 THR 570 -4.256 -24.755 2.522 512 HG21 THR 570 HG21 THR 570 -6.496 -21.997 3.132 513 HG22 THR 570 HG22 THR 570 -6.346 -23.437 2.137 514 HG23 THR 570 HG23 THR 570 -5.484 -21.956 1.682 515 H ILE 571 H ILE 571 -4.752 -21.571 6.209 516 HA ILE 571 HA ILE 571 -2.502 -22.843 7.552 517 HB ILE 571 HB ILE 571 -4.971 -21.493 8.729 518 HG12 ILE 571 HG12 ILE 571 -3.192 -19.962 9.758 519 HG13 ILE 571 HG13 ILE 571 -2.084 -20.696 8.608 520 HG21 ILE 571 HG21 ILE 571 -4.269 -23.359 10.115 521 HG22 ILE 571 HG22 ILE 571 -3.980 -21.817 10.926 522 HG23 ILE 571 HG23 ILE 571 -2.636 -22.701 10.198 523 HD11 ILE 571 HD11 ILE 571 -3.425 -19.854 6.779 524 HD12 ILE 571 HD12 ILE 571 -2.879 -18.557 7.842 525 HD13 ILE 571 HD13 ILE 571 -4.550 -19.125 7.929 526 H SER 572 H SER 572 -2.585 -24.943 7.869 527 HA SER 572 HA SER 572 -5.155 -26.358 7.672 528 HB2 SER 572 HB2 SER 572 -2.317 -27.420 7.624 529 HB3 SER 572 HB3 SER 572 -3.786 -28.335 7.275 530 HG SER 572 HG SER 572 -3.546 -26.039 5.850 531 H VAL 573 H VAL 573 -6.113 -26.783 9.546 532 HA VAL 573 HA VAL 573 -4.428 -27.357 11.909 533 HB VAL 573 HB VAL 573 -7.133 -25.967 11.896 534 HG11 VAL 573 HG11 VAL 573 -6.934 -27.397 13.861 535 HG12 VAL 573 HG12 VAL 573 -6.877 -25.689 14.294 536 HG13 VAL 573 HG13 VAL 573 -5.389 -26.637 14.266 537 HG21 VAL 573 HG21 VAL 573 -5.872 -24.064 12.873 538 HG22 VAL 573 HG22 VAL 573 -5.437 -24.469 11.216 539 HG23 VAL 573 HG23 VAL 573 -4.380 -24.955 12.544 540 H LYS 574 H LYS 574 -4.775 -29.252 12.887 541 HA LYS 574 HA LYS 574 -6.847 -30.994 11.879 542 HB2 LYS 574 HB2 LYS 574 -4.623 -31.927 12.202 543 HB3 LYS 574 HB3 LYS 574 -4.593 -31.399 13.870 544 HG2 LYS 574 HG2 LYS 574 -4.972 -33.786 13.753 545 HG3 LYS 574 HG3 LYS 574 -6.408 -32.984 14.386 546 HD2 LYS 574 HD2 LYS 574 -7.447 -33.113 12.162 547 HD3 LYS 574 HD3 LYS 574 -6.014 -33.932 11.544 548 HE2 LYS 574 HE2 LYS 574 -7.803 -34.941 13.748 549 HE3 LYS 574 HE3 LYS 574 -7.845 -35.488 12.074 550 HZ1 LYS 574 HZ1 LYS 574 -5.556 -36.278 12.350 551 HZ2 LYS 574 HZ2 LYS 574 -6.593 -37.017 13.443 552 HZ3 LYS 574 HZ3 LYS 574 -5.573 -35.806 13.969 553 H VAL 575 H VAL 575 -8.782 -30.897 12.750 554 HA VAL 575 HA VAL 575 -9.092 -29.846 15.435 555 HB VAL 575 HB VAL 575 -11.252 -30.883 13.554 556 HG11 VAL 575 HG11 VAL 575 -11.927 -30.750 15.914 557 HG12 VAL 575 HG12 VAL 575 -12.795 -29.575 14.928 558 HG13 VAL 575 HG13 VAL 575 -11.469 -29.049 15.947 559 HG21 VAL 575 HG21 VAL 575 -10.293 -28.043 13.928 560 HG22 VAL 575 HG22 VAL 575 -11.678 -28.539 12.953 561 HG23 VAL 575 HG23 VAL 575 -10.051 -29.040 12.495 562 H ILE 576 H ILE 576 -9.304 -31.123 17.178 563 HA ILE 576 HA ILE 576 -8.972 -34.035 16.868 564 HB ILE 576 HB ILE 576 -9.061 -32.356 19.392 565 HG12 ILE 576 HG12 ILE 576 -7.275 -31.484 17.971 566 HG13 ILE 576 HG13 ILE 576 -6.621 -32.303 19.378 567 HG21 ILE 576 HG21 ILE 576 -7.798 -34.210 20.398 568 HG22 ILE 576 HG22 ILE 576 -7.862 -35.077 18.866 569 HG23 ILE 576 HG23 ILE 576 -9.350 -34.750 19.753 570 HD11 ILE 576 HD11 ILE 576 -6.777 -33.396 16.583 571 HD12 ILE 576 HD12 ILE 576 -6.139 -34.248 17.992 572 HD13 ILE 576 HD13 ILE 576 -5.327 -32.797 17.400 573 H ASP 577 H ASP 577 -10.266 -35.513 17.881 574 HA ASP 577 HA ASP 577 -12.953 -34.950 17.461 575 HB2 ASP 577 HB2 ASP 577 -13.475 -37.129 18.193 576 HB3 ASP 577 HB3 ASP 577 -11.963 -37.233 17.336 577 H ASP 578 H ASP 578 -14.475 -34.376 18.581 578 HA ASP 578 HA ASP 578 -14.264 -32.393 20.342 579 HB2 ASP 578 HB2 ASP 578 -16.268 -32.809 19.152 580 HB3 ASP 578 HB3 ASP 578 -16.576 -34.276 20.074 581 H GLU 579 H GLU 579 -13.374 -32.191 22.229 582 HA GLU 579 HA GLU 579 -13.568 -34.149 24.298 583 HB2 GLU 579 HB2 GLU 579 -12.405 -31.391 24.135 584 HB3 GLU 579 HB3 GLU 579 -12.550 -32.224 25.680 585 HG2 GLU 579 HG2 GLU 579 -11.077 -33.284 23.282 586 HG3 GLU 579 HG3 GLU 579 -10.330 -32.464 24.653 587 H GLU 580 H GLU 580 -14.665 -33.956 26.218 588 HA GLU 580 HA GLU 580 -17.345 -33.176 25.767 589 HB2 GLU 580 HB2 GLU 580 -16.057 -34.329 28.219 590 HB3 GLU 580 HB3 GLU 580 -17.785 -34.159 27.972 591 HG2 GLU 580 HG2 GLU 580 -17.644 -35.647 26.023 592 HG3 GLU 580 HG3 GLU 580 -15.915 -35.832 26.314 593 H TYR 581 H TYR 581 -14.859 -31.314 27.038 594 HA TYR 581 HA TYR 581 -16.239 -29.978 29.112 595 HB2 TYR 581 HB2 TYR 581 -13.919 -29.025 27.433 596 HB3 TYR 581 HB3 TYR 581 -14.525 -28.179 28.852 597 HD1 TYR 581 HD1 TYR 581 -14.243 -29.109 31.073 598 HD2 TYR 581 HD2 TYR 581 -12.648 -31.091 27.667 599 HE1 TYR 581 HE1 TYR 581 -12.855 -30.499 32.536 600 HE2 TYR 581 HE2 TYR 581 -11.250 -32.484 29.128 601 HH TYR 581 HH TYR 581 -10.336 -32.440 31.311 602 H GLU 582 H GLU 582 -15.500 -28.671 25.899 603 HA GLU 582 HA GLU 582 -18.013 -27.139 26.084 604 HB2 GLU 582 HB2 GLU 582 -15.462 -26.511 24.576 605 HB3 GLU 582 HB3 GLU 582 -16.949 -25.584 24.419 606 HG2 GLU 582 HG2 GLU 582 -15.244 -25.887 26.882 607 HG3 GLU 582 HG3 GLU 582 -15.322 -24.475 25.832 608 H LYS 583 H LYS 583 -19.368 -27.260 24.277 609 HA LYS 583 HA LYS 583 -18.817 -29.497 22.496 610 HB2 LYS 583 HB2 LYS 583 -21.041 -29.346 23.532 611 HB3 LYS 583 HB3 LYS 583 -21.289 -27.769 22.796 612 HG2 LYS 583 HG2 LYS 583 -21.268 -28.761 20.580 613 HG3 LYS 583 HG3 LYS 583 -20.926 -30.346 21.268 614 HD2 LYS 583 HD2 LYS 583 -23.403 -28.719 21.843 615 HD3 LYS 583 HD3 LYS 583 -23.313 -30.021 20.658 616 HE2 LYS 583 HE2 LYS 583 -22.733 -31.604 22.438 617 HE3 LYS 583 HE3 LYS 583 -22.804 -30.304 23.624 618 HZ1 LYS 583 HZ1 LYS 583 -25.104 -31.192 21.971 619 HZ2 LYS 583 HZ2 LYS 583 -25.149 -30.059 23.215 620 HZ3 LYS 583 HZ3 LYS 583 -24.820 -31.671 23.553 621 H ASN 584 H ASN 584 -20.135 -26.217 21.988 622 HA ASN 584 HA ASN 584 -18.408 -26.146 19.672 623 HB2 ASN 584 HB2 ASN 584 -19.723 -24.243 18.829 624 HB3 ASN 584 HB3 ASN 584 -20.750 -25.640 19.093 625 HD21 ASN 584 HD21 ASN 584 -21.313 -22.826 18.879 626 HD22 ASN 584 HD22 ASN 584 -22.152 -22.383 20.320 627 H LYS 585 H LYS 585 -16.889 -24.719 19.509 628 HA LYS 585 HA LYS 585 -16.313 -22.930 21.720 629 HB2 LYS 585 HB2 LYS 585 -14.112 -24.223 22.008 630 HB3 LYS 585 HB3 LYS 585 -15.573 -24.915 22.711 631 HG2 LYS 585 HG2 LYS 585 -15.759 -26.153 20.429 632 HG3 LYS 585 HG3 LYS 585 -14.026 -25.827 20.317 633 HD2 LYS 585 HD2 LYS 585 -13.590 -27.063 22.267 634 HD3 LYS 585 HD3 LYS 585 -15.300 -27.040 22.716 635 HE2 LYS 585 HE2 LYS 585 -15.788 -28.405 20.691 636 HE3 LYS 585 HE3 LYS 585 -14.048 -28.549 20.425 637 HZ1 LYS 585 HZ1 LYS 585 -15.084 -30.444 21.648 638 HZ2 LYS 585 HZ2 LYS 585 -15.472 -29.395 22.860 639 HZ3 LYS 585 HZ3 LYS 585 -13.817 -29.667 22.515 640 H THR 586 H THR 586 -14.216 -21.810 21.236 641 HA THR 586 HA THR 586 -13.556 -21.975 18.443 642 HB THR 586 HB THR 586 -15.424 -20.469 18.364 643 HG1 THR 586 HG1 THR 586 -13.485 -19.972 17.160 644 HG21 THR 586 HG21 THR 586 -15.469 -19.723 20.667 645 HG22 THR 586 HG22 THR 586 -15.493 -18.349 19.560 646 HG23 THR 586 HG23 THR 586 -14.000 -18.772 20.416 647 H PHE 587 H PHE 587 -11.690 -21.009 17.835 648 HA PHE 587 HA PHE 587 -10.017 -19.872 19.891 649 HB2 PHE 587 HB2 PHE 587 -8.091 -21.168 19.123 650 HB3 PHE 587 HB3 PHE 587 -9.355 -22.274 19.627 651 HD1 PHE 587 HD1 PHE 587 -10.632 -23.515 17.845 652 HD2 PHE 587 HD2 PHE 587 -7.207 -21.152 16.984 653 HE1 PHE 587 HE1 PHE 587 -10.323 -24.717 15.706 654 HE2 PHE 587 HE2 PHE 587 -6.914 -22.344 14.851 655 HZ PHE 587 HZ PHE 587 -8.474 -24.127 14.223 656 H PHE 588 H PHE 588 -8.111 -18.825 18.650 657 HA PHE 588 HA PHE 588 -9.348 -17.592 16.293 658 HB2 PHE 588 HB2 PHE 588 -7.621 -16.221 18.385 659 HB3 PHE 588 HB3 PHE 588 -8.229 -15.479 16.915 660 HD1 PHE 588 HD2 PHE 588 -9.108 -16.737 20.247 661 HD2 PHE 588 HD1 PHE 588 -10.528 -14.799 16.733 662 HE1 PHE 588 HE2 PHE 588 -11.151 -16.065 21.449 663 HE2 PHE 588 HE1 PHE 588 -12.566 -14.120 17.930 664 HZ PHE 588 HZ PHE 588 -12.879 -14.754 20.289 665 H LEU 589 H LEU 589 -7.867 -16.734 14.782 666 HA LEU 589 HA LEU 589 -5.259 -18.092 14.827 667 HB2 LEU 589 HB2 LEU 589 -7.290 -18.715 13.099 668 HB3 LEU 589 HB3 LEU 589 -6.498 -17.425 12.219 669 HG LEU 589 HG LEU 589 -5.692 -19.512 11.404 670 HD11 LEU 589 HD11 LEU 589 -3.285 -19.392 11.844 671 HD12 LEU 589 HD12 LEU 589 -3.600 -18.236 13.139 672 HD13 LEU 589 HD13 LEU 589 -3.998 -17.825 11.474 673 HD21 LEU 589 HD21 LEU 589 -4.547 -21.131 12.885 674 HD22 LEU 589 HD22 LEU 589 -6.268 -20.934 13.217 675 HD23 LEU 589 HD23 LEU 589 -5.084 -20.170 14.268 676 H GLU 590 H GLU 590 -3.674 -16.631 14.727 677 HA GLU 590 HA GLU 590 -4.337 -14.025 13.582 678 HB2 GLU 590 HB2 GLU 590 -4.178 -13.765 15.972 679 HB3 GLU 590 HB3 GLU 590 -2.617 -14.581 16.002 680 HG2 GLU 590 HG2 GLU 590 -1.629 -12.748 14.744 681 HG3 GLU 590 HG3 GLU 590 -3.196 -11.949 14.654 682 H ILE 591 H ILE 591 -3.091 -13.369 12.052 683 HA ILE 591 HA ILE 591 -0.633 -14.830 11.545 684 HB ILE 591 HB ILE 591 -0.698 -13.758 9.287 685 HG12 ILE 591 HG12 ILE 591 -3.479 -12.864 10.122 686 HG13 ILE 591 HG13 ILE 591 -2.104 -11.800 9.855 687 HG21 ILE 591 HG21 ILE 591 -1.475 -16.004 9.577 688 HG22 ILE 591 HG22 ILE 591 -2.514 -15.195 8.397 689 HG23 ILE 591 HG23 ILE 591 -3.060 -15.435 10.062 690 HD11 ILE 591 HD11 ILE 591 -3.464 -13.499 7.769 691 HD12 ILE 591 HD12 ILE 591 -2.093 -12.424 7.485 692 HD13 ILE 591 HD13 ILE 591 -3.650 -11.759 7.978 693 H GLY 592 H GLY 592 1.243 -13.725 11.282 694 HA2 GLY 592 HA2 GLY 592 1.331 -11.314 12.874 695 HA3 GLY 592 HA3 GLY 592 2.713 -12.244 12.314 696 H GLU 593 H GLU 593 3.259 -9.865 12.007 697 HA GLU 593 HA GLU 593 2.098 -8.732 9.688 698 HB2 GLU 593 HB2 GLU 593 4.369 -7.822 11.441 699 HB3 GLU 593 HB3 GLU 593 3.777 -6.906 10.054 700 HG2 GLU 593 HG2 GLU 593 1.563 -6.822 11.036 701 HG3 GLU 593 HG3 GLU 593 2.130 -7.733 12.428 702 HA PRO 594 HA PRO 594 4.407 -10.895 6.745 703 HB2 PRO 594 HB2 PRO 594 4.238 -9.005 4.734 704 HB3 PRO 594 HB3 PRO 594 2.963 -10.160 5.108 705 HG2 PRO 594 HG2 PRO 594 3.258 -7.321 5.913 706 HG3 PRO 594 HG3 PRO 594 1.789 -8.174 5.441 707 HD2 PRO 594 HD2 PRO 594 2.345 -7.616 7.972 708 HD3 PRO 594 HD3 PRO 594 1.540 -9.136 7.552 709 H ARG 595 H ARG 595 6.529 -11.099 6.542 710 HA ARG 595 HA ARG 595 8.126 -8.651 6.667 711 HB2 ARG 595 HB2 ARG 595 10.024 -10.002 7.412 712 HB3 ARG 595 HB3 ARG 595 8.654 -10.257 8.476 713 HG2 ARG 595 HG2 ARG 595 8.225 -12.412 7.488 714 HG3 ARG 595 HG3 ARG 595 9.458 -12.130 6.257 715 HD2 ARG 595 HD2 ARG 595 9.911 -12.415 9.230 716 HD3 ARG 595 HD3 ARG 595 10.337 -13.591 7.989 717 HE ARG 595 HE ARG 595 11.585 -10.974 8.416 718 HH11 ARG 595 HH11 ARG 595 11.821 -14.254 7.004 719 HH12 ARG 595 HH12 ARG 595 13.440 -14.032 6.499 720 HH21 ARG 595 HH21 ARG 595 13.837 -10.758 7.699 721 HH22 ARG 595 HH22 ARG 595 14.579 -12.051 6.894 722 H LEU 596 H LEU 596 9.325 -8.073 4.987 723 HA LEU 596 HA LEU 596 9.129 -9.462 2.518 724 HB2 LEU 596 HB2 LEU 596 9.419 -6.901 3.064 725 HB3 LEU 596 HB3 LEU 596 11.103 -7.299 3.257 726 HG LEU 596 HG LEU 596 10.545 -6.268 1.064 727 HD11 LEU 596 HD11 LEU 596 11.761 -7.817 -0.364 728 HD12 LEU 596 HD12 LEU 596 11.574 -9.088 0.849 729 HD13 LEU 596 HD13 LEU 596 12.532 -7.655 1.214 730 HD21 LEU 596 HD21 LEU 596 9.283 -7.485 -0.577 731 HD22 LEU 596 HD22 LEU 596 8.329 -7.314 0.924 732 HD23 LEU 596 HD23 LEU 596 9.118 -8.836 0.548 733 H VAL 597 H VAL 597 10.664 -10.928 1.800 734 HA VAL 597 HA VAL 597 12.642 -11.668 3.761 735 HB VAL 597 HB VAL 597 12.242 -12.913 1.016 736 HG11 VAL 597 HG11 VAL 597 13.503 -14.004 3.532 737 HG12 VAL 597 HG12 VAL 597 14.368 -13.468 2.090 738 HG13 VAL 597 HG13 VAL 597 13.306 -14.877 2.011 739 HG21 VAL 597 HG21 VAL 597 10.997 -13.704 3.647 740 HG22 VAL 597 HG22 VAL 597 10.858 -14.596 2.130 741 HG23 VAL 597 HG23 VAL 597 10.147 -12.988 2.278 742 H GLU 598 H GLU 598 13.603 -9.635 3.639 743 HA GLU 598 HA GLU 598 15.067 -8.823 1.287 744 HB2 GLU 598 HB2 GLU 598 13.892 -7.458 3.339 745 HB3 GLU 598 HB3 GLU 598 15.541 -7.519 3.929 746 HG2 GLU 598 HG2 GLU 598 14.942 -6.484 1.172 747 HG3 GLU 598 HG3 GLU 598 14.734 -5.458 2.579 748 H MET 599 H MET 599 17.434 -8.292 1.644 749 HA MET 599 HA MET 599 18.675 -10.669 2.859 750 HB2 MET 599 HB2 MET 599 20.429 -10.438 1.122 751 HB3 MET 599 HB3 MET 599 18.832 -10.743 0.452 752 HG2 MET 599 HG2 MET 599 18.591 -8.352 0.014 753 HG3 MET 599 HG3 MET 599 20.223 -8.094 0.622 754 HE1 MET 599 HE1 MET 599 19.176 -7.095 -2.244 755 HE2 MET 599 HE2 MET 599 20.567 -7.483 -3.256 756 HE3 MET 599 HE3 MET 599 20.809 -6.802 -1.647 757 H SER 600 H SER 600 18.634 -7.219 2.747 758 HA SER 600 HA SER 600 21.270 -7.020 3.957 759 HB2 SER 600 HB2 SER 600 19.396 -4.833 3.073 760 HB3 SER 600 HB3 SER 600 21.119 -4.691 3.436 761 HG SER 600 HG SER 600 19.811 -5.902 1.299 762 H GLU 601 H GLU 601 21.541 -6.434 6.014 763 HA GLU 601 HA GLU 601 19.246 -5.844 7.741 764 HB2 GLU 601 HB2 GLU 601 22.189 -6.220 8.276 765 HB3 GLU 601 HB3 GLU 601 21.002 -5.872 9.528 766 HG2 GLU 601 HG2 GLU 601 19.958 -8.031 9.130 767 HG3 GLU 601 HG3 GLU 601 21.082 -8.342 7.804 768 H LYS 602 H LYS 602 19.084 -3.727 8.719 769 HA LYS 602 HA LYS 602 20.564 -1.706 7.317 770 HB2 LYS 602 HB2 LYS 602 18.600 -1.407 9.601 771 HB3 LYS 602 HB3 LYS 602 19.310 -0.077 8.697 772 HG2 LYS 602 HG2 LYS 602 18.270 -1.030 6.630 773 HG3 LYS 602 HG3 LYS 602 17.441 -2.189 7.663 774 HD2 LYS 602 HD2 LYS 602 15.930 -0.381 7.207 775 HD3 LYS 602 HD3 LYS 602 16.429 -0.286 8.895 776 HE2 LYS 602 HE2 LYS 602 16.393 1.923 7.829 777 HE3 LYS 602 HE3 LYS 602 18.012 1.490 8.355 778 HZ1 LYS 602 HZ1 LYS 602 16.986 1.284 5.564 779 HZ2 LYS 602 HZ2 LYS 602 18.530 0.874 6.046 780 HZ3 LYS 602 HZ3 LYS 602 18.048 2.470 6.129 781 H LYS 603 H LYS 603 22.515 -1.129 7.803 782 HA LYS 603 HA LYS 603 23.427 -1.455 10.573 783 HB2 LYS 603 HB2 LYS 603 24.972 -1.817 8.005 784 HB3 LYS 603 HB3 LYS 603 25.666 -1.885 9.619 785 HG2 LYS 603 HG2 LYS 603 23.583 -3.758 8.514 786 HG3 LYS 603 HG3 LYS 603 25.296 -4.120 8.708 787 HD2 LYS 603 HD2 LYS 603 25.057 -3.773 11.143 788 HD3 LYS 603 HD3 LYS 603 23.329 -3.496 10.920 789 HE2 LYS 603 HE2 LYS 603 23.148 -5.752 9.925 790 HE3 LYS 603 HE3 LYS 603 24.849 -6.017 10.297 791 HZ1 LYS 603 HZ1 LYS 603 24.364 -5.838 12.617 792 HZ2 LYS 603 HZ2 LYS 603 23.302 -6.962 11.914 793 HZ3 LYS 603 HZ3 LYS 603 22.751 -5.425 12.308 794 H GLY 604 H GLY 604 22.257 0.893 9.124 795 HA2 GLY 604 HA2 GLY 604 24.447 2.746 8.830 796 HA3 GLY 604 HA3 GLY 604 22.733 3.124 8.727 797 H GLY 605 H GLY 605 23.167 1.381 11.459 798 HA2 GLY 605 HA2 GLY 605 22.928 3.716 13.119 799 HA3 GLY 605 HA3 GLY 605 22.743 2.043 13.625 800 H PHE 606 H PHE 606 25.190 4.202 12.381 801 HA PHE 606 HA PHE 606 27.325 2.876 13.784 802 HB2 PHE 606 HB2 PHE 606 27.249 5.593 12.434 803 HB3 PHE 606 HB3 PHE 606 28.704 4.753 12.950 804 HD1 PHE 606 HD1 PHE 606 29.121 2.432 11.883 805 HD2 PHE 606 HD2 PHE 606 26.469 5.339 10.269 806 HE1 PHE 606 HE1 PHE 606 29.276 1.347 9.681 807 HE2 PHE 606 HE2 PHE 606 26.619 4.261 8.065 808 HZ PHE 606 HZ PHE 606 28.027 2.259 7.769 809 H THR 607 H THR 607 28.492 3.864 15.595 810 HA THR 607 HA THR 607 26.694 5.056 17.380 811 HB THR 607 HB THR 607 28.441 3.602 18.290 812 HG1 THR 607 HG1 THR 607 27.632 5.506 19.470 813 HG21 THR 607 HG21 THR 607 30.429 5.713 17.417 814 HG22 THR 607 HG22 THR 607 30.284 4.081 16.755 815 HG23 THR 607 HG23 THR 607 30.810 4.313 18.420 816 H ILE 608 H ILE 608 25.982 6.993 17.249 817 HA ILE 608 HA ILE 608 27.786 9.194 16.560 818 HB ILE 608 HB ILE 608 26.728 8.350 14.472 819 HG12 ILE 608 HG12 ILE 608 25.790 11.120 15.292 820 HG13 ILE 608 HG13 ILE 608 27.352 10.726 14.594 821 HG21 ILE 608 HG21 ILE 608 24.120 9.106 15.769 822 HG22 ILE 608 HG22 ILE 608 24.662 7.486 15.340 823 HG23 ILE 608 HG23 ILE 608 24.326 8.668 14.072 824 HD11 ILE 608 HD11 ILE 608 25.908 11.724 12.946 825 HD12 ILE 608 HD12 ILE 608 24.679 10.501 13.254 826 HD13 ILE 608 HD13 ILE 608 26.218 10.034 12.526 827 H THR 609 H THR 609 25.889 8.056 18.854 828 HA THR 609 HA THR 609 23.996 10.094 19.315 829 HB THR 609 HB THR 609 25.313 8.286 21.358 830 HG1 THR 609 HG1 THR 609 22.929 7.822 19.791 831 HG21 THR 609 HG21 THR 609 24.031 10.145 22.327 832 HG22 THR 609 HG22 THR 609 23.204 8.612 22.605 833 HG23 THR 609 HG23 THR 609 22.639 9.702 21.343 834 H GLU 610 H GLU 610 24.286 12.052 20.206 835 HA GLU 610 HA GLU 610 26.873 12.639 21.425 836 HB2 GLU 610 HB2 GLU 610 26.760 14.867 20.357 837 HB3 GLU 610 HB3 GLU 610 26.915 13.544 19.215 838 HG2 GLU 610 HG2 GLU 610 24.533 13.669 18.724 839 HG3 GLU 610 HG3 GLU 610 24.362 14.979 19.894 840 H GLU 611 H GLU 611 26.452 15.186 22.180 841 HA GLU 611 HA GLU 611 24.984 14.915 24.526 842 HB2 GLU 611 HB2 GLU 611 25.984 17.420 23.179 843 HB3 GLU 611 HB3 GLU 611 25.302 17.358 24.786 844 HG2 GLU 611 HG2 GLU 611 27.686 17.474 24.921 845 HG3 GLU 611 HG3 GLU 611 27.141 15.903 25.490 846 H TYR 612 H TYR 612 22.986 15.132 24.924 847 HA TYR 612 HA TYR 612 21.075 16.351 23.121 848 HB2 TYR 612 HB2 TYR 612 20.683 14.247 24.519 849 HB3 TYR 612 HB3 TYR 612 20.772 15.261 25.941 850 HD1 TYR 612 HD2 TYR 612 18.922 16.863 26.427 851 HD2 TYR 612 HD1 TYR 612 18.731 14.140 23.169 852 HE1 TYR 612 HE2 TYR 612 16.486 17.179 26.309 853 HE2 TYR 612 HE1 TYR 612 16.296 14.442 23.048 854 HH TYR 612 HH TYR 612 14.694 16.929 24.637 855 H ASP 613 H ASP 613 22.776 16.744 26.098 856 HA ASP 613 HA ASP 613 22.927 18.251 27.723 857 HB2 ASP 613 HB2 ASP 613 24.648 19.046 26.256 858 HB3 ASP 613 HB3 ASP 613 23.485 20.035 25.370 859 H ASP 614 H ASP 614 21.231 18.367 28.775 860 HA ASP 614 HA ASP 614 19.878 20.715 29.261 861 HB2 ASP 614 HB2 ASP 614 18.802 20.388 27.011 862 HB3 ASP 614 HB3 ASP 614 18.202 18.826 27.557 863 H LYS 615 H LYS 615 19.278 17.360 28.714 864 HA LYS 615 HA LYS 615 19.487 16.529 31.366 865 HB2 LYS 615 HB2 LYS 615 17.195 17.602 31.469 866 HB3 LYS 615 HB3 LYS 615 16.693 16.529 30.174 867 HG2 LYS 615 HG2 LYS 615 15.906 15.755 32.353 868 HG3 LYS 615 HG3 LYS 615 17.008 14.598 31.608 869 HD2 LYS 615 HD2 LYS 615 18.824 15.362 33.012 870 HD3 LYS 615 HD3 LYS 615 17.799 16.628 33.693 871 HE2 LYS 615 HE2 LYS 615 16.396 15.021 34.735 872 HE3 LYS 615 HE3 LYS 615 17.199 13.683 33.915 873 HZ1 LYS 615 HZ1 LYS 615 17.948 13.905 36.204 874 HZ2 LYS 615 HZ2 LYS 615 18.434 15.493 35.924 875 HZ3 LYS 615 HZ3 LYS 615 19.228 14.238 35.158 876 H GLN 616 H GLN 616 20.676 14.816 30.688 877 HA GLN 616 HA GLN 616 20.167 13.584 28.201 878 HB2 GLN 616 HB2 GLN 616 21.876 11.906 28.816 879 HB3 GLN 616 HB3 GLN 616 22.440 13.542 29.077 880 HG2 GLN 616 HG2 GLN 616 22.061 13.298 31.466 881 HG3 GLN 616 HG3 GLN 616 21.466 11.657 31.210 882 HE21 GLN 616 HE21 GLN 616 23.074 10.765 32.466 883 HE22 GLN 616 HE22 GLN 616 24.717 10.651 31.935 884 HA PRO 617 HA PRO 617 16.778 11.202 29.330 885 HB2 PRO 617 HB2 PRO 617 16.697 9.480 27.229 886 HB3 PRO 617 HB3 PRO 617 16.231 11.181 27.117 887 HG2 PRO 617 HG2 PRO 617 18.800 9.865 26.337 888 HG3 PRO 617 HG3 PRO 617 17.877 11.113 25.480 889 HD2 PRO 617 HD2 PRO 617 20.069 11.669 26.976 890 HD3 PRO 617 HD3 PRO 617 18.717 12.804 26.777 891 H LEU 618 H LEU 618 16.927 9.915 31.054 892 HA LEU 618 HA LEU 618 18.697 7.732 31.343 893 HB2 LEU 618 HB2 LEU 618 17.594 8.832 33.258 894 HB3 LEU 618 HB3 LEU 618 16.043 8.233 32.706 895 HG LEU 618 HG LEU 618 16.856 5.912 33.079 896 HD11 LEU 618 HD11 LEU 618 19.242 6.275 32.874 897 HD12 LEU 618 HD12 LEU 618 18.858 5.558 34.438 898 HD13 LEU 618 HD13 LEU 618 19.234 7.276 34.325 899 HD21 LEU 618 HD21 LEU 618 15.507 7.026 34.746 900 HD22 LEU 618 HD22 LEU 618 16.947 7.758 35.453 901 HD23 LEU 618 HD23 LEU 618 16.720 6.008 35.526 902 H THR 619 H THR 619 15.341 7.996 30.275 903 HA THR 619 HA THR 619 15.461 5.232 29.452 904 HB THR 619 HB THR 619 13.295 6.004 30.384 905 HG1 THR 619 HG1 THR 619 12.649 5.661 27.694 906 HG21 THR 619 HG21 THR 619 13.195 7.924 28.048 907 HG22 THR 619 HG22 THR 619 13.302 8.353 29.758 908 HG23 THR 619 HG23 THR 619 11.846 7.582 29.130 909 H SER 620 H SER 620 16.047 4.656 27.419 910 HA SER 620 HA SER 620 17.386 6.820 26.130 911 HB2 SER 620 HB2 SER 620 18.508 4.630 26.671 912 HB3 SER 620 HB3 SER 620 17.556 3.910 25.374 913 HG SER 620 HG SER 620 19.772 5.497 25.277 914 H LYS 621 H LYS 621 17.649 6.355 23.730 915 HA LYS 621 HA LYS 621 15.029 6.728 22.477 916 HB2 LYS 621 HB2 LYS 621 16.413 8.390 21.019 917 HB3 LYS 621 HB3 LYS 621 15.878 8.905 22.610 918 HG2 LYS 621 HG2 LYS 621 18.195 9.611 22.229 919 HG3 LYS 621 HG3 LYS 621 18.129 8.420 23.525 920 HD2 LYS 621 HD2 LYS 621 18.654 6.719 21.634 921 HD3 LYS 621 HD3 LYS 621 19.158 8.137 20.721 922 HE2 LYS 621 HE2 LYS 621 20.824 8.663 22.357 923 HE3 LYS 621 HE3 LYS 621 20.201 7.412 23.439 924 HZ1 LYS 621 HZ1 LYS 621 20.875 5.726 21.862 925 HZ2 LYS 621 HZ2 LYS 621 22.215 6.701 22.195 926 HZ3 LYS 621 HZ3 LYS 621 21.344 6.907 20.761 927 H GLU 622 H GLU 622 15.088 6.291 20.177 928 HA GLU 622 HA GLU 622 17.299 4.562 19.362 929 HB2 GLU 622 HB2 GLU 622 14.365 4.443 18.606 930 HB3 GLU 622 HB3 GLU 622 15.611 3.598 17.715 931 HG2 GLU 622 HG2 GLU 622 14.488 2.051 19.186 932 HG3 GLU 622 HG3 GLU 622 16.135 2.285 19.743 933 H GLU 623 H GLU 623 18.600 5.945 18.217 934 HA GLU 623 HA GLU 623 17.340 7.955 16.664 935 HB2 GLU 623 HB2 GLU 623 19.660 8.575 15.841 936 HB3 GLU 623 HB3 GLU 623 19.361 8.759 17.553 937 HG2 GLU 623 HG2 GLU 623 20.733 6.349 16.418 938 HG3 GLU 623 HG3 GLU 623 21.601 7.828 16.821 939 H GLU 624 H GLU 624 18.269 4.770 15.992 940 HA GLU 624 HA GLU 624 17.465 5.356 13.228 941 HB2 GLU 624 HB2 GLU 624 18.673 2.758 14.223 942 HB3 GLU 624 HB3 GLU 624 18.251 3.124 12.566 943 HG2 GLU 624 HG2 GLU 624 20.560 3.295 12.619 944 HG3 GLU 624 HG3 GLU 624 20.023 4.969 12.751 945 H GLU 625 H GLU 625 15.330 5.517 13.593 946 HA GLU 625 HA GLU 625 13.999 3.783 15.358 947 HB2 GLU 625 HB2 GLU 625 13.261 6.098 14.910 948 HB3 GLU 625 HB3 GLU 625 12.813 5.628 13.280 949 HG2 GLU 625 HG2 GLU 625 11.103 4.175 14.105 950 HG3 GLU 625 HG3 GLU 625 11.644 4.418 15.764 951 H ARG 626 H ARG 626 13.119 1.926 15.071 952 HA ARG 626 HA ARG 626 13.658 0.257 12.925 953 HB2 ARG 626 HB2 ARG 626 13.262 -0.558 15.175 954 HB3 ARG 626 HB3 ARG 626 11.615 0.031 15.144 955 HG2 ARG 626 HG2 ARG 626 11.783 -2.406 14.901 956 HG3 ARG 626 HG3 ARG 626 11.004 -1.640 13.519 957 HD2 ARG 626 HD2 ARG 626 12.617 -3.411 12.902 958 HD3 ARG 626 HD3 ARG 626 13.007 -1.834 12.214 959 HE ARG 626 HE ARG 626 14.349 -2.262 14.669 960 HH11 ARG 626 HH11 ARG 626 14.419 -3.321 11.284 961 HH12 ARG 626 HH12 ARG 626 16.103 -3.545 11.227 962 HH21 ARG 626 HH21 ARG 626 16.667 -2.536 14.606 963 HH22 ARG 626 HH22 ARG 626 17.425 -3.111 13.197 964 H ARG 627 H ARG 627 10.839 2.168 13.675 965 HA ARG 627 HA ARG 627 9.041 1.151 11.839 966 HB2 ARG 627 HB2 ARG 627 8.450 2.646 13.710 967 HB3 ARG 627 HB3 ARG 627 9.271 3.970 12.914 968 HG2 ARG 627 HG2 ARG 627 6.964 2.612 11.571 969 HG3 ARG 627 HG3 ARG 627 6.686 3.811 12.833 970 HD2 ARG 627 HD2 ARG 627 7.874 5.468 11.578 971 HD3 ARG 627 HD3 ARG 627 8.338 4.282 10.358 972 HE ARG 627 HE ARG 627 5.728 4.116 10.206 973 HH11 ARG 627 HH11 ARG 627 7.674 7.055 10.562 974 HH12 ARG 627 HH12 ARG 627 6.653 8.003 9.586 975 HH21 ARG 627 HH21 ARG 627 4.343 5.437 8.865 976 HH22 ARG 627 HH22 ARG 627 4.720 7.078 8.618 977 H ILE 628 H ILE 628 11.769 3.222 11.271 978 HA ILE 628 HA ILE 628 10.963 4.287 8.767 979 HB ILE 628 HB ILE 628 13.757 3.835 9.883 980 HG12 ILE 628 HG12 ILE 628 12.021 6.305 9.795 981 HG13 ILE 628 HG13 ILE 628 12.339 5.331 11.224 982 HG21 ILE 628 HG21 ILE 628 13.835 4.054 7.438 983 HG22 ILE 628 HG22 ILE 628 14.540 5.461 8.231 984 HG23 ILE 628 HG23 ILE 628 12.918 5.559 7.543 985 HD11 ILE 628 HD11 ILE 628 14.706 5.943 11.093 986 HD12 ILE 628 HD12 ILE 628 13.667 7.365 11.211 987 HD13 ILE 628 HD13 ILE 628 14.369 6.912 9.658 988 H ALA 629 H ALA 629 12.270 1.214 9.720 989 HA ALA 629 HA ALA 629 12.883 0.432 6.994 990 HB1 ALA 629 HB1 ALA 629 13.480 -1.723 7.987 991 HB2 ALA 629 HB2 ALA 629 12.843 -1.187 9.542 992 HB3 ALA 629 HB3 ALA 629 14.259 -0.395 8.853 993 H GLU 630 H GLU 630 10.275 0.412 9.181 994 HA GLU 630 HA GLU 630 8.942 -1.854 8.043 995 HB2 GLU 630 HB2 GLU 630 7.953 0.127 10.094 996 HB3 GLU 630 HB3 GLU 630 7.227 -1.438 9.722 997 HG2 GLU 630 HG2 GLU 630 9.241 -2.570 10.444 998 HG3 GLU 630 HG3 GLU 630 10.009 -1.031 10.787 999 H MET 631 H MET 631 9.088 1.443 7.374 1000 HA MET 631 HA MET 631 6.523 1.626 6.087 1001 HB2 MET 631 HB2 MET 631 7.224 3.766 5.228 1002 HB3 MET 631 HB3 MET 631 7.790 3.653 6.885 1003 HG2 MET 631 HG2 MET 631 10.035 3.105 6.076 1004 HG3 MET 631 HG3 MET 631 9.457 3.212 4.417 1005 HE1 MET 631 HE1 MET 631 11.725 6.363 4.702 1006 HE2 MET 631 HE2 MET 631 11.351 4.901 3.787 1007 HE3 MET 631 HE3 MET 631 11.986 4.773 5.425 1008 H GLY 632 H GLY 632 9.495 0.206 5.312 1009 HA2 GLY 632 HA2 GLY 632 8.829 0.121 2.450 1010 HA3 GLY 632 HA3 GLY 632 10.449 -0.072 3.114 1011 H ARG 633 H ARG 633 7.480 -1.468 4.330 1012 HA ARG 633 HA ARG 633 8.476 -4.131 3.686 1013 HB2 ARG 633 HB2 ARG 633 7.270 -3.109 6.246 1014 HB3 ARG 633 HB3 ARG 633 7.257 -4.807 5.819 1015 HG2 ARG 633 HG2 ARG 633 9.718 -4.744 5.725 1016 HG3 ARG 633 HG3 ARG 633 9.642 -3.065 6.263 1017 HD2 ARG 633 HD2 ARG 633 10.041 -4.696 8.138 1018 HD3 ARG 633 HD3 ARG 633 8.604 -3.705 8.356 1019 HE ARG 633 HE ARG 633 7.755 -6.005 7.107 1020 HH11 ARG 633 HH11 ARG 633 9.367 -5.259 10.182 1021 HH12 ARG 633 HH12 ARG 633 8.596 -6.512 11.024 1022 HH21 ARG 633 HH21 ARG 633 6.679 -7.698 8.327 1023 HH22 ARG 633 HH22 ARG 633 7.066 -7.895 9.997 1024 HA PRO 634 HA PRO 634 4.283 -4.800 2.305 1025 HB2 PRO 634 HB2 PRO 634 4.101 -7.456 3.003 1026 HB3 PRO 634 HB3 PRO 634 4.862 -6.900 1.509 1027 HG2 PRO 634 HG2 PRO 634 6.128 -7.724 4.082 1028 HG3 PRO 634 HG3 PRO 634 6.675 -8.018 2.429 1029 HD2 PRO 634 HD2 PRO 634 7.737 -6.120 4.005 1030 HD3 PRO 634 HD3 PRO 634 7.622 -5.930 2.241 1031 H ILE 635 H ILE 635 2.371 -4.589 3.405 1032 HA ILE 635 HA ILE 635 2.524 -5.195 6.225 1033 HB ILE 635 HB ILE 635 1.149 -3.163 6.708 1034 HG12 ILE 635 HG12 ILE 635 1.474 -1.227 5.015 1035 HG13 ILE 635 HG13 ILE 635 1.815 -2.473 3.831 1036 HG21 ILE 635 HG21 ILE 635 3.886 -2.752 5.553 1037 HG22 ILE 635 HG22 ILE 635 3.496 -3.198 7.218 1038 HG23 ILE 635 HG23 ILE 635 3.072 -1.595 6.607 1039 HD11 ILE 635 HD11 ILE 635 -0.759 -2.121 5.353 1040 HD12 ILE 635 HD12 ILE 635 -0.434 -3.380 4.161 1041 HD13 ILE 635 HD13 ILE 635 -0.470 -1.685 3.669 1042 H LEU 636 H LEU 636 0.312 -5.111 7.242 1043 HA LEU 636 HA LEU 636 -1.352 -6.704 5.485 1044 HB2 LEU 636 HB2 LEU 636 -2.318 -7.609 7.658 1045 HB3 LEU 636 HB3 LEU 636 -0.748 -8.174 7.141 1046 HG LEU 636 HG LEU 636 0.298 -6.655 8.835 1047 HD11 LEU 636 HD11 LEU 636 -1.073 -5.728 10.620 1048 HD12 LEU 636 HD12 LEU 636 -2.534 -6.214 9.758 1049 HD13 LEU 636 HD13 LEU 636 -1.460 -4.998 9.062 1050 HD21 LEU 636 HD21 LEU 636 -0.273 -8.023 10.752 1051 HD22 LEU 636 HD22 LEU 636 -0.125 -9.011 9.291 1052 HD23 LEU 636 HD23 LEU 636 -1.718 -8.581 9.916 1053 H GLY 637 H GLY 637 -3.714 -6.820 6.400 1054 HA2 GLY 637 HA2 GLY 637 -4.816 -4.251 5.841 1055 HA3 GLY 637 HA3 GLY 637 -5.650 -5.748 6.264 1056 H GLU 638 H GLU 638 -6.845 -3.774 7.312 1057 HA GLU 638 HA GLU 638 -5.803 -2.866 9.780 1058 HB2 GLU 638 HB2 GLU 638 -7.463 -1.584 8.586 1059 HB3 GLU 638 HB3 GLU 638 -8.601 -2.914 8.662 1060 HG2 GLU 638 HG2 GLU 638 -8.820 -2.643 11.037 1061 HG3 GLU 638 HG3 GLU 638 -7.574 -1.392 11.039 1062 H HIS 639 H HIS 639 -7.921 -5.480 8.836 1063 HA HIS 639 HA HIS 639 -7.772 -6.504 11.580 1064 HB2 HIS 639 HB2 HIS 639 -9.885 -6.934 9.469 1065 HB3 HIS 639 HB3 HIS 639 -9.744 -7.958 10.888 1066 HD1 HIS 639 HD1 HIS 639 -10.645 -7.019 13.100 1067 HD2 HIS 639 HD2 HIS 639 -10.817 -4.333 9.936 1068 HE1 HIS 639 HE1 HIS 639 -12.147 -5.147 13.858 1069 H THR 640 H THR 640 -6.468 -8.138 11.841 1070 HA THR 640 HA THR 640 -6.422 -10.152 9.785 1071 HB THR 640 HB THR 640 -4.026 -10.585 10.293 1072 HG1 THR 640 HG1 THR 640 -4.306 -7.962 11.402 1073 HG21 THR 640 HG21 THR 640 -4.836 -9.623 8.224 1074 HG22 THR 640 HG22 THR 640 -3.236 -9.025 8.630 1075 HG23 THR 640 HG23 THR 640 -4.665 -7.999 8.895 1076 H LYS 641 H LYS 641 -7.805 -11.267 10.985 1077 HA LYS 641 HA LYS 641 -6.743 -12.921 13.024 1078 HB2 LYS 641 HB2 LYS 641 -7.246 -10.883 14.373 1079 HB3 LYS 641 HB3 LYS 641 -8.893 -10.926 13.759 1080 HG2 LYS 641 HG2 LYS 641 -9.288 -13.041 14.890 1081 HG3 LYS 641 HG3 LYS 641 -7.628 -13.067 15.459 1082 HD2 LYS 641 HD2 LYS 641 -9.073 -12.376 17.254 1083 HD3 LYS 641 HD3 LYS 641 -8.087 -11.007 16.775 1084 HE2 LYS 641 HE2 LYS 641 -10.928 -11.444 15.827 1085 HE3 LYS 641 HE3 LYS 641 -10.544 -10.552 17.284 1086 HZ1 LYS 641 HZ1 LYS 641 -9.803 -9.758 14.485 1087 HZ2 LYS 641 HZ2 LYS 641 -9.282 -8.963 15.858 1088 HZ3 LYS 641 HZ3 LYS 641 -10.910 -9.041 15.505 1089 H LEU 642 H LEU 642 -8.137 -14.618 13.377 1090 HA LEU 642 HA LEU 642 -10.570 -14.705 11.748 1091 HB2 LEU 642 HB2 LEU 642 -8.744 -15.844 10.629 1092 HB3 LEU 642 HB3 LEU 642 -8.413 -16.747 12.090 1093 HG LEU 642 HG LEU 642 -10.759 -17.718 11.840 1094 HD11 LEU 642 HD11 LEU 642 -10.438 -16.598 9.091 1095 HD12 LEU 642 HD12 LEU 642 -11.652 -16.131 10.285 1096 HD13 LEU 642 HD13 LEU 642 -11.652 -17.763 9.611 1097 HD21 LEU 642 HD21 LEU 642 -9.958 -19.298 10.147 1098 HD22 LEU 642 HD22 LEU 642 -8.848 -19.008 11.486 1099 HD23 LEU 642 HD23 LEU 642 -8.532 -18.267 9.922 1100 H GLU 643 H GLU 643 -12.210 -15.631 12.844 1101 HA GLU 643 HA GLU 643 -11.619 -16.812 15.455 1102 HB2 GLU 643 HB2 GLU 643 -13.241 -14.883 15.344 1103 HB3 GLU 643 HB3 GLU 643 -14.254 -15.870 14.312 1104 HG2 GLU 643 HG2 GLU 643 -14.562 -17.475 16.089 1105 HG3 GLU 643 HG3 GLU 643 -13.495 -16.536 17.137 1106 H VAL 644 H VAL 644 -11.521 -18.989 15.368 1107 HA VAL 644 HA VAL 644 -12.962 -20.364 13.210 1108 HB VAL 644 HB VAL 644 -10.785 -21.459 14.994 1109 HG11 VAL 644 HG11 VAL 644 -10.661 -23.267 13.407 1110 HG12 VAL 644 HG12 VAL 644 -11.902 -22.514 12.406 1111 HG13 VAL 644 HG13 VAL 644 -12.310 -23.113 14.019 1112 HG21 VAL 644 HG21 VAL 644 -10.578 -20.371 12.194 1113 HG22 VAL 644 HG22 VAL 644 -9.292 -21.224 13.049 1114 HG23 VAL 644 HG23 VAL 644 -9.875 -19.663 13.642 1115 H ILE 645 H ILE 645 -14.848 -21.031 13.870 1116 HA ILE 645 HA ILE 645 -15.211 -21.809 16.668 1117 HB ILE 645 HB ILE 645 -17.300 -21.537 14.503 1118 HG12 ILE 645 HG12 ILE 645 -16.697 -19.558 16.704 1119 HG13 ILE 645 HG13 ILE 645 -16.014 -19.417 15.087 1120 HG21 ILE 645 HG21 ILE 645 -17.536 -21.713 17.528 1121 HG22 ILE 645 HG22 ILE 645 -17.965 -22.992 16.400 1122 HG23 ILE 645 HG23 ILE 645 -18.888 -21.488 16.421 1123 HD11 ILE 645 HD11 ILE 645 -18.233 -19.253 14.159 1124 HD12 ILE 645 HD12 ILE 645 -17.945 -17.993 15.353 1125 HD13 ILE 645 HD13 ILE 645 -18.949 -19.396 15.768 1126 H ILE 646 H ILE 646 -15.106 -23.816 17.172 1127 HA ILE 646 HA ILE 646 -15.335 -25.896 15.136 1128 HB ILE 646 HB ILE 646 -14.463 -26.176 18.043 1129 HG12 ILE 646 HG12 ILE 646 -12.701 -26.120 15.581 1130 HG13 ILE 646 HG13 ILE 646 -12.869 -24.780 16.710 1131 HG21 ILE 646 HG21 ILE 646 -13.630 -28.355 17.353 1132 HG22 ILE 646 HG22 ILE 646 -14.301 -28.091 15.742 1133 HG23 ILE 646 HG23 ILE 646 -15.375 -28.200 17.136 1134 HD11 ILE 646 HD11 ILE 646 -11.963 -26.163 18.499 1135 HD12 ILE 646 HD12 ILE 646 -10.841 -26.069 17.143 1136 HD13 ILE 646 HD13 ILE 646 -11.814 -27.520 17.387 1137 H GLU 647 H GLU 647 -17.342 -26.583 14.934 1138 HA GLU 647 HA GLU 647 -18.635 -27.518 17.282 1139 HB2 GLU 647 HB2 GLU 647 -20.811 -26.580 16.773 1140 HB3 GLU 647 HB3 GLU 647 -19.656 -25.282 16.891 1141 HG2 GLU 647 HG2 GLU 647 -19.653 -24.965 14.525 1142 HG3 GLU 647 HG3 GLU 647 -20.620 -26.427 14.279 1143 H GLU 648 H GLU 648 -20.749 -28.845 16.118 1144 HA GLU 648 HA GLU 648 -19.343 -30.166 14.022 1145 HB2 GLU 648 HB2 GLU 648 -21.208 -31.847 13.975 1146 HB3 GLU 648 HB3 GLU 648 -20.331 -31.755 15.481 1147 HG2 GLU 648 HG2 GLU 648 -22.637 -32.084 15.947 1148 HG3 GLU 648 HG3 GLU 648 -22.188 -30.449 16.421 1149 H SER 649 H SER 649 -19.752 -30.168 11.923 1150 HA SER 649 HA SER 649 -21.938 -28.416 11.053 1151 HB2 SER 649 HB2 SER 649 -19.463 -27.732 10.606 1152 HB3 SER 649 HB3 SER 649 -19.416 -29.111 9.515 1153 HG SER 649 HG SER 649 -21.556 -27.724 8.872 1154 H TYR 650 H TYR 650 -21.758 -31.287 11.864 1155 HA TYR 650 HA TYR 650 -21.822 -33.084 9.885 1156 HB2 TYR 650 HB2 TYR 650 -21.637 -33.064 12.443 1157 HB3 TYR 650 HB3 TYR 650 -23.395 -33.082 12.405 1158 HD1 TYR 650 HD1 TYR 650 -20.555 -34.610 10.902 1159 HD2 TYR 650 HD2 TYR 650 -24.375 -35.111 12.476 1160 HE1 TYR 650 HE1 TYR 650 -20.298 -37.039 10.592 1161 HE2 TYR 650 HE2 TYR 650 -24.243 -37.532 12.211 1162 HH TYR 650 HH TYR 650 -23.035 -39.131 10.912 1163 H GLU 651 H GLU 651 -24.486 -31.402 11.619 1164 HA GLU 651 HA GLU 651 -26.344 -32.525 9.747 1165 HB2 GLU 651 HB2 GLU 651 -28.125 -31.407 10.962 1166 HB3 GLU 651 HB3 GLU 651 -27.058 -32.250 12.065 1167 HG2 GLU 651 HG2 GLU 651 -26.064 -30.169 12.749 1168 HG3 GLU 651 HG3 GLU 651 -26.985 -29.311 11.506 1169 H PHE 652 H PHE 652 -24.793 -29.419 10.088 1170 HA PHE 652 HA PHE 652 -26.170 -28.569 7.634 1171 HB2 PHE 652 HB2 PHE 652 -26.308 -26.292 8.425 1172 HB3 PHE 652 HB3 PHE 652 -27.043 -27.327 9.639 1173 HD1 PHE 652 HD2 PHE 652 -25.569 -27.920 11.702 1174 HD2 PHE 652 HD1 PHE 652 -24.669 -24.755 8.998 1175 HE1 PHE 652 HE2 PHE 652 -24.119 -26.891 13.388 1176 HE2 PHE 652 HE1 PHE 652 -23.217 -23.723 10.685 1177 HZ PHE 652 HZ PHE 652 -22.939 -24.792 12.883 1178 H LYS 653 H LYS 653 -24.835 -27.872 6.050 1179 HA LYS 653 HA LYS 653 -21.991 -27.992 6.641 1180 HB2 LYS 653 HB2 LYS 653 -22.890 -29.282 4.735 1181 HB3 LYS 653 HB3 LYS 653 -23.448 -27.800 3.995 1182 HG2 LYS 653 HG2 LYS 653 -21.192 -27.040 3.675 1183 HG3 LYS 653 HG3 LYS 653 -20.562 -28.430 4.555 1184 HD2 LYS 653 HD2 LYS 653 -22.180 -28.630 2.015 1185 HD3 LYS 653 HD3 LYS 653 -20.420 -28.623 2.063 1186 HE2 LYS 653 HE2 LYS 653 -22.211 -30.670 3.396 1187 HE3 LYS 653 HE3 LYS 653 -21.320 -30.896 1.898 1188 HZ1 LYS 653 HZ1 LYS 653 -20.112 -30.438 4.583 1189 HZ2 LYS 653 HZ2 LYS 653 -19.254 -30.554 3.140 1190 HZ3 LYS 653 HZ3 LYS 653 -20.093 -31.873 3.706 1191 H SER 654 H SER 654 -24.455 -25.703 5.911 1192 HA SER 654 HA SER 654 -22.471 -23.569 6.046 1193 HB2 SER 654 HB2 SER 654 -24.866 -23.652 4.186 1194 HB3 SER 654 HB3 SER 654 -23.699 -22.333 4.324 1195 HG SER 654 HG SER 654 -22.080 -23.885 3.714 1196 H THR 655 H THR 655 -23.119 -21.806 7.282 1197 HA THR 655 HA THR 655 -25.263 -22.205 9.110 1198 HB THR 655 HB THR 655 -23.520 -19.762 8.667 1199 HG1 THR 655 HG1 THR 655 -22.496 -21.199 10.606 1200 HG21 THR 655 HG21 THR 655 -24.803 -20.898 11.164 1201 HG22 THR 655 HG22 THR 655 -25.408 -19.516 10.250 1202 HG23 THR 655 HG23 THR 655 -23.850 -19.414 11.070 1203 H VAL 656 H VAL 656 -27.299 -21.154 9.025 1204 HA VAL 656 HA VAL 656 -28.009 -19.778 6.588 1205 HB VAL 656 HB VAL 656 -29.648 -20.064 9.147 1206 HG11 VAL 656 HG11 VAL 656 -30.528 -19.379 6.340 1207 HG12 VAL 656 HG12 VAL 656 -30.464 -18.268 7.708 1208 HG13 VAL 656 HG13 VAL 656 -31.597 -19.619 7.723 1209 HG21 VAL 656 HG21 VAL 656 -30.798 -21.917 8.037 1210 HG22 VAL 656 HG22 VAL 656 -29.074 -22.253 8.222 1211 HG23 VAL 656 HG23 VAL 656 -29.715 -21.760 6.655 1212 H ASP 657 H ASP 657 -27.380 -19.018 9.903 1213 HA ASP 657 HA ASP 657 -27.839 -16.195 9.689 1214 HB2 ASP 657 HB2 ASP 657 -28.061 -17.176 11.859 1215 HB3 ASP 657 HB3 ASP 657 -26.453 -17.884 11.769 Start of MODEL 16 1 H HIS 501 H HIS 501 5.052 0.926 -0.890 2 HA HIS 501 HA HIS 501 3.714 -0.372 1.311 3 HB2 HIS 501 HB2 HIS 501 2.539 1.764 1.130 4 HB3 HIS 501 HB3 HIS 501 2.382 1.561 -0.608 5 HD1 HIS 501 HD1 HIS 501 0.792 0.576 2.626 6 HD2 HIS 501 HD2 HIS 501 0.407 -0.276 -1.423 7 HE1 HIS 501 HE1 HIS 501 -1.438 -0.568 2.355 8 H ALA 502 H ALA 502 3.468 -2.391 0.717 9 HA ALA 502 HA ALA 502 3.402 -3.048 -2.112 10 HB1 ALA 502 HB1 ALA 502 4.881 -4.354 -0.658 11 HB2 ALA 502 HB2 ALA 502 3.629 -5.388 -1.365 12 HB3 ALA 502 HB3 ALA 502 3.489 -4.831 0.304 13 H GLY 503 H GLY 503 1.504 -4.198 0.728 14 HA2 GLY 503 HA2 GLY 503 -0.973 -3.456 -0.315 15 HA3 GLY 503 HA3 GLY 503 -0.644 -5.121 -0.783 16 H ILE 504 H ILE 504 -2.559 -5.583 0.593 17 HA ILE 504 HA ILE 504 -2.037 -5.408 3.477 18 HB ILE 504 HB ILE 504 -4.624 -5.406 1.900 19 HG12 ILE 504 HG12 ILE 504 -5.121 -3.329 3.285 20 HG13 ILE 504 HG13 ILE 504 -3.444 -3.375 3.801 21 HG21 ILE 504 HG21 ILE 504 -5.024 -6.883 3.710 22 HG22 ILE 504 HG22 ILE 504 -5.880 -5.365 3.997 23 HG23 ILE 504 HG23 ILE 504 -4.386 -5.714 4.867 24 HD11 ILE 504 HD11 ILE 504 -2.732 -3.093 1.499 25 HD12 ILE 504 HD12 ILE 504 -3.810 -1.781 2.003 26 HD13 ILE 504 HD13 ILE 504 -4.410 -3.088 0.969 27 H PHE 505 H PHE 505 -1.724 -7.334 4.456 28 HA PHE 505 HA PHE 505 -2.889 -9.764 3.285 29 HB2 PHE 505 HB2 PHE 505 -0.759 -9.348 5.376 30 HB3 PHE 505 HB3 PHE 505 -1.598 -10.885 5.235 31 HD1 PHE 505 HD1 PHE 505 -1.589 -11.950 2.885 32 HD2 PHE 505 HD2 PHE 505 1.165 -8.989 4.165 33 HE1 PHE 505 HE1 PHE 505 -0.003 -12.691 1.169 34 HE2 PHE 505 HE2 PHE 505 2.748 -9.719 2.434 35 HZ PHE 505 HZ PHE 505 2.154 -11.581 0.928 36 H THR 506 H THR 506 -4.477 -10.920 4.320 37 HA THR 506 HA THR 506 -5.089 -10.661 7.041 38 HB THR 506 HB THR 506 -6.054 -8.459 6.213 39 HG1 THR 506 HG1 THR 506 -7.288 -8.847 7.877 40 HG21 THR 506 HG21 THR 506 -8.141 -8.540 4.870 41 HG22 THR 506 HG22 THR 506 -7.916 -10.279 4.657 42 HG23 THR 506 HG23 THR 506 -6.750 -9.150 3.976 43 H PHE 507 H PHE 507 -7.425 -11.796 7.306 44 HA PHE 507 HA PHE 507 -7.140 -14.252 5.829 45 HB2 PHE 507 HB2 PHE 507 -8.972 -13.442 8.082 46 HB3 PHE 507 HB3 PHE 507 -9.105 -14.976 7.246 47 HD1 PHE 507 HD2 PHE 507 -6.970 -12.977 9.477 48 HD2 PHE 507 HD1 PHE 507 -7.560 -16.706 7.539 49 HE1 PHE 507 HE2 PHE 507 -5.259 -13.984 10.910 50 HE2 PHE 507 HE1 PHE 507 -5.876 -17.733 8.942 51 HZ PHE 507 HZ PHE 507 -4.687 -16.346 10.657 52 H GLU 508 H GLU 508 -8.860 -15.272 4.687 53 HA GLU 508 HA GLU 508 -10.160 -13.481 2.948 54 HB2 GLU 508 HB2 GLU 508 -9.345 -15.721 2.300 55 HB3 GLU 508 HB3 GLU 508 -10.557 -16.440 3.349 56 HG2 GLU 508 HG2 GLU 508 -12.315 -15.497 2.024 57 HG3 GLU 508 HG3 GLU 508 -11.103 -14.661 1.038 58 H GLU 509 H GLU 509 -11.176 -15.463 5.652 59 HA GLU 509 HA GLU 509 -13.607 -13.876 5.699 60 HB2 GLU 509 HB2 GLU 509 -14.769 -15.777 6.770 61 HB3 GLU 509 HB3 GLU 509 -14.246 -16.164 5.144 62 HG2 GLU 509 HG2 GLU 509 -12.586 -16.960 7.504 63 HG3 GLU 509 HG3 GLU 509 -13.998 -17.904 7.052 64 HA PRO 510 HA PRO 510 -12.092 -12.841 9.733 65 HB2 PRO 510 HB2 PRO 510 -14.363 -11.921 10.882 66 HB3 PRO 510 HB3 PRO 510 -13.490 -10.999 9.654 67 HG2 PRO 510 HG2 PRO 510 -15.949 -12.675 9.376 68 HG3 PRO 510 HG3 PRO 510 -15.565 -11.118 8.619 69 HD2 PRO 510 HD2 PRO 510 -15.350 -13.529 7.340 70 HD3 PRO 510 HD3 PRO 510 -14.372 -12.108 6.927 71 H VAL 511 H VAL 511 -14.727 -15.003 9.214 72 HA VAL 511 HA VAL 511 -14.199 -16.429 11.709 73 HB VAL 511 HB VAL 511 -16.999 -15.767 10.727 74 HG11 VAL 511 HG11 VAL 511 -16.874 -17.897 11.844 75 HG12 VAL 511 HG12 VAL 511 -17.755 -16.735 12.839 76 HG13 VAL 511 HG13 VAL 511 -16.087 -17.148 13.233 77 HG21 VAL 511 HG21 VAL 511 -17.258 -14.384 12.755 78 HG22 VAL 511 HG22 VAL 511 -16.047 -13.741 11.651 79 HG23 VAL 511 HG23 VAL 511 -15.544 -14.594 13.106 80 H THR 512 H THR 512 -14.154 -18.594 11.279 81 HA THR 512 HA THR 512 -15.440 -19.498 8.820 82 HB THR 512 HB THR 512 -12.970 -19.392 8.483 83 HG1 THR 512 HG1 THR 512 -13.030 -21.139 7.391 84 HG21 THR 512 HG21 THR 512 -12.229 -19.753 10.767 85 HG22 THR 512 HG22 THR 512 -11.501 -20.954 9.693 86 HG23 THR 512 HG23 THR 512 -12.863 -21.396 10.724 87 H HIS 513 H HIS 513 -16.522 -21.427 8.995 88 HA HIS 513 HA HIS 513 -16.760 -22.499 11.716 89 HB2 HIS 513 HB2 HIS 513 -18.761 -22.560 9.425 90 HB3 HIS 513 HB3 HIS 513 -19.003 -23.333 10.982 91 HD1 HIS 513 HD1 HIS 513 -20.527 -21.946 12.484 92 HD2 HIS 513 HD2 HIS 513 -18.292 -19.591 9.864 93 HE1 HIS 513 HE1 HIS 513 -21.250 -19.594 12.868 94 H VAL 514 H VAL 514 -15.857 -24.415 11.980 95 HA VAL 514 HA VAL 514 -15.527 -26.075 9.602 96 HB VAL 514 HB VAL 514 -13.449 -26.960 10.466 97 HG11 VAL 514 HG11 VAL 514 -12.005 -24.944 10.448 98 HG12 VAL 514 HG12 VAL 514 -13.446 -23.951 10.582 99 HG13 VAL 514 HG13 VAL 514 -13.207 -24.962 9.156 100 HG21 VAL 514 HG21 VAL 514 -13.842 -25.168 12.869 101 HG22 VAL 514 HG22 VAL 514 -12.395 -26.125 12.534 102 HG23 VAL 514 HG23 VAL 514 -13.927 -26.930 12.859 103 H SER 515 H SER 515 -15.602 -28.334 9.914 104 HA SER 515 HA SER 515 -17.688 -29.172 11.614 105 HB2 SER 515 HB2 SER 515 -15.838 -30.376 9.633 106 HB3 SER 515 HB3 SER 515 -17.185 -31.277 10.288 107 HG SER 515 HG SER 515 -17.523 -30.142 8.208 108 H GLU 516 H GLU 516 -17.501 -30.813 13.240 109 HA GLU 516 HA GLU 516 -15.239 -30.836 14.868 110 HB2 GLU 516 HB2 GLU 516 -16.459 -32.576 16.157 111 HB3 GLU 516 HB3 GLU 516 -17.499 -31.324 15.599 112 HG2 GLU 516 HG2 GLU 516 -18.378 -32.670 13.830 113 HG3 GLU 516 HG3 GLU 516 -17.186 -33.920 14.130 114 H SER 517 H SER 517 -16.360 -33.304 12.525 115 HA SER 517 HA SER 517 -13.808 -34.659 12.836 116 HB2 SER 517 HB2 SER 517 -16.493 -35.683 11.922 117 HB3 SER 517 HB3 SER 517 -15.027 -36.668 11.974 118 HG SER 517 HG SER 517 -15.136 -35.740 14.374 119 H ILE 518 H ILE 518 -13.166 -32.851 11.427 120 HA ILE 518 HA ILE 518 -13.662 -33.464 8.604 121 HB ILE 518 HB ILE 518 -14.275 -31.260 9.216 122 HG12 ILE 518 HG12 ILE 518 -11.708 -31.123 7.625 123 HG13 ILE 518 HG13 ILE 518 -13.300 -31.514 6.973 124 HG21 ILE 518 HG21 ILE 518 -11.480 -30.832 10.243 125 HG22 ILE 518 HG22 ILE 518 -12.992 -30.889 11.166 126 HG23 ILE 518 HG23 ILE 518 -12.707 -29.569 10.044 127 HD11 ILE 518 HD11 ILE 518 -12.708 -29.230 6.500 128 HD12 ILE 518 HD12 ILE 518 -12.438 -28.951 8.229 129 HD13 ILE 518 HD13 ILE 518 -14.071 -29.300 7.644 130 H GLY 519 H GLY 519 -11.242 -33.289 11.063 131 HA2 GLY 519 HA2 GLY 519 -9.187 -34.370 10.972 132 HA3 GLY 519 HA3 GLY 519 -9.351 -34.462 9.221 133 H ILE 520 H ILE 520 -9.332 -32.261 8.106 134 HA ILE 520 HA ILE 520 -7.406 -30.462 9.367 135 HB ILE 520 HB ILE 520 -7.098 -31.708 6.617 136 HG12 ILE 520 HG12 ILE 520 -6.183 -33.093 8.448 137 HG13 ILE 520 HG13 ILE 520 -4.917 -32.499 7.382 138 HG21 ILE 520 HG21 ILE 520 -5.521 -29.430 7.789 139 HG22 ILE 520 HG22 ILE 520 -6.607 -29.366 6.403 140 HG23 ILE 520 HG23 ILE 520 -5.109 -30.291 6.305 141 HD11 ILE 520 HD11 ILE 520 -5.624 -31.378 10.086 142 HD12 ILE 520 HD12 ILE 520 -4.351 -30.777 9.025 143 HD13 ILE 520 HD13 ILE 520 -4.237 -32.397 9.712 144 H MET 521 H MET 521 -8.109 -28.493 9.165 145 HA MET 521 HA MET 521 -9.968 -27.899 6.976 146 HB2 MET 521 HB2 MET 521 -10.876 -26.116 8.337 147 HB3 MET 521 HB3 MET 521 -10.848 -27.581 9.297 148 HG2 MET 521 HG2 MET 521 -10.066 -26.035 10.853 149 HG3 MET 521 HG3 MET 521 -8.577 -26.569 10.116 150 HE1 MET 521 HE1 MET 521 -9.367 -23.779 11.671 151 HE2 MET 521 HE2 MET 521 -8.345 -22.619 10.817 152 HE3 MET 521 HE3 MET 521 -7.683 -24.177 11.316 153 H GLU 522 H GLU 522 -9.623 -25.946 5.788 154 HA GLU 522 HA GLU 522 -6.956 -24.815 6.102 155 HB2 GLU 522 HB2 GLU 522 -8.096 -26.022 3.633 156 HB3 GLU 522 HB3 GLU 522 -7.000 -24.658 3.492 157 HG2 GLU 522 HG2 GLU 522 -5.299 -25.817 4.632 158 HG3 GLU 522 HG3 GLU 522 -6.347 -27.203 4.967 159 H VAL 523 H VAL 523 -6.916 -22.793 6.268 160 HA VAL 523 HA VAL 523 -9.178 -21.190 5.281 161 HB VAL 523 HB VAL 523 -7.191 -20.591 7.494 162 HG11 VAL 523 HG11 VAL 523 -8.549 -18.649 7.964 163 HG12 VAL 523 HG12 VAL 523 -9.619 -19.026 6.617 164 HG13 VAL 523 HG13 VAL 523 -7.937 -18.571 6.315 165 HG21 VAL 523 HG21 VAL 523 -8.865 -22.354 7.971 166 HG22 VAL 523 HG22 VAL 523 -10.143 -21.156 7.708 167 HG23 VAL 523 HG23 VAL 523 -8.968 -20.951 9.012 168 H LYS 524 H LYS 524 -8.758 -19.674 3.800 169 HA LYS 524 HA LYS 524 -6.052 -19.464 2.831 170 HB2 LYS 524 HB2 LYS 524 -8.715 -18.787 1.664 171 HB3 LYS 524 HB3 LYS 524 -7.236 -18.102 0.996 172 HG2 LYS 524 HG2 LYS 524 -6.341 -20.289 0.630 173 HG3 LYS 524 HG3 LYS 524 -7.747 -21.024 1.392 174 HD2 LYS 524 HD2 LYS 524 -9.149 -20.286 -0.349 175 HD3 LYS 524 HD3 LYS 524 -7.837 -19.311 -1.056 176 HE2 LYS 524 HE2 LYS 524 -6.583 -21.216 -1.555 177 HE3 LYS 524 HE3 LYS 524 -7.685 -22.277 -0.679 178 HZ1 LYS 524 HZ1 LYS 524 -8.028 -22.456 -3.066 179 HZ2 LYS 524 HZ2 LYS 524 -8.277 -20.802 -3.208 180 HZ3 LYS 524 HZ3 LYS 524 -9.389 -21.763 -2.349 181 H VAL 525 H VAL 525 -4.903 -17.771 2.842 182 HA VAL 525 HA VAL 525 -5.876 -15.427 4.326 183 HB VAL 525 HB VAL 525 -3.026 -16.274 3.760 184 HG11 VAL 525 HG11 VAL 525 -2.398 -14.640 5.476 185 HG12 VAL 525 HG12 VAL 525 -4.089 -14.169 5.637 186 HG13 VAL 525 HG13 VAL 525 -3.232 -13.868 4.124 187 HG21 VAL 525 HG21 VAL 525 -4.107 -17.877 5.165 188 HG22 VAL 525 HG22 VAL 525 -4.656 -16.606 6.261 189 HG23 VAL 525 HG23 VAL 525 -2.929 -16.957 6.102 190 H LEU 526 H LEU 526 -6.131 -13.613 3.250 191 HA LEU 526 HA LEU 526 -5.834 -13.593 0.427 192 HB2 LEU 526 HB2 LEU 526 -6.682 -11.448 2.360 193 HB3 LEU 526 HB3 LEU 526 -6.690 -11.262 0.619 194 HG LEU 526 HG LEU 526 -8.361 -13.265 2.149 195 HD11 LEU 526 HD11 LEU 526 -10.233 -11.826 1.511 196 HD12 LEU 526 HD12 LEU 526 -9.090 -10.649 0.858 197 HD13 LEU 526 HD13 LEU 526 -9.092 -11.021 2.585 198 HD21 LEU 526 HD21 LEU 526 -8.333 -12.504 -0.773 199 HD22 LEU 526 HD22 LEU 526 -9.499 -13.569 0.006 200 HD23 LEU 526 HD23 LEU 526 -7.810 -14.048 -0.096 201 H ARG 527 H ARG 527 -4.322 -12.875 -0.711 202 HA ARG 527 HA ARG 527 -1.827 -12.115 0.416 203 HB2 ARG 527 HB2 ARG 527 -2.116 -13.593 -1.571 204 HB3 ARG 527 HB3 ARG 527 -2.719 -12.220 -2.473 205 HG2 ARG 527 HG2 ARG 527 -0.540 -11.113 -2.194 206 HG3 ARG 527 HG3 ARG 527 0.061 -12.541 -1.350 207 HD2 ARG 527 HD2 ARG 527 0.767 -12.640 -3.643 208 HD3 ARG 527 HD3 ARG 527 -0.452 -13.883 -3.366 209 HE ARG 527 HE ARG 527 -1.865 -11.739 -4.258 210 HH11 ARG 527 HH11 ARG 527 0.727 -13.745 -5.593 211 HH12 ARG 527 HH12 ARG 527 0.431 -13.301 -7.208 212 HH21 ARG 527 HH21 ARG 527 -2.313 -11.185 -6.510 213 HH22 ARG 527 HH22 ARG 527 -1.350 -11.848 -7.740 214 H THR 528 H THR 528 -0.613 -10.174 -0.318 215 HA THR 528 HA THR 528 -1.712 -7.767 0.199 216 HB THR 528 HB THR 528 0.347 -7.107 -1.291 217 HG1 THR 528 HG1 THR 528 0.527 -9.174 -2.178 218 HG21 THR 528 HG21 THR 528 0.603 -8.607 1.317 219 HG22 THR 528 HG22 THR 528 0.249 -6.886 1.146 220 HG23 THR 528 HG23 THR 528 1.813 -7.523 0.635 221 H SER 529 H SER 529 -2.729 -6.291 -0.973 222 HA SER 529 HA SER 529 -3.923 -6.474 -3.343 223 HB2 SER 529 HB2 SER 529 -2.676 -4.039 -2.075 224 HB3 SER 529 HB3 SER 529 -4.219 -4.132 -2.950 225 HG SER 529 HG SER 529 -5.127 -5.053 -1.310 226 H GLY 530 H GLY 530 -0.616 -5.399 -2.637 227 HA2 GLY 530 HA2 GLY 530 0.028 -5.643 -5.482 228 HA3 GLY 530 HA3 GLY 530 0.753 -4.428 -4.423 229 H ALA 531 H ALA 531 0.740 -7.713 -5.346 230 HA ALA 531 HA ALA 531 2.531 -8.531 -3.223 231 HB1 ALA 531 HB1 ALA 531 0.829 -10.081 -4.060 232 HB2 ALA 531 HB2 ALA 531 2.451 -10.725 -4.309 233 HB3 ALA 531 HB3 ALA 531 1.560 -10.026 -5.661 234 H ARG 532 H ARG 532 4.553 -7.849 -3.364 235 HA ARG 532 HA ARG 532 5.833 -7.834 -6.008 236 HB2 ARG 532 HB2 ARG 532 6.394 -5.871 -3.773 237 HB3 ARG 532 HB3 ARG 532 7.033 -5.828 -5.405 238 HG2 ARG 532 HG2 ARG 532 4.176 -5.354 -4.577 239 HG3 ARG 532 HG3 ARG 532 5.320 -4.141 -5.144 240 HD2 ARG 532 HD2 ARG 532 5.380 -5.187 -7.337 241 HD3 ARG 532 HD3 ARG 532 4.359 -6.496 -6.753 242 HE ARG 532 HE ARG 532 3.416 -3.733 -6.744 243 HH11 ARG 532 HH11 ARG 532 2.989 -7.123 -7.744 244 HH12 ARG 532 HH12 ARG 532 1.495 -6.832 -8.510 245 HH21 ARG 532 HH21 ARG 532 1.311 -3.407 -7.722 246 HH22 ARG 532 HH22 ARG 532 0.520 -4.725 -8.479 247 H GLY 533 H GLY 533 7.125 -9.574 -5.910 248 HA2 GLY 533 HA2 GLY 533 9.259 -10.413 -5.402 249 HA3 GLY 533 HA3 GLY 533 9.262 -9.453 -3.931 250 H ASN 534 H ASN 534 9.527 -10.830 -2.304 251 HA ASN 534 HA ASN 534 7.674 -13.076 -2.060 252 HB2 ASN 534 HB2 ASN 534 9.820 -13.988 -2.854 253 HB3 ASN 534 HB3 ASN 534 10.670 -13.152 -1.570 254 HD21 ASN 534 HD21 ASN 534 7.598 -14.870 -1.043 255 HD22 ASN 534 HD22 ASN 534 8.304 -16.102 -0.084 256 H VAL 535 H VAL 535 6.759 -13.229 -0.086 257 HA VAL 535 HA VAL 535 7.818 -11.618 2.130 258 HB VAL 535 HB VAL 535 4.901 -11.892 1.376 259 HG11 VAL 535 HG11 VAL 535 6.250 -10.196 3.459 260 HG12 VAL 535 HG12 VAL 535 5.204 -11.583 3.744 261 HG13 VAL 535 HG13 VAL 535 4.539 -10.105 3.070 262 HG21 VAL 535 HG21 VAL 535 6.729 -9.532 0.934 263 HG22 VAL 535 HG22 VAL 535 4.976 -9.493 0.736 264 HG23 VAL 535 HG23 VAL 535 5.965 -10.519 -0.309 265 H ILE 536 H ILE 536 7.565 -12.629 4.119 266 HA ILE 536 HA ILE 536 6.176 -15.212 4.116 267 HB ILE 536 HB ILE 536 8.460 -14.274 5.878 268 HG12 ILE 536 HG12 ILE 536 9.223 -15.099 3.732 269 HG13 ILE 536 HG13 ILE 536 9.659 -16.248 4.991 270 HG21 ILE 536 HG21 ILE 536 8.310 -16.485 6.978 271 HG22 ILE 536 HG22 ILE 536 6.802 -16.747 6.072 272 HG23 ILE 536 HG23 ILE 536 6.900 -15.446 7.247 273 HD11 ILE 536 HD11 ILE 536 7.488 -16.479 2.924 274 HD12 ILE 536 HD12 ILE 536 7.610 -17.542 4.314 275 HD13 ILE 536 HD13 ILE 536 8.914 -17.496 3.120 276 H VAL 537 H VAL 537 4.489 -15.432 5.419 277 HA VAL 537 HA VAL 537 4.029 -13.319 7.380 278 HB VAL 537 HB VAL 537 1.892 -14.905 5.929 279 HG11 VAL 537 HG11 VAL 537 1.691 -12.462 7.679 280 HG12 VAL 537 HG12 VAL 537 1.187 -14.099 8.104 281 HG13 VAL 537 HG13 VAL 537 0.346 -13.221 6.823 282 HG21 VAL 537 HG21 VAL 537 2.835 -12.094 5.413 283 HG22 VAL 537 HG22 VAL 537 1.444 -12.862 4.632 284 HG23 VAL 537 HG23 VAL 537 3.080 -13.484 4.365 285 HA PRO 538 HA PRO 538 4.185 -17.078 9.951 286 HB2 PRO 538 HB2 PRO 538 4.369 -15.760 12.318 287 HB3 PRO 538 HB3 PRO 538 5.771 -16.058 11.283 288 HG2 PRO 538 HG2 PRO 538 4.181 -13.576 11.680 289 HG3 PRO 538 HG3 PRO 538 5.913 -13.762 11.376 290 HD2 PRO 538 HD2 PRO 538 4.059 -13.016 9.481 291 HD3 PRO 538 HD3 PRO 538 5.627 -13.762 9.113 292 H TYR 539 H TYR 539 2.740 -17.997 11.503 293 HA TYR 539 HA TYR 539 0.429 -16.427 12.281 294 HB2 TYR 539 HB2 TYR 539 -1.233 -18.032 11.431 295 HB3 TYR 539 HB3 TYR 539 -0.259 -17.331 10.145 296 HD1 TYR 539 HD1 TYR 539 -0.932 -20.411 12.055 297 HD2 TYR 539 HD2 TYR 539 1.152 -18.677 8.789 298 HE1 TYR 539 HE1 TYR 539 -0.426 -22.653 11.197 299 HE2 TYR 539 HE2 TYR 539 1.658 -20.914 7.921 300 HH TYR 539 HH TYR 539 0.125 -23.667 8.956 301 H LYS 540 H LYS 540 -1.108 -17.778 13.653 302 HA LYS 540 HA LYS 540 0.131 -19.913 15.209 303 HB2 LYS 540 HB2 LYS 540 0.170 -18.662 17.284 304 HB3 LYS 540 HB3 LYS 540 1.166 -17.845 16.092 305 HG2 LYS 540 HG2 LYS 540 -0.675 -16.276 15.616 306 HG3 LYS 540 HG3 LYS 540 -1.623 -17.040 16.883 307 HD2 LYS 540 HD2 LYS 540 0.106 -16.395 18.526 308 HD3 LYS 540 HD3 LYS 540 1.002 -15.597 17.231 309 HE2 LYS 540 HE2 LYS 540 -0.912 -14.127 16.808 310 HE3 LYS 540 HE3 LYS 540 -1.797 -14.908 18.115 311 HZ1 LYS 540 HZ1 LYS 540 -0.064 -14.118 19.646 312 HZ2 LYS 540 HZ2 LYS 540 -0.875 -12.874 18.882 313 HZ3 LYS 540 HZ3 LYS 540 0.680 -13.282 18.380 314 H THR 541 H THR 541 -1.338 -21.026 16.475 315 HA THR 541 HA THR 541 -4.108 -20.338 16.148 316 HB THR 541 HB THR 541 -4.350 -22.480 17.557 317 HG1 THR 541 HG1 THR 541 -2.301 -22.886 18.336 318 HG21 THR 541 HG21 THR 541 -4.802 -22.405 15.180 319 HG22 THR 541 HG22 THR 541 -3.965 -23.909 15.577 320 HG23 THR 541 HG23 THR 541 -3.078 -22.555 14.846 321 H ILE 542 H ILE 542 -5.309 -19.456 17.659 322 HA ILE 542 HA ILE 542 -4.078 -18.772 20.222 323 HB ILE 542 HB ILE 542 -6.398 -17.647 18.697 324 HG12 ILE 542 HG12 ILE 542 -3.714 -16.390 19.289 325 HG13 ILE 542 HG13 ILE 542 -4.181 -17.112 17.753 326 HG21 ILE 542 HG21 ILE 542 -6.479 -15.851 20.403 327 HG22 ILE 542 HG22 ILE 542 -5.208 -16.671 21.302 328 HG23 ILE 542 HG23 ILE 542 -6.788 -17.438 21.114 329 HD11 ILE 542 HD11 ILE 542 -4.304 -14.670 17.756 330 HD12 ILE 542 HD12 ILE 542 -5.542 -14.745 19.019 331 HD13 ILE 542 HD13 ILE 542 -5.850 -15.435 17.420 332 H GLU 543 H GLU 543 -4.689 -20.046 21.799 333 HA GLU 543 HA GLU 543 -7.033 -21.711 21.756 334 HB2 GLU 543 HB2 GLU 543 -5.077 -21.039 23.960 335 HB3 GLU 543 HB3 GLU 543 -6.305 -22.293 24.045 336 HG2 GLU 543 HG2 GLU 543 -5.238 -23.584 22.403 337 HG3 GLU 543 HG3 GLU 543 -4.161 -22.263 21.953 338 H GLY 544 H GLY 544 -8.915 -20.638 21.876 339 HA2 GLY 544 HA2 GLY 544 -9.074 -18.468 23.869 340 HA3 GLY 544 HA3 GLY 544 -10.028 -18.507 22.391 341 H THR 545 H THR 545 -11.637 -20.066 22.160 342 HA THR 545 HA THR 545 -12.866 -20.668 24.731 343 HB THR 545 HB THR 545 -14.279 -20.504 22.080 344 HG1 THR 545 HG1 THR 545 -14.278 -18.262 22.212 345 HG21 THR 545 HG21 THR 545 -15.500 -21.111 24.140 346 HG22 THR 545 HG22 THR 545 -16.027 -19.546 23.479 347 HG23 THR 545 HG23 THR 545 -14.932 -19.599 24.864 348 H ALA 546 H ALA 546 -10.851 -22.341 23.406 349 HA ALA 546 HA ALA 546 -12.221 -24.832 23.303 350 HB1 ALA 546 HB1 ALA 546 -10.754 -23.864 20.836 351 HB2 ALA 546 HB2 ALA 546 -12.495 -24.106 20.962 352 HB3 ALA 546 HB3 ALA 546 -11.402 -25.488 21.073 353 H ARG 547 H ARG 547 -10.739 -26.574 23.573 354 HA ARG 547 HA ARG 547 -8.309 -25.776 24.855 355 HB2 ARG 547 HB2 ARG 547 -9.866 -28.300 24.644 356 HB3 ARG 547 HB3 ARG 547 -8.170 -28.366 25.117 357 HG2 ARG 547 HG2 ARG 547 -8.532 -27.050 27.002 358 HG3 ARG 547 HG3 ARG 547 -10.156 -26.597 26.484 359 HD2 ARG 547 HD2 ARG 547 -9.460 -29.469 26.925 360 HD3 ARG 547 HD3 ARG 547 -9.840 -28.439 28.306 361 HE ARG 547 HE ARG 547 -11.980 -27.978 27.206 362 HH11 ARG 547 HH11 ARG 547 -10.347 -30.934 26.112 363 HH12 ARG 547 HH12 ARG 547 -11.790 -31.795 25.817 364 HH21 ARG 547 HH21 ARG 547 -13.951 -29.206 26.912 365 HH22 ARG 547 HH22 ARG 547 -13.849 -30.784 26.267 366 H GLY 548 H GLY 548 -6.508 -25.566 23.904 367 HA2 GLY 548 HA2 GLY 548 -6.023 -26.732 21.277 368 HA3 GLY 548 HA3 GLY 548 -5.013 -25.536 22.073 369 H GLY 549 H GLY 549 -3.312 -27.022 21.277 370 HA2 GLY 549 HA2 GLY 549 -1.604 -28.429 21.889 371 HA3 GLY 549 HA3 GLY 549 -2.413 -28.653 23.435 372 H GLY 550 H GLY 550 -4.280 -29.241 20.636 373 HA2 GLY 550 HA2 GLY 550 -4.769 -31.203 19.498 374 HA3 GLY 550 HA3 GLY 550 -3.584 -32.036 20.487 375 H GLU 551 H GLU 551 -6.386 -30.116 21.522 376 HA GLU 551 HA GLU 551 -7.349 -32.611 22.733 377 HB2 GLU 551 HB2 GLU 551 -6.499 -30.760 24.292 378 HB3 GLU 551 HB3 GLU 551 -7.978 -29.909 23.842 379 HG2 GLU 551 HG2 GLU 551 -8.342 -31.081 25.880 380 HG3 GLU 551 HG3 GLU 551 -9.285 -31.842 24.603 381 H ASP 552 H ASP 552 -8.690 -29.356 21.975 382 HA ASP 552 HA ASP 552 -10.943 -30.728 20.681 383 HB2 ASP 552 HB2 ASP 552 -10.524 -27.781 21.320 384 HB3 ASP 552 HB3 ASP 552 -11.888 -28.384 20.399 385 H PHE 553 H PHE 553 -8.232 -28.660 20.181 386 HA PHE 553 HA PHE 553 -8.267 -29.351 17.380 387 HB2 PHE 553 HB2 PHE 553 -7.877 -27.083 16.617 388 HB3 PHE 553 HB3 PHE 553 -9.349 -27.091 17.573 389 HD1 PHE 553 HD1 PHE 553 -9.368 -26.049 19.823 390 HD2 PHE 553 HD2 PHE 553 -5.965 -25.836 17.285 391 HE1 PHE 553 HE1 PHE 553 -8.470 -24.200 21.171 392 HE2 PHE 553 HE2 PHE 553 -5.064 -24.000 18.632 393 HZ PHE 553 HZ PHE 553 -6.308 -23.176 20.568 394 H GLU 554 H GLU 554 -6.200 -29.273 16.490 395 HA GLU 554 HA GLU 554 -4.091 -29.614 18.430 396 HB2 GLU 554 HB2 GLU 554 -4.597 -30.878 16.132 397 HB3 GLU 554 HB3 GLU 554 -3.601 -29.571 15.502 398 HG2 GLU 554 HG2 GLU 554 -1.958 -30.237 17.344 399 HG3 GLU 554 HG3 GLU 554 -2.914 -31.702 17.435 400 H ASP 555 H ASP 555 -2.309 -28.249 18.571 401 HA ASP 555 HA ASP 555 -2.853 -25.495 17.820 402 HB2 ASP 555 HB2 ASP 555 -2.007 -26.018 20.098 403 HB3 ASP 555 HB3 ASP 555 -0.557 -26.712 19.397 404 H THR 556 H THR 556 -1.638 -24.316 16.304 405 HA THR 556 HA THR 556 0.614 -25.628 15.128 406 HB THR 556 HB THR 556 -1.338 -26.538 13.824 407 HG1 THR 556 HG1 THR 556 0.755 -26.253 12.938 408 HG21 THR 556 HG21 THR 556 -2.420 -25.043 12.168 409 HG22 THR 556 HG22 THR 556 -1.666 -23.655 12.959 410 HG23 THR 556 HG23 THR 556 -2.846 -24.636 13.825 411 H CYS 557 H CYS 557 1.860 -24.267 13.853 412 HA CYS 557 HA CYS 557 1.191 -21.528 13.517 413 HB2 CYS 557 HB2 CYS 557 3.145 -20.694 14.813 414 HB3 CYS 557 HB3 CYS 557 1.953 -21.483 15.828 415 HG CYS 557 HG CYS 557 3.396 -23.894 15.937 416 H GLY 558 H GLY 558 3.219 -20.487 12.371 417 HA2 GLY 558 HA2 GLY 558 5.291 -21.814 11.364 418 HA3 GLY 558 HA3 GLY 558 3.949 -22.374 10.365 419 H GLU 559 H GLU 559 5.162 -21.305 8.675 420 HA GLU 559 HA GLU 559 4.532 -18.455 8.580 421 HB2 GLU 559 HB2 GLU 559 7.082 -19.842 7.840 422 HB3 GLU 559 HB3 GLU 559 6.702 -18.189 7.373 423 HG2 GLU 559 HG2 GLU 559 6.662 -17.509 9.678 424 HG3 GLU 559 HG3 GLU 559 6.857 -19.178 10.206 425 H LEU 560 H LEU 560 3.525 -17.883 6.791 426 HA LEU 560 HA LEU 560 3.293 -19.834 4.627 427 HB2 LEU 560 HB2 LEU 560 1.662 -17.400 5.295 428 HB3 LEU 560 HB3 LEU 560 1.427 -18.378 3.864 429 HG LEU 560 HG LEU 560 1.044 -19.275 6.710 430 HD11 LEU 560 HD11 LEU 560 -0.672 -17.759 5.969 431 HD12 LEU 560 HD12 LEU 560 -1.304 -19.401 6.099 432 HD13 LEU 560 HD13 LEU 560 -0.930 -18.725 4.517 433 HD21 LEU 560 HD21 LEU 560 1.787 -21.176 5.465 434 HD22 LEU 560 HD22 LEU 560 0.797 -20.749 4.093 435 HD23 LEU 560 HD23 LEU 560 0.026 -21.310 5.583 436 H GLU 561 H GLU 561 4.083 -19.441 2.712 437 HA GLU 561 HA GLU 561 5.672 -17.036 2.419 438 HB2 GLU 561 HB2 GLU 561 6.694 -19.290 2.181 439 HB3 GLU 561 HB3 GLU 561 5.666 -19.547 0.774 440 HG2 GLU 561 HG2 GLU 561 6.750 -17.450 -0.184 441 HG3 GLU 561 HG3 GLU 561 7.845 -17.559 1.151 442 H PHE 562 H PHE 562 4.941 -15.464 1.227 443 HA PHE 562 HA PHE 562 3.108 -16.069 -0.975 444 HB2 PHE 562 HB2 PHE 562 3.195 -13.694 0.872 445 HB3 PHE 562 HB3 PHE 562 2.347 -13.663 -0.668 446 HD1 PHE 562 HD1 PHE 562 2.390 -15.071 2.724 447 HD2 PHE 562 HD2 PHE 562 0.298 -14.829 -0.973 448 HE1 PHE 562 HE1 PHE 562 0.383 -16.002 3.795 449 HE2 PHE 562 HE2 PHE 562 -1.704 -15.758 0.096 450 HZ PHE 562 HZ PHE 562 -1.663 -16.346 2.464 451 H GLN 563 H GLN 563 3.392 -14.779 -2.848 452 HA GLN 563 HA GLN 563 5.803 -13.203 -3.061 453 HB2 GLN 563 HB2 GLN 563 5.301 -15.663 -4.749 454 HB3 GLN 563 HB3 GLN 563 6.547 -14.463 -5.036 455 HG2 GLN 563 HG2 GLN 563 7.523 -15.065 -2.881 456 HG3 GLN 563 HG3 GLN 563 6.311 -16.316 -2.714 457 HE21 GLN 563 HE21 GLN 563 9.112 -15.322 -4.548 458 HE22 GLN 563 HE22 GLN 563 9.397 -16.883 -5.211 459 H ASN 564 H ASN 564 5.927 -12.610 -5.478 460 HA ASN 564 HA ASN 564 3.501 -11.425 -6.366 461 HB2 ASN 564 HB2 ASN 564 5.678 -10.476 -6.972 462 HB3 ASN 564 HB3 ASN 564 6.127 -11.969 -7.783 463 HD21 ASN 564 HD21 ASN 564 6.513 -10.943 -9.704 464 HD22 ASN 564 HD22 ASN 564 5.261 -10.295 -10.700 465 H ASP 565 H ASP 565 5.373 -14.265 -7.083 466 HA ASP 565 HA ASP 565 3.708 -15.245 -9.168 467 HB2 ASP 565 HB2 ASP 565 6.112 -15.715 -9.041 468 HB3 ASP 565 HB3 ASP 565 5.847 -16.631 -7.563 469 H GLU 566 H GLU 566 4.206 -16.223 -5.780 470 HA GLU 566 HA GLU 566 2.382 -18.321 -5.587 471 HB2 GLU 566 HB2 GLU 566 3.527 -16.370 -3.641 472 HB3 GLU 566 HB3 GLU 566 2.262 -17.476 -3.151 473 HG2 GLU 566 HG2 GLU 566 4.870 -18.337 -4.363 474 HG3 GLU 566 HG3 GLU 566 4.580 -18.214 -2.626 475 H ILE 567 H ILE 567 0.251 -18.411 -5.355 476 HA ILE 567 HA ILE 567 -1.233 -15.963 -5.616 477 HB ILE 567 HB ILE 567 -3.255 -17.591 -5.735 478 HG12 ILE 567 HG12 ILE 567 -1.101 -19.563 -6.514 479 HG13 ILE 567 HG13 ILE 567 -1.812 -19.599 -4.918 480 HG21 ILE 567 HG21 ILE 567 -2.434 -16.322 -7.619 481 HG22 ILE 567 HG22 ILE 567 -2.847 -17.958 -8.130 482 HG23 ILE 567 HG23 ILE 567 -1.159 -17.510 -7.896 483 HD11 ILE 567 HD11 ILE 567 -3.965 -19.989 -5.883 484 HD12 ILE 567 HD12 ILE 567 -2.804 -21.226 -6.379 485 HD13 ILE 567 HD13 ILE 567 -3.281 -19.947 -7.512 486 H VAL 568 H VAL 568 -2.174 -18.769 -3.603 487 HA VAL 568 HA VAL 568 -2.521 -16.900 -1.398 488 HB VAL 568 HB VAL 568 -4.690 -17.308 -2.677 489 HG11 VAL 568 HG11 VAL 568 -4.376 -19.582 -3.300 490 HG12 VAL 568 HG12 VAL 568 -5.870 -19.367 -2.389 491 HG13 VAL 568 HG13 VAL 568 -4.455 -20.074 -1.605 492 HG21 VAL 568 HG21 VAL 568 -6.078 -17.650 -0.698 493 HG22 VAL 568 HG22 VAL 568 -4.757 -16.531 -0.370 494 HG23 VAL 568 HG23 VAL 568 -4.665 -18.194 0.204 495 H LYS 569 H LYS 569 -2.650 -18.079 0.693 496 HA LYS 569 HA LYS 569 -1.551 -20.781 0.568 497 HB2 LYS 569 HB2 LYS 569 -0.873 -18.552 2.454 498 HB3 LYS 569 HB3 LYS 569 -0.395 -20.231 2.677 499 HG2 LYS 569 HG2 LYS 569 0.216 -19.099 0.115 500 HG3 LYS 569 HG3 LYS 569 1.100 -18.318 1.439 501 HD2 LYS 569 HD2 LYS 569 2.513 -20.081 0.651 502 HD3 LYS 569 HD3 LYS 569 1.738 -20.755 2.066 503 HE2 LYS 569 HE2 LYS 569 1.779 -22.378 0.256 504 HE3 LYS 569 HE3 LYS 569 0.128 -21.928 0.655 505 HZ1 LYS 569 HZ1 LYS 569 1.671 -20.771 -1.633 506 HZ2 LYS 569 HZ2 LYS 569 0.004 -20.585 -1.348 507 HZ3 LYS 569 HZ3 LYS 569 0.628 -22.069 -1.760 508 H THR 570 H THR 570 -2.007 -22.022 2.431 509 HA THR 570 HA THR 570 -4.449 -21.237 3.850 510 HB THR 570 HB THR 570 -4.872 -23.826 3.811 511 HG1 THR 570 HG1 THR 570 -3.999 -24.926 2.280 512 HG21 THR 570 HG21 THR 570 -6.272 -23.589 1.836 513 HG22 THR 570 HG22 THR 570 -5.470 -22.065 1.408 514 HG23 THR 570 HG23 THR 570 -6.411 -22.192 2.884 515 H ILE 571 H ILE 571 -4.659 -21.927 5.923 516 HA ILE 571 HA ILE 571 -2.307 -23.151 7.167 517 HB ILE 571 HB ILE 571 -4.754 -21.873 8.481 518 HG12 ILE 571 HG12 ILE 571 -2.972 -20.315 9.472 519 HG13 ILE 571 HG13 ILE 571 -1.906 -20.959 8.234 520 HG21 ILE 571 HG21 ILE 571 -3.934 -23.736 9.806 521 HG22 ILE 571 HG22 ILE 571 -3.670 -22.196 10.625 522 HG23 ILE 571 HG23 ILE 571 -2.325 -23.018 9.835 523 HD11 ILE 571 HD11 ILE 571 -2.834 -18.842 7.602 524 HD12 ILE 571 HD12 ILE 571 -4.475 -19.490 7.755 525 HD13 ILE 571 HD13 ILE 571 -3.377 -20.122 6.519 526 H SER 572 H SER 572 -2.391 -25.244 7.732 527 HA SER 572 HA SER 572 -4.946 -26.676 7.427 528 HB2 SER 572 HB2 SER 572 -2.114 -27.740 7.625 529 HB3 SER 572 HB3 SER 572 -3.553 -28.648 7.153 530 HG SER 572 HG SER 572 -3.303 -26.450 5.659 531 H VAL 573 H VAL 573 -5.993 -26.949 9.329 532 HA VAL 573 HA VAL 573 -4.343 -27.369 11.740 533 HB VAL 573 HB VAL 573 -7.105 -26.113 11.616 534 HG11 VAL 573 HG11 VAL 573 -5.341 -26.586 14.019 535 HG12 VAL 573 HG12 VAL 573 -6.866 -27.410 13.654 536 HG13 VAL 573 HG13 VAL 573 -6.856 -25.683 14.007 537 HG21 VAL 573 HG21 VAL 573 -5.417 -24.582 10.861 538 HG22 VAL 573 HG22 VAL 573 -4.420 -24.943 12.271 539 HG23 VAL 573 HG23 VAL 573 -5.949 -24.096 12.474 540 H LYS 574 H LYS 574 -4.557 -29.198 12.779 541 HA LYS 574 HA LYS 574 -6.439 -31.193 11.950 542 HB2 LYS 574 HB2 LYS 574 -4.231 -31.913 12.527 543 HB3 LYS 574 HB3 LYS 574 -4.265 -31.032 14.036 544 HG2 LYS 574 HG2 LYS 574 -4.458 -33.340 14.551 545 HG3 LYS 574 HG3 LYS 574 -6.021 -32.593 14.841 546 HD2 LYS 574 HD2 LYS 574 -6.312 -34.743 13.780 547 HD3 LYS 574 HD3 LYS 574 -6.802 -33.464 12.667 548 HE2 LYS 574 HE2 LYS 574 -4.774 -33.669 11.430 549 HE3 LYS 574 HE3 LYS 574 -4.076 -34.743 12.640 550 HZ1 LYS 574 HZ1 LYS 574 -4.908 -35.916 10.670 551 HZ2 LYS 574 HZ2 LYS 574 -6.466 -35.397 11.001 552 HZ3 LYS 574 HZ3 LYS 574 -5.656 -36.397 12.084 553 H VAL 575 H VAL 575 -8.415 -31.292 12.720 554 HA VAL 575 HA VAL 575 -9.015 -30.001 15.262 555 HB VAL 575 HB VAL 575 -10.937 -31.237 13.244 556 HG11 VAL 575 HG11 VAL 575 -11.846 -31.201 15.507 557 HG12 VAL 575 HG12 VAL 575 -12.682 -30.024 14.492 558 HG13 VAL 575 HG13 VAL 575 -11.470 -29.486 15.646 559 HG21 VAL 575 HG21 VAL 575 -11.502 -28.926 12.630 560 HG22 VAL 575 HG22 VAL 575 -9.804 -29.286 12.306 561 HG23 VAL 575 HG23 VAL 575 -10.251 -28.336 13.723 562 H ILE 576 H ILE 576 -9.379 -31.148 17.037 563 HA ILE 576 HA ILE 576 -8.875 -34.066 16.943 564 HB ILE 576 HB ILE 576 -8.977 -32.202 19.319 565 HG12 ILE 576 HG12 ILE 576 -7.262 -31.402 17.751 566 HG13 ILE 576 HG13 ILE 576 -6.589 -31.999 19.259 567 HG21 ILE 576 HG21 ILE 576 -7.683 -33.878 20.469 568 HG22 ILE 576 HG22 ILE 576 -7.626 -34.892 19.023 569 HG23 ILE 576 HG23 ILE 576 -9.166 -34.588 19.842 570 HD11 ILE 576 HD11 ILE 576 -5.921 -34.043 18.160 571 HD12 ILE 576 HD12 ILE 576 -5.247 -32.630 17.329 572 HD13 ILE 576 HD13 ILE 576 -6.658 -33.490 16.657 573 H ASP 577 H ASP 577 -10.250 -35.476 17.617 574 HA ASP 577 HA ASP 577 -12.954 -34.498 18.033 575 HB2 ASP 577 HB2 ASP 577 -11.937 -37.277 17.511 576 HB3 ASP 577 HB3 ASP 577 -13.588 -36.921 17.968 577 H ASP 578 H ASP 578 -12.560 -33.698 20.140 578 HA ASP 578 HA ASP 578 -12.442 -35.825 22.148 579 HB2 ASP 578 HB2 ASP 578 -11.117 -33.739 22.633 580 HB3 ASP 578 HB3 ASP 578 -12.620 -32.832 22.613 581 H GLU 579 H GLU 579 -14.260 -36.814 22.301 582 HA GLU 579 HA GLU 579 -16.679 -35.462 21.610 583 HB2 GLU 579 HB2 GLU 579 -16.179 -38.326 22.404 584 HB3 GLU 579 HB3 GLU 579 -17.729 -37.689 21.861 585 HG2 GLU 579 HG2 GLU 579 -16.784 -37.110 19.713 586 HG3 GLU 579 HG3 GLU 579 -15.191 -37.634 20.248 587 H GLU 580 H GLU 580 -16.669 -33.982 23.218 588 HA GLU 580 HA GLU 580 -18.043 -34.893 25.623 589 HB2 GLU 580 HB2 GLU 580 -15.676 -34.466 26.235 590 HB3 GLU 580 HB3 GLU 580 -15.795 -32.863 25.538 591 HG2 GLU 580 HG2 GLU 580 -15.937 -32.753 27.955 592 HG3 GLU 580 HG3 GLU 580 -17.452 -32.238 27.219 593 H TYR 581 H TYR 581 -19.918 -33.844 25.699 594 HA TYR 581 HA TYR 581 -20.337 -31.598 24.015 595 HB2 TYR 581 HB2 TYR 581 -22.166 -33.012 25.948 596 HB3 TYR 581 HB3 TYR 581 -22.648 -31.549 25.092 597 HD1 TYR 581 HD1 TYR 581 -22.485 -31.580 22.538 598 HD2 TYR 581 HD2 TYR 581 -22.423 -35.109 24.906 599 HE1 TYR 581 HE1 TYR 581 -23.132 -32.899 20.570 600 HE2 TYR 581 HE2 TYR 581 -23.069 -36.439 22.938 601 HH TYR 581 HH TYR 581 -22.864 -35.250 19.841 602 H GLU 582 H GLU 582 -19.714 -29.768 24.407 603 HA GLU 582 HA GLU 582 -19.822 -28.561 27.035 604 HB2 GLU 582 HB2 GLU 582 -17.543 -29.647 26.616 605 HB3 GLU 582 HB3 GLU 582 -17.373 -28.620 25.213 606 HG2 GLU 582 HG2 GLU 582 -17.342 -26.648 26.668 607 HG3 GLU 582 HG3 GLU 582 -17.551 -27.685 28.079 608 H LYS 583 H LYS 583 -18.875 -26.101 26.246 609 HA LYS 583 HA LYS 583 -20.957 -25.157 24.589 610 HB2 LYS 583 HB2 LYS 583 -20.035 -23.770 26.381 611 HB3 LYS 583 HB3 LYS 583 -18.452 -23.784 25.622 612 HG2 LYS 583 HG2 LYS 583 -19.438 -22.591 23.675 613 HG3 LYS 583 HG3 LYS 583 -20.958 -22.488 24.554 614 HD2 LYS 583 HD2 LYS 583 -18.341 -21.350 25.530 615 HD3 LYS 583 HD3 LYS 583 -19.558 -20.426 24.659 616 HE2 LYS 583 HE2 LYS 583 -21.177 -20.933 26.455 617 HE3 LYS 583 HE3 LYS 583 -19.905 -21.785 27.329 618 HZ1 LYS 583 HZ1 LYS 583 -20.196 -19.481 28.104 619 HZ2 LYS 583 HZ2 LYS 583 -19.811 -18.930 26.553 620 HZ3 LYS 583 HZ3 LYS 583 -18.655 -19.735 27.463 621 H ASN 584 H ASN 584 -20.828 -24.321 22.550 622 HA ASN 584 HA ASN 584 -19.433 -25.569 20.558 623 HB2 ASN 584 HB2 ASN 584 -21.399 -24.102 20.206 624 HB3 ASN 584 HB3 ASN 584 -20.389 -22.697 20.523 625 HD21 ASN 584 HD21 ASN 584 -20.824 -21.852 18.508 626 HD22 ASN 584 HD22 ASN 584 -20.137 -22.505 17.069 627 H LYS 585 H LYS 585 -17.508 -25.466 19.759 628 HA LYS 585 HA LYS 585 -15.500 -24.202 21.426 629 HB2 LYS 585 HB2 LYS 585 -15.303 -26.222 19.214 630 HB3 LYS 585 HB3 LYS 585 -14.016 -25.780 20.330 631 HG2 LYS 585 HG2 LYS 585 -16.627 -26.926 21.277 632 HG3 LYS 585 HG3 LYS 585 -15.257 -27.956 20.821 633 HD2 LYS 585 HD2 LYS 585 -13.944 -26.875 22.550 634 HD3 LYS 585 HD3 LYS 585 -15.301 -25.806 22.922 635 HE2 LYS 585 HE2 LYS 585 -15.175 -27.704 24.474 636 HE3 LYS 585 HE3 LYS 585 -16.663 -27.689 23.525 637 HZ1 LYS 585 HZ1 LYS 585 -15.619 -29.926 23.686 638 HZ2 LYS 585 HZ2 LYS 585 -14.274 -29.324 22.902 639 HZ3 LYS 585 HZ3 LYS 585 -15.732 -29.392 22.088 640 H THR 586 H THR 586 -14.221 -22.587 20.725 641 HA THR 586 HA THR 586 -13.777 -22.292 17.939 642 HB THR 586 HB THR 586 -15.820 -21.015 18.031 643 HG1 THR 586 HG1 THR 586 -13.976 -20.157 16.876 644 HG21 THR 586 HG21 THR 586 -14.569 -19.371 20.233 645 HG22 THR 586 HG22 THR 586 -15.901 -20.521 20.421 646 HG23 THR 586 HG23 THR 586 -16.124 -19.063 19.453 647 H PHE 587 H PHE 587 -11.903 -21.430 17.462 648 HA PHE 587 HA PHE 587 -10.391 -20.209 19.622 649 HB2 PHE 587 HB2 PHE 587 -8.362 -21.385 18.898 650 HB3 PHE 587 HB3 PHE 587 -9.599 -22.542 19.358 651 HD1 PHE 587 HD1 PHE 587 -10.798 -23.790 17.513 652 HD2 PHE 587 HD2 PHE 587 -7.380 -21.365 16.816 653 HE1 PHE 587 HE1 PHE 587 -10.386 -24.972 15.386 654 HE2 PHE 587 HE2 PHE 587 -6.971 -22.537 14.692 655 HZ PHE 587 HZ PHE 587 -8.478 -24.343 13.982 656 H PHE 588 H PHE 588 -8.318 -19.205 18.418 657 HA PHE 588 HA PHE 588 -9.503 -17.830 16.130 658 HB2 PHE 588 HB2 PHE 588 -7.828 -16.557 18.342 659 HB3 PHE 588 HB3 PHE 588 -8.376 -15.760 16.881 660 HD1 PHE 588 HD1 PHE 588 -9.554 -17.422 19.989 661 HD2 PHE 588 HD2 PHE 588 -10.444 -14.728 16.821 662 HE1 PHE 588 HE1 PHE 588 -11.606 -16.719 21.172 663 HE2 PHE 588 HE2 PHE 588 -12.470 -14.016 17.987 664 HZ PHE 588 HZ PHE 588 -13.062 -15.016 20.169 665 H LEU 589 H LEU 589 -8.064 -17.162 14.584 666 HA LEU 589 HA LEU 589 -5.382 -18.392 14.729 667 HB2 LEU 589 HB2 LEU 589 -7.356 -19.093 12.960 668 HB3 LEU 589 HB3 LEU 589 -6.610 -17.766 12.098 669 HG LEU 589 HG LEU 589 -5.727 -19.826 11.281 670 HD11 LEU 589 HD11 LEU 589 -4.111 -18.072 11.313 671 HD12 LEU 589 HD12 LEU 589 -3.321 -19.599 11.707 672 HD13 LEU 589 HD13 LEU 589 -3.689 -18.440 12.984 673 HD21 LEU 589 HD21 LEU 589 -6.222 -21.254 13.132 674 HD22 LEU 589 HD22 LEU 589 -5.030 -20.437 14.132 675 HD23 LEU 589 HD23 LEU 589 -4.506 -21.388 12.736 676 H GLU 590 H GLU 590 -3.794 -16.881 14.466 677 HA GLU 590 HA GLU 590 -4.622 -14.317 13.341 678 HB2 GLU 590 HB2 GLU 590 -4.577 -14.219 15.813 679 HB3 GLU 590 HB3 GLU 590 -2.865 -14.629 15.779 680 HG2 GLU 590 HG2 GLU 590 -2.448 -12.553 14.511 681 HG3 GLU 590 HG3 GLU 590 -4.159 -12.158 14.642 682 H ILE 591 H ILE 591 -3.047 -13.302 12.162 683 HA ILE 591 HA ILE 591 -0.652 -14.874 11.651 684 HB ILE 591 HB ILE 591 -0.530 -13.593 9.487 685 HG12 ILE 591 HG12 ILE 591 -3.340 -12.781 10.261 686 HG13 ILE 591 HG13 ILE 591 -1.966 -11.702 10.043 687 HG21 ILE 591 HG21 ILE 591 -2.248 -14.955 8.343 688 HG22 ILE 591 HG22 ILE 591 -2.904 -15.388 9.928 689 HG23 ILE 591 HG23 ILE 591 -1.268 -15.864 9.490 690 HD11 ILE 591 HD11 ILE 591 -3.323 -13.341 7.928 691 HD12 ILE 591 HD12 ILE 591 -1.923 -12.295 7.653 692 HD13 ILE 591 HD13 ILE 591 -3.470 -11.596 8.146 693 H GLY 592 H GLY 592 1.269 -13.689 11.254 694 HA2 GLY 592 HA2 GLY 592 1.375 -11.343 13.009 695 HA3 GLY 592 HA3 GLY 592 2.738 -12.377 12.612 696 H GLU 593 H GLU 593 3.547 -10.110 12.334 697 HA GLU 593 HA GLU 593 2.777 -8.521 10.178 698 HB2 GLU 593 HB2 GLU 593 5.118 -8.652 11.984 699 HB3 GLU 593 HB3 GLU 593 5.272 -7.705 10.507 700 HG2 GLU 593 HG2 GLU 593 2.855 -7.335 12.112 701 HG3 GLU 593 HG3 GLU 593 4.355 -6.643 12.771 702 HA PRO 594 HA PRO 594 4.464 -10.878 6.900 703 HB2 PRO 594 HB2 PRO 594 4.089 -8.962 4.973 704 HB3 PRO 594 HB3 PRO 594 2.836 -10.082 5.495 705 HG2 PRO 594 HG2 PRO 594 3.227 -7.237 6.135 706 HG3 PRO 594 HG3 PRO 594 1.734 -8.178 6.044 707 HD2 PRO 594 HD2 PRO 594 3.044 -7.395 8.360 708 HD3 PRO 594 HD3 PRO 594 1.853 -8.694 8.309 709 H ARG 595 H ARG 595 6.496 -11.080 6.669 710 HA ARG 595 HA ARG 595 8.207 -8.722 6.768 711 HB2 ARG 595 HB2 ARG 595 10.039 -10.377 7.367 712 HB3 ARG 595 HB3 ARG 595 8.787 -10.158 8.580 713 HG2 ARG 595 HG2 ARG 595 7.746 -12.248 7.926 714 HG3 ARG 595 HG3 ARG 595 8.903 -12.423 6.611 715 HD2 ARG 595 HD2 ARG 595 9.659 -12.319 9.527 716 HD3 ARG 595 HD3 ARG 595 9.407 -13.815 8.627 717 HE ARG 595 HE ARG 595 11.454 -11.819 7.910 718 HH11 ARG 595 HH11 ARG 595 10.541 -15.240 8.490 719 HH12 ARG 595 HH12 ARG 595 12.026 -15.846 7.944 720 HH21 ARG 595 HH21 ARG 595 13.490 -12.694 7.176 721 HH22 ARG 595 HH22 ARG 595 13.735 -14.383 7.181 722 H LEU 596 H LEU 596 8.986 -8.087 4.973 723 HA LEU 596 HA LEU 596 8.827 -9.393 2.541 724 HB2 LEU 596 HB2 LEU 596 9.134 -6.890 3.133 725 HB3 LEU 596 HB3 LEU 596 10.822 -7.301 3.329 726 HG LEU 596 HG LEU 596 10.164 -6.183 1.142 727 HD11 LEU 596 HD11 LEU 596 11.545 -8.852 0.935 728 HD12 LEU 596 HD12 LEU 596 12.305 -7.336 1.417 729 HD13 LEU 596 HD13 LEU 596 11.666 -7.519 -0.214 730 HD21 LEU 596 HD21 LEU 596 8.114 -7.503 0.893 731 HD22 LEU 596 HD22 LEU 596 9.094 -8.921 0.529 732 HD23 LEU 596 HD23 LEU 596 9.126 -7.517 -0.556 733 H VAL 597 H VAL 597 10.131 -10.866 1.662 734 HA VAL 597 HA VAL 597 12.327 -11.836 3.267 735 HB VAL 597 HB VAL 597 11.310 -12.927 0.634 736 HG11 VAL 597 HG11 VAL 597 13.616 -13.575 1.134 737 HG12 VAL 597 HG12 VAL 597 12.530 -14.959 1.269 738 HG13 VAL 597 HG13 VAL 597 13.114 -14.152 2.725 739 HG21 VAL 597 HG21 VAL 597 10.725 -13.787 3.444 740 HG22 VAL 597 HG22 VAL 597 10.218 -14.631 1.972 741 HG23 VAL 597 HG23 VAL 597 9.591 -13.020 2.328 742 H GLU 598 H GLU 598 13.796 -10.347 3.085 743 HA GLU 598 HA GLU 598 14.786 -9.670 0.473 744 HB2 GLU 598 HB2 GLU 598 14.698 -7.907 2.180 745 HB3 GLU 598 HB3 GLU 598 15.697 -8.873 3.253 746 HG2 GLU 598 HG2 GLU 598 16.893 -7.024 2.105 747 HG3 GLU 598 HG3 GLU 598 17.585 -8.626 1.853 748 H MET 599 H MET 599 16.313 -10.855 -0.460 749 HA MET 599 HA MET 599 17.314 -13.146 0.936 750 HB2 MET 599 HB2 MET 599 16.656 -13.214 -1.459 751 HB3 MET 599 HB3 MET 599 18.007 -12.161 -1.844 752 HG2 MET 599 HG2 MET 599 19.581 -13.858 -1.179 753 HG3 MET 599 HG3 MET 599 18.277 -14.888 -0.599 754 HE1 MET 599 HE1 MET 599 16.486 -16.052 -2.170 755 HE2 MET 599 HE2 MET 599 16.473 -15.910 -3.926 756 HE3 MET 599 HE3 MET 599 16.057 -14.516 -2.933 757 H SER 600 H SER 600 18.319 -9.961 0.416 758 HA SER 600 HA SER 600 21.098 -10.366 0.852 759 HB2 SER 600 HB2 SER 600 20.293 -8.386 -0.348 760 HB3 SER 600 HB3 SER 600 19.370 -7.872 1.055 761 HG SER 600 HG SER 600 21.029 -6.990 1.805 762 H GLU 601 H GLU 601 18.406 -10.606 2.876 763 HA GLU 601 HA GLU 601 19.240 -9.623 5.377 764 HB2 GLU 601 HB2 GLU 601 16.961 -10.525 4.746 765 HB3 GLU 601 HB3 GLU 601 17.646 -12.133 4.790 766 HG2 GLU 601 HG2 GLU 601 16.479 -11.810 6.808 767 HG3 GLU 601 HG3 GLU 601 18.197 -11.719 7.197 768 H LYS 602 H LYS 602 21.051 -10.213 6.431 769 HA LYS 602 HA LYS 602 22.373 -12.646 5.541 770 HB2 LYS 602 HB2 LYS 602 23.529 -10.510 5.186 771 HB3 LYS 602 HB3 LYS 602 23.517 -10.217 6.915 772 HG2 LYS 602 HG2 LYS 602 25.698 -10.983 6.169 773 HG3 LYS 602 HG3 LYS 602 24.967 -12.182 7.243 774 HD2 LYS 602 HD2 LYS 602 24.302 -13.521 5.341 775 HD3 LYS 602 HD3 LYS 602 24.910 -12.296 4.227 776 HE2 LYS 602 HE2 LYS 602 26.429 -14.183 4.423 777 HE3 LYS 602 HE3 LYS 602 27.175 -12.706 5.014 778 HZ1 LYS 602 HZ1 LYS 602 27.545 -14.722 6.393 779 HZ2 LYS 602 HZ2 LYS 602 25.917 -14.726 6.818 780 HZ3 LYS 602 HZ3 LYS 602 26.903 -13.427 7.243 781 H LYS 603 H LYS 603 22.673 -14.283 6.831 782 HA LYS 603 HA LYS 603 23.047 -13.808 9.631 783 HB2 LYS 603 HB2 LYS 603 21.689 -15.746 10.338 784 HB3 LYS 603 HB3 LYS 603 20.690 -14.538 9.569 785 HG2 LYS 603 HG2 LYS 603 21.657 -17.025 8.169 786 HG3 LYS 603 HG3 LYS 603 20.149 -16.949 9.075 787 HD2 LYS 603 HD2 LYS 603 19.439 -15.083 7.576 788 HD3 LYS 603 HD3 LYS 603 20.897 -15.355 6.625 789 HE2 LYS 603 HE2 LYS 603 19.034 -16.507 5.589 790 HE3 LYS 603 HE3 LYS 603 20.176 -17.679 6.234 791 HZ1 LYS 603 HZ1 LYS 603 17.889 -18.282 6.708 792 HZ2 LYS 603 HZ2 LYS 603 17.638 -16.852 7.547 793 HZ3 LYS 603 HZ3 LYS 603 18.709 -18.000 8.147 794 H GLY 604 H GLY 604 23.865 -16.078 10.576 795 HA2 GLY 604 HA2 GLY 604 25.074 -17.899 8.927 796 HA3 GLY 604 HA3 GLY 604 26.198 -16.556 9.096 797 H GLY 605 H GLY 605 27.569 -18.067 10.109 798 HA2 GLY 605 HA2 GLY 605 27.204 -17.998 12.965 799 HA3 GLY 605 HA3 GLY 605 27.292 -19.605 12.246 800 H PHE 606 H PHE 606 28.966 -16.517 11.866 801 HA PHE 606 HA PHE 606 31.480 -17.816 11.314 802 HB2 PHE 606 HB2 PHE 606 30.768 -14.922 11.800 803 HB3 PHE 606 HB3 PHE 606 32.411 -15.467 11.525 804 HD1 PHE 606 HD2 PHE 606 32.964 -16.549 9.345 805 HD2 PHE 606 HD1 PHE 606 29.306 -14.501 10.018 806 HE1 PHE 606 HE2 PHE 606 32.660 -16.316 6.917 807 HE2 PHE 606 HE1 PHE 606 28.993 -14.259 7.590 808 HZ PHE 606 HZ PHE 606 30.679 -15.169 6.038 809 H THR 607 H THR 607 33.458 -17.257 12.592 810 HA THR 607 HA THR 607 33.029 -17.847 15.309 811 HB THR 607 HB THR 607 35.588 -17.154 13.832 812 HG1 THR 607 HG1 THR 607 34.092 -19.464 14.350 813 HG21 THR 607 HG21 THR 607 35.803 -16.853 16.290 814 HG22 THR 607 HG22 THR 607 36.741 -18.232 15.719 815 HG23 THR 607 HG23 THR 607 35.197 -18.494 16.529 816 H ILE 608 H ILE 608 31.739 -16.142 15.839 817 HA ILE 608 HA ILE 608 33.193 -13.802 16.814 818 HB ILE 608 HB ILE 608 30.407 -13.710 15.574 819 HG12 ILE 608 HG12 ILE 608 32.973 -12.463 14.534 820 HG13 ILE 608 HG13 ILE 608 32.201 -13.887 13.854 821 HG21 ILE 608 HG21 ILE 608 30.656 -12.172 17.446 822 HG22 ILE 608 HG22 ILE 608 30.537 -11.287 15.927 823 HG23 ILE 608 HG23 ILE 608 32.104 -11.483 16.710 824 HD11 ILE 608 HD11 ILE 608 31.033 -11.111 13.950 825 HD12 ILE 608 HD12 ILE 608 30.248 -12.534 13.264 826 HD13 ILE 608 HD13 ILE 608 31.725 -11.904 12.535 827 H THR 609 H THR 609 33.210 -14.511 18.879 828 HA THR 609 HA THR 609 32.514 -14.836 20.967 829 HB THR 609 HB THR 609 29.694 -14.088 20.092 830 HG1 THR 609 HG1 THR 609 32.041 -12.688 20.027 831 HG21 THR 609 HG21 THR 609 31.253 -13.597 22.648 832 HG22 THR 609 HG22 THR 609 29.989 -14.809 22.451 833 HG23 THR 609 HG23 THR 609 29.590 -13.093 22.350 834 H GLU 610 H GLU 610 32.279 -16.995 18.820 835 HA GLU 610 HA GLU 610 30.253 -18.760 19.953 836 HB2 GLU 610 HB2 GLU 610 31.058 -20.470 18.367 837 HB3 GLU 610 HB3 GLU 610 30.760 -18.961 17.521 838 HG2 GLU 610 HG2 GLU 610 33.093 -18.503 17.373 839 HG3 GLU 610 HG3 GLU 610 33.477 -19.835 18.455 840 H GLU 611 H GLU 611 33.148 -17.692 20.745 841 HA GLU 611 HA GLU 611 34.600 -19.866 21.802 842 HB2 GLU 611 HB2 GLU 611 35.188 -17.369 21.175 843 HB3 GLU 611 HB3 GLU 611 34.668 -17.038 22.809 844 HG2 GLU 611 HG2 GLU 611 36.871 -18.962 22.131 845 HG3 GLU 611 HG3 GLU 611 37.131 -17.250 22.413 846 H TYR 612 H TYR 612 33.385 -21.134 23.113 847 HA TYR 612 HA TYR 612 32.263 -21.971 24.761 848 HB2 TYR 612 HB2 TYR 612 33.069 -19.493 26.273 849 HB3 TYR 612 HB3 TYR 612 32.004 -20.697 26.994 850 HD1 TYR 612 HD1 TYR 612 32.891 -23.183 26.778 851 HD2 TYR 612 HD2 TYR 612 35.336 -19.717 26.649 852 HE1 TYR 612 HE1 TYR 612 34.826 -24.540 27.433 853 HE2 TYR 612 HE2 TYR 612 37.287 -21.063 27.300 854 HH TYR 612 HH TYR 612 37.256 -24.426 27.183 855 H ASP 613 H ASP 613 30.693 -21.893 23.239 856 HA ASP 613 HA ASP 613 28.170 -21.293 24.282 857 HB2 ASP 613 HB2 ASP 613 28.947 -18.977 23.395 858 HB3 ASP 613 HB3 ASP 613 28.866 -19.701 21.795 859 H ASP 614 H ASP 614 26.729 -22.631 23.106 860 HA ASP 614 HA ASP 614 28.126 -24.119 20.989 861 HB2 ASP 614 HB2 ASP 614 27.863 -25.438 23.025 862 HB3 ASP 614 HB3 ASP 614 26.120 -25.225 22.945 863 H LYS 615 H LYS 615 25.068 -22.616 21.803 864 HA LYS 615 HA LYS 615 23.920 -23.905 19.466 865 HB2 LYS 615 HB2 LYS 615 22.506 -22.099 21.427 866 HB3 LYS 615 HB3 LYS 615 21.751 -23.003 20.125 867 HG2 LYS 615 HG2 LYS 615 23.061 -24.101 22.603 868 HG3 LYS 615 HG3 LYS 615 21.370 -24.236 22.111 869 HD2 LYS 615 HD2 LYS 615 22.017 -25.623 20.212 870 HD3 LYS 615 HD3 LYS 615 23.715 -25.450 20.654 871 HE2 LYS 615 HE2 LYS 615 23.138 -26.488 22.851 872 HE3 LYS 615 HE3 LYS 615 21.556 -26.875 22.166 873 HZ1 LYS 615 HZ1 LYS 615 22.713 -28.085 20.384 874 HZ2 LYS 615 HZ2 LYS 615 23.043 -28.732 21.901 875 HZ3 LYS 615 HZ3 LYS 615 24.190 -27.739 21.137 876 H GLN 616 H GLN 616 23.907 -20.499 20.509 877 HA GLN 616 HA GLN 616 24.524 -19.898 17.758 878 HB2 GLN 616 HB2 GLN 616 22.798 -18.094 17.690 879 HB3 GLN 616 HB3 GLN 616 22.138 -19.719 17.713 880 HG2 GLN 616 HG2 GLN 616 21.520 -19.492 20.020 881 HG3 GLN 616 HG3 GLN 616 22.355 -17.942 20.132 882 HE21 GLN 616 HE21 GLN 616 21.468 -16.161 19.172 883 HE22 GLN 616 HE22 GLN 616 19.821 -16.096 18.665 884 HA PRO 617 HA PRO 617 27.292 -17.330 20.016 885 HB2 PRO 617 HB2 PRO 617 28.487 -16.138 17.889 886 HB3 PRO 617 HB3 PRO 617 28.838 -17.802 18.369 887 HG2 PRO 617 HG2 PRO 617 27.016 -16.800 16.220 888 HG3 PRO 617 HG3 PRO 617 28.180 -18.135 16.162 889 HD2 PRO 617 HD2 PRO 617 25.534 -18.533 16.525 890 HD3 PRO 617 HD3 PRO 617 26.759 -19.587 17.264 891 H LEU 618 H LEU 618 27.458 -15.130 20.563 892 HA LEU 618 HA LEU 618 25.206 -13.514 20.021 893 HB2 LEU 618 HB2 LEU 618 27.835 -12.704 21.256 894 HB3 LEU 618 HB3 LEU 618 26.407 -11.701 21.196 895 HG LEU 618 HG LEU 618 26.736 -14.257 22.765 896 HD11 LEU 618 HD11 LEU 618 26.372 -11.402 23.628 897 HD12 LEU 618 HD12 LEU 618 27.864 -12.333 23.718 898 HD13 LEU 618 HD13 LEU 618 26.471 -12.804 24.693 899 HD21 LEU 618 HD21 LEU 618 24.343 -12.452 22.470 900 HD22 LEU 618 HD22 LEU 618 24.501 -13.744 23.654 901 HD23 LEU 618 HD23 LEU 618 24.460 -14.131 21.933 902 H THR 619 H THR 619 25.053 -13.310 17.890 903 HA THR 619 HA THR 619 26.612 -11.118 16.805 904 HB THR 619 HB THR 619 25.923 -13.612 15.198 905 HG1 THR 619 HG1 THR 619 27.957 -13.164 16.908 906 HG21 THR 619 HG21 THR 619 26.087 -11.516 13.896 907 HG22 THR 619 HG22 THR 619 27.413 -12.614 13.511 908 HG23 THR 619 HG23 THR 619 27.692 -11.233 14.567 909 H SER 620 H SER 620 24.943 -9.695 16.939 910 HA SER 620 HA SER 620 22.286 -10.561 16.186 911 HB2 SER 620 HB2 SER 620 22.698 -9.251 18.303 912 HB3 SER 620 HB3 SER 620 23.230 -7.902 17.303 913 HG SER 620 HG SER 620 21.118 -7.566 17.769 914 H LYS 621 H LYS 621 21.115 -9.349 14.589 915 HA LYS 621 HA LYS 621 22.775 -8.703 12.364 916 HB2 LYS 621 HB2 LYS 621 19.789 -8.486 12.659 917 HB3 LYS 621 HB3 LYS 621 20.669 -8.274 11.154 918 HG2 LYS 621 HG2 LYS 621 21.487 -10.633 11.435 919 HG3 LYS 621 HG3 LYS 621 20.347 -10.787 12.771 920 HD2 LYS 621 HD2 LYS 621 19.646 -10.095 9.914 921 HD3 LYS 621 HD3 LYS 621 19.410 -11.661 10.679 922 HE2 LYS 621 HE2 LYS 621 17.837 -10.688 12.245 923 HE3 LYS 621 HE3 LYS 621 18.136 -9.083 11.573 924 HZ1 LYS 621 HZ1 LYS 621 16.882 -11.373 10.166 925 HZ2 LYS 621 HZ2 LYS 621 17.300 -9.898 9.454 926 HZ3 LYS 621 HZ3 LYS 621 16.126 -9.947 10.670 927 H GLU 622 H GLU 622 23.842 -6.921 12.519 928 HA GLU 622 HA GLU 622 22.352 -4.469 13.050 929 HB2 GLU 622 HB2 GLU 622 25.321 -5.034 13.313 930 HB3 GLU 622 HB3 GLU 622 24.581 -3.454 13.530 931 HG2 GLU 622 HG2 GLU 622 23.277 -4.324 15.422 932 HG3 GLU 622 HG3 GLU 622 24.025 -5.901 15.208 933 H GLU 623 H GLU 623 22.942 -2.653 11.636 934 HA GLU 623 HA GLU 623 23.148 -1.717 9.629 935 HB2 GLU 623 HB2 GLU 623 25.236 -3.875 9.242 936 HB3 GLU 623 HB3 GLU 623 24.967 -2.565 8.099 937 HG2 GLU 623 HG2 GLU 623 25.789 -2.250 10.978 938 HG3 GLU 623 HG3 GLU 623 26.847 -2.082 9.574 939 H GLU 624 H GLU 624 21.026 -3.327 9.944 940 HA GLU 624 HA GLU 624 20.648 -5.151 7.770 941 HB2 GLU 624 HB2 GLU 624 18.766 -3.905 9.769 942 HB3 GLU 624 HB3 GLU 624 18.216 -5.008 8.523 943 HG2 GLU 624 HG2 GLU 624 19.587 -6.774 9.436 944 HG3 GLU 624 HG3 GLU 624 20.264 -5.666 10.630 945 H GLU 625 H GLU 625 18.303 -4.620 6.635 946 HA GLU 625 HA GLU 625 18.503 -1.926 5.525 947 HB2 GLU 625 HB2 GLU 625 18.143 -2.915 3.270 948 HB3 GLU 625 HB3 GLU 625 19.709 -3.273 3.987 949 HG2 GLU 625 HG2 GLU 625 18.651 -5.475 4.704 950 HG3 GLU 625 HG3 GLU 625 17.352 -5.075 3.579 951 H ARG 626 H ARG 626 16.756 -2.912 7.445 952 HA ARG 626 HA ARG 626 14.219 -3.747 6.468 953 HB2 ARG 626 HB2 ARG 626 14.703 -2.018 8.880 954 HB3 ARG 626 HB3 ARG 626 13.344 -3.079 8.583 955 HG2 ARG 626 HG2 ARG 626 14.819 -5.013 8.828 956 HG3 ARG 626 HG3 ARG 626 16.171 -3.917 9.160 957 HD2 ARG 626 HD2 ARG 626 14.759 -2.909 10.972 958 HD3 ARG 626 HD3 ARG 626 13.646 -4.254 10.742 959 HE ARG 626 HE ARG 626 16.204 -5.269 11.152 960 HH11 ARG 626 HH11 ARG 626 13.585 -3.625 12.896 961 HH12 ARG 626 HH12 ARG 626 14.132 -4.097 14.436 962 HH21 ARG 626 HH21 ARG 626 17.016 -5.787 13.235 963 HH22 ARG 626 HH22 ARG 626 16.148 -5.384 14.657 964 H ARG 627 H ARG 627 15.678 -0.638 7.207 965 HA ARG 627 HA ARG 627 13.460 0.952 6.608 966 HB2 ARG 627 HB2 ARG 627 15.229 1.778 8.002 967 HB3 ARG 627 HB3 ARG 627 16.404 1.551 6.721 968 HG2 ARG 627 HG2 ARG 627 14.180 3.427 6.165 969 HG3 ARG 627 HG3 ARG 627 15.379 3.909 7.369 970 HD2 ARG 627 HD2 ARG 627 16.015 2.999 4.563 971 HD3 ARG 627 HD3 ARG 627 15.956 4.688 5.089 972 HE ARG 627 HE ARG 627 17.661 3.707 6.833 973 HH11 ARG 627 HH11 ARG 627 17.605 3.192 3.323 974 HH12 ARG 627 HH12 ARG 627 19.289 2.969 3.224 975 HH21 ARG 627 HH21 ARG 627 19.963 3.446 6.647 976 HH22 ARG 627 HH22 ARG 627 20.643 3.138 5.108 977 H ILE 628 H ILE 628 15.784 -0.556 4.561 978 HA ILE 628 HA ILE 628 15.151 1.038 2.266 979 HB ILE 628 HB ILE 628 16.472 -1.699 2.440 980 HG12 ILE 628 HG12 ILE 628 17.659 1.071 2.099 981 HG13 ILE 628 HG13 ILE 628 17.801 0.046 3.517 982 HG21 ILE 628 HG21 ILE 628 15.464 -1.389 0.247 983 HG22 ILE 628 HG22 ILE 628 17.223 -1.291 0.128 984 HG23 ILE 628 HG23 ILE 628 16.253 0.181 0.085 985 HD11 ILE 628 HD11 ILE 628 19.133 -1.556 2.204 986 HD12 ILE 628 HD12 ILE 628 19.850 0.049 2.211 987 HD13 ILE 628 HD13 ILE 628 18.963 -0.512 0.796 988 H ALA 629 H ALA 629 14.050 -1.967 3.672 989 HA ALA 629 HA ALA 629 12.243 -2.639 1.580 990 HB1 ALA 629 HB1 ALA 629 11.307 -4.260 3.154 991 HB2 ALA 629 HB2 ALA 629 12.190 -3.496 4.476 992 HB3 ALA 629 HB3 ALA 629 13.072 -4.311 3.185 993 H GLU 630 H GLU 630 12.098 -0.539 4.295 994 HA GLU 630 HA GLU 630 9.394 -0.210 4.766 995 HB2 GLU 630 HB2 GLU 630 11.696 1.667 5.035 996 HB3 GLU 630 HB3 GLU 630 10.057 2.191 5.392 997 HG2 GLU 630 HG2 GLU 630 11.397 -0.164 6.677 998 HG3 GLU 630 HG3 GLU 630 11.353 1.462 7.375 999 H MET 631 H MET 631 11.150 0.928 2.001 1000 HA MET 631 HA MET 631 9.197 2.921 1.383 1001 HB2 MET 631 HB2 MET 631 10.327 3.149 -0.818 1002 HB3 MET 631 HB3 MET 631 11.385 3.366 0.557 1003 HG2 MET 631 HG2 MET 631 12.537 2.188 -1.108 1004 HG3 MET 631 HG3 MET 631 12.218 1.062 0.201 1005 HE1 MET 631 HE1 MET 631 13.221 0.137 -2.634 1006 HE2 MET 631 HE2 MET 631 12.176 -1.251 -2.945 1007 HE3 MET 631 HE3 MET 631 12.838 -0.987 -1.330 1008 H GLY 632 H GLY 632 9.131 -0.385 1.141 1009 HA2 GLY 632 HA2 GLY 632 6.633 -0.301 -0.230 1010 HA3 GLY 632 HA3 GLY 632 7.922 -1.026 -1.190 1011 H ARG 633 H ARG 633 6.883 -1.157 2.222 1012 HA ARG 633 HA ARG 633 7.559 -3.967 2.150 1013 HB2 ARG 633 HB2 ARG 633 7.249 -4.022 4.597 1014 HB3 ARG 633 HB3 ARG 633 8.396 -2.786 4.122 1015 HG2 ARG 633 HG2 ARG 633 7.041 -1.080 4.806 1016 HG3 ARG 633 HG3 ARG 633 5.551 -2.003 4.558 1017 HD2 ARG 633 HD2 ARG 633 7.576 -2.511 6.760 1018 HD3 ARG 633 HD3 ARG 633 6.076 -1.603 6.966 1019 HE ARG 633 HE ARG 633 5.664 -4.231 5.879 1020 HH11 ARG 633 HH11 ARG 633 6.033 -2.561 9.024 1021 HH12 ARG 633 HH12 ARG 633 5.101 -3.740 9.853 1022 HH21 ARG 633 HH21 ARG 633 4.462 -5.759 7.057 1023 HH22 ARG 633 HH22 ARG 633 4.157 -5.544 8.739 1024 HA PRO 634 HA PRO 634 3.335 -5.396 2.037 1025 HB2 PRO 634 HB2 PRO 634 3.724 -7.788 3.227 1026 HB3 PRO 634 HB3 PRO 634 4.230 -7.495 1.562 1027 HG2 PRO 634 HG2 PRO 634 5.911 -7.519 4.054 1028 HG3 PRO 634 HG3 PRO 634 6.274 -8.160 2.461 1029 HD2 PRO 634 HD2 PRO 634 7.229 -5.794 3.307 1030 HD3 PRO 634 HD3 PRO 634 6.862 -6.125 1.602 1031 H ILE 635 H ILE 635 1.686 -5.034 3.413 1032 HA ILE 635 HA ILE 635 2.392 -5.051 6.208 1033 HB ILE 635 HB ILE 635 0.954 -3.060 6.573 1034 HG12 ILE 635 HG12 ILE 635 0.640 -1.528 4.480 1035 HG13 ILE 635 HG13 ILE 635 0.771 -3.017 3.562 1036 HG21 ILE 635 HG21 ILE 635 2.530 -1.378 5.728 1037 HG22 ILE 635 HG22 ILE 635 3.222 -2.610 4.670 1038 HG23 ILE 635 HG23 ILE 635 3.347 -2.786 6.421 1039 HD11 ILE 635 HD11 ILE 635 -1.537 -2.365 3.908 1040 HD12 ILE 635 HD12 ILE 635 -1.302 -2.411 5.658 1041 HD13 ILE 635 HD13 ILE 635 -1.186 -3.893 4.715 1042 H LEU 636 H LEU 636 0.495 -5.259 7.591 1043 HA LEU 636 HA LEU 636 -1.416 -6.864 6.163 1044 HB2 LEU 636 HB2 LEU 636 -2.096 -7.765 8.426 1045 HB3 LEU 636 HB3 LEU 636 -0.600 -8.337 7.737 1046 HG LEU 636 HG LEU 636 0.661 -6.938 9.355 1047 HD11 LEU 636 HD11 LEU 636 -1.017 -5.161 9.612 1048 HD12 LEU 636 HD12 LEU 636 -0.458 -5.816 11.151 1049 HD13 LEU 636 HD13 LEU 636 -2.041 -6.283 10.510 1050 HD21 LEU 636 HD21 LEU 636 -1.467 -8.637 10.562 1051 HD22 LEU 636 HD22 LEU 636 0.061 -8.198 11.339 1052 HD23 LEU 636 HD23 LEU 636 0.054 -9.225 9.893 1053 H GLY 637 H GLY 637 -3.612 -6.929 7.165 1054 HA2 GLY 637 HA2 GLY 637 -4.600 -4.310 6.694 1055 HA3 GLY 637 HA3 GLY 637 -5.517 -5.770 7.021 1056 H GLU 638 H GLU 638 -6.751 -4.008 8.067 1057 HA GLU 638 HA GLU 638 -5.911 -2.738 10.446 1058 HB2 GLU 638 HB2 GLU 638 -7.723 -2.041 8.884 1059 HB3 GLU 638 HB3 GLU 638 -8.680 -3.391 9.462 1060 HG2 GLU 638 HG2 GLU 638 -8.710 -2.391 11.690 1061 HG3 GLU 638 HG3 GLU 638 -7.755 -1.037 11.078 1062 H HIS 639 H HIS 639 -7.746 -5.633 9.696 1063 HA HIS 639 HA HIS 639 -7.327 -6.586 12.428 1064 HB2 HIS 639 HB2 HIS 639 -9.790 -6.884 10.711 1065 HB3 HIS 639 HB3 HIS 639 -9.432 -7.977 12.035 1066 HD1 HIS 639 HD1 HIS 639 -10.455 -7.323 14.229 1067 HD2 HIS 639 HD2 HIS 639 -10.037 -4.090 11.652 1068 HE1 HIS 639 HE1 HIS 639 -11.559 -5.381 15.364 1069 H THR 640 H THR 640 -6.207 -8.376 12.473 1070 HA THR 640 HA THR 640 -6.412 -10.186 10.217 1071 HB THR 640 HB THR 640 -4.024 -10.814 10.727 1072 HG1 THR 640 HG1 THR 640 -3.965 -9.563 12.691 1073 HG21 THR 640 HG21 THR 640 -3.128 -9.153 9.241 1074 HG22 THR 640 HG22 THR 640 -4.465 -8.053 9.607 1075 HG23 THR 640 HG23 THR 640 -4.772 -9.557 8.737 1076 H LYS 641 H LYS 641 -7.803 -11.491 11.212 1077 HA LYS 641 HA LYS 641 -6.877 -13.296 13.134 1078 HB2 LYS 641 HB2 LYS 641 -7.138 -11.451 14.696 1079 HB3 LYS 641 HB3 LYS 641 -8.792 -11.188 14.169 1080 HG2 LYS 641 HG2 LYS 641 -9.459 -13.317 15.094 1081 HG3 LYS 641 HG3 LYS 641 -7.793 -13.691 15.512 1082 HD2 LYS 641 HD2 LYS 641 -9.181 -11.260 16.618 1083 HD3 LYS 641 HD3 LYS 641 -9.369 -12.837 17.373 1084 HE2 LYS 641 HE2 LYS 641 -7.658 -11.733 18.553 1085 HE3 LYS 641 HE3 LYS 641 -6.876 -12.938 17.543 1086 HZ1 LYS 641 HZ1 LYS 641 -6.274 -11.089 15.975 1087 HZ2 LYS 641 HZ2 LYS 641 -5.592 -10.967 17.460 1088 HZ3 LYS 641 HZ3 LYS 641 -6.915 -9.987 17.080 1089 H LEU 642 H LEU 642 -8.113 -14.979 13.187 1090 HA LEU 642 HA LEU 642 -10.598 -14.956 11.616 1091 HB2 LEU 642 HB2 LEU 642 -8.715 -16.042 10.557 1092 HB3 LEU 642 HB3 LEU 642 -8.448 -16.984 12.005 1093 HG LEU 642 HG LEU 642 -10.735 -17.994 11.608 1094 HD11 LEU 642 HD11 LEU 642 -11.588 -16.352 10.048 1095 HD12 LEU 642 HD12 LEU 642 -11.538 -17.970 9.339 1096 HD13 LEU 642 HD13 LEU 642 -10.313 -16.785 8.905 1097 HD21 LEU 642 HD21 LEU 642 -9.810 -19.464 9.852 1098 HD22 LEU 642 HD22 LEU 642 -8.824 -19.250 11.295 1099 HD23 LEU 642 HD23 LEU 642 -8.383 -18.406 9.814 1100 H GLU 643 H GLU 643 -12.304 -15.641 12.773 1101 HA GLU 643 HA GLU 643 -11.914 -16.946 15.351 1102 HB2 GLU 643 HB2 GLU 643 -13.578 -15.042 14.984 1103 HB3 GLU 643 HB3 GLU 643 -14.463 -16.131 13.945 1104 HG2 GLU 643 HG2 GLU 643 -14.824 -17.645 15.837 1105 HG3 GLU 643 HG3 GLU 643 -13.970 -16.517 16.884 1106 H VAL 644 H VAL 644 -11.655 -19.141 15.174 1107 HA VAL 644 HA VAL 644 -12.984 -20.489 12.937 1108 HB VAL 644 HB VAL 644 -10.864 -21.611 14.778 1109 HG11 VAL 644 HG11 VAL 644 -11.941 -22.636 12.149 1110 HG12 VAL 644 HG12 VAL 644 -12.355 -23.248 13.745 1111 HG13 VAL 644 HG13 VAL 644 -10.703 -23.408 13.151 1112 HG21 VAL 644 HG21 VAL 644 -10.573 -20.525 11.987 1113 HG22 VAL 644 HG22 VAL 644 -9.309 -21.348 12.895 1114 HG23 VAL 644 HG23 VAL 644 -9.928 -19.788 13.451 1115 H ILE 645 H ILE 645 -14.873 -21.198 13.492 1116 HA ILE 645 HA ILE 645 -15.367 -22.057 16.225 1117 HB ILE 645 HB ILE 645 -17.248 -21.652 13.891 1118 HG12 ILE 645 HG12 ILE 645 -16.796 -19.850 16.269 1119 HG13 ILE 645 HG13 ILE 645 -16.077 -19.586 14.687 1120 HG21 ILE 645 HG21 ILE 645 -18.086 -23.219 15.565 1121 HG22 ILE 645 HG22 ILE 645 -19.003 -21.715 15.570 1122 HG23 ILE 645 HG23 ILE 645 -17.807 -22.020 16.832 1123 HD11 ILE 645 HD11 ILE 645 -19.021 -19.682 15.268 1124 HD12 ILE 645 HD12 ILE 645 -18.247 -19.363 13.709 1125 HD13 ILE 645 HD13 ILE 645 -18.050 -18.221 15.039 1126 H ILE 646 H ILE 646 -15.380 -24.179 16.657 1127 HA ILE 646 HA ILE 646 -15.413 -26.093 14.430 1128 HB ILE 646 HB ILE 646 -14.723 -26.665 17.345 1129 HG12 ILE 646 HG12 ILE 646 -12.782 -26.293 15.055 1130 HG13 ILE 646 HG13 ILE 646 -13.092 -25.070 16.281 1131 HG21 ILE 646 HG21 ILE 646 -13.780 -28.727 16.467 1132 HG22 ILE 646 HG22 ILE 646 -14.308 -28.275 14.845 1133 HG23 ILE 646 HG23 ILE 646 -15.501 -28.580 16.106 1134 HD11 ILE 646 HD11 ILE 646 -11.058 -26.326 16.754 1135 HD12 ILE 646 HD12 ILE 646 -11.985 -27.826 16.792 1136 HD13 ILE 646 HD13 ILE 646 -12.271 -26.581 18.005 1137 H GLU 647 H GLU 647 -17.444 -26.550 14.041 1138 HA GLU 647 HA GLU 647 -19.338 -26.683 16.264 1139 HB2 GLU 647 HB2 GLU 647 -19.845 -26.636 13.295 1140 HB3 GLU 647 HB3 GLU 647 -21.057 -26.558 14.553 1141 HG2 GLU 647 HG2 GLU 647 -20.123 -24.401 15.280 1142 HG3 GLU 647 HG3 GLU 647 -18.971 -24.482 13.942 1143 H GLU 648 H GLU 648 -20.070 -28.620 16.901 1144 HA GLU 648 HA GLU 648 -19.223 -30.917 15.488 1145 HB2 GLU 648 HB2 GLU 648 -20.946 -32.054 17.168 1146 HB3 GLU 648 HB3 GLU 648 -19.318 -31.586 17.613 1147 HG2 GLU 648 HG2 GLU 648 -20.931 -30.996 19.374 1148 HG3 GLU 648 HG3 GLU 648 -20.171 -29.568 18.702 1149 H SER 649 H SER 649 -20.040 -31.940 13.979 1150 HA SER 649 HA SER 649 -22.654 -31.116 13.065 1151 HB2 SER 649 HB2 SER 649 -20.118 -30.948 11.427 1152 HB3 SER 649 HB3 SER 649 -21.749 -30.584 10.845 1153 HG SER 649 HG SER 649 -20.199 -29.216 12.783 1154 H TYR 650 H TYR 650 -23.468 -33.087 13.279 1155 HA TYR 650 HA TYR 650 -22.034 -35.409 12.274 1156 HB2 TYR 650 HB2 TYR 650 -24.799 -35.263 13.490 1157 HB3 TYR 650 HB3 TYR 650 -23.829 -36.710 13.245 1158 HD1 TYR 650 HD1 TYR 650 -24.259 -33.699 15.215 1159 HD2 TYR 650 HD2 TYR 650 -22.052 -37.272 14.762 1160 HE1 TYR 650 HE1 TYR 650 -23.336 -33.394 17.494 1161 HE2 TYR 650 HE2 TYR 650 -21.109 -37.000 17.029 1162 HH TYR 650 HH TYR 650 -20.701 -35.098 18.586 1163 H GLU 651 H GLU 651 -24.708 -33.336 11.662 1164 HA GLU 651 HA GLU 651 -25.843 -34.923 9.636 1165 HB2 GLU 651 HB2 GLU 651 -26.245 -31.952 10.002 1166 HB3 GLU 651 HB3 GLU 651 -27.323 -33.079 9.206 1167 HG2 GLU 651 HG2 GLU 651 -26.725 -32.904 12.147 1168 HG3 GLU 651 HG3 GLU 651 -28.238 -32.515 11.337 1169 H PHE 652 H PHE 652 -23.843 -32.000 9.740 1170 HA PHE 652 HA PHE 652 -23.364 -32.186 6.897 1171 HB2 PHE 652 HB2 PHE 652 -23.821 -29.951 7.759 1172 HB3 PHE 652 HB3 PHE 652 -22.505 -30.095 8.917 1173 HD1 PHE 652 HD2 PHE 652 -23.103 -30.286 5.239 1174 HD2 PHE 652 HD1 PHE 652 -20.469 -29.144 8.380 1175 HE1 PHE 652 HE2 PHE 652 -21.553 -29.330 3.585 1176 HE2 PHE 652 HE1 PHE 652 -18.913 -28.189 6.732 1177 HZ PHE 652 HZ PHE 652 -19.454 -28.280 4.333 1178 H LYS 653 H LYS 653 -21.984 -33.639 6.411 1179 HA LYS 653 HA LYS 653 -19.655 -34.086 8.077 1180 HB2 LYS 653 HB2 LYS 653 -20.810 -35.645 5.774 1181 HB3 LYS 653 HB3 LYS 653 -19.282 -36.044 6.544 1182 HG2 LYS 653 HG2 LYS 653 -20.444 -36.377 8.673 1183 HG3 LYS 653 HG3 LYS 653 -21.974 -35.978 7.894 1184 HD2 LYS 653 HD2 LYS 653 -21.782 -37.897 6.441 1185 HD3 LYS 653 HD3 LYS 653 -20.171 -38.245 7.067 1186 HE2 LYS 653 HE2 LYS 653 -21.862 -39.717 8.049 1187 HE3 LYS 653 HE3 LYS 653 -21.089 -38.704 9.262 1188 HZ1 LYS 653 HZ1 LYS 653 -23.482 -38.888 9.548 1189 HZ2 LYS 653 HZ2 LYS 653 -23.761 -38.164 8.055 1190 HZ3 LYS 653 HZ3 LYS 653 -23.040 -37.291 9.310 1191 H SER 654 H SER 654 -17.571 -34.277 7.051 1192 HA SER 654 HA SER 654 -17.256 -32.757 4.586 1193 HB2 SER 654 HB2 SER 654 -15.694 -32.230 7.128 1194 HB3 SER 654 HB3 SER 654 -15.582 -31.337 5.609 1195 HG SER 654 HG SER 654 -18.084 -31.273 6.212 1196 H THR 655 H THR 655 -15.287 -33.354 3.507 1197 HA THR 655 HA THR 655 -13.719 -35.424 4.757 1198 HB THR 655 HB THR 655 -15.416 -36.691 3.566 1199 HG1 THR 655 HG1 THR 655 -13.567 -37.765 3.352 1200 HG21 THR 655 HG21 THR 655 -15.724 -36.503 1.132 1201 HG22 THR 655 HG22 THR 655 -14.628 -35.121 1.108 1202 HG23 THR 655 HG23 THR 655 -16.165 -35.013 1.966 1203 H VAL 656 H VAL 656 -11.645 -35.163 4.333 1204 HA VAL 656 HA VAL 656 -10.883 -33.189 2.323 1205 HB VAL 656 HB VAL 656 -9.218 -34.333 4.601 1206 HG11 VAL 656 HG11 VAL 656 -7.855 -33.576 2.736 1207 HG12 VAL 656 HG12 VAL 656 -7.669 -32.489 4.114 1208 HG13 VAL 656 HG13 VAL 656 -8.675 -32.015 2.746 1209 HG21 VAL 656 HG21 VAL 656 -9.521 -32.156 5.689 1210 HG22 VAL 656 HG22 VAL 656 -11.058 -32.988 5.456 1211 HG23 VAL 656 HG23 VAL 656 -10.601 -31.663 4.387 1212 H ASP 657 H ASP 657 -11.018 -34.458 0.555 1213 HA ASP 657 HA ASP 657 -9.500 -36.965 0.505 1214 HB2 ASP 657 HB2 ASP 657 -10.818 -37.586 -1.389 1215 HB3 ASP 657 HB3 ASP 657 -11.920 -36.961 -0.170 Start of MODEL 17 1 H HIS 501 H HIS 501 3.448 0.082 -0.116 2 HA HIS 501 HA HIS 501 4.994 -0.485 2.108 3 HB2 HIS 501 HB2 HIS 501 2.150 -1.505 2.346 4 HB3 HIS 501 HB3 HIS 501 3.477 -1.828 3.447 5 HD1 HIS 501 HD1 HIS 501 4.162 0.196 5.067 6 HD2 HIS 501 HD2 HIS 501 0.744 0.788 2.773 7 HE1 HIS 501 HE1 HIS 501 2.965 2.167 6.078 8 H ALA 502 H ALA 502 2.271 -1.944 0.435 9 HA ALA 502 HA ALA 502 3.506 -3.465 -1.499 10 HB1 ALA 502 HB1 ALA 502 2.897 -5.057 0.987 11 HB2 ALA 502 HB2 ALA 502 4.517 -4.702 0.414 12 HB3 ALA 502 HB3 ALA 502 3.443 -5.728 -0.555 13 H GLY 503 H GLY 503 1.067 -3.804 1.078 14 HA2 GLY 503 HA2 GLY 503 -1.191 -3.229 -0.228 15 HA3 GLY 503 HA3 GLY 503 -0.868 -4.897 -0.706 16 H ILE 504 H ILE 504 -2.583 -5.833 0.446 17 HA ILE 504 HA ILE 504 -2.467 -5.504 3.357 18 HB ILE 504 HB ILE 504 -4.952 -5.846 1.635 19 HG12 ILE 504 HG12 ILE 504 -5.675 -3.690 2.820 20 HG13 ILE 504 HG13 ILE 504 -3.980 -3.483 3.230 21 HG21 ILE 504 HG21 ILE 504 -5.272 -7.131 3.547 22 HG22 ILE 504 HG22 ILE 504 -6.267 -5.673 3.652 23 HG23 ILE 504 HG23 ILE 504 -4.780 -5.802 4.596 24 HD11 ILE 504 HD11 ILE 504 -5.104 -3.666 0.433 25 HD12 ILE 504 HD12 ILE 504 -3.415 -3.452 0.846 26 HD13 ILE 504 HD13 ILE 504 -4.589 -2.187 1.255 27 H PHE 505 H PHE 505 -2.171 -7.351 4.389 28 HA PHE 505 HA PHE 505 -3.073 -9.859 3.160 29 HB2 PHE 505 HB2 PHE 505 -0.895 -9.308 5.179 30 HB3 PHE 505 HB3 PHE 505 -1.602 -10.906 5.016 31 HD1 PHE 505 HD2 PHE 505 -1.272 -12.199 2.983 32 HD2 PHE 505 HD1 PHE 505 0.645 -8.447 3.550 33 HE1 PHE 505 HE2 PHE 505 0.305 -12.747 1.189 34 HE2 PHE 505 HE1 PHE 505 2.236 -8.992 1.751 35 HZ PHE 505 HZ PHE 505 2.054 -11.160 0.563 36 H THR 506 H THR 506 -4.612 -11.039 4.232 37 HA THR 506 HA THR 506 -5.123 -10.837 6.964 38 HB THR 506 HB THR 506 -6.117 -8.618 6.327 39 HG1 THR 506 HG1 THR 506 -7.751 -8.951 7.731 40 HG21 THR 506 HG21 THR 506 -8.036 -10.294 4.678 41 HG22 THR 506 HG22 THR 506 -6.838 -9.173 4.035 42 HG23 THR 506 HG23 THR 506 -8.193 -8.564 4.989 43 H PHE 507 H PHE 507 -7.571 -11.799 7.201 44 HA PHE 507 HA PHE 507 -7.306 -14.349 5.866 45 HB2 PHE 507 HB2 PHE 507 -9.157 -13.391 8.049 46 HB3 PHE 507 HB3 PHE 507 -9.248 -14.987 7.328 47 HD1 PHE 507 HD1 PHE 507 -7.480 -16.584 7.633 48 HD2 PHE 507 HD2 PHE 507 -7.413 -12.831 9.611 49 HE1 PHE 507 HE1 PHE 507 -5.852 -17.470 9.195 50 HE2 PHE 507 HE2 PHE 507 -5.754 -13.694 11.206 51 HZ PHE 507 HZ PHE 507 -4.964 -16.017 11.014 52 H GLU 508 H GLU 508 -9.070 -15.349 4.743 53 HA GLU 508 HA GLU 508 -10.363 -13.651 2.906 54 HB2 GLU 508 HB2 GLU 508 -9.657 -16.184 2.779 55 HB3 GLU 508 HB3 GLU 508 -11.212 -16.478 3.528 56 HG2 GLU 508 HG2 GLU 508 -10.939 -14.942 0.979 57 HG3 GLU 508 HG3 GLU 508 -11.012 -16.697 0.988 58 H GLU 509 H GLU 509 -11.456 -15.431 5.764 59 HA GLU 509 HA GLU 509 -13.673 -13.557 5.935 60 HB2 GLU 509 HB2 GLU 509 -15.013 -15.315 7.051 61 HB3 GLU 509 HB3 GLU 509 -14.643 -15.722 5.389 62 HG2 GLU 509 HG2 GLU 509 -13.018 -16.799 7.673 63 HG3 GLU 509 HG3 GLU 509 -14.520 -17.565 7.174 64 HA PRO 510 HA PRO 510 -11.837 -12.805 9.908 65 HB2 PRO 510 HB2 PRO 510 -13.893 -11.572 11.171 66 HB3 PRO 510 HB3 PRO 510 -12.968 -10.790 9.881 67 HG2 PRO 510 HG2 PRO 510 -15.633 -12.124 9.762 68 HG3 PRO 510 HG3 PRO 510 -15.105 -10.615 8.995 69 HD2 PRO 510 HD2 PRO 510 -15.268 -13.003 7.669 70 HD3 PRO 510 HD3 PRO 510 -14.127 -11.717 7.233 71 H VAL 511 H VAL 511 -14.654 -14.722 9.488 72 HA VAL 511 HA VAL 511 -14.113 -16.212 11.941 73 HB VAL 511 HB VAL 511 -16.912 -15.388 11.074 74 HG11 VAL 511 HG11 VAL 511 -17.647 -16.446 13.177 75 HG12 VAL 511 HG12 VAL 511 -15.988 -17.008 13.432 76 HG13 VAL 511 HG13 VAL 511 -16.899 -17.572 12.046 77 HG21 VAL 511 HG21 VAL 511 -15.822 -13.464 12.102 78 HG22 VAL 511 HG22 VAL 511 -15.350 -14.438 13.490 79 HG23 VAL 511 HG23 VAL 511 -17.055 -14.104 13.187 80 H THR 512 H THR 512 -14.074 -18.342 11.450 81 HA THR 512 HA THR 512 -15.441 -19.175 9.013 82 HB THR 512 HB THR 512 -12.975 -19.089 8.599 83 HG1 THR 512 HG1 THR 512 -12.827 -21.468 8.060 84 HG21 THR 512 HG21 THR 512 -12.831 -21.219 10.734 85 HG22 THR 512 HG22 THR 512 -12.193 -19.583 10.866 86 HG23 THR 512 HG23 THR 512 -11.494 -20.710 9.701 87 H HIS 513 H HIS 513 -16.490 -21.082 9.120 88 HA HIS 513 HA HIS 513 -16.546 -22.331 11.743 89 HB2 HIS 513 HB2 HIS 513 -18.873 -23.166 11.043 90 HB3 HIS 513 HB3 HIS 513 -18.718 -21.464 11.438 91 HD1 HIS 513 HD1 HIS 513 -19.602 -19.840 9.705 92 HD2 HIS 513 HD2 HIS 513 -19.052 -23.668 8.167 93 HE1 HIS 513 HE1 HIS 513 -20.593 -19.817 7.399 94 H VAL 514 H VAL 514 -15.764 -24.242 11.895 95 HA VAL 514 HA VAL 514 -15.468 -25.790 9.429 96 HB VAL 514 HB VAL 514 -13.395 -26.740 10.267 97 HG11 VAL 514 HG11 VAL 514 -13.381 -23.737 10.479 98 HG12 VAL 514 HG12 VAL 514 -13.148 -24.692 9.017 99 HG13 VAL 514 HG13 VAL 514 -11.945 -24.737 10.306 100 HG21 VAL 514 HG21 VAL 514 -12.342 -25.966 12.360 101 HG22 VAL 514 HG22 VAL 514 -13.884 -26.768 12.660 102 HG23 VAL 514 HG23 VAL 514 -13.779 -25.008 12.717 103 H SER 515 H SER 515 -15.346 -28.151 9.865 104 HA SER 515 HA SER 515 -17.577 -28.777 11.583 105 HB2 SER 515 HB2 SER 515 -17.312 -29.653 9.195 106 HB3 SER 515 HB3 SER 515 -16.032 -30.657 9.836 107 HG SER 515 HG SER 515 -18.659 -31.031 9.962 108 H GLU 516 H GLU 516 -17.542 -30.172 13.195 109 HA GLU 516 HA GLU 516 -15.406 -30.654 14.896 110 HB2 GLU 516 HB2 GLU 516 -17.763 -30.779 15.499 111 HB3 GLU 516 HB3 GLU 516 -17.986 -32.138 14.424 112 HG2 GLU 516 HG2 GLU 516 -18.014 -32.984 16.584 113 HG3 GLU 516 HG3 GLU 516 -16.448 -33.426 15.917 114 H SER 517 H SER 517 -16.565 -32.337 12.049 115 HA SER 517 HA SER 517 -14.686 -34.550 12.506 116 HB2 SER 517 HB2 SER 517 -17.079 -35.176 12.616 117 HB3 SER 517 HB3 SER 517 -17.315 -34.548 10.993 118 HG SER 517 HG SER 517 -15.340 -36.454 11.426 119 H ILE 518 H ILE 518 -14.204 -31.895 11.074 120 HA ILE 518 HA ILE 518 -14.074 -32.683 8.301 121 HB ILE 518 HB ILE 518 -14.482 -30.296 8.802 122 HG12 ILE 518 HG12 ILE 518 -11.858 -30.813 7.414 123 HG13 ILE 518 HG13 ILE 518 -13.455 -30.819 6.674 124 HG21 ILE 518 HG21 ILE 518 -12.709 -28.863 9.665 125 HG22 ILE 518 HG22 ILE 518 -11.718 -30.295 9.992 126 HG23 ILE 518 HG23 ILE 518 -13.260 -30.059 10.835 127 HD11 ILE 518 HD11 ILE 518 -13.668 -28.432 7.153 128 HD12 ILE 518 HD12 ILE 518 -12.229 -28.783 6.170 129 HD13 ILE 518 HD13 ILE 518 -12.072 -28.468 7.901 130 H GLY 519 H GLY 519 -11.904 -32.683 11.017 131 HA2 GLY 519 HA2 GLY 519 -9.882 -33.912 11.128 132 HA3 GLY 519 HA3 GLY 519 -9.962 -34.071 9.376 133 H ILE 520 H ILE 520 -9.537 -32.170 8.146 134 HA ILE 520 HA ILE 520 -7.601 -30.386 9.472 135 HB ILE 520 HB ILE 520 -7.407 -31.590 6.713 136 HG12 ILE 520 HG12 ILE 520 -6.648 -33.108 8.502 137 HG13 ILE 520 HG13 ILE 520 -5.324 -32.634 7.447 138 HG21 ILE 520 HG21 ILE 520 -6.682 -29.306 6.577 139 HG22 ILE 520 HG22 ILE 520 -5.263 -30.347 6.468 140 HG23 ILE 520 HG23 ILE 520 -5.632 -29.508 7.975 141 HD11 ILE 520 HD11 ILE 520 -4.638 -30.976 9.142 142 HD12 ILE 520 HD12 ILE 520 -4.586 -32.637 9.718 143 HD13 ILE 520 HD13 ILE 520 -5.916 -31.582 10.200 144 H MET 521 H MET 521 -8.161 -28.386 9.259 145 HA MET 521 HA MET 521 -9.986 -27.709 7.068 146 HB2 MET 521 HB2 MET 521 -10.849 -25.926 8.411 147 HB3 MET 521 HB3 MET 521 -10.869 -27.385 9.376 148 HG2 MET 521 HG2 MET 521 -10.037 -25.867 10.955 149 HG3 MET 521 HG3 MET 521 -8.572 -26.437 10.205 150 HE1 MET 521 HE1 MET 521 -9.409 -23.557 11.728 151 HE2 MET 521 HE2 MET 521 -8.264 -22.482 10.918 152 HE3 MET 521 HE3 MET 521 -7.738 -24.067 11.494 153 H GLU 522 H GLU 522 -9.533 -25.876 5.828 154 HA GLU 522 HA GLU 522 -6.887 -24.734 6.245 155 HB2 GLU 522 HB2 GLU 522 -8.137 -25.664 3.692 156 HB3 GLU 522 HB3 GLU 522 -6.932 -24.390 3.690 157 HG2 GLU 522 HG2 GLU 522 -5.326 -25.827 4.677 158 HG3 GLU 522 HG3 GLU 522 -6.494 -27.149 4.823 159 H VAL 523 H VAL 523 -6.741 -22.690 6.233 160 HA VAL 523 HA VAL 523 -9.059 -21.074 5.394 161 HB VAL 523 HB VAL 523 -7.004 -20.443 7.547 162 HG11 VAL 523 HG11 VAL 523 -9.483 -18.914 6.759 163 HG12 VAL 523 HG12 VAL 523 -7.821 -18.448 6.373 164 HG13 VAL 523 HG13 VAL 523 -8.349 -18.519 8.054 165 HG21 VAL 523 HG21 VAL 523 -8.640 -22.215 8.108 166 HG22 VAL 523 HG22 VAL 523 -9.937 -21.032 7.883 167 HG23 VAL 523 HG23 VAL 523 -8.710 -20.800 9.135 168 H LYS 524 H LYS 524 -8.636 -19.763 3.727 169 HA LYS 524 HA LYS 524 -5.927 -19.548 2.775 170 HB2 LYS 524 HB2 LYS 524 -8.438 -18.398 1.603 171 HB3 LYS 524 HB3 LYS 524 -6.869 -18.542 0.831 172 HG2 LYS 524 HG2 LYS 524 -7.162 -21.069 1.203 173 HG3 LYS 524 HG3 LYS 524 -8.860 -20.674 1.454 174 HD2 LYS 524 HD2 LYS 524 -7.182 -20.111 -0.957 175 HD3 LYS 524 HD3 LYS 524 -8.528 -21.266 -0.850 176 HE2 LYS 524 HE2 LYS 524 -9.969 -19.234 -0.307 177 HE3 LYS 524 HE3 LYS 524 -8.525 -18.301 -0.750 178 HZ1 LYS 524 HZ1 LYS 524 -8.589 -19.206 -2.955 179 HZ2 LYS 524 HZ2 LYS 524 -10.049 -18.478 -2.641 180 HZ3 LYS 524 HZ3 LYS 524 -9.930 -20.160 -2.597 181 H VAL 525 H VAL 525 -4.747 -17.836 2.910 182 HA VAL 525 HA VAL 525 -5.830 -15.488 4.290 183 HB VAL 525 HB VAL 525 -2.934 -16.219 3.779 184 HG11 VAL 525 HG11 VAL 525 -3.280 -13.830 4.165 185 HG12 VAL 525 HG12 VAL 525 -2.433 -14.575 5.526 186 HG13 VAL 525 HG13 VAL 525 -4.151 -14.199 5.655 187 HG21 VAL 525 HG21 VAL 525 -3.992 -17.883 5.150 188 HG22 VAL 525 HG22 VAL 525 -4.595 -16.639 6.248 189 HG23 VAL 525 HG23 VAL 525 -2.855 -16.932 6.106 190 H LEU 526 H LEU 526 -6.232 -13.766 3.138 191 HA LEU 526 HA LEU 526 -5.898 -13.690 0.344 192 HB2 LEU 526 HB2 LEU 526 -6.660 -11.516 2.292 193 HB3 LEU 526 HB3 LEU 526 -6.721 -11.347 0.552 194 HG LEU 526 HG LEU 526 -8.398 -13.277 2.177 195 HD11 LEU 526 HD11 LEU 526 -9.128 -10.709 0.785 196 HD12 LEU 526 HD12 LEU 526 -9.056 -10.970 2.530 197 HD13 LEU 526 HD13 LEU 526 -10.255 -11.821 1.559 198 HD21 LEU 526 HD21 LEU 526 -7.931 -14.162 -0.045 199 HD22 LEU 526 HD22 LEU 526 -8.406 -12.631 -0.773 200 HD23 LEU 526 HD23 LEU 526 -9.605 -13.616 0.054 201 H ARG 527 H ARG 527 -4.410 -12.919 -0.834 202 HA ARG 527 HA ARG 527 -1.915 -12.110 0.358 203 HB2 ARG 527 HB2 ARG 527 -2.066 -13.807 -1.453 204 HB3 ARG 527 HB3 ARG 527 -2.692 -12.579 -2.531 205 HG2 ARG 527 HG2 ARG 527 -0.535 -11.328 -2.152 206 HG3 ARG 527 HG3 ARG 527 0.068 -12.787 -1.362 207 HD2 ARG 527 HD2 ARG 527 0.748 -12.804 -3.668 208 HD3 ARG 527 HD3 ARG 527 -0.472 -14.054 -3.416 209 HE ARG 527 HE ARG 527 -1.844 -11.790 -4.195 210 HH11 ARG 527 HH11 ARG 527 0.458 -14.038 -5.679 211 HH12 ARG 527 HH12 ARG 527 0.051 -13.578 -7.265 212 HH21 ARG 527 HH21 ARG 527 -2.376 -11.200 -6.383 213 HH22 ARG 527 HH22 ARG 527 -1.566 -11.955 -7.673 214 H THR 528 H THR 528 -0.823 -10.266 -0.421 215 HA THR 528 HA THR 528 -2.117 -7.857 -0.280 216 HB THR 528 HB THR 528 0.172 -7.916 0.248 217 HG1 THR 528 HG1 THR 528 0.970 -6.632 -1.880 218 HG21 THR 528 HG21 THR 528 0.833 -9.870 -1.020 219 HG22 THR 528 HG22 THR 528 1.935 -8.524 -1.344 220 HG23 THR 528 HG23 THR 528 0.690 -8.955 -2.522 221 H SER 529 H SER 529 -2.705 -6.294 -1.720 222 HA SER 529 HA SER 529 -3.809 -6.890 -4.144 223 HB2 SER 529 HB2 SER 529 -4.371 -4.914 -2.704 224 HB3 SER 529 HB3 SER 529 -2.845 -4.181 -3.161 225 HG SER 529 HG SER 529 -5.185 -4.145 -4.406 226 H GLY 530 H GLY 530 -0.634 -5.740 -3.247 227 HA2 GLY 530 HA2 GLY 530 0.291 -6.031 -6.028 228 HA3 GLY 530 HA3 GLY 530 0.930 -4.817 -4.918 229 H ALA 531 H ALA 531 1.029 -8.125 -5.874 230 HA ALA 531 HA ALA 531 2.654 -8.834 -3.577 231 HB1 ALA 531 HB1 ALA 531 2.623 -11.086 -4.483 232 HB2 ALA 531 HB2 ALA 531 1.822 -10.514 -5.939 233 HB3 ALA 531 HB3 ALA 531 0.977 -10.453 -4.389 234 H ARG 532 H ARG 532 4.610 -8.007 -3.718 235 HA ARG 532 HA ARG 532 6.044 -8.492 -6.205 236 HB2 ARG 532 HB2 ARG 532 6.176 -6.086 -4.394 237 HB3 ARG 532 HB3 ARG 532 7.354 -6.397 -5.652 238 HG2 ARG 532 HG2 ARG 532 4.398 -5.977 -6.060 239 HG3 ARG 532 HG3 ARG 532 5.655 -4.787 -6.385 240 HD2 ARG 532 HD2 ARG 532 6.620 -6.293 -8.087 241 HD3 ARG 532 HD3 ARG 532 5.362 -7.479 -7.749 242 HE ARG 532 HE ARG 532 4.409 -4.878 -8.488 243 HH11 ARG 532 HH11 ARG 532 5.257 -8.140 -9.676 244 HH12 ARG 532 HH12 ARG 532 4.447 -7.958 -11.148 245 HH21 ARG 532 HH21 ARG 532 3.271 -4.673 -10.489 246 HH22 ARG 532 HH22 ARG 532 3.253 -5.945 -11.618 247 H GLY 533 H GLY 533 7.555 -9.858 -5.981 248 HA2 GLY 533 HA2 GLY 533 9.621 -10.603 -5.169 249 HA3 GLY 533 HA3 GLY 533 9.342 -9.642 -3.727 250 H ASN 534 H ASN 534 9.622 -11.022 -2.175 251 HA ASN 534 HA ASN 534 7.825 -13.318 -1.992 252 HB2 ASN 534 HB2 ASN 534 10.022 -14.225 -2.627 253 HB3 ASN 534 HB3 ASN 534 10.792 -13.315 -1.338 254 HD21 ASN 534 HD21 ASN 534 7.719 -15.088 -0.950 255 HD22 ASN 534 HD22 ASN 534 8.386 -16.240 0.129 256 H VAL 535 H VAL 535 6.758 -13.314 -0.137 257 HA VAL 535 HA VAL 535 7.745 -11.676 2.068 258 HB VAL 535 HB VAL 535 4.900 -11.744 1.013 259 HG11 VAL 535 HG11 VAL 535 6.110 -10.163 3.266 260 HG12 VAL 535 HG12 VAL 535 4.934 -11.473 3.410 261 HG13 VAL 535 HG13 VAL 535 4.479 -9.949 2.639 262 HG21 VAL 535 HG21 VAL 535 6.963 -9.574 0.902 263 HG22 VAL 535 HG22 VAL 535 5.266 -9.374 0.420 264 HG23 VAL 535 HG23 VAL 535 6.330 -10.495 -0.456 265 H ILE 536 H ILE 536 7.522 -12.667 3.958 266 HA ILE 536 HA ILE 536 6.101 -15.222 3.979 267 HB ILE 536 HB ILE 536 8.316 -14.199 5.780 268 HG12 ILE 536 HG12 ILE 536 9.140 -14.973 3.645 269 HG13 ILE 536 HG13 ILE 536 9.593 -16.119 4.905 270 HG21 ILE 536 HG21 ILE 536 6.729 -15.447 7.067 271 HG22 ILE 536 HG22 ILE 536 8.234 -16.366 6.881 272 HG23 ILE 536 HG23 ILE 536 6.808 -16.760 5.899 273 HD11 ILE 536 HD11 ILE 536 7.592 -17.471 4.170 274 HD12 ILE 536 HD12 ILE 536 8.938 -17.378 3.045 275 HD13 ILE 536 HD13 ILE 536 7.509 -16.400 2.763 276 H VAL 537 H VAL 537 4.441 -15.519 5.340 277 HA VAL 537 HA VAL 537 3.859 -13.313 7.148 278 HB VAL 537 HB VAL 537 1.791 -15.039 5.749 279 HG11 VAL 537 HG11 VAL 537 1.458 -12.583 7.468 280 HG12 VAL 537 HG12 VAL 537 1.025 -14.233 7.919 281 HG13 VAL 537 HG13 VAL 537 0.159 -13.418 6.615 282 HG21 VAL 537 HG21 VAL 537 2.929 -13.575 4.187 283 HG22 VAL 537 HG22 VAL 537 2.623 -12.196 5.231 284 HG23 VAL 537 HG23 VAL 537 1.268 -13.016 4.437 285 HA PRO 538 HA PRO 538 4.162 -16.834 10.024 286 HB2 PRO 538 HB2 PRO 538 4.294 -15.282 12.261 287 HB3 PRO 538 HB3 PRO 538 5.706 -15.642 11.272 288 HG2 PRO 538 HG2 PRO 538 4.052 -13.177 11.399 289 HG3 PRO 538 HG3 PRO 538 5.790 -13.357 11.121 290 HD2 PRO 538 HD2 PRO 538 3.942 -12.838 9.158 291 HD3 PRO 538 HD3 PRO 538 5.516 -13.599 8.873 292 H TYR 539 H TYR 539 2.765 -17.691 11.619 293 HA TYR 539 HA TYR 539 0.410 -16.220 12.399 294 HB2 TYR 539 HB2 TYR 539 -1.210 -17.829 11.499 295 HB3 TYR 539 HB3 TYR 539 -0.254 -17.114 10.207 296 HD1 TYR 539 HD2 TYR 539 -0.874 -20.203 12.120 297 HD2 TYR 539 HD1 TYR 539 1.200 -18.440 8.856 298 HE1 TYR 539 HE2 TYR 539 -0.321 -22.438 11.274 299 HE2 TYR 539 HE1 TYR 539 1.752 -20.675 8.004 300 HH TYR 539 HH TYR 539 1.973 -22.902 8.792 301 H LYS 540 H LYS 540 -0.891 -17.410 13.938 302 HA LYS 540 HA LYS 540 0.233 -19.817 15.109 303 HB2 LYS 540 HB2 LYS 540 0.499 -18.876 17.332 304 HB3 LYS 540 HB3 LYS 540 1.565 -18.067 16.195 305 HG2 LYS 540 HG2 LYS 540 0.205 -16.142 16.132 306 HG3 LYS 540 HG3 LYS 540 -1.113 -16.964 16.965 307 HD2 LYS 540 HD2 LYS 540 0.301 -17.158 18.960 308 HD3 LYS 540 HD3 LYS 540 1.580 -16.267 18.120 309 HE2 LYS 540 HE2 LYS 540 -1.195 -15.257 18.504 310 HE3 LYS 540 HE3 LYS 540 0.114 -14.891 19.643 311 HZ1 LYS 540 HZ1 LYS 540 0.195 -14.242 16.736 312 HZ2 LYS 540 HZ2 LYS 540 1.270 -13.717 17.917 313 HZ3 LYS 540 HZ3 LYS 540 -0.315 -13.152 17.891 314 H THR 541 H THR 541 -1.141 -20.841 16.548 315 HA THR 541 HA THR 541 -3.912 -20.166 16.301 316 HB THR 541 HB THR 541 -4.030 -22.298 17.773 317 HG1 THR 541 HG1 THR 541 -2.182 -23.133 18.278 318 HG21 THR 541 HG21 THR 541 -4.688 -22.257 15.426 319 HG22 THR 541 HG22 THR 541 -3.790 -23.738 15.739 320 HG23 THR 541 HG23 THR 541 -3.002 -22.372 14.934 321 H ILE 542 H ILE 542 -5.176 -19.362 17.894 322 HA ILE 542 HA ILE 542 -3.959 -18.758 20.505 323 HB ILE 542 HB ILE 542 -6.391 -17.558 19.160 324 HG12 ILE 542 HG12 ILE 542 -3.659 -16.305 19.525 325 HG13 ILE 542 HG13 ILE 542 -4.241 -16.997 18.019 326 HG21 ILE 542 HG21 ILE 542 -4.921 -16.720 21.670 327 HG22 ILE 542 HG22 ILE 542 -6.519 -17.461 21.598 328 HG23 ILE 542 HG23 ILE 542 -6.266 -15.845 20.937 329 HD11 ILE 542 HD11 ILE 542 -5.555 -14.705 19.454 330 HD12 ILE 542 HD12 ILE 542 -5.937 -15.337 17.838 331 HD13 ILE 542 HD13 ILE 542 -4.389 -14.548 18.145 332 H GLU 543 H GLU 543 -4.735 -19.947 22.155 333 HA GLU 543 HA GLU 543 -6.877 -21.813 21.764 334 HB2 GLU 543 HB2 GLU 543 -5.334 -21.064 24.250 335 HB3 GLU 543 HB3 GLU 543 -6.446 -22.417 24.117 336 HG2 GLU 543 HG2 GLU 543 -5.022 -23.536 22.588 337 HG3 GLU 543 HG3 GLU 543 -3.981 -22.123 22.425 338 H GLY 544 H GLY 544 -8.836 -20.978 21.654 339 HA2 GLY 544 HA2 GLY 544 -9.644 -18.792 23.410 340 HA3 GLY 544 HA3 GLY 544 -10.607 -19.501 22.111 341 H THR 545 H THR 545 -12.318 -20.518 22.844 342 HA THR 545 HA THR 545 -12.297 -21.690 25.481 343 HB THR 545 HB THR 545 -14.315 -20.448 24.692 344 HG1 THR 545 HG1 THR 545 -14.384 -23.106 25.555 345 HG21 THR 545 HG21 THR 545 -14.155 -21.105 22.444 346 HG22 THR 545 HG22 THR 545 -15.765 -21.599 23.071 347 HG23 THR 545 HG23 THR 545 -14.420 -22.777 22.906 348 H ALA 546 H ALA 546 -11.375 -22.599 22.496 349 HA ALA 546 HA ALA 546 -11.768 -25.440 23.002 350 HB1 ALA 546 HB1 ALA 546 -12.217 -24.652 20.710 351 HB2 ALA 546 HB2 ALA 546 -10.854 -25.767 20.747 352 HB3 ALA 546 HB3 ALA 546 -10.568 -24.031 20.603 353 H ARG 547 H ARG 547 -10.089 -26.721 23.514 354 HA ARG 547 HA ARG 547 -7.805 -25.432 24.684 355 HB2 ARG 547 HB2 ARG 547 -8.855 -28.220 24.654 356 HB3 ARG 547 HB3 ARG 547 -7.398 -27.728 25.514 357 HG2 ARG 547 HG2 ARG 547 -8.528 -26.392 26.943 358 HG3 ARG 547 HG3 ARG 547 -9.989 -26.320 25.950 359 HD2 ARG 547 HD2 ARG 547 -8.919 -28.752 27.342 360 HD3 ARG 547 HD3 ARG 547 -10.322 -27.811 27.883 361 HE ARG 547 HE ARG 547 -10.645 -28.644 25.187 362 HH11 ARG 547 HH11 ARG 547 -10.914 -29.986 28.459 363 HH12 ARG 547 HH12 ARG 547 -12.002 -31.214 27.990 364 HH21 ARG 547 HH21 ARG 547 -12.042 -30.315 24.558 365 HH22 ARG 547 HH22 ARG 547 -12.651 -31.434 25.680 366 H GLY 548 H GLY 548 -5.797 -25.670 24.032 367 HA2 GLY 548 HA2 GLY 548 -5.385 -26.729 21.339 368 HA3 GLY 548 HA3 GLY 548 -4.277 -25.681 22.219 369 H GLY 549 H GLY 549 -2.707 -27.229 21.439 370 HA2 GLY 549 HA2 GLY 549 -1.129 -28.778 21.991 371 HA3 GLY 549 HA3 GLY 549 -1.982 -29.051 23.499 372 H GLY 550 H GLY 550 -3.899 -29.441 20.695 373 HA2 GLY 550 HA2 GLY 550 -4.457 -31.360 19.476 374 HA3 GLY 550 HA3 GLY 550 -3.323 -32.283 20.457 375 H GLU 551 H GLU 551 -5.581 -30.188 21.975 376 HA GLU 551 HA GLU 551 -6.813 -32.518 23.218 377 HB2 GLU 551 HB2 GLU 551 -5.722 -30.480 24.424 378 HB3 GLU 551 HB3 GLU 551 -7.232 -29.673 24.061 379 HG2 GLU 551 HG2 GLU 551 -8.457 -31.103 25.453 380 HG3 GLU 551 HG3 GLU 551 -7.142 -32.280 25.537 381 H ASP 552 H ASP 552 -7.948 -29.311 22.020 382 HA ASP 552 HA ASP 552 -10.302 -30.731 20.931 383 HB2 ASP 552 HB2 ASP 552 -9.974 -27.772 21.482 384 HB3 ASP 552 HB3 ASP 552 -11.362 -28.489 20.689 385 H PHE 553 H PHE 553 -7.663 -28.598 20.289 386 HA PHE 553 HA PHE 553 -7.923 -29.345 17.524 387 HB2 PHE 553 HB2 PHE 553 -7.536 -27.107 16.688 388 HB3 PHE 553 HB3 PHE 553 -8.940 -27.069 17.734 389 HD1 PHE 553 HD2 PHE 553 -8.815 -25.972 19.936 390 HD2 PHE 553 HD1 PHE 553 -5.547 -25.906 17.216 391 HE1 PHE 553 HE2 PHE 553 -7.803 -24.109 21.186 392 HE2 PHE 553 HE1 PHE 553 -4.535 -24.063 18.459 393 HZ PHE 553 HZ PHE 553 -5.658 -23.150 20.446 394 H GLU 554 H GLU 554 -6.015 -29.375 16.476 395 HA GLU 554 HA GLU 554 -3.675 -29.753 18.143 396 HB2 GLU 554 HB2 GLU 554 -4.684 -31.163 16.143 397 HB3 GLU 554 HB3 GLU 554 -3.865 -29.960 15.174 398 HG2 GLU 554 HG2 GLU 554 -2.531 -31.735 17.176 399 HG3 GLU 554 HG3 GLU 554 -2.645 -32.084 15.457 400 H ASP 555 H ASP 555 -2.208 -28.107 18.337 401 HA ASP 555 HA ASP 555 -2.746 -25.547 17.227 402 HB2 ASP 555 HB2 ASP 555 -0.499 -26.603 18.894 403 HB3 ASP 555 HB3 ASP 555 -0.406 -25.004 18.176 404 H THR 556 H THR 556 -1.442 -24.267 15.922 405 HA THR 556 HA THR 556 0.688 -25.545 14.568 406 HB THR 556 HB THR 556 -1.181 -26.164 13.114 407 HG1 THR 556 HG1 THR 556 -0.121 -25.714 11.379 408 HG21 THR 556 HG21 THR 556 -2.767 -24.414 13.604 409 HG22 THR 556 HG22 THR 556 -2.403 -24.379 11.870 410 HG23 THR 556 HG23 THR 556 -1.664 -23.202 12.960 411 H CYS 557 H CYS 557 2.123 -24.190 13.878 412 HA CYS 557 HA CYS 557 1.726 -21.335 13.984 413 HB2 CYS 557 HB2 CYS 557 3.732 -21.151 15.520 414 HB3 CYS 557 HB3 CYS 557 2.277 -21.773 16.275 415 HG CYS 557 HG CYS 557 3.110 -24.463 16.173 416 H GLY 558 H GLY 558 3.271 -20.314 12.617 417 HA2 GLY 558 HA2 GLY 558 5.646 -21.227 11.808 418 HA3 GLY 558 HA3 GLY 558 4.503 -22.120 10.810 419 H GLU 559 H GLU 559 5.342 -21.027 8.990 420 HA GLU 559 HA GLU 559 4.325 -18.312 8.720 421 HB2 GLU 559 HB2 GLU 559 7.119 -19.234 8.094 422 HB3 GLU 559 HB3 GLU 559 6.445 -17.677 7.614 423 HG2 GLU 559 HG2 GLU 559 6.201 -17.072 9.966 424 HG3 GLU 559 HG3 GLU 559 6.864 -18.631 10.445 425 H LEU 560 H LEU 560 3.565 -17.843 6.739 426 HA LEU 560 HA LEU 560 3.458 -19.990 4.735 427 HB2 LEU 560 HB2 LEU 560 1.859 -17.456 5.054 428 HB3 LEU 560 HB3 LEU 560 1.637 -18.633 3.777 429 HG LEU 560 HG LEU 560 1.199 -19.155 6.710 430 HD11 LEU 560 HD11 LEU 560 -1.164 -19.209 6.122 431 HD12 LEU 560 HD12 LEU 560 -0.766 -18.720 4.477 432 HD13 LEU 560 HD13 LEU 560 -0.450 -17.626 5.824 433 HD21 LEU 560 HD21 LEU 560 0.699 -20.854 4.268 434 HD22 LEU 560 HD22 LEU 560 0.129 -21.234 5.890 435 HD23 LEU 560 HD23 LEU 560 1.860 -21.179 5.559 436 H GLU 561 H GLU 561 4.241 -19.699 2.692 437 HA GLU 561 HA GLU 561 5.893 -17.333 2.344 438 HB2 GLU 561 HB2 GLU 561 6.890 -19.635 2.195 439 HB3 GLU 561 HB3 GLU 561 5.901 -19.866 0.751 440 HG2 GLU 561 HG2 GLU 561 7.084 -17.860 -0.246 441 HG3 GLU 561 HG3 GLU 561 8.082 -17.869 1.164 442 H PHE 562 H PHE 562 4.919 -15.739 1.295 443 HA PHE 562 HA PHE 562 3.243 -16.382 -1.021 444 HB2 PHE 562 HB2 PHE 562 3.376 -13.935 0.739 445 HB3 PHE 562 HB3 PHE 562 2.554 -13.950 -0.811 446 HD1 PHE 562 HD2 PHE 562 0.515 -15.148 -1.112 447 HD2 PHE 562 HD1 PHE 562 2.472 -15.093 2.652 448 HE1 PHE 562 HE2 PHE 562 -1.553 -15.929 -0.034 449 HE2 PHE 562 HE1 PHE 562 0.410 -15.879 3.742 450 HZ PHE 562 HZ PHE 562 -1.607 -16.298 2.384 451 H GLN 563 H GLN 563 3.641 -15.262 -2.950 452 HA GLN 563 HA GLN 563 6.024 -13.630 -3.100 453 HB2 GLN 563 HB2 GLN 563 5.651 -16.034 -4.916 454 HB3 GLN 563 HB3 GLN 563 6.930 -14.843 -4.988 455 HG2 GLN 563 HG2 GLN 563 7.702 -15.590 -2.764 456 HG3 GLN 563 HG3 GLN 563 6.497 -16.873 -2.822 457 HE21 GLN 563 HE21 GLN 563 9.457 -15.664 -4.142 458 HE22 GLN 563 HE22 GLN 563 9.934 -17.108 -4.920 459 H ASN 564 H ASN 564 6.214 -13.107 -5.591 460 HA ASN 564 HA ASN 564 3.915 -11.627 -6.348 461 HB2 ASN 564 HB2 ASN 564 6.314 -11.114 -6.948 462 HB3 ASN 564 HB3 ASN 564 6.277 -12.456 -8.070 463 HD21 ASN 564 HD21 ASN 564 3.514 -11.758 -9.073 464 HD22 ASN 564 HD22 ASN 564 3.737 -10.337 -10.007 465 H ASP 565 H ASP 565 5.303 -14.691 -7.308 466 HA ASP 565 HA ASP 565 3.310 -15.164 -9.342 467 HB2 ASP 565 HB2 ASP 565 5.644 -15.905 -9.630 468 HB3 ASP 565 HB3 ASP 565 5.442 -17.000 -8.269 469 H GLU 566 H GLU 566 3.975 -16.321 -6.050 470 HA GLU 566 HA GLU 566 2.231 -18.485 -5.989 471 HB2 GLU 566 HB2 GLU 566 3.207 -16.664 -3.817 472 HB3 GLU 566 HB3 GLU 566 2.298 -18.136 -3.535 473 HG2 GLU 566 HG2 GLU 566 5.000 -17.926 -4.835 474 HG3 GLU 566 HG3 GLU 566 4.650 -18.501 -3.202 475 H ILE 567 H ILE 567 0.148 -18.715 -5.530 476 HA ILE 567 HA ILE 567 -1.498 -16.402 -5.889 477 HB ILE 567 HB ILE 567 -3.423 -18.135 -5.720 478 HG12 ILE 567 HG12 ILE 567 -1.196 -20.056 -6.389 479 HG13 ILE 567 HG13 ILE 567 -1.818 -19.954 -4.757 480 HG21 ILE 567 HG21 ILE 567 -2.796 -17.065 -7.773 481 HG22 ILE 567 HG22 ILE 567 -3.077 -18.777 -8.078 482 HG23 ILE 567 HG23 ILE 567 -1.431 -18.158 -7.972 483 HD11 ILE 567 HD11 ILE 567 -3.358 -20.693 -7.226 484 HD12 ILE 567 HD12 ILE 567 -4.019 -20.561 -5.591 485 HD13 ILE 567 HD13 ILE 567 -2.805 -21.787 -5.952 486 H VAL 568 H VAL 568 -2.287 -18.995 -3.553 487 HA VAL 568 HA VAL 568 -2.473 -17.025 -1.458 488 HB VAL 568 HB VAL 568 -4.692 -17.055 -2.588 489 HG11 VAL 568 HG11 VAL 568 -4.790 -19.957 -1.844 490 HG12 VAL 568 HG12 VAL 568 -4.795 -19.276 -3.480 491 HG13 VAL 568 HG13 VAL 568 -6.162 -18.997 -2.384 492 HG21 VAL 568 HG21 VAL 568 -6.107 -17.500 -0.658 493 HG22 VAL 568 HG22 VAL 568 -4.674 -16.554 -0.227 494 HG23 VAL 568 HG23 VAL 568 -4.752 -18.278 0.156 495 H LYS 569 H LYS 569 -2.473 -18.043 0.626 496 HA LYS 569 HA LYS 569 -1.474 -20.814 0.574 497 HB2 LYS 569 HB2 LYS 569 -0.868 -18.522 2.414 498 HB3 LYS 569 HB3 LYS 569 -0.441 -20.188 2.769 499 HG2 LYS 569 HG2 LYS 569 0.429 -19.201 0.190 500 HG3 LYS 569 HG3 LYS 569 1.191 -18.378 1.561 501 HD2 LYS 569 HD2 LYS 569 2.601 -20.201 0.920 502 HD3 LYS 569 HD3 LYS 569 1.769 -20.725 2.370 503 HE2 LYS 569 HE2 LYS 569 0.216 -22.030 1.076 504 HE3 LYS 569 HE3 LYS 569 0.901 -21.418 -0.429 505 HZ1 LYS 569 HZ1 LYS 569 2.321 -23.098 1.567 506 HZ2 LYS 569 HZ2 LYS 569 2.979 -22.463 0.140 507 HZ3 LYS 569 HZ3 LYS 569 1.752 -23.602 0.050 508 H THR 570 H THR 570 -1.965 -22.053 2.412 509 HA THR 570 HA THR 570 -4.399 -21.254 3.834 510 HB THR 570 HB THR 570 -4.812 -23.829 3.799 511 HG1 THR 570 HG1 THR 570 -3.953 -24.913 2.204 512 HG21 THR 570 HG21 THR 570 -6.188 -23.599 1.816 513 HG22 THR 570 HG22 THR 570 -5.351 -22.092 1.378 514 HG23 THR 570 HG23 THR 570 -6.324 -22.184 2.850 515 H ILE 571 H ILE 571 -4.561 -21.868 5.922 516 HA ILE 571 HA ILE 571 -2.248 -23.196 7.125 517 HB ILE 571 HB ILE 571 -4.608 -21.824 8.494 518 HG12 ILE 571 HG12 ILE 571 -2.719 -20.316 9.403 519 HG13 ILE 571 HG13 ILE 571 -1.768 -20.978 8.081 520 HG21 ILE 571 HG21 ILE 571 -3.423 -22.149 10.593 521 HG22 ILE 571 HG22 ILE 571 -2.153 -23.020 9.738 522 HG23 ILE 571 HG23 ILE 571 -3.781 -23.689 9.806 523 HD11 ILE 571 HD11 ILE 571 -4.340 -19.460 7.796 524 HD12 ILE 571 HD12 ILE 571 -3.331 -20.078 6.482 525 HD13 ILE 571 HD13 ILE 571 -2.718 -18.815 7.551 526 H SER 572 H SER 572 -2.417 -25.270 7.664 527 HA SER 572 HA SER 572 -5.046 -26.584 7.479 528 HB2 SER 572 HB2 SER 572 -3.561 -28.659 7.362 529 HB3 SER 572 HB3 SER 572 -3.479 -27.573 5.975 530 HG SER 572 HG SER 572 -1.509 -26.992 6.505 531 H VAL 573 H VAL 573 -6.019 -26.868 9.337 532 HA VAL 573 HA VAL 573 -4.346 -27.326 11.729 533 HB VAL 573 HB VAL 573 -7.078 -26.006 11.648 534 HG11 VAL 573 HG11 VAL 573 -5.204 -26.379 13.984 535 HG12 VAL 573 HG12 VAL 573 -6.750 -27.209 13.723 536 HG13 VAL 573 HG13 VAL 573 -6.712 -25.468 13.993 537 HG21 VAL 573 HG21 VAL 573 -5.439 -24.516 10.736 538 HG22 VAL 573 HG22 VAL 573 -4.358 -24.824 12.094 539 HG23 VAL 573 HG23 VAL 573 -5.867 -23.957 12.358 540 H LYS 574 H LYS 574 -4.671 -29.168 12.775 541 HA LYS 574 HA LYS 574 -6.740 -30.983 11.886 542 HB2 LYS 574 HB2 LYS 574 -4.618 -32.011 12.267 543 HB3 LYS 574 HB3 LYS 574 -4.436 -31.255 13.833 544 HG2 LYS 574 HG2 LYS 574 -4.915 -33.520 14.268 545 HG3 LYS 574 HG3 LYS 574 -6.400 -32.645 14.605 546 HD2 LYS 574 HD2 LYS 574 -7.013 -34.633 13.446 547 HD3 LYS 574 HD3 LYS 574 -7.175 -33.312 12.289 548 HE2 LYS 574 HE2 LYS 574 -5.069 -33.883 11.272 549 HE3 LYS 574 HE3 LYS 574 -4.755 -35.097 12.508 550 HZ1 LYS 574 HZ1 LYS 574 -6.962 -35.209 10.509 551 HZ2 LYS 574 HZ2 LYS 574 -6.650 -36.372 11.675 552 HZ3 LYS 574 HZ3 LYS 574 -5.537 -36.085 10.450 553 H VAL 575 H VAL 575 -8.603 -31.093 12.701 554 HA VAL 575 HA VAL 575 -9.256 -29.819 15.232 555 HB VAL 575 HB VAL 575 -11.027 -31.204 13.183 556 HG11 VAL 575 HG11 VAL 575 -11.766 -29.545 15.585 557 HG12 VAL 575 HG12 VAL 575 -12.031 -31.278 15.395 558 HG13 VAL 575 HG13 VAL 575 -12.901 -30.134 14.372 559 HG21 VAL 575 HG21 VAL 575 -10.581 -28.265 13.712 560 HG22 VAL 575 HG22 VAL 575 -11.747 -28.935 12.571 561 HG23 VAL 575 HG23 VAL 575 -10.018 -29.163 12.304 562 H ILE 576 H ILE 576 -9.330 -30.971 17.069 563 HA ILE 576 HA ILE 576 -9.051 -33.867 16.910 564 HB ILE 576 HB ILE 576 -9.029 -32.078 19.335 565 HG12 ILE 576 HG12 ILE 576 -7.246 -31.408 17.790 566 HG13 ILE 576 HG13 ILE 576 -6.595 -32.122 19.254 567 HG21 ILE 576 HG21 ILE 576 -7.836 -33.937 20.411 568 HG22 ILE 576 HG22 ILE 576 -8.012 -34.890 18.936 569 HG23 ILE 576 HG23 ILE 576 -9.444 -34.414 19.854 570 HD11 ILE 576 HD11 ILE 576 -6.234 -34.217 18.025 571 HD12 ILE 576 HD12 ILE 576 -5.363 -32.857 17.315 572 HD13 ILE 576 HD13 ILE 576 -6.848 -33.446 16.561 573 H ASP 577 H ASP 577 -10.503 -35.186 17.401 574 HA ASP 577 HA ASP 577 -13.250 -34.433 17.637 575 HB2 ASP 577 HB2 ASP 577 -11.919 -37.140 17.914 576 HB3 ASP 577 HB3 ASP 577 -13.643 -36.855 17.739 577 H ASP 578 H ASP 578 -13.974 -33.688 19.556 578 HA ASP 578 HA ASP 578 -13.241 -35.209 21.957 579 HB2 ASP 578 HB2 ASP 578 -11.843 -33.280 22.102 580 HB3 ASP 578 HB3 ASP 578 -13.178 -32.208 21.702 581 H GLU 579 H GLU 579 -14.896 -35.861 23.079 582 HA GLU 579 HA GLU 579 -17.325 -34.259 23.096 583 HB2 GLU 579 HB2 GLU 579 -17.228 -37.228 22.609 584 HB3 GLU 579 HB3 GLU 579 -18.683 -36.339 22.996 585 HG2 GLU 579 HG2 GLU 579 -18.414 -35.039 20.934 586 HG3 GLU 579 HG3 GLU 579 -16.973 -35.985 20.552 587 H GLU 580 H GLU 580 -16.360 -33.681 25.213 588 HA GLU 580 HA GLU 580 -16.970 -35.743 27.180 589 HB2 GLU 580 HB2 GLU 580 -15.933 -34.226 28.893 590 HB3 GLU 580 HB3 GLU 580 -14.812 -34.717 27.641 591 HG2 GLU 580 HG2 GLU 580 -14.978 -32.537 26.598 592 HG3 GLU 580 HG3 GLU 580 -16.211 -32.045 27.760 593 H TYR 581 H TYR 581 -17.723 -32.422 26.325 594 HA TYR 581 HA TYR 581 -20.443 -32.691 26.568 595 HB2 TYR 581 HB2 TYR 581 -19.926 -32.807 29.054 596 HB3 TYR 581 HB3 TYR 581 -19.289 -31.181 28.961 597 HD1 TYR 581 HD2 TYR 581 -22.306 -33.245 28.811 598 HD2 TYR 581 HD1 TYR 581 -20.808 -29.273 28.814 599 HE1 TYR 581 HE2 TYR 581 -24.560 -32.401 29.244 600 HE2 TYR 581 HE1 TYR 581 -23.071 -28.414 29.255 601 HH TYR 581 HH TYR 581 -25.418 -29.203 28.889 602 H GLU 582 H GLU 582 -18.876 -29.875 27.933 603 HA GLU 582 HA GLU 582 -18.649 -27.802 27.303 604 HB2 GLU 582 HB2 GLU 582 -17.686 -29.189 24.833 605 HB3 GLU 582 HB3 GLU 582 -17.602 -27.442 25.001 606 HG2 GLU 582 HG2 GLU 582 -16.311 -29.477 26.805 607 HG3 GLU 582 HG3 GLU 582 -15.495 -28.427 25.644 608 H LYS 583 H LYS 583 -19.029 -26.263 25.197 609 HA LYS 583 HA LYS 583 -21.822 -26.714 24.589 610 HB2 LYS 583 HB2 LYS 583 -21.487 -24.936 26.293 611 HB3 LYS 583 HB3 LYS 583 -20.528 -24.038 25.125 612 HG2 LYS 583 HG2 LYS 583 -22.741 -23.120 25.203 613 HG3 LYS 583 HG3 LYS 583 -22.499 -23.926 23.648 614 HD2 LYS 583 HD2 LYS 583 -23.689 -25.905 24.532 615 HD3 LYS 583 HD3 LYS 583 -23.963 -25.036 26.037 616 HE2 LYS 583 HE2 LYS 583 -25.937 -24.918 24.651 617 HE3 LYS 583 HE3 LYS 583 -25.210 -23.325 24.813 618 HZ1 LYS 583 HZ1 LYS 583 -24.884 -25.104 22.444 619 HZ2 LYS 583 HZ2 LYS 583 -24.278 -23.549 22.573 620 HZ3 LYS 583 HZ3 LYS 583 -25.942 -23.812 22.551 621 H ASN 584 H ASN 584 -18.920 -24.842 23.631 622 HA ASN 584 HA ASN 584 -19.281 -25.628 20.879 623 HB2 ASN 584 HB2 ASN 584 -20.713 -23.625 21.001 624 HB3 ASN 584 HB3 ASN 584 -19.387 -22.705 21.695 625 HD21 ASN 584 HD21 ASN 584 -20.631 -24.194 18.820 626 HD22 ASN 584 HD22 ASN 584 -19.615 -23.370 17.702 627 H LYS 585 H LYS 585 -17.341 -25.610 19.792 628 HA LYS 585 HA LYS 585 -14.992 -24.945 21.437 629 HB2 LYS 585 HB2 LYS 585 -15.256 -26.651 18.975 630 HB3 LYS 585 HB3 LYS 585 -13.774 -26.440 19.904 631 HG2 LYS 585 HG2 LYS 585 -16.314 -27.751 20.833 632 HG3 LYS 585 HG3 LYS 585 -14.873 -28.595 20.266 633 HD2 LYS 585 HD2 LYS 585 -13.612 -27.568 22.132 634 HD3 LYS 585 HD3 LYS 585 -15.119 -26.850 22.710 635 HE2 LYS 585 HE2 LYS 585 -14.608 -28.915 23.911 636 HE3 LYS 585 HE3 LYS 585 -16.092 -29.081 22.972 637 HZ1 LYS 585 HZ1 LYS 585 -14.641 -31.029 22.791 638 HZ2 LYS 585 HZ2 LYS 585 -13.399 -30.082 22.271 639 HZ3 LYS 585 HZ3 LYS 585 -14.746 -30.289 21.265 640 H THR 586 H THR 586 -14.017 -23.038 20.851 641 HA THR 586 HA THR 586 -13.594 -22.615 18.071 642 HB THR 586 HB THR 586 -15.737 -21.432 18.361 643 HG1 THR 586 HG1 THR 586 -13.951 -20.524 17.066 644 HG21 THR 586 HG21 THR 586 -15.648 -20.890 20.716 645 HG22 THR 586 HG22 THR 586 -15.897 -19.430 19.747 646 HG23 THR 586 HG23 THR 586 -14.303 -19.777 20.426 647 H PHE 587 H PHE 587 -11.850 -21.320 17.612 648 HA PHE 587 HA PHE 587 -10.323 -20.254 19.815 649 HB2 PHE 587 HB2 PHE 587 -8.264 -21.376 19.101 650 HB3 PHE 587 HB3 PHE 587 -9.475 -22.575 19.509 651 HD1 PHE 587 HD1 PHE 587 -10.564 -23.878 17.674 652 HD2 PHE 587 HD2 PHE 587 -7.334 -21.209 16.951 653 HE1 PHE 587 HE1 PHE 587 -10.143 -24.965 15.502 654 HE2 PHE 587 HE2 PHE 587 -6.918 -22.294 14.784 655 HZ PHE 587 HZ PHE 587 -8.326 -24.172 14.065 656 H PHE 588 H PHE 588 -8.235 -19.200 18.593 657 HA PHE 588 HA PHE 588 -9.423 -17.834 16.302 658 HB2 PHE 588 HB2 PHE 588 -7.932 -16.551 18.608 659 HB3 PHE 588 HB3 PHE 588 -8.303 -15.737 17.097 660 HD1 PHE 588 HD2 PHE 588 -9.745 -17.276 20.101 661 HD2 PHE 588 HD1 PHE 588 -10.433 -14.863 16.684 662 HE1 PHE 588 HE2 PHE 588 -11.947 -16.632 21.009 663 HE2 PHE 588 HE1 PHE 588 -12.618 -14.208 17.568 664 HZ PHE 588 HZ PHE 588 -13.387 -15.091 19.733 665 H LEU 589 H LEU 589 -7.983 -16.993 14.840 666 HA LEU 589 HA LEU 589 -5.284 -18.154 14.961 667 HB2 LEU 589 HB2 LEU 589 -7.243 -18.804 13.158 668 HB3 LEU 589 HB3 LEU 589 -6.485 -17.457 12.352 669 HG LEU 589 HG LEU 589 -5.580 -19.487 11.477 670 HD11 LEU 589 HD11 LEU 589 -3.197 -19.252 11.906 671 HD12 LEU 589 HD12 LEU 589 -3.558 -18.177 13.259 672 HD13 LEU 589 HD13 LEU 589 -3.985 -17.703 11.615 673 HD21 LEU 589 HD21 LEU 589 -4.368 -21.096 12.883 674 HD22 LEU 589 HD22 LEU 589 -6.086 -20.985 13.267 675 HD23 LEU 589 HD23 LEU 589 -4.902 -20.210 14.315 676 H GLU 590 H GLU 590 -3.746 -16.633 14.865 677 HA GLU 590 HA GLU 590 -4.506 -14.003 13.835 678 HB2 GLU 590 HB2 GLU 590 -4.348 -13.941 16.274 679 HB3 GLU 590 HB3 GLU 590 -2.709 -14.583 16.208 680 HG2 GLU 590 HG2 GLU 590 -2.005 -12.547 15.017 681 HG3 GLU 590 HG3 GLU 590 -3.650 -11.927 15.132 682 H ILE 591 H ILE 591 -3.195 -13.236 12.362 683 HA ILE 591 HA ILE 591 -0.776 -14.733 11.767 684 HB ILE 591 HB ILE 591 -0.819 -13.503 9.575 685 HG12 ILE 591 HG12 ILE 591 -3.591 -12.665 10.496 686 HG13 ILE 591 HG13 ILE 591 -2.230 -11.585 10.237 687 HG21 ILE 591 HG21 ILE 591 -2.582 -14.898 8.585 688 HG22 ILE 591 HG22 ILE 591 -3.189 -15.234 10.211 689 HG23 ILE 591 HG23 ILE 591 -1.588 -15.782 9.747 690 HD11 ILE 591 HD11 ILE 591 -3.663 -13.195 8.132 691 HD12 ILE 591 HD12 ILE 591 -2.279 -12.137 7.842 692 HD13 ILE 591 HD13 ILE 591 -3.807 -11.462 8.419 693 H GLY 592 H GLY 592 1.136 -13.647 11.461 694 HA2 GLY 592 HA2 GLY 592 1.309 -11.226 13.065 695 HA3 GLY 592 HA3 GLY 592 2.666 -12.221 12.535 696 H GLU 593 H GLU 593 3.023 -9.662 12.200 697 HA GLU 593 HA GLU 593 1.920 -8.707 9.797 698 HB2 GLU 593 HB2 GLU 593 4.232 -7.718 11.446 699 HB3 GLU 593 HB3 GLU 593 3.632 -6.891 10.012 700 HG2 GLU 593 HG2 GLU 593 1.446 -6.696 11.028 701 HG3 GLU 593 HG3 GLU 593 2.030 -7.503 12.476 702 HA PRO 594 HA PRO 594 4.239 -10.923 6.899 703 HB2 PRO 594 HB2 PRO 594 4.062 -9.092 4.834 704 HB3 PRO 594 HB3 PRO 594 2.801 -10.254 5.243 705 HG2 PRO 594 HG2 PRO 594 3.051 -7.389 5.974 706 HG3 PRO 594 HG3 PRO 594 1.595 -8.271 5.518 707 HD2 PRO 594 HD2 PRO 594 2.154 -7.640 8.034 708 HD3 PRO 594 HD3 PRO 594 1.354 -9.174 7.661 709 H ARG 595 H ARG 595 6.278 -11.087 6.352 710 HA ARG 595 HA ARG 595 8.029 -8.764 6.705 711 HB2 ARG 595 HB2 ARG 595 9.782 -10.506 7.361 712 HB3 ARG 595 HB3 ARG 595 8.494 -10.221 8.524 713 HG2 ARG 595 HG2 ARG 595 7.340 -12.229 7.747 714 HG3 ARG 595 HG3 ARG 595 8.613 -12.468 6.553 715 HD2 ARG 595 HD2 ARG 595 9.089 -12.431 9.527 716 HD3 ARG 595 HD3 ARG 595 8.782 -13.901 8.605 717 HE ARG 595 HE ARG 595 11.026 -12.127 7.950 718 HH11 ARG 595 HH11 ARG 595 9.831 -15.390 8.863 719 HH12 ARG 595 HH12 ARG 595 11.333 -16.117 8.602 720 HH21 ARG 595 HH21 ARG 595 13.071 -13.193 7.643 721 HH22 ARG 595 HH22 ARG 595 13.211 -14.853 7.930 722 H LEU 596 H LEU 596 9.123 -8.160 4.988 723 HA LEU 596 HA LEU 596 8.968 -9.520 2.525 724 HB2 LEU 596 HB2 LEU 596 9.240 -6.984 3.129 725 HB3 LEU 596 HB3 LEU 596 10.935 -7.356 3.246 726 HG LEU 596 HG LEU 596 10.251 -6.277 1.103 727 HD11 LEU 596 HD11 LEU 596 12.278 -7.519 1.171 728 HD12 LEU 596 HD12 LEU 596 11.478 -7.760 -0.388 729 HD13 LEU 596 HD13 LEU 596 11.425 -9.028 0.846 730 HD21 LEU 596 HD21 LEU 596 8.089 -7.388 0.950 731 HD22 LEU 596 HD22 LEU 596 8.915 -8.900 0.562 732 HD23 LEU 596 HD23 LEU 596 9.027 -7.523 -0.543 733 H VAL 597 H VAL 597 10.452 -10.870 1.604 734 HA VAL 597 HA VAL 597 12.578 -11.788 3.367 735 HB VAL 597 HB VAL 597 11.680 -13.019 0.763 736 HG11 VAL 597 HG11 VAL 597 12.819 -15.004 1.566 737 HG12 VAL 597 HG12 VAL 597 13.269 -14.167 3.052 738 HG13 VAL 597 HG13 VAL 597 13.945 -13.644 1.509 739 HG21 VAL 597 HG21 VAL 597 10.446 -14.600 2.129 740 HG22 VAL 597 HG22 VAL 597 9.843 -12.955 2.346 741 HG23 VAL 597 HG23 VAL 597 10.873 -13.692 3.580 742 H GLU 598 H GLU 598 14.138 -10.351 3.188 743 HA GLU 598 HA GLU 598 15.763 -10.420 0.809 744 HB2 GLU 598 HB2 GLU 598 14.012 -8.363 1.020 745 HB3 GLU 598 HB3 GLU 598 15.292 -7.734 2.044 746 HG2 GLU 598 HG2 GLU 598 15.558 -8.532 -0.849 747 HG3 GLU 598 HG3 GLU 598 15.405 -6.885 -0.255 748 H MET 599 H MET 599 17.907 -9.490 1.486 749 HA MET 599 HA MET 599 18.592 -10.420 4.121 750 HB2 MET 599 HB2 MET 599 20.867 -10.014 3.488 751 HB3 MET 599 HB3 MET 599 20.037 -10.778 2.141 752 HG2 MET 599 HG2 MET 599 19.721 -8.498 1.185 753 HG3 MET 599 HG3 MET 599 20.788 -7.898 2.451 754 HE1 MET 599 HE1 MET 599 22.035 -10.784 -0.928 755 HE2 MET 599 HE2 MET 599 20.427 -10.076 -0.750 756 HE3 MET 599 HE3 MET 599 20.995 -11.285 0.397 757 H SER 600 H SER 600 17.446 -7.536 2.969 758 HA SER 600 HA SER 600 18.946 -5.907 4.838 759 HB2 SER 600 HB2 SER 600 16.799 -5.091 2.887 760 HB3 SER 600 HB3 SER 600 17.887 -4.015 3.769 761 HG SER 600 HG SER 600 18.415 -5.801 1.677 762 H GLU 601 H GLU 601 18.241 -6.335 6.822 763 HA GLU 601 HA GLU 601 15.664 -5.290 7.502 764 HB2 GLU 601 HB2 GLU 601 15.124 -7.232 9.023 765 HB3 GLU 601 HB3 GLU 601 15.029 -7.613 7.316 766 HG2 GLU 601 HG2 GLU 601 17.196 -8.729 7.437 767 HG3 GLU 601 HG3 GLU 601 17.316 -8.318 9.146 768 H LYS 602 H LYS 602 16.505 -3.637 8.555 769 HA LYS 602 HA LYS 602 18.827 -3.847 10.157 770 HB2 LYS 602 HB2 LYS 602 17.578 -1.752 9.025 771 HB3 LYS 602 HB3 LYS 602 16.895 -1.627 10.639 772 HG2 LYS 602 HG2 LYS 602 19.840 -1.604 9.969 773 HG3 LYS 602 HG3 LYS 602 18.856 -0.194 10.348 774 HD2 LYS 602 HD2 LYS 602 18.507 -1.020 12.600 775 HD3 LYS 602 HD3 LYS 602 19.384 -2.503 12.220 776 HE2 LYS 602 HE2 LYS 602 20.782 -0.902 13.456 777 HE3 LYS 602 HE3 LYS 602 21.427 -1.221 11.846 778 HZ1 LYS 602 HZ1 LYS 602 21.457 1.168 12.452 779 HZ2 LYS 602 HZ2 LYS 602 19.769 1.127 12.579 780 HZ3 LYS 602 HZ3 LYS 602 20.497 0.876 11.105 781 H LYS 603 H LYS 603 18.934 -4.786 12.033 782 HA LYS 603 HA LYS 603 16.595 -4.756 13.747 783 HB2 LYS 603 HB2 LYS 603 17.143 -7.135 14.394 784 HB3 LYS 603 HB3 LYS 603 16.593 -6.928 12.743 785 HG2 LYS 603 HG2 LYS 603 19.204 -6.835 12.281 786 HG3 LYS 603 HG3 LYS 603 19.245 -7.768 13.776 787 HD2 LYS 603 HD2 LYS 603 17.669 -8.458 11.284 788 HD3 LYS 603 HD3 LYS 603 19.145 -9.248 11.814 789 HE2 LYS 603 HE2 LYS 603 18.001 -10.099 13.783 790 HE3 LYS 603 HE3 LYS 603 16.534 -9.227 13.340 791 HZ1 LYS 603 HZ1 LYS 603 17.795 -11.410 11.760 792 HZ2 LYS 603 HZ2 LYS 603 16.411 -10.578 11.302 793 HZ3 LYS 603 HZ3 LYS 603 16.392 -11.559 12.675 794 H GLY 604 H GLY 604 16.936 -4.019 15.679 795 HA2 GLY 604 HA2 GLY 604 19.730 -3.412 16.357 796 HA3 GLY 604 HA3 GLY 604 18.352 -2.426 16.825 797 H GLY 605 H GLY 605 19.846 -2.837 18.826 798 HA2 GLY 605 HA2 GLY 605 19.007 -3.578 21.005 799 HA3 GLY 605 HA3 GLY 605 18.755 -5.159 20.262 800 H PHE 606 H PHE 606 20.394 -4.679 22.535 801 HA PHE 606 HA PHE 606 22.788 -5.930 21.629 802 HB2 PHE 606 HB2 PHE 606 23.375 -3.545 21.262 803 HB3 PHE 606 HB3 PHE 606 22.972 -3.194 22.936 804 HD1 PHE 606 HD1 PHE 606 25.272 -5.171 20.803 805 HD2 PHE 606 HD2 PHE 606 24.594 -3.406 24.616 806 HE1 PHE 606 HE1 PHE 606 27.592 -5.676 21.446 807 HE2 PHE 606 HE2 PHE 606 26.913 -3.910 25.264 808 HZ PHE 606 HZ PHE 606 28.412 -5.047 23.680 809 H THR 607 H THR 607 23.155 -7.427 23.118 810 HA THR 607 HA THR 607 21.961 -7.056 25.717 811 HB THR 607 HB THR 607 22.586 -9.509 26.032 812 HG1 THR 607 HG1 THR 607 22.869 -9.601 23.219 813 HG21 THR 607 HG21 THR 607 20.772 -8.824 23.714 814 HG22 THR 607 HG22 THR 607 20.312 -8.820 25.417 815 HG23 THR 607 HG23 THR 607 20.745 -10.335 24.623 816 H ILE 608 H ILE 608 23.219 -5.891 26.989 817 HA ILE 608 HA ILE 608 26.047 -5.944 26.962 818 HB ILE 608 HB ILE 608 24.227 -5.083 29.250 819 HG12 ILE 608 HG12 ILE 608 25.500 -3.426 27.051 820 HG13 ILE 608 HG13 ILE 608 23.793 -3.841 27.151 821 HG21 ILE 608 HG21 ILE 608 26.518 -5.492 29.995 822 HG22 ILE 608 HG22 ILE 608 26.163 -3.763 30.022 823 HG23 ILE 608 HG23 ILE 608 27.137 -4.445 28.717 824 HD11 ILE 608 HD11 ILE 608 23.613 -2.547 29.225 825 HD12 ILE 608 HD12 ILE 608 24.191 -1.561 27.882 826 HD13 ILE 608 HD13 ILE 608 25.323 -2.131 29.107 827 H THR 609 H THR 609 26.885 -7.908 27.145 828 HA THR 609 HA THR 609 25.907 -9.745 29.117 829 HB THR 609 HB THR 609 28.221 -10.077 27.182 830 HG1 THR 609 HG1 THR 609 25.996 -9.523 26.325 831 HG21 THR 609 HG21 THR 609 27.707 -12.472 27.437 832 HG22 THR 609 HG22 THR 609 26.405 -12.076 28.557 833 HG23 THR 609 HG23 THR 609 28.080 -11.744 28.999 834 H GLU 610 H GLU 610 26.396 -9.017 31.001 835 HA GLU 610 HA GLU 610 28.880 -9.108 32.247 836 HB2 GLU 610 HB2 GLU 610 29.215 -7.083 30.765 837 HB3 GLU 610 HB3 GLU 610 27.895 -6.314 31.619 838 HG2 GLU 610 HG2 GLU 610 29.163 -6.316 33.658 839 HG3 GLU 610 HG3 GLU 610 30.465 -7.227 32.881 840 H GLU 611 H GLU 611 25.813 -7.499 31.837 841 HA GLU 611 HA GLU 611 25.099 -7.821 34.642 842 HB2 GLU 611 HB2 GLU 611 24.635 -5.672 33.379 843 HB3 GLU 611 HB3 GLU 611 23.582 -6.588 32.316 844 HG2 GLU 611 HG2 GLU 611 22.324 -5.365 33.996 845 HG3 GLU 611 HG3 GLU 611 22.117 -7.106 34.167 846 H TYR 612 H TYR 612 23.843 -9.584 35.166 847 HA TYR 612 HA TYR 612 23.290 -11.359 32.913 848 HB2 TYR 612 HB2 TYR 612 24.857 -12.056 34.746 849 HB3 TYR 612 HB3 TYR 612 23.470 -12.084 35.823 850 HD1 TYR 612 HD2 TYR 612 24.619 -13.492 32.575 851 HD2 TYR 612 HD1 TYR 612 22.371 -14.106 36.132 852 HE1 TYR 612 HE2 TYR 612 24.243 -15.827 31.922 853 HE2 TYR 612 HE1 TYR 612 21.991 -16.446 35.491 854 HH TYR 612 HH TYR 612 21.970 -17.771 33.542 855 H ASP 613 H ASP 613 21.320 -10.757 32.232 856 HA ASP 613 HA ASP 613 19.092 -11.917 33.359 857 HB2 ASP 613 HB2 ASP 613 17.687 -9.985 33.918 858 HB3 ASP 613 HB3 ASP 613 19.132 -9.904 34.904 859 H ASP 614 H ASP 614 17.114 -10.816 31.983 860 HA ASP 614 HA ASP 614 18.017 -11.204 29.274 861 HB2 ASP 614 HB2 ASP 614 15.262 -10.595 30.355 862 HB3 ASP 614 HB3 ASP 614 15.602 -10.771 28.641 863 H LYS 615 H LYS 615 19.104 -9.635 28.379 864 HA LYS 615 HA LYS 615 18.431 -6.900 29.074 865 HB2 LYS 615 HB2 LYS 615 20.791 -7.991 29.137 866 HB3 LYS 615 HB3 LYS 615 20.765 -7.792 27.399 867 HG2 LYS 615 HG2 LYS 615 21.968 -5.985 28.579 868 HG3 LYS 615 HG3 LYS 615 20.619 -5.396 27.612 869 HD2 LYS 615 HD2 LYS 615 20.776 -4.321 29.854 870 HD3 LYS 615 HD3 LYS 615 19.240 -5.146 29.612 871 HE2 LYS 615 HE2 LYS 615 20.199 -7.094 30.872 872 HE3 LYS 615 HE3 LYS 615 21.629 -6.117 31.193 873 HZ1 LYS 615 HZ1 LYS 615 20.000 -6.176 32.983 874 HZ2 LYS 615 HZ2 LYS 615 18.872 -5.401 31.998 875 HZ3 LYS 615 HZ3 LYS 615 20.285 -4.588 32.447 876 H GLN 616 H GLN 616 16.629 -8.198 27.548 877 HA GLN 616 HA GLN 616 16.897 -7.779 24.770 878 HB2 GLN 616 HB2 GLN 616 15.360 -9.458 25.476 879 HB3 GLN 616 HB3 GLN 616 14.459 -8.336 26.475 880 HG2 GLN 616 HG2 GLN 616 13.807 -7.121 24.442 881 HG3 GLN 616 HG3 GLN 616 14.615 -8.348 23.473 882 HE21 GLN 616 HE21 GLN 616 11.821 -7.504 23.599 883 HE22 GLN 616 HE22 GLN 616 10.896 -8.925 23.898 884 HA PRO 617 HA PRO 617 14.306 -3.784 25.146 885 HB2 PRO 617 HB2 PRO 617 13.437 -2.813 27.450 886 HB3 PRO 617 HB3 PRO 617 12.653 -4.226 26.727 887 HG2 PRO 617 HG2 PRO 617 14.677 -4.116 28.934 888 HG3 PRO 617 HG3 PRO 617 13.171 -5.046 28.850 889 HD2 PRO 617 HD2 PRO 617 15.641 -6.079 28.270 890 HD3 PRO 617 HD3 PRO 617 14.116 -6.694 27.600 891 H LEU 618 H LEU 618 17.105 -4.067 25.573 892 HA LEU 618 HA LEU 618 18.033 -1.989 27.324 893 HB2 LEU 618 HB2 LEU 618 19.307 -4.090 26.843 894 HB3 LEU 618 HB3 LEU 618 19.551 -3.535 25.211 895 HG LEU 618 HG LEU 618 21.543 -3.320 26.751 896 HD11 LEU 618 HD11 LEU 618 22.245 -1.121 25.990 897 HD12 LEU 618 HD12 LEU 618 20.588 -0.752 25.511 898 HD13 LEU 618 HD13 LEU 618 21.475 -2.039 24.697 899 HD21 LEU 618 HD21 LEU 618 21.610 -1.475 28.327 900 HD22 LEU 618 HD22 LEU 618 20.331 -2.612 28.758 901 HD23 LEU 618 HD23 LEU 618 19.931 -1.089 27.967 902 H THR 619 H THR 619 17.576 -0.003 26.804 903 HA THR 619 HA THR 619 18.542 1.046 24.338 904 HB THR 619 HB THR 619 16.315 0.449 23.590 905 HG1 THR 619 HG1 THR 619 15.420 2.590 23.211 906 HG21 THR 619 HG21 THR 619 15.243 1.958 25.985 907 HG22 THR 619 HG22 THR 619 15.181 0.212 25.747 908 HG23 THR 619 HG23 THR 619 14.261 1.280 24.685 909 H SER 620 H SER 620 19.411 2.979 24.703 910 HA SER 620 HA SER 620 18.762 4.326 27.212 911 HB2 SER 620 HB2 SER 620 20.875 4.993 25.130 912 HB3 SER 620 HB3 SER 620 20.754 5.671 26.755 913 HG SER 620 HG SER 620 21.887 3.371 25.929 914 H LYS 621 H LYS 621 18.651 4.489 23.801 915 HA LYS 621 HA LYS 621 16.251 5.517 23.395 916 HB2 LYS 621 HB2 LYS 621 17.009 7.723 24.368 917 HB3 LYS 621 HB3 LYS 621 18.272 7.795 23.149 918 HG2 LYS 621 HG2 LYS 621 16.364 9.235 22.586 919 HG3 LYS 621 HG3 LYS 621 16.597 7.963 21.386 920 HD2 LYS 621 HD2 LYS 621 14.807 6.654 22.462 921 HD3 LYS 621 HD3 LYS 621 14.556 7.958 23.619 922 HE2 LYS 621 HE2 LYS 621 14.210 8.144 20.619 923 HE3 LYS 621 HE3 LYS 621 12.915 8.000 21.803 924 HZ1 LYS 621 HZ1 LYS 621 13.231 10.260 21.047 925 HZ2 LYS 621 HZ2 LYS 621 14.811 10.281 21.628 926 HZ3 LYS 621 HZ3 LYS 621 13.508 10.132 22.701 927 H GLU 622 H GLU 622 17.041 3.631 22.257 928 HA GLU 622 HA GLU 622 18.905 4.049 20.130 929 HB2 GLU 622 HB2 GLU 622 16.984 1.729 20.363 930 HB3 GLU 622 HB3 GLU 622 18.531 1.771 19.537 931 HG2 GLU 622 HG2 GLU 622 18.007 1.713 22.487 932 HG3 GLU 622 HG3 GLU 622 18.787 0.476 21.511 933 H GLU 623 H GLU 623 18.439 4.538 18.100 934 HA GLU 623 HA GLU 623 16.141 5.896 17.490 935 HB2 GLU 623 HB2 GLU 623 16.927 5.842 15.169 936 HB3 GLU 623 HB3 GLU 623 18.196 6.270 16.302 937 HG2 GLU 623 HG2 GLU 623 18.964 3.886 16.189 938 HG3 GLU 623 HG3 GLU 623 17.808 3.654 14.878 939 H GLU 624 H GLU 624 14.226 5.385 16.889 940 HA GLU 624 HA GLU 624 13.609 2.600 16.416 941 HB2 GLU 624 HB2 GLU 624 12.332 4.083 18.080 942 HB3 GLU 624 HB3 GLU 624 11.702 4.946 16.694 943 HG2 GLU 624 HG2 GLU 624 11.295 1.998 17.129 944 HG3 GLU 624 HG3 GLU 624 10.190 3.228 17.725 945 H GLU 625 H GLU 625 14.302 2.258 14.464 946 HA GLU 625 HA GLU 625 13.518 4.090 12.320 947 HB2 GLU 625 HB2 GLU 625 15.422 3.196 11.081 948 HB3 GLU 625 HB3 GLU 625 15.905 3.890 12.623 949 HG2 GLU 625 HG2 GLU 625 15.927 1.588 13.556 950 HG3 GLU 625 HG3 GLU 625 15.669 0.979 11.918 951 H ARG 626 H ARG 626 12.483 1.388 13.674 952 HA ARG 626 HA ARG 626 12.112 -0.386 11.494 953 HB2 ARG 626 HB2 ARG 626 10.573 -0.019 14.076 954 HB3 ARG 626 HB3 ARG 626 10.198 -1.284 12.914 955 HG2 ARG 626 HG2 ARG 626 12.362 -2.288 13.274 956 HG3 ARG 626 HG3 ARG 626 12.834 -0.960 14.329 957 HD2 ARG 626 HD2 ARG 626 11.138 -1.571 15.938 958 HD3 ARG 626 HD3 ARG 626 10.510 -2.814 14.856 959 HE ARG 626 HE ARG 626 13.042 -3.570 15.152 960 HH11 ARG 626 HH11 ARG 626 10.653 -2.657 17.647 961 HH12 ARG 626 HH12 ARG 626 11.263 -3.762 18.798 962 HH21 ARG 626 HH21 ARG 626 13.837 -5.073 16.803 963 HH22 ARG 626 HH22 ARG 626 13.078 -5.137 18.318 964 H ARG 627 H ARG 627 10.430 2.337 12.808 965 HA ARG 627 HA ARG 627 8.042 2.328 11.349 966 HB2 ARG 627 HB2 ARG 627 8.948 3.811 13.322 967 HB3 ARG 627 HB3 ARG 627 9.527 4.848 12.037 968 HG2 ARG 627 HG2 ARG 627 6.641 4.055 12.409 969 HG3 ARG 627 HG3 ARG 627 7.363 5.529 13.038 970 HD2 ARG 627 HD2 ARG 627 7.859 6.263 10.791 971 HD3 ARG 627 HD3 ARG 627 7.210 4.755 10.138 972 HE ARG 627 HE ARG 627 5.353 6.158 11.782 973 HH11 ARG 627 HH11 ARG 627 6.706 6.030 8.524 974 HH12 ARG 627 HH12 ARG 627 5.319 6.677 7.770 975 HH21 ARG 627 HH21 ARG 627 3.478 7.072 10.785 976 HH22 ARG 627 HH22 ARG 627 3.431 7.292 9.094 977 H ILE 628 H ILE 628 11.271 3.371 10.457 978 HA ILE 628 HA ILE 628 10.557 4.730 8.060 979 HB ILE 628 HB ILE 628 13.211 3.434 8.801 980 HG12 ILE 628 HG12 ILE 628 12.307 6.301 9.121 981 HG13 ILE 628 HG13 ILE 628 12.468 5.144 10.439 982 HG21 ILE 628 HG21 ILE 628 14.200 4.968 7.154 983 HG22 ILE 628 HG22 ILE 628 12.591 5.546 6.727 984 HG23 ILE 628 HG23 ILE 628 13.040 3.871 6.402 985 HD11 ILE 628 HD11 ILE 628 14.885 5.035 10.003 986 HD12 ILE 628 HD12 ILE 628 14.352 6.676 10.369 987 HD13 ILE 628 HD13 ILE 628 14.689 6.210 8.702 988 H ALA 629 H ALA 629 11.347 1.442 8.910 989 HA ALA 629 HA ALA 629 11.428 0.545 6.189 990 HB1 ALA 629 HB1 ALA 629 12.786 -0.553 7.923 991 HB2 ALA 629 HB2 ALA 629 11.695 -1.688 7.129 992 HB3 ALA 629 HB3 ALA 629 11.309 -1.072 8.735 993 H GLU 630 H GLU 630 9.029 0.856 8.656 994 HA GLU 630 HA GLU 630 7.085 -0.966 7.943 995 HB2 GLU 630 HB2 GLU 630 6.706 1.855 8.955 996 HB3 GLU 630 HB3 GLU 630 5.429 0.647 8.898 997 HG2 GLU 630 HG2 GLU 630 7.984 0.419 10.470 998 HG3 GLU 630 HG3 GLU 630 6.437 0.959 11.121 999 H MET 631 H MET 631 7.783 2.099 6.435 1000 HA MET 631 HA MET 631 5.398 2.041 4.775 1001 HB2 MET 631 HB2 MET 631 6.208 4.106 3.785 1002 HB3 MET 631 HB3 MET 631 6.337 4.205 5.535 1003 HG2 MET 631 HG2 MET 631 8.717 3.748 5.403 1004 HG3 MET 631 HG3 MET 631 8.599 3.571 3.655 1005 HE1 MET 631 HE1 MET 631 10.549 5.228 3.314 1006 HE2 MET 631 HE2 MET 631 10.720 5.438 5.057 1007 HE3 MET 631 HE3 MET 631 10.634 6.852 4.001 1008 H GLY 632 H GLY 632 8.343 0.495 4.643 1009 HA2 GLY 632 HA2 GLY 632 8.252 0.359 1.709 1010 HA3 GLY 632 HA3 GLY 632 9.734 0.305 2.652 1011 H ARG 633 H ARG 633 7.348 -1.329 4.299 1012 HA ARG 633 HA ARG 633 8.135 -3.822 3.043 1013 HB2 ARG 633 HB2 ARG 633 8.372 -4.923 5.245 1014 HB3 ARG 633 HB3 ARG 633 9.431 -3.540 5.134 1015 HG2 ARG 633 HG2 ARG 633 8.627 -3.482 7.313 1016 HG3 ARG 633 HG3 ARG 633 7.644 -2.294 6.461 1017 HD2 ARG 633 HD2 ARG 633 5.837 -3.912 6.264 1018 HD3 ARG 633 HD3 ARG 633 6.830 -5.135 7.049 1019 HE ARG 633 HE ARG 633 6.681 -2.952 8.766 1020 HH11 ARG 633 HH11 ARG 633 4.466 -5.374 7.418 1021 HH12 ARG 633 HH12 ARG 633 3.389 -5.284 8.750 1022 HH21 ARG 633 HH21 ARG 633 5.237 -2.875 10.540 1023 HH22 ARG 633 HH22 ARG 633 3.881 -3.903 10.612 1024 HA PRO 634 HA PRO 634 3.902 -4.827 2.620 1025 HB2 PRO 634 HB2 PRO 634 3.878 -7.468 3.362 1026 HB3 PRO 634 HB3 PRO 634 4.423 -6.860 1.791 1027 HG2 PRO 634 HG2 PRO 634 6.062 -7.546 4.211 1028 HG3 PRO 634 HG3 PRO 634 6.372 -7.986 2.527 1029 HD2 PRO 634 HD2 PRO 634 7.653 -5.973 3.652 1030 HD3 PRO 634 HD3 PRO 634 7.074 -5.828 1.976 1031 H ILE 635 H ILE 635 2.010 -4.724 3.848 1032 HA ILE 635 HA ILE 635 2.366 -5.134 6.702 1033 HB ILE 635 HB ILE 635 0.705 -3.334 6.960 1034 HG12 ILE 635 HG12 ILE 635 1.216 -2.332 4.230 1035 HG13 ILE 635 HG13 ILE 635 0.160 -3.734 4.356 1036 HG21 ILE 635 HG21 ILE 635 3.110 -2.829 7.188 1037 HG22 ILE 635 HG22 ILE 635 2.284 -1.462 6.415 1038 HG23 ILE 635 HG23 ILE 635 3.206 -2.613 5.442 1039 HD11 ILE 635 HD11 ILE 635 -1.253 -2.576 5.826 1040 HD12 ILE 635 HD12 ILE 635 -1.047 -1.679 4.307 1041 HD13 ILE 635 HD13 ILE 635 -0.214 -1.136 5.790 1042 H LEU 636 H LEU 636 0.046 -5.127 7.628 1043 HA LEU 636 HA LEU 636 -1.550 -6.762 5.895 1044 HB2 LEU 636 HB2 LEU 636 -2.488 -7.834 8.007 1045 HB3 LEU 636 HB3 LEU 636 -0.896 -8.309 7.482 1046 HG LEU 636 HG LEU 636 0.100 -6.914 9.271 1047 HD11 LEU 636 HD11 LEU 636 -1.311 -6.024 11.053 1048 HD12 LEU 636 HD12 LEU 636 -2.750 -6.448 10.124 1049 HD13 LEU 636 HD13 LEU 636 -1.635 -5.226 9.513 1050 HD21 LEU 636 HD21 LEU 636 -0.567 -8.333 11.129 1051 HD22 LEU 636 HD22 LEU 636 -0.372 -9.270 9.643 1052 HD23 LEU 636 HD23 LEU 636 -1.986 -8.848 10.221 1053 H GLY 637 H GLY 637 -3.878 -6.956 6.863 1054 HA2 GLY 637 HA2 GLY 637 -4.955 -4.393 6.274 1055 HA3 GLY 637 HA3 GLY 637 -5.839 -5.867 6.628 1056 H GLU 638 H GLU 638 -6.920 -3.748 7.509 1057 HA GLU 638 HA GLU 638 -6.083 -2.680 9.984 1058 HB2 GLU 638 HB2 GLU 638 -7.553 -1.541 8.391 1059 HB3 GLU 638 HB3 GLU 638 -8.796 -2.743 8.673 1060 HG2 GLU 638 HG2 GLU 638 -9.068 -1.981 10.942 1061 HG3 GLU 638 HG3 GLU 638 -7.721 -0.857 10.750 1062 H HIS 639 H HIS 639 -8.150 -5.337 9.068 1063 HA HIS 639 HA HIS 639 -8.162 -6.151 11.869 1064 HB2 HIS 639 HB2 HIS 639 -10.412 -6.361 9.868 1065 HB3 HIS 639 HB3 HIS 639 -10.318 -7.423 11.265 1066 HD1 HIS 639 HD1 HIS 639 -11.330 -6.544 13.385 1067 HD2 HIS 639 HD2 HIS 639 -10.636 -3.548 10.596 1068 HE1 HIS 639 HE1 HIS 639 -12.336 -4.452 14.353 1069 H THR 640 H THR 640 -7.062 -7.898 12.179 1070 HA THR 640 HA THR 640 -7.056 -9.946 10.133 1071 HB THR 640 HB THR 640 -4.626 -10.380 10.866 1072 HG1 THR 640 HG1 THR 640 -3.929 -9.000 12.310 1073 HG21 THR 640 HG21 THR 640 -3.748 -8.902 9.147 1074 HG22 THR 640 HG22 THR 640 -5.218 -7.922 9.222 1075 HG23 THR 640 HG23 THR 640 -5.294 -9.584 8.638 1076 H LYS 641 H LYS 641 -8.360 -11.307 11.192 1077 HA LYS 641 HA LYS 641 -7.360 -12.734 13.445 1078 HB2 LYS 641 HB2 LYS 641 -8.299 -10.669 14.534 1079 HB3 LYS 641 HB3 LYS 641 -9.863 -11.089 13.858 1080 HG2 LYS 641 HG2 LYS 641 -9.717 -13.263 15.103 1081 HG3 LYS 641 HG3 LYS 641 -8.284 -12.634 15.902 1082 HD2 LYS 641 HD2 LYS 641 -11.042 -11.389 16.024 1083 HD3 LYS 641 HD3 LYS 641 -10.350 -12.423 17.260 1084 HE2 LYS 641 HE2 LYS 641 -10.095 -10.191 18.040 1085 HE3 LYS 641 HE3 LYS 641 -8.505 -10.694 17.493 1086 HZ1 LYS 641 HZ1 LYS 641 -10.388 -9.030 15.898 1087 HZ2 LYS 641 HZ2 LYS 641 -8.767 -9.338 15.517 1088 HZ3 LYS 641 HZ3 LYS 641 -9.152 -8.424 16.843 1089 H LEU 642 H LEU 642 -8.417 -14.665 13.547 1090 HA LEU 642 HA LEU 642 -10.757 -14.985 11.816 1091 HB2 LEU 642 HB2 LEU 642 -8.703 -15.844 10.816 1092 HB3 LEU 642 HB3 LEU 642 -8.434 -16.814 12.249 1093 HG LEU 642 HG LEU 642 -10.637 -17.949 11.714 1094 HD11 LEU 642 HD11 LEU 642 -11.324 -17.916 9.403 1095 HD12 LEU 642 HD12 LEU 642 -10.158 -16.644 9.067 1096 HD13 LEU 642 HD13 LEU 642 -11.518 -16.331 10.155 1097 HD21 LEU 642 HD21 LEU 642 -9.568 -19.350 10.014 1098 HD22 LEU 642 HD22 LEU 642 -8.587 -19.064 11.450 1099 HD23 LEU 642 HD23 LEU 642 -8.222 -18.198 9.957 1100 H GLU 643 H GLU 643 -12.389 -15.469 13.173 1101 HA GLU 643 HA GLU 643 -11.898 -16.990 15.605 1102 HB2 GLU 643 HB2 GLU 643 -13.610 -15.121 15.574 1103 HB3 GLU 643 HB3 GLU 643 -14.524 -16.041 14.397 1104 HG2 GLU 643 HG2 GLU 643 -14.876 -17.822 16.041 1105 HG3 GLU 643 HG3 GLU 643 -13.941 -16.916 17.223 1106 H VAL 644 H VAL 644 -11.634 -19.128 15.330 1107 HA VAL 644 HA VAL 644 -12.974 -20.394 13.064 1108 HB VAL 644 HB VAL 644 -10.813 -21.542 14.853 1109 HG11 VAL 644 HG11 VAL 644 -10.644 -23.319 13.227 1110 HG12 VAL 644 HG12 VAL 644 -11.881 -22.558 12.224 1111 HG13 VAL 644 HG13 VAL 644 -12.305 -23.202 13.810 1112 HG21 VAL 644 HG21 VAL 644 -10.574 -20.424 12.057 1113 HG22 VAL 644 HG22 VAL 644 -9.287 -21.213 12.959 1114 HG23 VAL 644 HG23 VAL 644 -9.950 -19.678 13.521 1115 H ILE 645 H ILE 645 -14.872 -21.090 13.604 1116 HA ILE 645 HA ILE 645 -15.353 -22.077 16.311 1117 HB ILE 645 HB ILE 645 -17.367 -21.596 14.108 1118 HG12 ILE 645 HG12 ILE 645 -16.637 -19.676 16.320 1119 HG13 ILE 645 HG13 ILE 645 -16.018 -19.546 14.678 1120 HG21 ILE 645 HG21 ILE 645 -18.095 -23.009 15.982 1121 HG22 ILE 645 HG22 ILE 645 -18.949 -21.467 15.963 1122 HG23 ILE 645 HG23 ILE 645 -17.642 -21.733 17.114 1123 HD11 ILE 645 HD11 ILE 645 -18.249 -19.276 13.831 1124 HD12 ILE 645 HD12 ILE 645 -17.906 -18.064 15.066 1125 HD13 ILE 645 HD13 ILE 645 -18.919 -19.463 15.453 1126 H ILE 646 H ILE 646 -15.338 -24.208 16.590 1127 HA ILE 646 HA ILE 646 -15.491 -25.993 14.286 1128 HB ILE 646 HB ILE 646 -14.796 -26.603 17.173 1129 HG12 ILE 646 HG12 ILE 646 -12.863 -26.296 14.862 1130 HG13 ILE 646 HG13 ILE 646 -13.135 -25.065 16.090 1131 HG21 ILE 646 HG21 ILE 646 -14.461 -28.241 14.676 1132 HG22 ILE 646 HG22 ILE 646 -15.633 -28.518 15.964 1133 HG23 ILE 646 HG23 ILE 646 -13.908 -28.705 16.286 1134 HD11 ILE 646 HD11 ILE 646 -12.095 -27.845 16.602 1135 HD12 ILE 646 HD12 ILE 646 -12.316 -26.583 17.809 1136 HD13 ILE 646 HD13 ILE 646 -11.113 -26.383 16.535 1137 H GLU 647 H GLU 647 -17.570 -26.496 13.902 1138 HA GLU 647 HA GLU 647 -19.310 -27.033 16.224 1139 HB2 GLU 647 HB2 GLU 647 -20.155 -26.091 13.480 1140 HB3 GLU 647 HB3 GLU 647 -21.203 -26.362 14.858 1141 HG2 GLU 647 HG2 GLU 647 -20.019 -24.531 16.041 1142 HG3 GLU 647 HG3 GLU 647 -19.111 -24.234 14.556 1143 H GLU 648 H GLU 648 -20.508 -28.975 16.093 1144 HA GLU 648 HA GLU 648 -19.589 -30.773 14.023 1145 HB2 GLU 648 HB2 GLU 648 -20.172 -31.630 16.301 1146 HB3 GLU 648 HB3 GLU 648 -21.845 -31.157 16.011 1147 HG2 GLU 648 HG2 GLU 648 -22.020 -32.738 14.197 1148 HG3 GLU 648 HG3 GLU 648 -20.315 -33.153 14.355 1149 H SER 649 H SER 649 -20.244 -30.624 12.171 1150 HA SER 649 HA SER 649 -22.990 -30.331 11.417 1151 HB2 SER 649 HB2 SER 649 -21.022 -28.105 10.755 1152 HB3 SER 649 HB3 SER 649 -22.656 -28.288 10.124 1153 HG SER 649 HG SER 649 -22.666 -28.365 12.803 1154 H TYR 650 H TYR 650 -22.958 -31.869 9.930 1155 HA TYR 650 HA TYR 650 -20.578 -32.211 8.250 1156 HB2 TYR 650 HB2 TYR 650 -23.144 -33.811 8.170 1157 HB3 TYR 650 HB3 TYR 650 -21.557 -34.294 7.588 1158 HD1 TYR 650 HD2 TYR 650 -19.689 -34.433 9.470 1159 HD2 TYR 650 HD1 TYR 650 -23.864 -34.580 10.188 1160 HE1 TYR 650 HE2 TYR 650 -19.265 -35.554 11.617 1161 HE2 TYR 650 HE1 TYR 650 -23.461 -35.697 12.358 1162 HH TYR 650 HH TYR 650 -20.370 -35.859 13.764 1163 H GLU 651 H GLU 651 -23.936 -31.588 8.266 1164 HA GLU 651 HA GLU 651 -24.271 -31.087 5.516 1165 HB2 GLU 651 HB2 GLU 651 -26.572 -30.629 6.135 1166 HB3 GLU 651 HB3 GLU 651 -26.012 -32.064 6.964 1167 HG2 GLU 651 HG2 GLU 651 -26.542 -29.322 8.138 1168 HG3 GLU 651 HG3 GLU 651 -27.372 -30.825 8.499 1169 H PHE 652 H PHE 652 -23.671 -29.226 8.400 1170 HA PHE 652 HA PHE 652 -23.399 -27.113 8.928 1171 HB2 PHE 652 HB2 PHE 652 -22.734 -26.785 6.009 1172 HB3 PHE 652 HB3 PHE 652 -22.753 -25.417 7.120 1173 HD1 PHE 652 HD1 PHE 652 -21.045 -28.532 6.222 1174 HD2 PHE 652 HD2 PHE 652 -21.068 -25.146 8.791 1175 HE1 PHE 652 HE1 PHE 652 -18.744 -29.051 6.931 1176 HE2 PHE 652 HE2 PHE 652 -18.773 -25.656 9.499 1177 HZ PHE 652 HZ PHE 652 -17.607 -27.606 8.569 1178 H LYS 653 H LYS 653 -25.424 -27.545 9.506 1179 HA LYS 653 HA LYS 653 -27.686 -26.453 8.242 1180 HB2 LYS 653 HB2 LYS 653 -27.531 -28.196 10.088 1181 HB3 LYS 653 HB3 LYS 653 -27.170 -26.884 11.186 1182 HG2 LYS 653 HG2 LYS 653 -29.472 -27.504 11.393 1183 HG3 LYS 653 HG3 LYS 653 -29.368 -25.896 10.678 1184 HD2 LYS 653 HD2 LYS 653 -29.852 -26.761 8.501 1185 HD3 LYS 653 HD3 LYS 653 -29.701 -28.423 9.071 1186 HE2 LYS 653 HE2 LYS 653 -32.046 -27.810 8.823 1187 HE3 LYS 653 HE3 LYS 653 -31.652 -28.106 10.512 1188 HZ1 LYS 653 HZ1 LYS 653 -33.026 -26.158 10.273 1189 HZ2 LYS 653 HZ2 LYS 653 -31.967 -25.467 9.200 1190 HZ3 LYS 653 HZ3 LYS 653 -31.506 -25.655 10.816 1191 H SER 654 H SER 654 -28.184 -24.302 8.073 1192 HA SER 654 HA SER 654 -26.349 -22.336 8.924 1193 HB2 SER 654 HB2 SER 654 -29.185 -21.906 7.953 1194 HB3 SER 654 HB3 SER 654 -27.851 -20.751 7.907 1195 HG SER 654 HG SER 654 -27.300 -23.164 6.720 1196 H THR 655 H THR 655 -29.660 -23.014 9.985 1197 HA THR 655 HA THR 655 -28.949 -21.845 12.552 1198 HB THR 655 HB THR 655 -30.559 -20.351 11.536 1199 HG1 THR 655 HG1 THR 655 -30.887 -21.089 13.798 1200 HG21 THR 655 HG21 THR 655 -32.816 -21.124 10.819 1201 HG22 THR 655 HG22 THR 655 -32.270 -22.792 11.032 1202 HG23 THR 655 HG23 THR 655 -31.506 -21.759 9.830 1203 H VAL 656 H VAL 656 -29.532 -23.057 14.349 1204 HA VAL 656 HA VAL 656 -30.497 -25.727 13.672 1205 HB VAL 656 HB VAL 656 -29.103 -26.638 15.505 1206 HG11 VAL 656 HG11 VAL 656 -27.546 -25.103 13.432 1207 HG12 VAL 656 HG12 VAL 656 -28.296 -26.681 13.211 1208 HG13 VAL 656 HG13 VAL 656 -26.963 -26.497 14.347 1209 HG21 VAL 656 HG21 VAL 656 -28.879 -24.629 16.888 1210 HG22 VAL 656 HG22 VAL 656 -27.920 -23.855 15.628 1211 HG23 VAL 656 HG23 VAL 656 -27.289 -25.271 16.466 1212 H ASP 657 H ASP 657 -31.727 -26.817 15.229 1213 HA ASP 657 HA ASP 657 -33.048 -25.005 17.152 1214 HB2 ASP 657 HB2 ASP 657 -34.156 -27.468 15.776 1215 HB3 ASP 657 HB3 ASP 657 -34.989 -26.611 17.066 Start of MODEL 18 1 H HIS 501 H HIS 501 6.903 -2.687 -0.457 2 HA HIS 501 HA HIS 501 5.413 -1.837 1.411 3 HB2 HIS 501 HB2 HIS 501 5.653 0.523 0.399 4 HB3 HIS 501 HB3 HIS 501 4.645 -0.055 -0.921 5 HD1 HIS 501 HD1 HIS 501 2.119 0.101 -0.537 6 HD2 HIS 501 HD2 HIS 501 4.342 0.395 2.964 7 HE1 HIS 501 HE1 HIS 501 0.481 0.622 1.287 8 H ALA 502 H ALA 502 3.113 -2.558 1.057 9 HA ALA 502 HA ALA 502 2.835 -4.164 -1.318 10 HB1 ALA 502 HB1 ALA 502 2.480 -5.155 1.495 11 HB2 ALA 502 HB2 ALA 502 3.876 -5.489 0.478 12 HB3 ALA 502 HB3 ALA 502 2.282 -6.100 0.012 13 H GLY 503 H GLY 503 0.639 -5.404 -0.395 14 HA2 GLY 503 HA2 GLY 503 -1.396 -3.291 -0.574 15 HA3 GLY 503 HA3 GLY 503 -1.500 -4.981 -1.081 16 H ILE 504 H ILE 504 -2.671 -6.233 0.050 17 HA ILE 504 HA ILE 504 -3.151 -5.559 2.860 18 HB ILE 504 HB ILE 504 -5.209 -6.488 0.831 19 HG12 ILE 504 HG12 ILE 504 -6.408 -4.327 1.537 20 HG13 ILE 504 HG13 ILE 504 -4.848 -3.802 2.161 21 HG21 ILE 504 HG21 ILE 504 -5.578 -5.961 3.741 22 HG22 ILE 504 HG22 ILE 504 -5.664 -7.513 2.897 23 HG23 ILE 504 HG23 ILE 504 -6.869 -6.262 2.573 24 HD11 ILE 504 HD11 ILE 504 -3.914 -3.999 -0.096 25 HD12 ILE 504 HD12 ILE 504 -5.281 -2.878 -0.044 26 HD13 ILE 504 HD13 ILE 504 -5.487 -4.503 -0.703 27 H PHE 505 H PHE 505 -2.727 -7.221 4.147 28 HA PHE 505 HA PHE 505 -3.149 -9.959 3.155 29 HB2 PHE 505 HB2 PHE 505 -1.203 -8.902 5.209 30 HB3 PHE 505 HB3 PHE 505 -1.727 -10.572 5.237 31 HD1 PHE 505 HD2 PHE 505 -1.231 -12.017 3.255 32 HD2 PHE 505 HD1 PHE 505 0.512 -8.181 3.803 33 HE1 PHE 505 HE2 PHE 505 0.583 -12.636 1.725 34 HE2 PHE 505 HE1 PHE 505 2.338 -8.793 2.274 35 HZ PHE 505 HZ PHE 505 2.378 -11.026 1.238 36 H THR 506 H THR 506 -4.886 -10.907 4.059 37 HA THR 506 HA THR 506 -5.443 -10.672 6.795 38 HB THR 506 HB THR 506 -6.353 -8.441 6.084 39 HG1 THR 506 HG1 THR 506 -7.864 -8.719 7.552 40 HG21 THR 506 HG21 THR 506 -8.398 -8.343 4.719 41 HG22 THR 506 HG22 THR 506 -8.328 -10.089 4.492 42 HG23 THR 506 HG23 THR 506 -7.071 -9.063 3.797 43 H PHE 507 H PHE 507 -7.814 -11.585 7.086 44 HA PHE 507 HA PHE 507 -7.738 -14.142 5.726 45 HB2 PHE 507 HB2 PHE 507 -9.317 -13.066 8.043 46 HB3 PHE 507 HB3 PHE 507 -9.652 -14.642 7.333 47 HD1 PHE 507 HD1 PHE 507 -7.952 -16.376 7.427 48 HD2 PHE 507 HD2 PHE 507 -7.493 -12.712 9.505 49 HE1 PHE 507 HE1 PHE 507 -6.302 -17.430 8.847 50 HE2 PHE 507 HE2 PHE 507 -5.804 -13.740 10.964 51 HZ PHE 507 HZ PHE 507 -5.193 -16.105 10.647 52 H GLU 508 H GLU 508 -9.533 -14.983 4.543 53 HA GLU 508 HA GLU 508 -10.950 -13.126 2.952 54 HB2 GLU 508 HB2 GLU 508 -11.653 -16.015 3.448 55 HB3 GLU 508 HB3 GLU 508 -12.208 -15.025 2.114 56 HG2 GLU 508 HG2 GLU 508 -9.873 -14.858 1.341 57 HG3 GLU 508 HG3 GLU 508 -9.415 -15.980 2.627 58 H GLU 509 H GLU 509 -11.677 -14.837 5.873 59 HA GLU 509 HA GLU 509 -14.222 -13.464 6.083 60 HB2 GLU 509 HB2 GLU 509 -15.153 -15.548 7.075 61 HB3 GLU 509 HB3 GLU 509 -14.768 -15.709 5.374 62 HG2 GLU 509 HG2 GLU 509 -12.562 -16.752 6.166 63 HG3 GLU 509 HG3 GLU 509 -13.328 -16.828 7.753 64 HA PRO 510 HA PRO 510 -12.448 -12.605 10.057 65 HB2 PRO 510 HB2 PRO 510 -14.625 -11.677 11.350 66 HB3 PRO 510 HB3 PRO 510 -13.837 -10.756 10.064 67 HG2 PRO 510 HG2 PRO 510 -16.316 -12.422 9.951 68 HG3 PRO 510 HG3 PRO 510 -15.977 -10.860 9.186 69 HD2 PRO 510 HD2 PRO 510 -15.819 -13.288 7.858 70 HD3 PRO 510 HD3 PRO 510 -14.917 -11.830 7.401 71 H VAL 511 H VAL 511 -15.254 -14.693 9.761 72 HA VAL 511 HA VAL 511 -14.441 -16.113 12.196 73 HB VAL 511 HB VAL 511 -17.343 -15.592 11.460 74 HG11 VAL 511 HG11 VAL 511 -16.121 -16.716 13.955 75 HG12 VAL 511 HG12 VAL 511 -16.965 -17.630 12.709 76 HG13 VAL 511 HG13 VAL 511 -17.845 -16.447 13.688 77 HG21 VAL 511 HG21 VAL 511 -16.360 -13.460 12.137 78 HG22 VAL 511 HG22 VAL 511 -15.739 -14.201 13.611 79 HG23 VAL 511 HG23 VAL 511 -17.478 -14.050 13.367 80 H THR 512 H THR 512 -14.353 -18.279 11.805 81 HA THR 512 HA THR 512 -15.842 -19.223 9.503 82 HB THR 512 HB THR 512 -13.421 -19.062 8.914 83 HG1 THR 512 HG1 THR 512 -14.758 -20.717 8.054 84 HG21 THR 512 HG21 THR 512 -13.046 -21.113 11.082 85 HG22 THR 512 HG22 THR 512 -12.456 -19.453 11.112 86 HG23 THR 512 HG23 THR 512 -11.802 -20.603 9.941 87 H HIS 513 H HIS 513 -16.940 -21.119 9.814 88 HA HIS 513 HA HIS 513 -16.638 -22.324 12.459 89 HB2 HIS 513 HB2 HIS 513 -19.012 -23.049 12.378 90 HB3 HIS 513 HB3 HIS 513 -18.876 -21.307 12.254 91 HD1 HIS 513 HD1 HIS 513 -20.777 -23.987 10.883 92 HD2 HIS 513 HD2 HIS 513 -18.998 -20.573 9.289 93 HE1 HIS 513 HE1 HIS 513 -21.956 -23.527 8.711 94 H VAL 514 H VAL 514 -15.639 -24.119 12.442 95 HA VAL 514 HA VAL 514 -15.637 -25.665 9.970 96 HB VAL 514 HB VAL 514 -13.468 -26.546 10.584 97 HG11 VAL 514 HG11 VAL 514 -13.582 -23.551 10.859 98 HG12 VAL 514 HG12 VAL 514 -13.451 -24.473 9.361 99 HG13 VAL 514 HG13 VAL 514 -12.121 -24.475 10.523 100 HG21 VAL 514 HG21 VAL 514 -13.680 -24.877 13.103 101 HG22 VAL 514 HG22 VAL 514 -12.242 -25.748 12.579 102 HG23 VAL 514 HG23 VAL 514 -13.699 -26.639 13.017 103 H SER 515 H SER 515 -15.688 -27.918 10.106 104 HA SER 515 HA SER 515 -17.502 -28.868 12.050 105 HB2 SER 515 HB2 SER 515 -16.079 -29.866 9.649 106 HB3 SER 515 HB3 SER 515 -17.158 -30.925 10.520 107 HG SER 515 HG SER 515 -18.294 -28.493 9.993 108 H GLU 516 H GLU 516 -17.035 -30.628 13.469 109 HA GLU 516 HA GLU 516 -14.462 -30.758 14.592 110 HB2 GLU 516 HB2 GLU 516 -16.450 -31.382 15.935 111 HB3 GLU 516 HB3 GLU 516 -16.748 -32.741 14.885 112 HG2 GLU 516 HG2 GLU 516 -14.549 -33.693 15.475 113 HG3 GLU 516 HG3 GLU 516 -14.320 -32.391 16.630 114 H SER 517 H SER 517 -16.145 -33.322 12.775 115 HA SER 517 HA SER 517 -13.823 -34.975 12.580 116 HB2 SER 517 HB2 SER 517 -16.515 -35.199 11.251 117 HB3 SER 517 HB3 SER 517 -15.349 -36.499 11.505 118 HG SER 517 HG SER 517 -15.569 -36.101 13.772 119 H ILE 518 H ILE 518 -13.701 -32.353 11.195 120 HA ILE 518 HA ILE 518 -13.930 -32.924 8.371 121 HB ILE 518 HB ILE 518 -14.462 -30.711 9.220 122 HG12 ILE 518 HG12 ILE 518 -12.047 -30.665 7.415 123 HG13 ILE 518 HG13 ILE 518 -13.719 -30.889 6.903 124 HG21 ILE 518 HG21 ILE 518 -12.912 -30.599 11.049 125 HG22 ILE 518 HG22 ILE 518 -12.795 -29.176 10.026 126 HG23 ILE 518 HG23 ILE 518 -11.545 -30.438 9.930 127 HD11 ILE 518 HD11 ILE 518 -14.252 -28.681 7.780 128 HD12 ILE 518 HD12 ILE 518 -13.007 -28.634 6.500 129 HD13 ILE 518 HD13 ILE 518 -12.547 -28.471 8.204 130 H GLY 519 H GLY 519 -11.475 -32.948 10.805 131 HA2 GLY 519 HA2 GLY 519 -9.403 -34.001 10.628 132 HA3 GLY 519 HA3 GLY 519 -9.594 -34.011 8.877 133 H ILE 520 H ILE 520 -9.556 -31.839 7.840 134 HA ILE 520 HA ILE 520 -7.645 -30.098 9.214 135 HB ILE 520 HB ILE 520 -7.472 -31.067 6.354 136 HG12 ILE 520 HG12 ILE 520 -6.528 -32.666 7.986 137 HG13 ILE 520 HG13 ILE 520 -5.293 -31.997 6.927 138 HG21 ILE 520 HG21 ILE 520 -5.441 -29.655 6.149 139 HG22 ILE 520 HG22 ILE 520 -5.826 -28.947 7.723 140 HG23 ILE 520 HG23 ILE 520 -6.931 -28.739 6.370 141 HD11 ILE 520 HD11 ILE 520 -4.494 -32.185 9.204 142 HD12 ILE 520 HD12 ILE 520 -5.826 -31.181 9.770 143 HD13 ILE 520 HD13 ILE 520 -4.588 -30.490 8.721 144 H MET 521 H MET 521 -8.446 -28.170 9.258 145 HA MET 521 HA MET 521 -10.362 -27.411 7.185 146 HB2 MET 521 HB2 MET 521 -11.215 -25.741 8.676 147 HB3 MET 521 HB3 MET 521 -11.087 -27.225 9.596 148 HG2 MET 521 HG2 MET 521 -10.282 -25.674 11.113 149 HG3 MET 521 HG3 MET 521 -8.801 -26.167 10.309 150 HE1 MET 521 HE1 MET 521 -9.526 -23.422 11.949 151 HE2 MET 521 HE2 MET 521 -8.600 -22.223 11.041 152 HE3 MET 521 HE3 MET 521 -7.869 -23.776 11.452 153 H GLU 522 H GLU 522 -10.024 -25.443 6.094 154 HA GLU 522 HA GLU 522 -7.342 -24.374 6.343 155 HB2 GLU 522 HB2 GLU 522 -8.620 -25.507 3.900 156 HB3 GLU 522 HB3 GLU 522 -7.378 -24.268 3.789 157 HG2 GLU 522 HG2 GLU 522 -5.807 -25.627 4.851 158 HG3 GLU 522 HG3 GLU 522 -7.008 -26.858 5.257 159 H VAL 523 H VAL 523 -7.292 -22.336 6.348 160 HA VAL 523 HA VAL 523 -9.606 -20.827 5.357 161 HB VAL 523 HB VAL 523 -7.630 -20.105 7.550 162 HG11 VAL 523 HG11 VAL 523 -9.094 -18.248 8.017 163 HG12 VAL 523 HG12 VAL 523 -10.152 -18.694 6.681 164 HG13 VAL 523 HG13 VAL 523 -8.494 -18.147 6.362 165 HG21 VAL 523 HG21 VAL 523 -9.195 -21.939 8.108 166 HG22 VAL 523 HG22 VAL 523 -10.541 -20.818 7.846 167 HG23 VAL 523 HG23 VAL 523 -9.355 -20.519 9.119 168 H LYS 524 H LYS 524 -9.103 -19.569 3.650 169 HA LYS 524 HA LYS 524 -6.334 -19.450 2.827 170 HB2 LYS 524 HB2 LYS 524 -8.721 -18.271 1.456 171 HB3 LYS 524 HB3 LYS 524 -7.125 -18.557 0.778 172 HG2 LYS 524 HG2 LYS 524 -7.637 -21.067 1.351 173 HG3 LYS 524 HG3 LYS 524 -9.302 -20.458 1.384 174 HD2 LYS 524 HD2 LYS 524 -7.399 -20.193 -0.892 175 HD3 LYS 524 HD3 LYS 524 -8.718 -21.378 -0.786 176 HE2 LYS 524 HE2 LYS 524 -8.943 -18.462 -0.608 177 HE3 LYS 524 HE3 LYS 524 -9.253 -19.337 -2.137 178 HZ1 LYS 524 HZ1 LYS 524 -11.073 -20.500 -0.713 179 HZ2 LYS 524 HZ2 LYS 524 -11.339 -18.910 -1.165 180 HZ3 LYS 524 HZ3 LYS 524 -10.819 -19.220 0.391 181 H VAL 525 H VAL 525 -5.132 -17.695 2.728 182 HA VAL 525 HA VAL 525 -6.171 -15.320 4.102 183 HB VAL 525 HB VAL 525 -3.291 -16.163 3.711 184 HG11 VAL 525 HG11 VAL 525 -4.489 -14.020 5.459 185 HG12 VAL 525 HG12 VAL 525 -3.562 -13.741 3.982 186 HG13 VAL 525 HG13 VAL 525 -2.779 -14.453 5.397 187 HG21 VAL 525 HG21 VAL 525 -4.462 -17.715 5.136 188 HG22 VAL 525 HG22 VAL 525 -5.043 -16.390 6.144 189 HG23 VAL 525 HG23 VAL 525 -3.316 -16.761 6.072 190 H LEU 526 H LEU 526 -6.346 -13.527 3.024 191 HA LEU 526 HA LEU 526 -6.027 -13.430 0.223 192 HB2 LEU 526 HB2 LEU 526 -6.595 -11.264 2.250 193 HB3 LEU 526 HB3 LEU 526 -6.660 -11.029 0.514 194 HG LEU 526 HG LEU 526 -8.436 -12.895 2.097 195 HD11 LEU 526 HD11 LEU 526 -9.033 -10.230 0.824 196 HD12 LEU 526 HD12 LEU 526 -8.926 -10.551 2.556 197 HD13 LEU 526 HD13 LEU 526 -10.206 -11.293 1.600 198 HD21 LEU 526 HD21 LEU 526 -8.062 -13.689 -0.171 199 HD22 LEU 526 HD22 LEU 526 -8.474 -12.094 -0.806 200 HD23 LEU 526 HD23 LEU 526 -9.698 -13.060 0.015 201 H ARG 527 H ARG 527 -4.249 -13.192 -0.788 202 HA ARG 527 HA ARG 527 -1.864 -12.234 0.454 203 HB2 ARG 527 HB2 ARG 527 -1.708 -14.060 -1.161 204 HB3 ARG 527 HB3 ARG 527 -2.442 -13.061 -2.406 205 HG2 ARG 527 HG2 ARG 527 -0.517 -11.565 -2.361 206 HG3 ARG 527 HG3 ARG 527 0.216 -12.540 -1.092 207 HD2 ARG 527 HD2 ARG 527 1.163 -12.968 -3.321 208 HD3 ARG 527 HD3 ARG 527 0.443 -14.399 -2.603 209 HE ARG 527 HE ARG 527 -0.914 -14.541 -4.318 210 HH11 ARG 527 HH11 ARG 527 -0.384 -10.995 -4.150 211 HH12 ARG 527 HH12 ARG 527 -0.663 -10.777 -5.794 212 HH21 ARG 527 HH21 ARG 527 -1.300 -14.112 -6.617 213 HH22 ARG 527 HH22 ARG 527 -1.271 -12.504 -7.172 214 H THR 528 H THR 528 -0.719 -10.424 -0.112 215 HA THR 528 HA THR 528 -1.931 -8.038 -0.451 216 HB THR 528 HB THR 528 0.245 -8.194 0.499 217 HG1 THR 528 HG1 THR 528 1.347 -7.081 -1.620 218 HG21 THR 528 HG21 THR 528 1.038 -10.204 -0.598 219 HG22 THR 528 HG22 THR 528 2.221 -8.899 -0.769 220 HG23 THR 528 HG23 THR 528 1.167 -9.326 -2.123 221 H SER 529 H SER 529 -2.693 -6.963 -2.134 222 HA SER 529 HA SER 529 -2.930 -7.707 -4.724 223 HB2 SER 529 HB2 SER 529 -4.193 -5.892 -3.695 224 HB3 SER 529 HB3 SER 529 -2.742 -4.930 -3.511 225 HG SER 529 HG SER 529 -3.863 -5.790 -5.968 226 H GLY 530 H GLY 530 -0.320 -6.015 -3.105 227 HA2 GLY 530 HA2 GLY 530 1.282 -6.031 -5.568 228 HA3 GLY 530 HA3 GLY 530 1.571 -5.016 -4.159 229 H ALA 531 H ALA 531 1.691 -8.284 -5.365 230 HA ALA 531 HA ALA 531 3.167 -9.138 -3.027 231 HB1 ALA 531 HB1 ALA 531 2.501 -10.608 -5.581 232 HB2 ALA 531 HB2 ALA 531 1.591 -10.693 -4.075 233 HB3 ALA 531 HB3 ALA 531 3.238 -11.323 -4.143 234 H ARG 532 H ARG 532 5.182 -8.521 -2.881 235 HA ARG 532 HA ARG 532 6.692 -8.222 -5.368 236 HB2 ARG 532 HB2 ARG 532 7.233 -6.856 -2.736 237 HB3 ARG 532 HB3 ARG 532 8.001 -6.538 -4.284 238 HG2 ARG 532 HG2 ARG 532 5.112 -6.024 -3.597 239 HG3 ARG 532 HG3 ARG 532 6.357 -4.793 -3.760 240 HD2 ARG 532 HD2 ARG 532 6.590 -5.299 -6.113 241 HD3 ARG 532 HD3 ARG 532 5.469 -6.652 -5.964 242 HE ARG 532 HE ARG 532 4.492 -4.041 -5.196 243 HH11 ARG 532 HH11 ARG 532 4.521 -6.599 -7.645 244 HH12 ARG 532 HH12 ARG 532 3.170 -5.993 -8.488 245 HH21 ARG 532 HH21 ARG 532 2.626 -3.241 -6.320 246 HH22 ARG 532 HH22 ARG 532 2.063 -4.007 -7.720 247 H GLY 533 H GLY 533 7.786 -10.036 -5.619 248 HA2 GLY 533 HA2 GLY 533 9.614 -11.380 -5.336 249 HA3 GLY 533 HA3 GLY 533 9.999 -10.479 -3.882 250 H ASN 534 H ASN 534 9.915 -11.547 -2.120 251 HA ASN 534 HA ASN 534 8.015 -13.736 -1.798 252 HB2 ASN 534 HB2 ASN 534 10.196 -14.742 -2.380 253 HB3 ASN 534 HB3 ASN 534 10.956 -13.861 -1.065 254 HD21 ASN 534 HD21 ASN 534 7.774 -15.417 -0.838 255 HD22 ASN 534 HD22 ASN 534 8.290 -16.591 0.300 256 H VAL 535 H VAL 535 6.933 -13.605 0.043 257 HA VAL 535 HA VAL 535 7.955 -11.939 2.221 258 HB VAL 535 HB VAL 535 5.113 -11.993 1.152 259 HG11 VAL 535 HG11 VAL 535 6.324 -10.366 3.368 260 HG12 VAL 535 HG12 VAL 535 5.155 -11.676 3.531 261 HG13 VAL 535 HG13 VAL 535 4.688 -10.167 2.734 262 HG21 VAL 535 HG21 VAL 535 7.178 -9.811 0.991 263 HG22 VAL 535 HG22 VAL 535 5.486 -9.654 0.487 264 HG23 VAL 535 HG23 VAL 535 6.567 -10.780 -0.347 265 H ILE 536 H ILE 536 7.590 -12.842 4.203 266 HA ILE 536 HA ILE 536 6.117 -15.370 4.231 267 HB ILE 536 HB ILE 536 8.315 -14.370 6.060 268 HG12 ILE 536 HG12 ILE 536 9.165 -15.270 3.970 269 HG13 ILE 536 HG13 ILE 536 9.556 -16.359 5.297 270 HG21 ILE 536 HG21 ILE 536 6.658 -15.495 7.368 271 HG22 ILE 536 HG22 ILE 536 8.104 -16.516 7.239 272 HG23 ILE 536 HG23 ILE 536 6.671 -16.843 6.241 273 HD11 ILE 536 HD11 ILE 536 7.567 -17.728 4.587 274 HD12 ILE 536 HD12 ILE 536 8.907 -17.674 3.449 275 HD13 ILE 536 HD13 ILE 536 7.478 -16.698 3.154 276 H VAL 537 H VAL 537 4.408 -15.556 5.530 277 HA VAL 537 HA VAL 537 3.887 -13.317 7.319 278 HB VAL 537 HB VAL 537 1.799 -14.940 5.826 279 HG11 VAL 537 HG11 VAL 537 1.459 -12.554 7.645 280 HG12 VAL 537 HG12 VAL 537 0.979 -14.211 8.012 281 HG13 VAL 537 HG13 VAL 537 0.175 -13.325 6.715 282 HG21 VAL 537 HG21 VAL 537 1.368 -12.857 4.597 283 HG22 VAL 537 HG22 VAL 537 3.035 -13.429 4.392 284 HG23 VAL 537 HG23 VAL 537 2.692 -12.100 5.489 285 HA PRO 538 HA PRO 538 4.038 -16.826 10.156 286 HB2 PRO 538 HB2 PRO 538 4.038 -15.315 12.426 287 HB3 PRO 538 HB3 PRO 538 5.492 -15.666 11.492 288 HG2 PRO 538 HG2 PRO 538 3.853 -13.187 11.588 289 HG3 PRO 538 HG3 PRO 538 5.598 -13.365 11.385 290 HD2 PRO 538 HD2 PRO 538 3.836 -12.828 9.342 291 HD3 PRO 538 HD3 PRO 538 5.423 -13.580 9.116 292 H TYR 539 H TYR 539 2.533 -17.747 11.579 293 HA TYR 539 HA TYR 539 0.135 -16.277 12.235 294 HB2 TYR 539 HB2 TYR 539 -1.413 -17.849 11.205 295 HB3 TYR 539 HB3 TYR 539 -0.343 -17.196 9.972 296 HD1 TYR 539 HD2 TYR 539 1.306 -18.612 8.893 297 HD2 TYR 539 HD1 TYR 539 -1.329 -20.199 11.818 298 HE1 TYR 539 HE2 TYR 539 1.852 -20.882 8.147 299 HE2 TYR 539 HE1 TYR 539 -0.790 -22.471 11.092 300 HH TYR 539 HH TYR 539 1.838 -23.162 9.041 301 H LYS 540 H LYS 540 -1.124 -17.362 13.795 302 HA LYS 540 HA LYS 540 -0.197 -19.867 14.780 303 HB2 LYS 540 HB2 LYS 540 0.214 -18.999 17.142 304 HB3 LYS 540 HB3 LYS 540 1.435 -18.662 15.930 305 HG2 LYS 540 HG2 LYS 540 1.133 -16.759 17.396 306 HG3 LYS 540 HG3 LYS 540 0.660 -16.364 15.748 307 HD2 LYS 540 HD2 LYS 540 -1.671 -16.582 16.347 308 HD3 LYS 540 HD3 LYS 540 -1.227 -17.109 17.971 309 HE2 LYS 540 HE2 LYS 540 -1.882 -14.758 17.901 310 HE3 LYS 540 HE3 LYS 540 -0.213 -15.030 18.421 311 HZ1 LYS 540 HZ1 LYS 540 -0.818 -14.322 15.597 312 HZ2 LYS 540 HZ2 LYS 540 0.628 -14.110 16.486 313 HZ3 LYS 540 HZ3 LYS 540 -0.700 -13.168 16.807 314 H THR 541 H THR 541 -1.544 -20.896 16.268 315 HA THR 541 HA THR 541 -4.235 -20.003 16.226 316 HB THR 541 HB THR 541 -4.447 -22.147 17.674 317 HG1 THR 541 HG1 THR 541 -2.398 -22.805 18.228 318 HG21 THR 541 HG21 THR 541 -4.355 -23.586 15.671 319 HG22 THR 541 HG22 THR 541 -3.426 -22.340 14.840 320 HG23 THR 541 HG23 THR 541 -5.093 -22.024 15.306 321 H ILE 542 H ILE 542 -5.311 -19.103 17.861 322 HA ILE 542 HA ILE 542 -3.857 -18.455 20.327 323 HB ILE 542 HB ILE 542 -6.294 -17.188 19.073 324 HG12 ILE 542 HG12 ILE 542 -3.482 -16.077 19.184 325 HG13 ILE 542 HG13 ILE 542 -4.231 -16.791 17.758 326 HG21 ILE 542 HG21 ILE 542 -5.957 -15.383 20.722 327 HG22 ILE 542 HG22 ILE 542 -4.623 -16.295 21.425 328 HG23 ILE 542 HG23 ILE 542 -6.263 -16.941 21.491 329 HD11 ILE 542 HD11 ILE 542 -5.891 -15.039 17.717 330 HD12 ILE 542 HD12 ILE 542 -4.268 -14.341 17.721 331 HD13 ILE 542 HD13 ILE 542 -5.233 -14.344 19.198 332 H GLU 543 H GLU 543 -4.495 -19.800 21.925 333 HA GLU 543 HA GLU 543 -6.821 -21.402 21.730 334 HB2 GLU 543 HB2 GLU 543 -4.997 -20.859 24.058 335 HB3 GLU 543 HB3 GLU 543 -6.309 -22.024 24.083 336 HG2 GLU 543 HG2 GLU 543 -5.255 -23.270 22.304 337 HG3 GLU 543 HG3 GLU 543 -3.935 -22.097 22.239 338 H GLY 544 H GLY 544 -8.764 -21.137 22.458 339 HA2 GLY 544 HA2 GLY 544 -9.355 -18.839 24.197 340 HA3 GLY 544 HA3 GLY 544 -10.396 -19.293 22.839 341 H THR 545 H THR 545 -12.089 -20.488 23.356 342 HA THR 545 HA THR 545 -12.177 -21.924 25.839 343 HB THR 545 HB THR 545 -14.441 -22.622 25.017 344 HG1 THR 545 HG1 THR 545 -15.078 -21.389 23.090 345 HG21 THR 545 HG21 THR 545 -15.437 -20.389 25.071 346 HG22 THR 545 HG22 THR 545 -13.870 -19.680 24.700 347 HG23 THR 545 HG23 THR 545 -14.119 -20.495 26.244 348 H ALA 546 H ALA 546 -11.435 -22.473 22.570 349 HA ALA 546 HA ALA 546 -11.469 -25.346 22.730 350 HB1 ALA 546 HB1 ALA 546 -10.609 -25.299 20.481 351 HB2 ALA 546 HB2 ALA 546 -10.197 -23.599 20.644 352 HB3 ALA 546 HB3 ALA 546 -11.888 -24.077 20.588 353 H ARG 547 H ARG 547 -9.869 -26.543 23.375 354 HA ARG 547 HA ARG 547 -7.459 -25.320 24.355 355 HB2 ARG 547 HB2 ARG 547 -8.620 -28.077 24.543 356 HB3 ARG 547 HB3 ARG 547 -7.084 -27.611 25.254 357 HG2 ARG 547 HG2 ARG 547 -8.129 -26.019 26.625 358 HG3 ARG 547 HG3 ARG 547 -9.723 -26.331 25.915 359 HD2 ARG 547 HD2 ARG 547 -8.463 -28.775 26.832 360 HD3 ARG 547 HD3 ARG 547 -8.584 -27.603 28.138 361 HE ARG 547 HE ARG 547 -10.865 -27.778 28.108 362 HH11 ARG 547 HH11 ARG 547 -9.726 -29.454 25.231 363 HH12 ARG 547 HH12 ARG 547 -11.049 -30.500 25.087 364 HH21 ARG 547 HH21 ARG 547 -12.740 -29.211 27.939 365 HH22 ARG 547 HH22 ARG 547 -12.852 -30.324 26.662 366 H GLY 548 H GLY 548 -5.542 -25.607 23.541 367 HA2 GLY 548 HA2 GLY 548 -5.356 -26.697 20.863 368 HA3 GLY 548 HA3 GLY 548 -4.090 -25.840 21.733 369 H GLY 549 H GLY 549 -2.565 -27.362 21.132 370 HA2 GLY 549 HA2 GLY 549 -1.213 -29.148 21.503 371 HA3 GLY 549 HA3 GLY 549 -2.089 -29.338 23.009 372 H GLY 550 H GLY 550 -3.952 -29.614 20.067 373 HA2 GLY 550 HA2 GLY 550 -4.600 -31.454 18.863 374 HA3 GLY 550 HA3 GLY 550 -3.476 -32.428 19.795 375 H GLU 551 H GLU 551 -5.620 -30.389 21.533 376 HA GLU 551 HA GLU 551 -6.998 -32.755 22.499 377 HB2 GLU 551 HB2 GLU 551 -5.862 -31.234 24.089 378 HB3 GLU 551 HB3 GLU 551 -6.936 -29.942 23.589 379 HG2 GLU 551 HG2 GLU 551 -8.815 -31.059 24.521 380 HG3 GLU 551 HG3 GLU 551 -7.855 -32.506 24.829 381 H ASP 552 H ASP 552 -8.031 -29.356 21.803 382 HA ASP 552 HA ASP 552 -10.497 -30.471 20.633 383 HB2 ASP 552 HB2 ASP 552 -9.770 -27.578 21.275 384 HB3 ASP 552 HB3 ASP 552 -11.228 -28.044 20.422 385 H PHE 553 H PHE 553 -7.760 -28.411 19.991 386 HA PHE 553 HA PHE 553 -7.947 -29.203 17.203 387 HB2 PHE 553 HB2 PHE 553 -7.429 -26.975 16.398 388 HB3 PHE 553 HB3 PHE 553 -8.881 -26.897 17.380 389 HD1 PHE 553 HD1 PHE 553 -8.807 -25.814 19.591 390 HD2 PHE 553 HD2 PHE 553 -5.429 -25.845 17.023 391 HE1 PHE 553 HE1 PHE 553 -7.793 -23.994 20.899 392 HE2 PHE 553 HE2 PHE 553 -4.409 -24.041 18.328 393 HZ PHE 553 HZ PHE 553 -5.588 -23.104 20.262 394 H GLU 554 H GLU 554 -5.982 -29.385 16.223 395 HA GLU 554 HA GLU 554 -3.697 -29.730 17.908 396 HB2 GLU 554 HB2 GLU 554 -4.398 -31.020 15.794 397 HB3 GLU 554 HB3 GLU 554 -3.852 -29.616 14.907 398 HG2 GLU 554 HG2 GLU 554 -2.103 -31.210 16.725 399 HG3 GLU 554 HG3 GLU 554 -2.306 -31.571 15.016 400 H ASP 555 H ASP 555 -2.262 -28.165 18.395 401 HA ASP 555 HA ASP 555 -2.891 -25.447 17.689 402 HB2 ASP 555 HB2 ASP 555 -2.239 -26.035 19.974 403 HB3 ASP 555 HB3 ASP 555 -0.660 -26.566 19.401 404 H THR 556 H THR 556 -2.078 -24.366 16.005 405 HA THR 556 HA THR 556 0.448 -25.337 14.967 406 HB THR 556 HB THR 556 -1.338 -26.108 13.463 407 HG1 THR 556 HG1 THR 556 -0.413 -25.386 11.579 408 HG21 THR 556 HG21 THR 556 -2.591 -24.474 12.093 409 HG22 THR 556 HG22 THR 556 -1.914 -23.179 13.087 410 HG23 THR 556 HG23 THR 556 -3.002 -24.367 13.808 411 H CYS 557 H CYS 557 1.844 -23.974 14.338 412 HA CYS 557 HA CYS 557 1.314 -21.157 14.137 413 HB2 CYS 557 HB2 CYS 557 3.299 -20.701 15.623 414 HB3 CYS 557 HB3 CYS 557 1.913 -21.364 16.485 415 HG CYS 557 HG CYS 557 3.017 -23.506 17.358 416 H GLY 558 H GLY 558 2.828 -20.259 12.690 417 HA2 GLY 558 HA2 GLY 558 5.170 -21.500 11.913 418 HA3 GLY 558 HA3 GLY 558 3.874 -22.112 10.886 419 H GLU 559 H GLU 559 4.802 -21.134 9.102 420 HA GLU 559 HA GLU 559 4.235 -18.307 8.887 421 HB2 GLU 559 HB2 GLU 559 6.921 -19.561 8.373 422 HB3 GLU 559 HB3 GLU 559 6.464 -17.956 7.814 423 HG2 GLU 559 HG2 GLU 559 6.205 -17.224 10.124 424 HG3 GLU 559 HG3 GLU 559 6.615 -18.839 10.691 425 H LEU 560 H LEU 560 3.339 -17.863 7.012 426 HA LEU 560 HA LEU 560 3.129 -19.936 4.965 427 HB2 LEU 560 HB2 LEU 560 1.797 -17.252 5.247 428 HB3 LEU 560 HB3 LEU 560 1.474 -18.410 3.978 429 HG LEU 560 HG LEU 560 0.895 -18.805 6.905 430 HD11 LEU 560 HD11 LEU 560 -0.901 -18.204 4.573 431 HD12 LEU 560 HD12 LEU 560 -0.541 -17.140 5.936 432 HD13 LEU 560 HD13 LEU 560 -1.437 -18.639 6.191 433 HD21 LEU 560 HD21 LEU 560 -0.364 -20.787 6.131 434 HD22 LEU 560 HD22 LEU 560 1.366 -20.927 5.833 435 HD23 LEU 560 HD23 LEU 560 0.279 -20.543 4.506 436 H GLU 561 H GLU 561 3.926 -19.666 2.942 437 HA GLU 561 HA GLU 561 5.770 -17.432 2.629 438 HB2 GLU 561 HB2 GLU 561 6.568 -19.800 2.561 439 HB3 GLU 561 HB3 GLU 561 5.630 -19.988 1.069 440 HG2 GLU 561 HG2 GLU 561 7.022 -18.054 0.176 441 HG3 GLU 561 HG3 GLU 561 8.007 -18.252 1.601 442 H PHE 562 H PHE 562 4.937 -15.822 1.453 443 HA PHE 562 HA PHE 562 3.188 -16.512 -0.798 444 HB2 PHE 562 HB2 PHE 562 3.375 -13.969 0.824 445 HB3 PHE 562 HB3 PHE 562 2.493 -14.093 -0.686 446 HD1 PHE 562 HD2 PHE 562 0.440 -15.387 -0.811 447 HD2 PHE 562 HD1 PHE 562 2.529 -14.910 2.851 448 HE1 PHE 562 HE2 PHE 562 -1.571 -16.092 0.415 449 HE2 PHE 562 HE1 PHE 562 0.524 -15.612 4.088 450 HZ PHE 562 HZ PHE 562 -1.524 -16.203 2.870 451 H GLN 563 H GLN 563 3.698 -15.698 -2.779 452 HA GLN 563 HA GLN 563 6.079 -14.039 -2.937 453 HB2 GLN 563 HB2 GLN 563 5.587 -16.462 -4.673 454 HB3 GLN 563 HB3 GLN 563 6.876 -15.298 -4.900 455 HG2 GLN 563 HG2 GLN 563 7.759 -15.904 -2.670 456 HG3 GLN 563 HG3 GLN 563 6.532 -17.165 -2.573 457 HE21 GLN 563 HE21 GLN 563 9.475 -16.120 -4.096 458 HE22 GLN 563 HE22 GLN 563 9.826 -17.653 -4.793 459 H ASN 564 H ASN 564 6.326 -13.409 -5.289 460 HA ASN 564 HA ASN 564 4.127 -11.794 -5.971 461 HB2 ASN 564 HB2 ASN 564 5.481 -11.130 -7.923 462 HB3 ASN 564 HB3 ASN 564 6.385 -11.079 -6.418 463 HD21 ASN 564 HD21 ASN 564 7.327 -11.242 -9.138 464 HD22 ASN 564 HD22 ASN 564 8.286 -12.662 -9.269 465 H ASP 565 H ASP 565 5.363 -14.759 -7.238 466 HA ASP 565 HA ASP 565 3.348 -14.833 -9.349 467 HB2 ASP 565 HB2 ASP 565 5.645 -15.498 -9.887 468 HB3 ASP 565 HB3 ASP 565 5.549 -16.796 -8.706 469 H GLU 566 H GLU 566 3.568 -15.903 -6.162 470 HA GLU 566 HA GLU 566 2.086 -18.313 -6.392 471 HB2 GLU 566 HB2 GLU 566 2.954 -16.578 -4.134 472 HB3 GLU 566 HB3 GLU 566 1.856 -17.917 -3.862 473 HG2 GLU 566 HG2 GLU 566 4.595 -18.120 -5.096 474 HG3 GLU 566 HG3 GLU 566 4.195 -18.525 -3.419 475 H ILE 567 H ILE 567 0.032 -18.589 -5.106 476 HA ILE 567 HA ILE 567 -1.725 -16.388 -5.802 477 HB ILE 567 HB ILE 567 -3.587 -18.190 -5.637 478 HG12 ILE 567 HG12 ILE 567 -1.292 -20.016 -6.367 479 HG13 ILE 567 HG13 ILE 567 -1.921 -19.968 -4.735 480 HG21 ILE 567 HG21 ILE 567 -3.291 -18.744 -8.009 481 HG22 ILE 567 HG22 ILE 567 -1.640 -18.129 -7.931 482 HG23 ILE 567 HG23 ILE 567 -2.999 -17.037 -7.676 483 HD11 ILE 567 HD11 ILE 567 -2.827 -21.820 -5.986 484 HD12 ILE 567 HD12 ILE 567 -3.475 -20.704 -7.203 485 HD13 ILE 567 HD13 ILE 567 -4.075 -20.660 -5.537 486 H VAL 568 H VAL 568 -2.374 -19.023 -3.505 487 HA VAL 568 HA VAL 568 -2.708 -17.041 -1.415 488 HB VAL 568 HB VAL 568 -4.862 -17.258 -2.667 489 HG11 VAL 568 HG11 VAL 568 -4.870 -20.079 -1.670 490 HG12 VAL 568 HG12 VAL 568 -4.727 -19.571 -3.358 491 HG13 VAL 568 HG13 VAL 568 -6.221 -19.266 -2.457 492 HG21 VAL 568 HG21 VAL 568 -6.323 -17.613 -0.755 493 HG22 VAL 568 HG22 VAL 568 -4.939 -16.593 -0.337 494 HG23 VAL 568 HG23 VAL 568 -4.975 -18.288 0.156 495 H LYS 569 H LYS 569 -2.727 -18.026 0.668 496 HA LYS 569 HA LYS 569 -1.789 -20.808 0.742 497 HB2 LYS 569 HB2 LYS 569 -1.140 -18.459 2.497 498 HB3 LYS 569 HB3 LYS 569 -0.798 -20.123 2.947 499 HG2 LYS 569 HG2 LYS 569 0.182 -19.358 0.338 500 HG3 LYS 569 HG3 LYS 569 0.925 -18.439 1.661 501 HD2 LYS 569 HD2 LYS 569 2.288 -20.376 1.199 502 HD3 LYS 569 HD3 LYS 569 1.435 -20.702 2.700 503 HE2 LYS 569 HE2 LYS 569 -0.216 -22.028 1.449 504 HE3 LYS 569 HE3 LYS 569 0.671 -21.721 -0.039 505 HZ1 LYS 569 HZ1 LYS 569 1.710 -23.173 2.332 506 HZ2 LYS 569 HZ2 LYS 569 2.589 -22.848 0.947 507 HZ3 LYS 569 HZ3 LYS 569 1.250 -23.857 0.866 508 H THR 570 H THR 570 -2.374 -21.956 2.673 509 HA THR 570 HA THR 570 -4.841 -21.001 3.918 510 HB THR 570 HB THR 570 -5.366 -23.553 4.085 511 HG1 THR 570 HG1 THR 570 -4.580 -24.822 2.516 512 HG21 THR 570 HG21 THR 570 -6.750 -22.001 2.881 513 HG22 THR 570 HG22 THR 570 -6.597 -23.504 1.982 514 HG23 THR 570 HG23 THR 570 -5.691 -22.064 1.469 515 H ILE 571 H ILE 571 -5.050 -21.405 6.072 516 HA ILE 571 HA ILE 571 -2.736 -22.623 7.367 517 HB ILE 571 HB ILE 571 -5.141 -21.170 8.560 518 HG12 ILE 571 HG12 ILE 571 -3.415 -19.689 9.595 519 HG13 ILE 571 HG13 ILE 571 -2.190 -20.553 8.689 520 HG21 ILE 571 HG21 ILE 571 -2.912 -22.506 10.085 521 HG22 ILE 571 HG22 ILE 571 -4.558 -23.097 9.938 522 HG23 ILE 571 HG23 ILE 571 -4.245 -21.578 10.786 523 HD11 ILE 571 HD11 ILE 571 -3.162 -19.783 6.640 524 HD12 ILE 571 HD12 ILE 571 -2.726 -18.451 7.722 525 HD13 ILE 571 HD13 ILE 571 -4.423 -18.929 7.541 526 H SER 572 H SER 572 -2.803 -24.656 7.605 527 HA SER 572 HA SER 572 -5.344 -26.085 7.429 528 HB2 SER 572 HB2 SER 572 -2.498 -27.124 7.429 529 HB3 SER 572 HB3 SER 572 -3.952 -28.013 6.971 530 HG SER 572 HG SER 572 -3.409 -25.610 5.696 531 H VAL 573 H VAL 573 -6.290 -26.466 9.331 532 HA VAL 573 HA VAL 573 -4.538 -26.996 11.626 533 HB VAL 573 HB VAL 573 -7.329 -25.780 11.714 534 HG11 VAL 573 HG11 VAL 573 -6.954 -27.225 13.655 535 HG12 VAL 573 HG12 VAL 573 -7.000 -25.518 14.107 536 HG13 VAL 573 HG13 VAL 573 -5.455 -26.354 14.014 537 HG21 VAL 573 HG21 VAL 573 -6.169 -23.820 12.671 538 HG22 VAL 573 HG22 VAL 573 -5.735 -24.177 11.003 539 HG23 VAL 573 HG23 VAL 573 -4.629 -24.610 12.313 540 H LYS 574 H LYS 574 -4.672 -28.891 12.458 541 HA LYS 574 HA LYS 574 -6.613 -30.794 11.539 542 HB2 LYS 574 HB2 LYS 574 -4.342 -31.556 11.909 543 HB3 LYS 574 HB3 LYS 574 -4.353 -30.962 13.552 544 HG2 LYS 574 HG2 LYS 574 -4.543 -33.346 13.588 545 HG3 LYS 574 HG3 LYS 574 -6.073 -32.654 14.103 546 HD2 LYS 574 HD2 LYS 574 -7.023 -33.058 11.900 547 HD3 LYS 574 HD3 LYS 574 -5.474 -33.691 11.337 548 HE2 LYS 574 HE2 LYS 574 -7.122 -34.866 13.579 549 HE3 LYS 574 HE3 LYS 574 -7.080 -35.474 11.929 550 HZ1 LYS 574 HZ1 LYS 574 -5.578 -36.751 13.340 551 HZ2 LYS 574 HZ2 LYS 574 -4.754 -35.364 13.786 552 HZ3 LYS 574 HZ3 LYS 574 -4.698 -35.887 12.203 553 H VAL 575 H VAL 575 -8.526 -30.634 12.246 554 HA VAL 575 HA VAL 575 -9.085 -29.615 14.903 555 HB VAL 575 HB VAL 575 -11.045 -30.601 12.793 556 HG11 VAL 575 HG11 VAL 575 -12.718 -29.357 14.081 557 HG12 VAL 575 HG12 VAL 575 -11.499 -28.908 15.262 558 HG13 VAL 575 HG13 VAL 575 -11.954 -30.600 15.067 559 HG21 VAL 575 HG21 VAL 575 -10.175 -27.772 13.405 560 HG22 VAL 575 HG22 VAL 575 -11.443 -28.235 12.269 561 HG23 VAL 575 HG23 VAL 575 -9.768 -28.692 11.956 562 H ILE 576 H ILE 576 -9.406 -30.908 16.553 563 HA ILE 576 HA ILE 576 -8.863 -33.668 16.097 564 HB ILE 576 HB ILE 576 -9.443 -32.308 18.704 565 HG12 ILE 576 HG12 ILE 576 -7.608 -31.148 17.648 566 HG13 ILE 576 HG13 ILE 576 -6.979 -32.142 18.952 567 HG21 ILE 576 HG21 ILE 576 -8.100 -34.127 19.657 568 HG22 ILE 576 HG22 ILE 576 -7.952 -34.837 18.047 569 HG23 ILE 576 HG23 ILE 576 -9.541 -34.744 18.823 570 HD11 ILE 576 HD11 ILE 576 -6.307 -33.826 17.289 571 HD12 ILE 576 HD12 ILE 576 -5.517 -32.269 17.057 572 HD13 ILE 576 HD13 ILE 576 -6.858 -32.747 16.010 573 H ASP 577 H ASP 577 -10.132 -35.115 15.937 574 HA ASP 577 HA ASP 577 -13.035 -34.842 16.260 575 HB2 ASP 577 HB2 ASP 577 -12.332 -35.825 14.153 576 HB3 ASP 577 HB3 ASP 577 -11.316 -36.992 14.984 577 H ASP 578 H ASP 578 -13.592 -35.119 18.348 578 HA ASP 578 HA ASP 578 -12.378 -37.427 19.687 579 HB2 ASP 578 HB2 ASP 578 -11.702 -35.193 20.611 580 HB3 ASP 578 HB3 ASP 578 -13.390 -34.917 21.024 581 H GLU 579 H GLU 579 -15.193 -35.278 20.059 582 HA GLU 579 HA GLU 579 -17.175 -36.928 19.338 583 HB2 GLU 579 HB2 GLU 579 -18.164 -37.768 21.440 584 HB3 GLU 579 HB3 GLU 579 -16.589 -38.492 21.171 585 HG2 GLU 579 HG2 GLU 579 -15.611 -36.985 22.811 586 HG3 GLU 579 HG3 GLU 579 -17.178 -36.213 23.035 587 H GLU 580 H GLU 580 -19.309 -36.130 20.339 588 HA GLU 580 HA GLU 580 -19.201 -33.287 20.186 589 HB2 GLU 580 HB2 GLU 580 -21.729 -33.447 20.454 590 HB3 GLU 580 HB3 GLU 580 -21.023 -34.233 19.056 591 HG2 GLU 580 HG2 GLU 580 -22.778 -35.608 19.966 592 HG3 GLU 580 HG3 GLU 580 -21.235 -36.410 20.208 593 H TYR 581 H TYR 581 -18.080 -34.598 22.551 594 HA TYR 581 HA TYR 581 -19.598 -33.916 24.879 595 HB2 TYR 581 HB2 TYR 581 -17.837 -35.645 24.842 596 HB3 TYR 581 HB3 TYR 581 -16.634 -34.413 24.504 597 HD1 TYR 581 HD2 TYR 581 -16.085 -32.751 26.317 598 HD2 TYR 581 HD1 TYR 581 -18.541 -36.149 27.009 599 HE1 TYR 581 HE2 TYR 581 -15.677 -32.551 28.725 600 HE2 TYR 581 HE1 TYR 581 -18.130 -35.957 29.411 601 HH TYR 581 HH TYR 581 -16.803 -33.234 30.830 602 H GLU 582 H GLU 582 -17.249 -32.367 22.828 603 HA GLU 582 HA GLU 582 -16.733 -30.259 24.692 604 HB2 GLU 582 HB2 GLU 582 -15.868 -30.568 21.823 605 HB3 GLU 582 HB3 GLU 582 -15.225 -29.410 22.978 606 HG2 GLU 582 HG2 GLU 582 -14.971 -32.412 23.105 607 HG3 GLU 582 HG3 GLU 582 -13.695 -31.252 22.745 608 H LYS 583 H LYS 583 -18.064 -28.688 24.972 609 HA LYS 583 HA LYS 583 -20.188 -28.134 23.124 610 HB2 LYS 583 HB2 LYS 583 -20.654 -28.239 25.493 611 HB3 LYS 583 HB3 LYS 583 -19.500 -26.955 25.813 612 HG2 LYS 583 HG2 LYS 583 -20.908 -25.391 24.529 613 HG3 LYS 583 HG3 LYS 583 -22.075 -26.688 24.273 614 HD2 LYS 583 HD2 LYS 583 -21.235 -25.640 26.975 615 HD3 LYS 583 HD3 LYS 583 -22.697 -25.164 26.117 616 HE2 LYS 583 HE2 LYS 583 -23.472 -27.478 26.152 617 HE3 LYS 583 HE3 LYS 583 -22.014 -27.959 27.019 618 HZ1 LYS 583 HZ1 LYS 583 -24.089 -26.086 27.992 619 HZ2 LYS 583 HZ2 LYS 583 -22.693 -26.497 28.833 620 HZ3 LYS 583 HZ3 LYS 583 -23.856 -27.671 28.507 621 H ASN 584 H ASN 584 -19.565 -27.078 21.369 622 HA ASN 584 HA ASN 584 -18.797 -25.501 19.951 623 HB2 ASN 584 HB2 ASN 584 -20.872 -24.486 20.856 624 HB3 ASN 584 HB3 ASN 584 -19.924 -23.660 22.081 625 HD21 ASN 584 HD21 ASN 584 -20.814 -23.759 18.711 626 HD22 ASN 584 HD22 ASN 584 -20.181 -22.216 18.298 627 H LYS 585 H LYS 585 -16.621 -25.775 19.932 628 HA LYS 585 HA LYS 585 -15.100 -24.216 21.880 629 HB2 LYS 585 HB2 LYS 585 -14.226 -26.425 20.027 630 HB3 LYS 585 HB3 LYS 585 -13.154 -25.534 21.096 631 HG2 LYS 585 HG2 LYS 585 -15.432 -27.313 21.892 632 HG3 LYS 585 HG3 LYS 585 -13.705 -27.621 22.101 633 HD2 LYS 585 HD2 LYS 585 -13.607 -25.568 23.547 634 HD3 LYS 585 HD3 LYS 585 -15.369 -25.496 23.450 635 HE2 LYS 585 HE2 LYS 585 -14.772 -26.592 25.466 636 HE3 LYS 585 HE3 LYS 585 -15.454 -27.787 24.368 637 HZ1 LYS 585 HZ1 LYS 585 -13.066 -28.335 23.760 638 HZ2 LYS 585 HZ2 LYS 585 -13.610 -28.787 25.242 639 HZ3 LYS 585 HZ3 LYS 585 -12.609 -27.414 25.103 640 H THR 586 H THR 586 -13.866 -22.539 21.298 641 HA THR 586 HA THR 586 -13.447 -22.189 18.486 642 HB THR 586 HB THR 586 -15.461 -21.022 18.659 643 HG1 THR 586 HG1 THR 586 -13.713 -19.833 17.696 644 HG21 THR 586 HG21 THR 586 -14.461 -19.628 21.140 645 HG22 THR 586 HG22 THR 586 -15.614 -20.966 21.076 646 HG23 THR 586 HG23 THR 586 -16.039 -19.418 20.356 647 H PHE 587 H PHE 587 -11.728 -21.029 17.930 648 HA PHE 587 HA PHE 587 -10.076 -19.862 19.996 649 HB2 PHE 587 HB2 PHE 587 -8.068 -20.966 19.132 650 HB3 PHE 587 HB3 PHE 587 -9.212 -22.171 19.671 651 HD1 PHE 587 HD1 PHE 587 -10.473 -23.508 17.943 652 HD2 PHE 587 HD2 PHE 587 -7.289 -20.878 16.919 653 HE1 PHE 587 HE1 PHE 587 -10.209 -24.654 15.768 654 HE2 PHE 587 HE2 PHE 587 -7.040 -22.026 14.757 655 HZ PHE 587 HZ PHE 587 -8.496 -23.910 14.192 656 H PHE 588 H PHE 588 -8.181 -18.735 18.714 657 HA PHE 588 HA PHE 588 -9.489 -17.429 16.435 658 HB2 PHE 588 HB2 PHE 588 -7.789 -16.132 18.605 659 HB3 PHE 588 HB3 PHE 588 -8.315 -15.333 17.133 660 HD1 PHE 588 HD2 PHE 588 -9.594 -17.040 20.181 661 HD2 PHE 588 HD1 PHE 588 -10.340 -14.211 17.093 662 HE1 PHE 588 HE2 PHE 588 -11.670 -16.355 21.326 663 HE2 PHE 588 HE1 PHE 588 -12.410 -13.518 18.222 664 HZ PHE 588 HZ PHE 588 -13.074 -14.587 20.343 665 H LEU 589 H LEU 589 -8.127 -16.698 14.837 666 HA LEU 589 HA LEU 589 -5.453 -17.929 14.860 667 HB2 LEU 589 HB2 LEU 589 -7.504 -18.567 13.150 668 HB3 LEU 589 HB3 LEU 589 -6.734 -17.260 12.284 669 HG LEU 589 HG LEU 589 -5.903 -19.323 11.429 670 HD11 LEU 589 HD11 LEU 589 -4.237 -17.593 11.508 671 HD12 LEU 589 HD12 LEU 589 -3.494 -19.161 11.836 672 HD13 LEU 589 HD13 LEU 589 -3.818 -18.044 13.159 673 HD21 LEU 589 HD21 LEU 589 -4.692 -20.930 12.860 674 HD22 LEU 589 HD22 LEU 589 -6.412 -20.786 13.218 675 HD23 LEU 589 HD23 LEU 589 -5.231 -20.011 14.270 676 H GLU 590 H GLU 590 -3.903 -16.423 14.707 677 HA GLU 590 HA GLU 590 -4.662 -13.889 13.480 678 HB2 GLU 590 HB2 GLU 590 -4.545 -13.517 15.859 679 HB3 GLU 590 HB3 GLU 590 -2.924 -14.197 15.915 680 HG2 GLU 590 HG2 GLU 590 -2.124 -12.406 14.437 681 HG3 GLU 590 HG3 GLU 590 -3.731 -11.695 14.444 682 H ILE 591 H ILE 591 -3.498 -13.416 11.867 683 HA ILE 591 HA ILE 591 -0.966 -14.714 11.484 684 HB ILE 591 HB ILE 591 -0.996 -13.557 9.260 685 HG12 ILE 591 HG12 ILE 591 -3.793 -12.720 10.117 686 HG13 ILE 591 HG13 ILE 591 -2.436 -11.638 9.859 687 HG21 ILE 591 HG21 ILE 591 -1.769 -15.841 9.535 688 HG22 ILE 591 HG22 ILE 591 -2.717 -15.009 8.289 689 HG23 ILE 591 HG23 ILE 591 -3.386 -15.257 9.907 690 HD11 ILE 591 HD11 ILE 591 -3.979 -11.562 8.006 691 HD12 ILE 591 HD12 ILE 591 -3.828 -13.298 7.769 692 HD13 ILE 591 HD13 ILE 591 -2.441 -12.241 7.471 693 H GLY 592 H GLY 592 0.901 -13.645 11.411 694 HA2 GLY 592 HA2 GLY 592 0.945 -11.199 12.946 695 HA3 GLY 592 HA3 GLY 592 2.330 -12.186 12.497 696 H GLU 593 H GLU 593 2.648 -9.632 12.171 697 HA GLU 593 HA GLU 593 1.801 -8.633 9.688 698 HB2 GLU 593 HB2 GLU 593 4.130 -7.873 11.403 699 HB3 GLU 593 HB3 GLU 593 3.582 -6.972 10.002 700 HG2 GLU 593 HG2 GLU 593 1.504 -6.505 10.992 701 HG3 GLU 593 HG3 GLU 593 1.844 -7.571 12.356 702 HA PRO 594 HA PRO 594 4.245 -10.956 6.965 703 HB2 PRO 594 HB2 PRO 594 4.327 -9.173 4.900 704 HB3 PRO 594 HB3 PRO 594 2.931 -10.189 5.241 705 HG2 PRO 594 HG2 PRO 594 3.429 -7.347 5.963 706 HG3 PRO 594 HG3 PRO 594 1.925 -8.085 5.403 707 HD2 PRO 594 HD2 PRO 594 2.373 -7.490 7.960 708 HD3 PRO 594 HD3 PRO 594 1.426 -8.918 7.523 709 H ARG 595 H ARG 595 6.283 -11.257 6.773 710 HA ARG 595 HA ARG 595 8.096 -9.003 7.117 711 HB2 ARG 595 HB2 ARG 595 9.749 -10.698 7.949 712 HB3 ARG 595 HB3 ARG 595 8.336 -10.526 8.977 713 HG2 ARG 595 HG2 ARG 595 7.393 -12.574 7.929 714 HG3 ARG 595 HG3 ARG 595 8.894 -12.722 7.014 715 HD2 ARG 595 HD2 ARG 595 8.695 -12.739 10.024 716 HD3 ARG 595 HD3 ARG 595 8.828 -14.176 9.016 717 HE ARG 595 HE ARG 595 10.897 -12.094 8.992 718 HH11 ARG 595 HH11 ARG 595 9.976 -15.541 9.529 719 HH12 ARG 595 HH12 ARG 595 11.590 -16.034 9.647 720 HH21 ARG 595 HH21 ARG 595 13.126 -12.888 9.211 721 HH22 ARG 595 HH22 ARG 595 13.374 -14.525 9.530 722 H LEU 596 H LEU 596 9.160 -8.430 5.394 723 HA LEU 596 HA LEU 596 9.032 -9.782 2.947 724 HB2 LEU 596 HB2 LEU 596 9.388 -7.294 3.518 725 HB3 LEU 596 HB3 LEU 596 11.042 -7.737 3.833 726 HG LEU 596 HG LEU 596 10.570 -6.629 1.604 727 HD11 LEU 596 HD11 LEU 596 12.088 -8.027 0.334 728 HD12 LEU 596 HD12 LEU 596 11.878 -9.331 1.504 729 HD13 LEU 596 HD13 LEU 596 12.647 -7.822 1.994 730 HD21 LEU 596 HD21 LEU 596 9.434 -9.324 0.962 731 HD22 LEU 596 HD22 LEU 596 9.610 -7.960 -0.165 732 HD23 LEU 596 HD23 LEU 596 8.506 -7.861 1.223 733 H VAL 597 H VAL 597 10.441 -11.265 2.109 734 HA VAL 597 HA VAL 597 12.440 -12.273 3.906 735 HB VAL 597 HB VAL 597 11.800 -13.187 1.081 736 HG11 VAL 597 HG11 VAL 597 13.369 -14.548 3.283 737 HG12 VAL 597 HG12 VAL 597 14.056 -13.843 1.818 738 HG13 VAL 597 HG13 VAL 597 12.987 -15.244 1.707 739 HG21 VAL 597 HG21 VAL 597 9.897 -13.420 2.564 740 HG22 VAL 597 HG22 VAL 597 10.916 -14.253 3.741 741 HG23 VAL 597 HG23 VAL 597 10.581 -15.002 2.177 742 H GLU 598 H GLU 598 13.637 -10.499 4.055 743 HA GLU 598 HA GLU 598 14.932 -9.398 1.772 744 HB2 GLU 598 HB2 GLU 598 14.339 -7.999 3.719 745 HB3 GLU 598 HB3 GLU 598 15.437 -8.939 4.717 746 HG2 GLU 598 HG2 GLU 598 16.396 -6.788 4.020 747 HG3 GLU 598 HG3 GLU 598 17.332 -8.167 3.446 748 H MET 599 H MET 599 16.650 -10.116 0.915 749 HA MET 599 HA MET 599 18.064 -12.260 2.228 750 HB2 MET 599 HB2 MET 599 18.273 -11.230 -0.604 751 HB3 MET 599 HB3 MET 599 19.123 -12.636 0.030 752 HG2 MET 599 HG2 MET 599 17.001 -13.744 0.471 753 HG3 MET 599 HG3 MET 599 16.130 -12.336 -0.125 754 HE1 MET 599 HE1 MET 599 15.484 -15.205 -1.153 755 HE2 MET 599 HE2 MET 599 15.381 -14.932 -2.892 756 HE3 MET 599 HE3 MET 599 14.718 -13.743 -1.770 757 H SER 600 H SER 600 18.305 -8.927 1.616 758 HA SER 600 HA SER 600 21.146 -8.842 1.964 759 HB2 SER 600 HB2 SER 600 19.889 -7.040 0.722 760 HB3 SER 600 HB3 SER 600 19.093 -6.604 2.231 761 HG SER 600 HG SER 600 20.720 -5.276 2.278 762 H GLU 601 H GLU 601 21.463 -10.025 3.773 763 HA GLU 601 HA GLU 601 20.318 -9.057 6.295 764 HB2 GLU 601 HB2 GLU 601 21.443 -11.779 5.614 765 HB3 GLU 601 HB3 GLU 601 20.751 -11.315 7.160 766 HG2 GLU 601 HG2 GLU 601 18.575 -11.070 6.154 767 HG3 GLU 601 HG3 GLU 601 19.249 -11.364 4.553 768 H LYS 602 H LYS 602 21.868 -9.662 8.156 769 HA LYS 602 HA LYS 602 24.594 -9.044 7.311 770 HB2 LYS 602 HB2 LYS 602 23.310 -8.489 9.989 771 HB3 LYS 602 HB3 LYS 602 24.971 -8.114 9.560 772 HG2 LYS 602 HG2 LYS 602 24.028 -6.610 7.751 773 HG3 LYS 602 HG3 LYS 602 22.454 -6.848 8.508 774 HD2 LYS 602 HD2 LYS 602 24.912 -5.667 9.805 775 HD3 LYS 602 HD3 LYS 602 23.473 -4.792 9.286 776 HE2 LYS 602 HE2 LYS 602 22.140 -6.022 10.927 777 HE3 LYS 602 HE3 LYS 602 23.583 -6.923 11.401 778 HZ1 LYS 602 HZ1 LYS 602 23.146 -5.161 12.942 779 HZ2 LYS 602 HZ2 LYS 602 23.196 -3.995 11.718 780 HZ3 LYS 602 HZ3 LYS 602 24.583 -4.854 12.127 781 H LYS 603 H LYS 603 26.258 -10.141 8.456 782 HA LYS 603 HA LYS 603 25.428 -12.836 9.152 783 HB2 LYS 603 HB2 LYS 603 27.807 -13.394 9.037 784 HB3 LYS 603 HB3 LYS 603 27.301 -12.555 7.582 785 HG2 LYS 603 HG2 LYS 603 28.332 -10.491 8.411 786 HG3 LYS 603 HG3 LYS 603 28.813 -11.330 9.887 787 HD2 LYS 603 HD2 LYS 603 30.183 -12.872 8.554 788 HD3 LYS 603 HD3 LYS 603 29.710 -12.017 7.086 789 HE2 LYS 603 HE2 LYS 603 30.750 -9.971 7.944 790 HE3 LYS 603 HE3 LYS 603 31.216 -10.832 9.411 791 HZ1 LYS 603 HZ1 LYS 603 32.165 -11.450 6.663 792 HZ2 LYS 603 HZ2 LYS 603 32.607 -12.295 8.040 793 HZ3 LYS 603 HZ3 LYS 603 33.059 -10.690 7.862 794 H GLY 604 H GLY 604 26.508 -13.856 11.077 795 HA2 GLY 604 HA2 GLY 604 26.212 -12.210 13.380 796 HA3 GLY 604 HA3 GLY 604 26.841 -13.865 13.341 797 H GLY 605 H GLY 605 28.983 -14.115 12.356 798 HA2 GLY 605 HA2 GLY 605 31.195 -13.625 12.139 799 HA3 GLY 605 HA3 GLY 605 30.733 -11.936 12.004 800 H PHE 606 H PHE 606 29.787 -13.660 14.846 801 HA PHE 606 HA PHE 606 31.659 -12.028 16.319 802 HB2 PHE 606 HB2 PHE 606 29.355 -13.737 17.311 803 HB3 PHE 606 HB3 PHE 606 30.402 -12.772 18.335 804 HD1 PHE 606 HD1 PHE 606 30.392 -10.273 18.074 805 HD2 PHE 606 HD2 PHE 606 27.497 -12.779 16.231 806 HE1 PHE 606 HE1 PHE 606 28.895 -8.339 17.802 807 HE2 PHE 606 HE2 PHE 606 25.998 -10.854 15.952 808 HZ PHE 606 HZ PHE 606 26.695 -8.628 16.737 809 H THR 607 H THR 607 33.575 -12.943 16.193 810 HA THR 607 HA THR 607 33.965 -15.748 16.443 811 HB THR 607 HB THR 607 35.981 -13.481 16.665 812 HG1 THR 607 HG1 THR 607 35.164 -15.050 14.433 813 HG21 THR 607 HG21 THR 607 36.798 -15.659 17.508 814 HG22 THR 607 HG22 THR 607 37.615 -15.205 16.015 815 HG23 THR 607 HG23 THR 607 36.337 -16.417 15.983 816 H ILE 608 H ILE 608 33.326 -16.516 18.307 817 HA ILE 608 HA ILE 608 33.872 -15.022 20.708 818 HB ILE 608 HB ILE 608 32.306 -16.694 21.812 819 HG12 ILE 608 HG12 ILE 608 30.632 -17.770 20.201 820 HG13 ILE 608 HG13 ILE 608 31.782 -17.463 18.918 821 HG21 ILE 608 HG21 ILE 608 31.613 -14.456 21.278 822 HG22 ILE 608 HG22 ILE 608 30.287 -15.572 20.943 823 HG23 ILE 608 HG23 ILE 608 31.253 -14.926 19.619 824 HD11 ILE 608 HD11 ILE 608 31.912 -19.755 19.638 825 HD12 ILE 608 HD12 ILE 608 32.179 -19.251 21.305 826 HD13 ILE 608 HD13 ILE 608 33.400 -18.917 20.080 827 H THR 609 H THR 609 34.679 -16.008 22.566 828 HA THR 609 HA THR 609 36.605 -18.123 21.973 829 HB THR 609 HB THR 609 37.634 -15.955 22.605 830 HG1 THR 609 HG1 THR 609 39.059 -16.909 23.677 831 HG21 THR 609 HG21 THR 609 36.035 -16.182 25.160 832 HG22 THR 609 HG22 THR 609 35.833 -14.963 23.900 833 HG23 THR 609 HG23 THR 609 37.307 -14.998 24.865 834 H GLU 610 H GLU 610 36.821 -19.754 23.803 835 HA GLU 610 HA GLU 610 34.167 -20.064 24.797 836 HB2 GLU 610 HB2 GLU 610 34.770 -22.389 25.519 837 HB3 GLU 610 HB3 GLU 610 34.800 -22.070 23.797 838 HG2 GLU 610 HG2 GLU 610 37.222 -21.972 23.853 839 HG3 GLU 610 HG3 GLU 610 37.198 -22.239 25.600 840 H GLU 611 H GLU 611 34.441 -18.312 25.999 841 HA GLU 611 HA GLU 611 35.212 -18.932 28.757 842 HB2 GLU 611 HB2 GLU 611 34.811 -16.255 27.375 843 HB3 GLU 611 HB3 GLU 611 35.177 -16.458 29.078 844 HG2 GLU 611 HG2 GLU 611 36.991 -17.329 26.840 845 HG3 GLU 611 HG3 GLU 611 37.115 -15.786 27.681 846 H TYR 612 H TYR 612 33.401 -19.537 29.798 847 HA TYR 612 HA TYR 612 30.892 -18.773 28.644 848 HB2 TYR 612 HB2 TYR 612 29.896 -20.392 30.438 849 HB3 TYR 612 HB3 TYR 612 30.735 -21.043 29.040 850 HD1 TYR 612 HD2 TYR 612 32.953 -22.048 29.286 851 HD2 TYR 612 HD1 TYR 612 30.790 -20.658 32.667 852 HE1 TYR 612 HE2 TYR 612 34.422 -23.354 30.753 853 HE2 TYR 612 HE1 TYR 612 32.251 -21.969 34.144 854 HH TYR 612 HH TYR 612 35.153 -23.229 33.097 855 H ASP 613 H ASP 613 31.570 -16.727 29.179 856 HA ASP 613 HA ASP 613 29.728 -15.241 30.360 857 HB2 ASP 613 HB2 ASP 613 30.425 -16.110 32.641 858 HB3 ASP 613 HB3 ASP 613 32.031 -15.441 32.354 859 H ASP 614 H ASP 614 30.149 -13.812 28.798 860 HA ASP 614 HA ASP 614 32.703 -12.418 28.919 861 HB2 ASP 614 HB2 ASP 614 33.032 -14.009 27.111 862 HB3 ASP 614 HB3 ASP 614 31.500 -13.539 26.378 863 H LYS 615 H LYS 615 32.531 -10.264 28.571 864 HA LYS 615 HA LYS 615 29.897 -9.252 28.954 865 HB2 LYS 615 HB2 LYS 615 32.401 -7.666 28.431 866 HB3 LYS 615 HB3 LYS 615 30.908 -7.076 29.123 867 HG2 LYS 615 HG2 LYS 615 32.860 -8.983 30.398 868 HG3 LYS 615 HG3 LYS 615 32.625 -7.302 30.831 869 HD2 LYS 615 HD2 LYS 615 31.386 -8.303 32.496 870 HD3 LYS 615 HD3 LYS 615 30.131 -8.202 31.261 871 HE2 LYS 615 HE2 LYS 615 30.536 -10.481 30.603 872 HE3 LYS 615 HE3 LYS 615 31.928 -10.584 31.668 873 HZ1 LYS 615 HZ1 LYS 615 29.064 -10.463 32.418 874 HZ2 LYS 615 HZ2 LYS 615 30.307 -10.142 33.509 875 HZ3 LYS 615 HZ3 LYS 615 30.239 -11.653 32.753 876 H GLN 616 H GLN 616 28.555 -9.162 27.350 877 HA GLN 616 HA GLN 616 29.363 -7.842 24.885 878 HB2 GLN 616 HB2 GLN 616 29.346 -10.274 24.448 879 HB3 GLN 616 HB3 GLN 616 27.706 -10.371 25.073 880 HG2 GLN 616 HG2 GLN 616 26.979 -8.849 23.254 881 HG3 GLN 616 HG3 GLN 616 28.609 -8.916 22.593 882 HE21 GLN 616 HE21 GLN 616 25.695 -10.655 23.164 883 HE22 GLN 616 HE22 GLN 616 26.012 -11.955 22.071 884 HA PRO 617 HA PRO 617 25.819 -5.539 26.444 885 HB2 PRO 617 HB2 PRO 617 26.038 -4.284 23.766 886 HB3 PRO 617 HB3 PRO 617 25.982 -3.518 25.355 887 HG2 PRO 617 HG2 PRO 617 28.259 -3.669 23.965 888 HG3 PRO 617 HG3 PRO 617 28.234 -3.820 25.729 889 HD2 PRO 617 HD2 PRO 617 28.551 -5.933 23.650 890 HD3 PRO 617 HD3 PRO 617 29.290 -5.804 25.262 891 H LEU 618 H LEU 618 23.952 -6.646 26.365 892 HA LEU 618 HA LEU 618 23.152 -7.945 23.968 893 HB2 LEU 618 HB2 LEU 618 21.171 -8.764 25.136 894 HB3 LEU 618 HB3 LEU 618 22.584 -9.011 26.113 895 HG LEU 618 HG LEU 618 20.846 -8.502 27.573 896 HD11 LEU 618 HD11 LEU 618 22.399 -5.973 27.323 897 HD12 LEU 618 HD12 LEU 618 22.811 -7.404 28.269 898 HD13 LEU 618 HD13 LEU 618 21.402 -6.434 28.701 899 HD21 LEU 618 HD21 LEU 618 19.185 -7.620 26.065 900 HD22 LEU 618 HD22 LEU 618 20.090 -6.115 25.896 901 HD23 LEU 618 HD23 LEU 618 19.366 -6.536 27.447 902 H THR 619 H THR 619 21.645 -7.399 22.506 903 HA THR 619 HA THR 619 20.754 -4.634 22.728 904 HB THR 619 HB THR 619 21.110 -6.275 20.207 905 HG1 THR 619 HG1 THR 619 22.833 -4.900 21.808 906 HG21 THR 619 HG21 THR 619 20.907 -4.097 19.093 907 HG22 THR 619 HG22 THR 619 20.692 -3.305 20.653 908 HG23 THR 619 HG23 THR 619 19.468 -4.426 20.056 909 H SER 620 H SER 620 18.705 -4.490 23.313 910 HA SER 620 HA SER 620 16.803 -6.534 22.704 911 HB2 SER 620 HB2 SER 620 15.436 -4.658 23.977 912 HB3 SER 620 HB3 SER 620 16.556 -5.716 24.851 913 HG SER 620 HG SER 620 16.865 -3.011 24.075 914 H LYS 621 H LYS 621 14.509 -4.979 22.248 915 HA LYS 621 HA LYS 621 14.985 -4.168 19.532 916 HB2 LYS 621 HB2 LYS 621 12.972 -5.503 20.238 917 HB3 LYS 621 HB3 LYS 621 12.420 -4.088 21.119 918 HG2 LYS 621 HG2 LYS 621 12.278 -2.835 19.020 919 HG3 LYS 621 HG3 LYS 621 12.826 -4.258 18.135 920 HD2 LYS 621 HD2 LYS 621 10.424 -4.132 17.966 921 HD3 LYS 621 HD3 LYS 621 10.847 -5.488 19.011 922 HE2 LYS 621 HE2 LYS 621 10.427 -4.062 20.987 923 HE3 LYS 621 HE3 LYS 621 9.949 -2.754 19.913 924 HZ1 LYS 621 HZ1 LYS 621 8.058 -3.927 20.778 925 HZ2 LYS 621 HZ2 LYS 621 8.619 -5.386 20.145 926 HZ3 LYS 621 HZ3 LYS 621 8.150 -4.140 19.108 927 H GLU 622 H GLU 622 16.338 -2.469 20.001 928 HA GLU 622 HA GLU 622 15.452 -0.174 21.495 929 HB2 GLU 622 HB2 GLU 622 17.870 -0.502 19.708 930 HB3 GLU 622 HB3 GLU 622 17.607 0.784 20.876 931 HG2 GLU 622 HG2 GLU 622 17.992 -2.143 21.494 932 HG3 GLU 622 HG3 GLU 622 19.169 -0.857 21.744 933 H GLU 623 H GLU 623 15.356 1.974 20.511 934 HA GLU 623 HA GLU 623 13.800 1.867 18.127 935 HB2 GLU 623 HB2 GLU 623 14.661 4.187 19.823 936 HB3 GLU 623 HB3 GLU 623 13.685 4.368 18.373 937 HG2 GLU 623 HG2 GLU 623 11.972 2.918 19.377 938 HG3 GLU 623 HG3 GLU 623 12.951 2.814 20.839 939 H GLU 624 H GLU 624 15.320 1.023 16.768 940 HA GLU 624 HA GLU 624 17.503 2.705 15.793 941 HB2 GLU 624 HB2 GLU 624 16.520 -0.012 14.928 942 HB3 GLU 624 HB3 GLU 624 17.962 0.779 14.322 943 HG2 GLU 624 HG2 GLU 624 18.972 0.620 16.527 944 HG3 GLU 624 HG3 GLU 624 17.497 -0.121 17.156 945 H GLU 625 H GLU 625 17.487 2.155 13.173 946 HA GLU 625 HA GLU 625 15.384 3.775 12.054 947 HB2 GLU 625 HB2 GLU 625 16.748 3.536 10.011 948 HB3 GLU 625 HB3 GLU 625 17.707 4.052 11.398 949 HG2 GLU 625 HG2 GLU 625 18.279 1.564 11.673 950 HG3 GLU 625 HG3 GLU 625 17.620 1.377 10.056 951 H ARG 626 H ARG 626 14.565 1.154 13.072 952 HA ARG 626 HA ARG 626 14.385 -0.817 11.037 953 HB2 ARG 626 HB2 ARG 626 12.688 -0.490 13.510 954 HB3 ARG 626 HB3 ARG 626 12.668 -1.893 12.462 955 HG2 ARG 626 HG2 ARG 626 15.068 -0.926 13.994 956 HG3 ARG 626 HG3 ARG 626 13.994 -2.224 14.509 957 HD2 ARG 626 HD2 ARG 626 14.576 -3.482 12.472 958 HD3 ARG 626 HD3 ARG 626 15.691 -2.193 12.014 959 HE ARG 626 HE ARG 626 16.748 -2.742 14.315 960 HH11 ARG 626 HH11 ARG 626 15.369 -5.186 12.108 961 HH12 ARG 626 HH12 ARG 626 16.394 -6.409 12.680 962 HH21 ARG 626 HH21 ARG 626 18.073 -4.418 15.034 963 HH22 ARG 626 HH22 ARG 626 17.946 -5.995 14.410 964 H ARG 627 H ARG 627 12.155 1.798 11.986 965 HA ARG 627 HA ARG 627 10.054 0.750 10.407 966 HB2 ARG 627 HB2 ARG 627 9.857 2.181 12.529 967 HB3 ARG 627 HB3 ARG 627 10.293 3.549 11.529 968 HG2 ARG 627 HG2 ARG 627 7.906 1.825 10.909 969 HG3 ARG 627 HG3 ARG 627 7.826 3.174 12.034 970 HD2 ARG 627 HD2 ARG 627 8.779 3.382 9.214 971 HD3 ARG 627 HD3 ARG 627 7.097 3.704 9.679 972 HE ARG 627 HE ARG 627 9.189 5.173 11.044 973 HH11 ARG 627 HH11 ARG 627 6.703 5.260 8.506 974 HH12 ARG 627 HH12 ARG 627 6.663 6.950 8.425 975 HH21 ARG 627 HH21 ARG 627 9.112 7.514 10.931 976 HH22 ARG 627 HH22 ARG 627 8.049 8.256 9.825 977 H ILE 628 H ILE 628 12.779 2.790 9.900 978 HA ILE 628 HA ILE 628 11.897 4.086 7.543 979 HB ILE 628 HB ILE 628 14.740 3.410 8.409 980 HG12 ILE 628 HG12 ILE 628 13.085 5.914 8.758 981 HG13 ILE 628 HG13 ILE 628 13.537 4.789 10.030 982 HG21 ILE 628 HG21 ILE 628 13.777 5.402 6.342 983 HG22 ILE 628 HG22 ILE 628 14.636 3.899 6.007 984 HG23 ILE 628 HG23 ILE 628 15.447 5.203 6.874 985 HD11 ILE 628 HD11 ILE 628 15.883 5.396 9.730 986 HD12 ILE 628 HD12 ILE 628 14.886 6.809 10.082 987 HD13 ILE 628 HD13 ILE 628 15.426 6.500 8.433 988 H ALA 629 H ALA 629 13.299 0.964 8.195 989 HA ALA 629 HA ALA 629 13.505 0.262 5.412 990 HB1 ALA 629 HB1 ALA 629 14.020 -1.989 6.231 991 HB2 ALA 629 HB2 ALA 629 13.545 -1.514 7.859 992 HB3 ALA 629 HB3 ALA 629 14.968 -0.792 7.118 993 H GLU 630 H GLU 630 11.403 -0.512 8.113 994 HA GLU 630 HA GLU 630 9.649 -2.221 6.757 995 HB2 GLU 630 HB2 GLU 630 9.278 -0.686 9.306 996 HB3 GLU 630 HB3 GLU 630 8.189 -1.932 8.721 997 HG2 GLU 630 HG2 GLU 630 11.109 -2.424 9.210 998 HG3 GLU 630 HG3 GLU 630 9.881 -2.661 10.445 999 H MET 631 H MET 631 9.808 1.142 6.518 1000 HA MET 631 HA MET 631 7.016 1.461 5.994 1001 HB2 MET 631 HB2 MET 631 7.499 3.752 5.257 1002 HB3 MET 631 HB3 MET 631 8.207 3.400 6.814 1003 HG2 MET 631 HG2 MET 631 9.723 4.704 5.666 1004 HG3 MET 631 HG3 MET 631 10.399 3.083 5.613 1005 HE1 MET 631 HE1 MET 631 11.349 5.554 3.740 1006 HE2 MET 631 HE2 MET 631 11.597 4.676 2.226 1007 HE3 MET 631 HE3 MET 631 12.069 3.949 3.765 1008 H GLY 632 H GLY 632 9.639 0.358 4.223 1009 HA2 GLY 632 HA2 GLY 632 8.030 0.389 1.758 1010 HA3 GLY 632 HA3 GLY 632 9.797 0.378 1.781 1011 H ARG 633 H ARG 633 7.409 -1.413 3.654 1012 HA ARG 633 HA ARG 633 8.436 -3.934 2.639 1013 HB2 ARG 633 HB2 ARG 633 8.119 -3.102 5.526 1014 HB3 ARG 633 HB3 ARG 633 8.292 -4.773 5.046 1015 HG2 ARG 633 HG2 ARG 633 10.315 -2.609 4.521 1016 HG3 ARG 633 HG3 ARG 633 10.389 -3.766 5.855 1017 HD2 ARG 633 HD2 ARG 633 10.527 -5.600 4.280 1018 HD3 ARG 633 HD3 ARG 633 10.407 -4.473 2.932 1019 HE ARG 633 HE ARG 633 12.539 -3.760 3.311 1020 HH11 ARG 633 HH11 ARG 633 11.665 -6.081 5.873 1021 HH12 ARG 633 HH12 ARG 633 13.280 -6.473 6.251 1022 HH21 ARG 633 HH21 ARG 633 14.778 -4.366 3.845 1023 HH22 ARG 633 HH22 ARG 633 15.049 -5.492 5.094 1024 HA PRO 634 HA PRO 634 4.178 -5.078 2.478 1025 HB2 PRO 634 HB2 PRO 634 4.197 -7.596 3.556 1026 HB3 PRO 634 HB3 PRO 634 4.702 -7.230 1.903 1027 HG2 PRO 634 HG2 PRO 634 6.382 -7.575 4.354 1028 HG3 PRO 634 HG3 PRO 634 6.647 -8.212 2.719 1029 HD2 PRO 634 HD2 PRO 634 7.949 -6.054 3.574 1030 HD3 PRO 634 HD3 PRO 634 7.361 -6.149 1.901 1031 H ILE 635 H ILE 635 2.421 -4.788 3.694 1032 HA ILE 635 HA ILE 635 2.619 -5.084 6.574 1033 HB ILE 635 HB ILE 635 1.329 -3.138 6.930 1034 HG12 ILE 635 HG12 ILE 635 -0.249 -3.033 5.121 1035 HG13 ILE 635 HG13 ILE 635 0.678 -1.540 5.124 1036 HG21 ILE 635 HG21 ILE 635 3.644 -2.641 6.789 1037 HG22 ILE 635 HG22 ILE 635 2.765 -1.302 6.039 1038 HG23 ILE 635 HG23 ILE 635 3.562 -2.507 5.035 1039 HD11 ILE 635 HD11 ILE 635 2.048 -2.452 3.310 1040 HD12 ILE 635 HD12 ILE 635 0.327 -2.267 2.891 1041 HD13 ILE 635 HD13 ILE 635 0.975 -3.863 3.334 1042 H LEU 636 H LEU 636 0.099 -4.860 7.324 1043 HA LEU 636 HA LEU 636 -1.174 -6.725 5.553 1044 HB2 LEU 636 HB2 LEU 636 -2.423 -7.555 7.661 1045 HB3 LEU 636 HB3 LEU 636 -0.772 -8.045 7.394 1046 HG LEU 636 HG LEU 636 -0.038 -6.335 9.059 1047 HD11 LEU 636 HD11 LEU 636 -1.890 -4.782 8.907 1048 HD12 LEU 636 HD12 LEU 636 -1.669 -5.339 10.567 1049 HD13 LEU 636 HD13 LEU 636 -2.983 -5.988 9.584 1050 HD21 LEU 636 HD21 LEU 636 -0.772 -7.579 11.013 1051 HD22 LEU 636 HD22 LEU 636 -0.382 -8.674 9.683 1052 HD23 LEU 636 HD23 LEU 636 -2.064 -8.314 10.069 1053 H GLY 637 H GLY 637 -3.722 -6.864 6.553 1054 HA2 GLY 637 HA2 GLY 637 -4.803 -4.544 5.278 1055 HA3 GLY 637 HA3 GLY 637 -5.690 -5.927 5.882 1056 H GLU 638 H GLU 638 -7.254 -4.477 6.626 1057 HA GLU 638 HA GLU 638 -6.649 -2.374 8.489 1058 HB2 GLU 638 HB2 GLU 638 -8.468 -2.378 6.726 1059 HB3 GLU 638 HB3 GLU 638 -9.322 -3.548 7.711 1060 HG2 GLU 638 HG2 GLU 638 -10.236 -1.359 8.065 1061 HG3 GLU 638 HG3 GLU 638 -9.427 -1.902 9.533 1062 H HIS 639 H HIS 639 -8.328 -5.484 8.564 1063 HA HIS 639 HA HIS 639 -7.828 -5.711 11.456 1064 HB2 HIS 639 HB2 HIS 639 -10.390 -6.345 9.968 1065 HB3 HIS 639 HB3 HIS 639 -10.000 -7.116 11.491 1066 HD1 HIS 639 HD1 HIS 639 -11.954 -6.084 12.799 1067 HD2 HIS 639 HD2 HIS 639 -9.537 -3.268 10.951 1068 HE1 HIS 639 HE1 HIS 639 -12.729 -3.854 13.647 1069 H THR 640 H THR 640 -6.834 -7.584 11.933 1070 HA THR 640 HA THR 640 -7.024 -9.742 9.980 1071 HB THR 640 HB THR 640 -4.624 -10.298 10.601 1072 HG1 THR 640 HG1 THR 640 -4.679 -8.747 12.349 1073 HG21 THR 640 HG21 THR 640 -5.098 -7.743 9.058 1074 HG22 THR 640 HG22 THR 640 -5.322 -9.378 8.446 1075 HG23 THR 640 HG23 THR 640 -3.705 -8.830 8.893 1076 H LYS 641 H LYS 641 -8.371 -10.999 11.116 1077 HA LYS 641 HA LYS 641 -7.300 -12.470 13.298 1078 HB2 LYS 641 HB2 LYS 641 -8.197 -10.412 14.490 1079 HB3 LYS 641 HB3 LYS 641 -9.783 -10.802 13.853 1080 HG2 LYS 641 HG2 LYS 641 -9.647 -13.008 15.044 1081 HG3 LYS 641 HG3 LYS 641 -8.158 -12.448 15.795 1082 HD2 LYS 641 HD2 LYS 641 -10.857 -11.108 16.057 1083 HD3 LYS 641 HD3 LYS 641 -10.149 -12.178 17.256 1084 HE2 LYS 641 HE2 LYS 641 -8.964 -9.584 16.325 1085 HE3 LYS 641 HE3 LYS 641 -9.892 -9.782 17.809 1086 HZ1 LYS 641 HZ1 LYS 641 -7.266 -11.055 17.189 1087 HZ2 LYS 641 HZ2 LYS 641 -8.166 -11.329 18.603 1088 HZ3 LYS 641 HZ3 LYS 641 -7.553 -9.815 18.282 1089 H LEU 642 H LEU 642 -8.465 -14.376 13.521 1090 HA LEU 642 HA LEU 642 -10.880 -14.629 11.906 1091 HB2 LEU 642 HB2 LEU 642 -8.956 -15.612 10.757 1092 HB3 LEU 642 HB3 LEU 642 -8.616 -16.566 12.186 1093 HG LEU 642 HG LEU 642 -10.904 -17.621 11.869 1094 HD11 LEU 642 HD11 LEU 642 -11.835 -17.563 9.652 1095 HD12 LEU 642 HD12 LEU 642 -10.669 -16.327 9.184 1096 HD13 LEU 642 HD13 LEU 642 -11.880 -15.976 10.418 1097 HD21 LEU 642 HD21 LEU 642 -10.076 -19.067 10.085 1098 HD22 LEU 642 HD22 LEU 642 -8.933 -18.815 11.404 1099 HD23 LEU 642 HD23 LEU 642 -8.697 -17.973 9.872 1100 H GLU 643 H GLU 643 -12.434 -15.366 13.126 1101 HA GLU 643 HA GLU 643 -11.823 -16.641 15.671 1102 HB2 GLU 643 HB2 GLU 643 -13.430 -14.728 15.601 1103 HB3 GLU 643 HB3 GLU 643 -14.413 -15.642 14.488 1104 HG2 GLU 643 HG2 GLU 643 -14.978 -17.233 16.148 1105 HG3 GLU 643 HG3 GLU 643 -13.797 -16.562 17.270 1106 H VAL 644 H VAL 644 -11.597 -18.807 15.495 1107 HA VAL 644 HA VAL 644 -13.094 -20.180 13.389 1108 HB VAL 644 HB VAL 644 -10.813 -21.250 15.065 1109 HG11 VAL 644 HG11 VAL 644 -12.346 -22.937 14.175 1110 HG12 VAL 644 HG12 VAL 644 -10.738 -23.063 13.486 1111 HG13 VAL 644 HG13 VAL 644 -12.047 -22.347 12.537 1112 HG21 VAL 644 HG21 VAL 644 -9.999 -19.429 13.640 1113 HG22 VAL 644 HG22 VAL 644 -10.727 -20.185 12.227 1114 HG23 VAL 644 HG23 VAL 644 -9.405 -20.984 13.067 1115 H ILE 645 H ILE 645 -14.860 -21.149 14.005 1116 HA ILE 645 HA ILE 645 -15.168 -22.039 16.788 1117 HB ILE 645 HB ILE 645 -17.249 -21.677 14.622 1118 HG12 ILE 645 HG12 ILE 645 -16.717 -19.817 16.935 1119 HG13 ILE 645 HG13 ILE 645 -16.049 -19.562 15.328 1120 HG21 ILE 645 HG21 ILE 645 -18.849 -21.775 16.481 1121 HG22 ILE 645 HG22 ILE 645 -17.520 -22.041 17.608 1122 HG23 ILE 645 HG23 ILE 645 -17.887 -23.252 16.379 1123 HD11 ILE 645 HD11 ILE 645 -18.269 -19.443 14.411 1124 HD12 ILE 645 HD12 ILE 645 -18.039 -18.240 15.682 1125 HD13 ILE 645 HD13 ILE 645 -18.971 -19.711 16.008 1126 H ILE 646 H ILE 646 -15.091 -24.130 17.141 1127 HA ILE 646 HA ILE 646 -15.131 -26.012 14.916 1128 HB ILE 646 HB ILE 646 -14.392 -26.452 17.837 1129 HG12 ILE 646 HG12 ILE 646 -12.551 -26.242 15.444 1130 HG13 ILE 646 HG13 ILE 646 -12.811 -24.948 16.607 1131 HG21 ILE 646 HG21 ILE 646 -15.218 -28.462 16.800 1132 HG22 ILE 646 HG22 ILE 646 -13.478 -28.585 17.074 1133 HG23 ILE 646 HG23 ILE 646 -14.095 -28.255 15.455 1134 HD11 ILE 646 HD11 ILE 646 -11.915 -26.373 18.382 1135 HD12 ILE 646 HD12 ILE 646 -10.758 -26.130 17.080 1136 HD13 ILE 646 HD13 ILE 646 -11.633 -27.659 17.206 1137 H GLU 647 H GLU 647 -17.066 -26.709 14.507 1138 HA GLU 647 HA GLU 647 -18.821 -27.376 16.740 1139 HB2 GLU 647 HB2 GLU 647 -20.725 -26.937 15.154 1140 HB3 GLU 647 HB3 GLU 647 -19.816 -25.523 15.668 1141 HG2 GLU 647 HG2 GLU 647 -18.632 -25.498 13.546 1142 HG3 GLU 647 HG3 GLU 647 -19.510 -26.938 13.034 1143 H GLU 648 H GLU 648 -19.921 -29.269 16.604 1144 HA GLU 648 HA GLU 648 -18.609 -31.240 15.045 1145 HB2 GLU 648 HB2 GLU 648 -19.896 -32.842 16.291 1146 HB3 GLU 648 HB3 GLU 648 -19.221 -31.664 17.391 1147 HG2 GLU 648 HG2 GLU 648 -22.059 -31.617 16.391 1148 HG3 GLU 648 HG3 GLU 648 -21.579 -32.377 17.904 1149 H SER 649 H SER 649 -19.271 -32.014 13.207 1150 HA SER 649 HA SER 649 -22.024 -31.830 12.425 1151 HB2 SER 649 HB2 SER 649 -19.785 -30.544 10.842 1152 HB3 SER 649 HB3 SER 649 -21.443 -30.755 10.254 1153 HG SER 649 HG SER 649 -21.380 -29.577 12.688 1154 H TYR 650 H TYR 650 -22.090 -34.007 12.438 1155 HA TYR 650 HA TYR 650 -20.075 -35.558 10.996 1156 HB2 TYR 650 HB2 TYR 650 -22.527 -36.549 12.447 1157 HB3 TYR 650 HB3 TYR 650 -21.096 -37.473 12.009 1158 HD1 TYR 650 HD1 TYR 650 -18.890 -36.776 13.116 1159 HD2 TYR 650 HD2 TYR 650 -22.696 -35.573 14.521 1160 HE1 TYR 650 HE1 TYR 650 -17.907 -36.268 15.312 1161 HE2 TYR 650 HE2 TYR 650 -21.733 -35.058 16.735 1162 HH TYR 650 HH TYR 650 -18.342 -34.918 17.240 1163 H GLU 651 H GLU 651 -22.938 -34.012 10.458 1164 HA GLU 651 HA GLU 651 -24.218 -35.973 8.871 1165 HB2 GLU 651 HB2 GLU 651 -24.837 -33.048 9.168 1166 HB3 GLU 651 HB3 GLU 651 -25.881 -34.254 8.421 1167 HG2 GLU 651 HG2 GLU 651 -24.980 -34.232 11.286 1168 HG3 GLU 651 HG3 GLU 651 -26.583 -33.789 10.704 1169 H PHE 652 H PHE 652 -22.183 -33.217 8.199 1170 HA PHE 652 HA PHE 652 -22.705 -33.413 5.368 1171 HB2 PHE 652 HB2 PHE 652 -20.856 -31.574 6.901 1172 HB3 PHE 652 HB3 PHE 652 -21.094 -31.494 5.164 1173 HD1 PHE 652 HD1 PHE 652 -23.619 -31.307 4.420 1174 HD2 PHE 652 HD2 PHE 652 -22.121 -30.204 8.243 1175 HE1 PHE 652 HE1 PHE 652 -25.559 -29.833 4.751 1176 HE2 PHE 652 HE2 PHE 652 -24.056 -28.729 8.576 1177 HZ PHE 652 HZ PHE 652 -25.780 -28.544 6.833 1178 H LYS 653 H LYS 653 -21.992 -35.492 5.022 1179 HA LYS 653 HA LYS 653 -19.219 -35.987 5.573 1180 HB2 LYS 653 HB2 LYS 653 -21.341 -37.934 4.717 1181 HB3 LYS 653 HB3 LYS 653 -19.650 -38.370 4.954 1182 HG2 LYS 653 HG2 LYS 653 -19.804 -37.574 7.291 1183 HG3 LYS 653 HG3 LYS 653 -21.514 -37.248 7.037 1184 HD2 LYS 653 HD2 LYS 653 -20.169 -39.943 6.863 1185 HD3 LYS 653 HD3 LYS 653 -21.152 -39.367 8.204 1186 HE2 LYS 653 HE2 LYS 653 -23.073 -39.175 6.676 1187 HE3 LYS 653 HE3 LYS 653 -22.079 -39.831 5.376 1188 HZ1 LYS 653 HZ1 LYS 653 -22.831 -41.219 7.884 1189 HZ2 LYS 653 HZ2 LYS 653 -21.807 -41.861 6.728 1190 HZ3 LYS 653 HZ3 LYS 653 -23.431 -41.547 6.352 1191 H SER 654 H SER 654 -18.776 -34.415 4.157 1192 HA SER 654 HA SER 654 -17.427 -35.580 1.923 1193 HB2 SER 654 HB2 SER 654 -19.103 -33.074 1.476 1194 HB3 SER 654 HB3 SER 654 -18.089 -33.884 0.302 1195 HG SER 654 HG SER 654 -19.852 -35.634 1.297 1196 H THR 655 H THR 655 -18.365 -32.692 3.777 1197 HA THR 655 HA THR 655 -15.807 -31.520 3.776 1198 HB THR 655 HB THR 655 -18.074 -31.290 5.795 1199 HG1 THR 655 HG1 THR 655 -17.519 -29.945 3.356 1200 HG21 THR 655 HG21 THR 655 -15.862 -29.348 5.051 1201 HG22 THR 655 HG22 THR 655 -15.938 -30.279 6.545 1202 HG23 THR 655 HG23 THR 655 -17.153 -29.043 6.214 1203 H VAL 656 H VAL 656 -17.566 -33.785 5.890 1204 HA VAL 656 HA VAL 656 -15.379 -34.341 7.624 1205 HB VAL 656 HB VAL 656 -17.788 -36.068 6.900 1206 HG11 VAL 656 HG11 VAL 656 -15.994 -37.442 7.794 1207 HG12 VAL 656 HG12 VAL 656 -17.315 -37.317 8.960 1208 HG13 VAL 656 HG13 VAL 656 -15.845 -36.373 9.186 1209 HG21 VAL 656 HG21 VAL 656 -18.704 -35.330 9.050 1210 HG22 VAL 656 HG22 VAL 656 -18.448 -33.983 7.939 1211 HG23 VAL 656 HG23 VAL 656 -17.315 -34.263 9.263 1212 H ASP 657 H ASP 657 -13.550 -35.156 6.903 1213 HA ASP 657 HA ASP 657 -13.551 -37.307 4.945 1214 HB2 ASP 657 HB2 ASP 657 -13.407 -35.136 3.666 1215 HB3 ASP 657 HB3 ASP 657 -11.931 -34.776 4.552 Start of MODEL 19 1 H HIS 501 H HIS 501 4.473 1.171 0.291 2 HA HIS 501 HA HIS 501 3.267 -0.069 2.049 3 HB2 HIS 501 HB2 HIS 501 0.991 0.698 0.227 4 HB3 HIS 501 HB3 HIS 501 0.894 -0.637 1.366 5 HD1 HIS 501 HD1 HIS 501 0.562 3.032 1.138 6 HD2 HIS 501 HD2 HIS 501 1.020 0.146 4.078 7 HE1 HIS 501 HE1 HIS 501 -0.127 4.117 3.296 8 H ALA 502 H ALA 502 2.955 -2.296 1.686 9 HA ALA 502 HA ALA 502 3.642 -3.228 -0.979 10 HB1 ALA 502 HB1 ALA 502 3.601 -5.471 0.018 11 HB2 ALA 502 HB2 ALA 502 2.983 -4.790 1.521 12 HB3 ALA 502 HB3 ALA 502 4.612 -4.375 0.963 13 H GLY 503 H GLY 503 1.015 -3.853 1.370 14 HA2 GLY 503 HA2 GLY 503 -1.106 -3.308 -0.218 15 HA3 GLY 503 HA3 GLY 503 -0.681 -4.986 -0.564 16 H ILE 504 H ILE 504 -2.423 -5.944 0.448 17 HA ILE 504 HA ILE 504 -2.608 -5.500 3.339 18 HB ILE 504 HB ILE 504 -4.912 -5.899 1.406 19 HG12 ILE 504 HG12 ILE 504 -5.813 -3.776 2.553 20 HG13 ILE 504 HG13 ILE 504 -4.173 -3.550 3.146 21 HG21 ILE 504 HG21 ILE 504 -5.357 -7.218 3.317 22 HG22 ILE 504 HG22 ILE 504 -6.431 -5.815 3.299 23 HG23 ILE 504 HG23 ILE 504 -5.040 -5.854 4.395 24 HD11 ILE 504 HD11 ILE 504 -4.702 -2.258 1.120 25 HD12 ILE 504 HD12 ILE 504 -4.920 -3.785 0.256 26 HD13 ILE 504 HD13 ILE 504 -3.343 -3.368 0.939 27 H PHE 505 H PHE 505 -1.985 -7.323 4.284 28 HA PHE 505 HA PHE 505 -2.869 -9.889 3.167 29 HB2 PHE 505 HB2 PHE 505 -0.785 -9.182 5.233 30 HB3 PHE 505 HB3 PHE 505 -1.461 -10.799 5.155 31 HD1 PHE 505 HD2 PHE 505 -1.274 -12.048 2.984 32 HD2 PHE 505 HD1 PHE 505 1.009 -8.574 3.864 33 HE1 PHE 505 HE2 PHE 505 0.357 -12.706 1.285 34 HE2 PHE 505 HE1 PHE 505 2.658 -9.228 2.154 35 HZ PHE 505 HZ PHE 505 2.310 -11.323 0.851 36 H THR 506 H THR 506 -4.634 -10.816 4.037 37 HA THR 506 HA THR 506 -5.174 -10.690 6.797 38 HB THR 506 HB THR 506 -5.999 -8.398 6.140 39 HG1 THR 506 HG1 THR 506 -7.528 -8.645 7.628 40 HG21 THR 506 HG21 THR 506 -6.751 -8.933 3.850 41 HG22 THR 506 HG22 THR 506 -8.053 -8.205 4.785 42 HG23 THR 506 HG23 THR 506 -8.036 -9.948 4.506 43 H PHE 507 H PHE 507 -7.689 -11.509 6.958 44 HA PHE 507 HA PHE 507 -7.473 -14.037 5.637 45 HB2 PHE 507 HB2 PHE 507 -9.192 -12.978 7.828 46 HB3 PHE 507 HB3 PHE 507 -9.592 -14.509 7.038 47 HD1 PHE 507 HD1 PHE 507 -8.079 -16.381 7.180 48 HD2 PHE 507 HD2 PHE 507 -7.319 -12.768 9.287 49 HE1 PHE 507 HE1 PHE 507 -6.485 -17.561 8.563 50 HE2 PHE 507 HE2 PHE 507 -5.701 -13.930 10.713 51 HZ PHE 507 HZ PHE 507 -5.253 -16.322 10.362 52 H GLU 508 H GLU 508 -9.003 -15.043 4.404 53 HA GLU 508 HA GLU 508 -10.241 -13.378 2.457 54 HB2 GLU 508 HB2 GLU 508 -9.013 -15.591 2.170 55 HB3 GLU 508 HB3 GLU 508 -10.410 -16.368 2.874 56 HG2 GLU 508 HG2 GLU 508 -10.791 -14.656 0.505 57 HG3 GLU 508 HG3 GLU 508 -9.991 -16.205 0.285 58 H GLU 509 H GLU 509 -11.184 -14.992 5.332 59 HA GLU 509 HA GLU 509 -13.796 -13.797 5.201 60 HB2 GLU 509 HB2 GLU 509 -14.776 -15.885 6.190 61 HB3 GLU 509 HB3 GLU 509 -14.311 -16.044 4.511 62 HG2 GLU 509 HG2 GLU 509 -12.123 -17.042 5.463 63 HG3 GLU 509 HG3 GLU 509 -13.050 -17.194 6.960 64 HA PRO 510 HA PRO 510 -12.346 -12.738 9.229 65 HB2 PRO 510 HB2 PRO 510 -14.616 -11.781 10.325 66 HB3 PRO 510 HB3 PRO 510 -13.764 -10.921 9.037 67 HG2 PRO 510 HG2 PRO 510 -16.211 -12.635 8.880 68 HG3 PRO 510 HG3 PRO 510 -15.847 -11.124 8.031 69 HD2 PRO 510 HD2 PRO 510 -15.574 -13.649 6.907 70 HD3 PRO 510 HD3 PRO 510 -14.689 -12.201 6.375 71 H VAL 511 H VAL 511 -15.028 -14.929 8.871 72 HA VAL 511 HA VAL 511 -14.395 -16.180 11.437 73 HB VAL 511 HB VAL 511 -17.253 -15.617 10.528 74 HG11 VAL 511 HG11 VAL 511 -17.920 -16.475 12.710 75 HG12 VAL 511 HG12 VAL 511 -16.235 -16.856 13.069 76 HG13 VAL 511 HG13 VAL 511 -17.060 -17.679 11.753 77 HG21 VAL 511 HG21 VAL 511 -16.228 -13.533 11.312 78 HG22 VAL 511 HG22 VAL 511 -15.745 -14.326 12.811 79 HG23 VAL 511 HG23 VAL 511 -17.455 -14.097 12.447 80 H THR 512 H THR 512 -14.422 -18.393 11.209 81 HA THR 512 HA THR 512 -15.733 -19.383 8.813 82 HB THR 512 HB THR 512 -13.249 -19.230 8.474 83 HG1 THR 512 HG1 THR 512 -13.900 -20.618 7.227 84 HG21 THR 512 HG21 THR 512 -13.156 -21.362 10.610 85 HG22 THR 512 HG22 THR 512 -12.494 -19.732 10.740 86 HG23 THR 512 HG23 THR 512 -11.798 -20.878 9.591 87 H HIS 513 H HIS 513 -16.847 -21.259 9.101 88 HA HIS 513 HA HIS 513 -16.744 -22.359 11.798 89 HB2 HIS 513 HB2 HIS 513 -19.018 -23.220 11.523 90 HB3 HIS 513 HB3 HIS 513 -19.026 -21.513 11.129 91 HD1 HIS 513 HD1 HIS 513 -20.458 -24.579 9.984 92 HD2 HIS 513 HD2 HIS 513 -18.766 -21.269 8.092 93 HE1 HIS 513 HE1 HIS 513 -21.308 -24.605 7.615 94 H VAL 514 H VAL 514 -15.928 -24.252 12.063 95 HA VAL 514 HA VAL 514 -15.570 -25.943 9.707 96 HB VAL 514 HB VAL 514 -13.438 -26.730 10.591 97 HG11 VAL 514 HG11 VAL 514 -13.543 -23.724 10.444 98 HG12 VAL 514 HG12 VAL 514 -13.267 -24.851 9.111 99 HG13 VAL 514 HG13 VAL 514 -12.065 -24.677 10.389 100 HG21 VAL 514 HG21 VAL 514 -12.360 -25.677 12.551 101 HG22 VAL 514 HG22 VAL 514 -13.847 -26.520 12.981 102 HG23 VAL 514 HG23 VAL 514 -13.837 -24.760 12.850 103 H SER 515 H SER 515 -15.556 -28.228 10.209 104 HA SER 515 HA SER 515 -17.444 -28.880 12.215 105 HB2 SER 515 HB2 SER 515 -15.874 -30.260 10.100 106 HB3 SER 515 HB3 SER 515 -17.047 -31.138 11.061 107 HG SER 515 HG SER 515 -18.410 -29.159 10.235 108 H GLU 516 H GLU 516 -16.817 -30.833 13.704 109 HA GLU 516 HA GLU 516 -14.227 -30.163 14.770 110 HB2 GLU 516 HB2 GLU 516 -16.204 -30.238 16.314 111 HB3 GLU 516 HB3 GLU 516 -16.329 -31.959 16.014 112 HG2 GLU 516 HG2 GLU 516 -14.424 -32.449 17.245 113 HG3 GLU 516 HG3 GLU 516 -13.789 -30.811 17.100 114 H SER 517 H SER 517 -15.963 -33.113 13.984 115 HA SER 517 HA SER 517 -13.556 -34.679 13.859 116 HB2 SER 517 HB2 SER 517 -16.383 -35.306 12.994 117 HB3 SER 517 HB3 SER 517 -15.086 -36.478 13.230 118 HG SER 517 HG SER 517 -16.542 -35.007 15.142 119 H ILE 518 H ILE 518 -13.216 -32.586 12.173 120 HA ILE 518 HA ILE 518 -13.786 -33.450 9.427 121 HB ILE 518 HB ILE 518 -14.292 -31.154 9.910 122 HG12 ILE 518 HG12 ILE 518 -11.818 -31.250 8.168 123 HG13 ILE 518 HG13 ILE 518 -13.462 -31.606 7.628 124 HG21 ILE 518 HG21 ILE 518 -12.779 -30.772 11.761 125 HG22 ILE 518 HG22 ILE 518 -12.703 -29.491 10.565 126 HG23 ILE 518 HG23 ILE 518 -11.399 -30.688 10.643 127 HD11 ILE 518 HD11 ILE 518 -12.375 -29.007 8.624 128 HD12 ILE 518 HD12 ILE 518 -14.064 -29.294 8.203 129 HD13 ILE 518 HD13 ILE 518 -12.799 -29.404 6.953 130 H GLY 519 H GLY 519 -11.179 -33.096 11.667 131 HA2 GLY 519 HA2 GLY 519 -9.097 -34.212 11.434 132 HA3 GLY 519 HA3 GLY 519 -9.385 -34.275 9.697 133 H ILE 520 H ILE 520 -9.285 -32.294 8.525 134 HA ILE 520 HA ILE 520 -7.497 -30.336 9.783 135 HB ILE 520 HB ILE 520 -7.161 -31.480 7.000 136 HG12 ILE 520 HG12 ILE 520 -6.367 -33.052 8.794 137 HG13 ILE 520 HG13 ILE 520 -5.098 -32.532 7.695 138 HG21 ILE 520 HG21 ILE 520 -5.516 -29.435 8.483 139 HG22 ILE 520 HG22 ILE 520 -6.530 -29.156 7.066 140 HG23 ILE 520 HG23 ILE 520 -5.074 -30.143 6.930 141 HD11 ILE 520 HD11 ILE 520 -4.325 -30.936 9.391 142 HD12 ILE 520 HD12 ILE 520 -4.298 -32.601 9.965 143 HD13 ILE 520 HD13 ILE 520 -5.589 -31.512 10.477 144 H MET 521 H MET 521 -8.092 -28.331 9.307 145 HA MET 521 HA MET 521 -10.067 -27.945 7.161 146 HB2 MET 521 HB2 MET 521 -10.953 -26.041 8.403 147 HB3 MET 521 HB3 MET 521 -10.984 -27.480 9.406 148 HG2 MET 521 HG2 MET 521 -10.241 -25.861 10.920 149 HG3 MET 521 HG3 MET 521 -8.729 -26.483 10.281 150 HE1 MET 521 HE1 MET 521 -8.434 -22.478 10.819 151 HE2 MET 521 HE2 MET 521 -7.726 -23.986 11.350 152 HE3 MET 521 HE3 MET 521 -9.429 -23.634 11.711 153 H GLU 522 H GLU 522 -9.738 -26.286 5.711 154 HA GLU 522 HA GLU 522 -7.159 -24.886 5.916 155 HB2 GLU 522 HB2 GLU 522 -8.618 -25.821 3.449 156 HB3 GLU 522 HB3 GLU 522 -7.409 -24.569 3.390 157 HG2 GLU 522 HG2 GLU 522 -6.351 -26.547 2.722 158 HG3 GLU 522 HG3 GLU 522 -5.799 -26.221 4.357 159 H VAL 523 H VAL 523 -7.219 -22.794 6.046 160 HA VAL 523 HA VAL 523 -9.611 -21.312 5.095 161 HB VAL 523 HB VAL 523 -7.770 -20.585 7.399 162 HG11 VAL 523 HG11 VAL 523 -9.290 -18.687 7.775 163 HG12 VAL 523 HG12 VAL 523 -10.169 -19.097 6.300 164 HG13 VAL 523 HG13 VAL 523 -8.476 -18.589 6.223 165 HG21 VAL 523 HG21 VAL 523 -9.354 -22.381 7.884 166 HG22 VAL 523 HG22 VAL 523 -10.696 -21.325 7.425 167 HG23 VAL 523 HG23 VAL 523 -9.683 -20.936 8.820 168 H LYS 524 H LYS 524 -9.227 -19.690 3.621 169 HA LYS 524 HA LYS 524 -6.513 -19.491 2.626 170 HB2 LYS 524 HB2 LYS 524 -8.978 -18.156 1.571 171 HB3 LYS 524 HB3 LYS 524 -7.436 -18.378 0.755 172 HG2 LYS 524 HG2 LYS 524 -7.983 -20.943 1.179 173 HG3 LYS 524 HG3 LYS 524 -9.621 -20.285 1.256 174 HD2 LYS 524 HD2 LYS 524 -7.715 -19.916 -1.015 175 HD3 LYS 524 HD3 LYS 524 -9.075 -21.047 -0.974 176 HE2 LYS 524 HE2 LYS 524 -9.255 -18.152 -0.546 177 HE3 LYS 524 HE3 LYS 524 -9.489 -18.858 -2.167 178 HZ1 LYS 524 HZ1 LYS 524 -11.331 -20.196 -0.890 179 HZ2 LYS 524 HZ2 LYS 524 -11.628 -18.627 -1.355 180 HZ3 LYS 524 HZ3 LYS 524 -11.249 -18.932 0.243 181 H VAL 525 H VAL 525 -5.327 -17.687 2.486 182 HA VAL 525 HA VAL 525 -6.213 -15.347 4.047 183 HB VAL 525 HB VAL 525 -3.383 -16.330 3.606 184 HG11 VAL 525 HG11 VAL 525 -3.502 -13.898 3.891 185 HG12 VAL 525 HG12 VAL 525 -2.743 -14.663 5.287 186 HG13 VAL 525 HG13 VAL 525 -4.418 -14.121 5.381 187 HG21 VAL 525 HG21 VAL 525 -5.118 -16.466 6.044 188 HG22 VAL 525 HG22 VAL 525 -3.408 -16.922 5.952 189 HG23 VAL 525 HG23 VAL 525 -4.615 -17.802 5.008 190 H LEU 526 H LEU 526 -6.262 -13.491 2.997 191 HA LEU 526 HA LEU 526 -5.882 -13.452 0.185 192 HB2 LEU 526 HB2 LEU 526 -6.534 -11.264 2.147 193 HB3 LEU 526 HB3 LEU 526 -6.519 -11.067 0.406 194 HG LEU 526 HG LEU 526 -8.358 -12.901 1.936 195 HD11 LEU 526 HD11 LEU 526 -10.103 -11.315 1.281 196 HD12 LEU 526 HD12 LEU 526 -8.873 -10.257 0.586 197 HD13 LEU 526 HD13 LEU 526 -8.891 -10.571 2.323 198 HD21 LEU 526 HD21 LEU 526 -7.870 -13.762 -0.280 199 HD22 LEU 526 HD22 LEU 526 -8.228 -12.185 -0.982 200 HD23 LEU 526 HD23 LEU 526 -9.512 -13.120 -0.217 201 H ARG 527 H ARG 527 -4.209 -12.978 -0.846 202 HA ARG 527 HA ARG 527 -1.739 -12.308 0.403 203 HB2 ARG 527 HB2 ARG 527 -1.927 -13.772 -1.588 204 HB3 ARG 527 HB3 ARG 527 -2.504 -12.401 -2.518 205 HG2 ARG 527 HG2 ARG 527 -0.333 -11.268 -2.087 206 HG3 ARG 527 HG3 ARG 527 0.231 -12.743 -1.304 207 HD2 ARG 527 HD2 ARG 527 1.006 -12.655 -3.580 208 HD3 ARG 527 HD3 ARG 527 -0.143 -13.969 -3.371 209 HE ARG 527 HE ARG 527 -1.783 -12.100 -4.250 210 HH11 ARG 527 HH11 ARG 527 1.442 -12.866 -5.486 211 HH12 ARG 527 HH12 ARG 527 1.109 -12.350 -7.074 212 HH21 ARG 527 HH21 ARG 527 -2.229 -11.373 -6.404 213 HH22 ARG 527 HH22 ARG 527 -1.016 -11.472 -7.598 214 H THR 528 H THR 528 -0.515 -10.446 -0.111 215 HA THR 528 HA THR 528 -1.720 -7.998 0.135 216 HB THR 528 HB THR 528 0.591 -8.253 0.723 217 HG1 THR 528 HG1 THR 528 1.380 -6.694 -1.251 218 HG21 THR 528 HG21 THR 528 1.212 -10.010 -0.834 219 HG22 THR 528 HG22 THR 528 2.351 -8.657 -0.928 220 HG23 THR 528 HG23 THR 528 1.105 -8.860 -2.168 221 H SER 529 H SER 529 -2.564 -6.571 -1.233 222 HA SER 529 HA SER 529 -3.377 -7.059 -3.782 223 HB2 SER 529 HB2 SER 529 -2.821 -4.403 -2.480 224 HB3 SER 529 HB3 SER 529 -4.134 -4.813 -3.605 225 HG SER 529 HG SER 529 -5.125 -5.940 -2.049 226 H GLY 530 H GLY 530 -0.380 -5.761 -2.524 227 HA2 GLY 530 HA2 GLY 530 0.640 -5.504 -5.262 228 HA3 GLY 530 HA3 GLY 530 1.146 -4.445 -3.940 229 H ALA 531 H ALA 531 1.345 -7.625 -5.284 230 HA ALA 531 HA ALA 531 3.111 -8.487 -3.159 231 HB1 ALA 531 HB1 ALA 531 3.062 -10.655 -4.243 232 HB2 ALA 531 HB2 ALA 531 2.168 -9.976 -5.604 233 HB3 ALA 531 HB3 ALA 531 1.418 -10.059 -4.012 234 H ARG 532 H ARG 532 5.035 -7.649 -3.303 235 HA ARG 532 HA ARG 532 6.379 -7.776 -5.895 236 HB2 ARG 532 HB2 ARG 532 6.862 -5.804 -3.651 237 HB3 ARG 532 HB3 ARG 532 7.701 -5.839 -5.193 238 HG2 ARG 532 HG2 ARG 532 4.753 -5.331 -4.846 239 HG3 ARG 532 HG3 ARG 532 5.961 -4.074 -5.057 240 HD2 ARG 532 HD2 ARG 532 6.527 -5.010 -7.260 241 HD3 ARG 532 HD3 ARG 532 5.302 -6.264 -7.035 242 HE ARG 532 HE ARG 532 3.698 -4.327 -6.834 243 HH11 ARG 532 HH11 ARG 532 6.531 -4.247 -8.981 244 HH12 ARG 532 HH12 ARG 532 5.885 -3.009 -9.958 245 HH21 ARG 532 HH21 ARG 532 2.857 -2.674 -8.218 246 HH22 ARG 532 HH22 ARG 532 3.794 -2.092 -9.530 247 H GLY 533 H GLY 533 7.450 -9.608 -5.705 248 HA2 GLY 533 HA2 GLY 533 9.440 -10.706 -5.149 249 HA3 GLY 533 HA3 GLY 533 9.559 -9.713 -3.703 250 H ASN 534 H ASN 534 9.855 -11.310 -2.271 251 HA ASN 534 HA ASN 534 7.693 -13.271 -1.977 252 HB2 ASN 534 HB2 ASN 534 9.776 -14.382 -2.674 253 HB3 ASN 534 HB3 ASN 534 10.650 -13.621 -1.357 254 HD21 ASN 534 HD21 ASN 534 7.415 -15.022 -1.030 255 HD22 ASN 534 HD22 ASN 534 7.911 -16.310 -0.012 256 H VAL 535 H VAL 535 6.694 -13.308 -0.058 257 HA VAL 535 HA VAL 535 7.821 -11.804 2.186 258 HB VAL 535 HB VAL 535 4.918 -11.772 1.277 259 HG11 VAL 535 HG11 VAL 535 6.280 -10.231 3.474 260 HG12 VAL 535 HG12 VAL 535 5.136 -11.557 3.680 261 HG13 VAL 535 HG13 VAL 535 4.605 -10.032 2.968 262 HG21 VAL 535 HG21 VAL 535 6.262 -10.474 -0.261 263 HG22 VAL 535 HG22 VAL 535 6.997 -9.630 1.096 264 HG23 VAL 535 HG23 VAL 535 5.281 -9.385 0.738 265 H ILE 536 H ILE 536 7.473 -12.819 4.112 266 HA ILE 536 HA ILE 536 5.952 -15.324 4.019 267 HB ILE 536 HB ILE 536 8.206 -14.522 5.880 268 HG12 ILE 536 HG12 ILE 536 9.005 -15.221 3.696 269 HG13 ILE 536 HG13 ILE 536 9.404 -16.440 4.906 270 HG21 ILE 536 HG21 ILE 536 6.565 -15.751 7.107 271 HG22 ILE 536 HG22 ILE 536 7.993 -16.767 6.844 272 HG23 ILE 536 HG23 ILE 536 6.533 -16.991 5.860 273 HD11 ILE 536 HD11 ILE 536 7.268 -16.521 2.805 274 HD12 ILE 536 HD12 ILE 536 7.372 -17.672 4.125 275 HD13 ILE 536 HD13 ILE 536 8.687 -17.559 2.947 276 H VAL 537 H VAL 537 4.294 -15.577 5.370 277 HA VAL 537 HA VAL 537 3.845 -13.452 7.318 278 HB VAL 537 HB VAL 537 1.655 -14.950 5.852 279 HG11 VAL 537 HG11 VAL 537 0.185 -13.190 6.743 280 HG12 VAL 537 HG12 VAL 537 1.566 -12.507 7.605 281 HG13 VAL 537 HG13 VAL 537 0.978 -14.117 8.022 282 HG21 VAL 537 HG21 VAL 537 2.876 -13.582 4.270 283 HG22 VAL 537 HG22 VAL 537 2.729 -12.190 5.332 284 HG23 VAL 537 HG23 VAL 537 1.284 -12.872 4.569 285 HA PRO 538 HA PRO 538 3.889 -17.260 9.802 286 HB2 PRO 538 HB2 PRO 538 4.123 -16.019 12.204 287 HB3 PRO 538 HB3 PRO 538 5.500 -16.344 11.152 288 HG2 PRO 538 HG2 PRO 538 4.024 -13.797 11.616 289 HG3 PRO 538 HG3 PRO 538 5.745 -14.055 11.296 290 HD2 PRO 538 HD2 PRO 538 3.914 -13.190 9.423 291 HD3 PRO 538 HD3 PRO 538 5.448 -13.990 9.036 292 H TYR 539 H TYR 539 2.383 -18.201 11.203 293 HA TYR 539 HA TYR 539 0.120 -16.553 11.991 294 HB2 TYR 539 HB2 TYR 539 -1.562 -18.023 11.092 295 HB3 TYR 539 HB3 TYR 539 -0.470 -17.538 9.806 296 HD1 TYR 539 HD2 TYR 539 -1.561 -20.356 11.920 297 HD2 TYR 539 HD1 TYR 539 0.863 -19.174 8.639 298 HE1 TYR 539 HE2 TYR 539 -1.315 -22.711 11.267 299 HE2 TYR 539 HE1 TYR 539 1.103 -21.533 7.966 300 HH TYR 539 HH TYR 539 0.943 -23.746 8.964 301 H LYS 540 H LYS 540 -1.214 -17.524 13.605 302 HA LYS 540 HA LYS 540 -0.065 -19.818 15.003 303 HB2 LYS 540 HB2 LYS 540 0.119 -18.574 17.099 304 HB3 LYS 540 HB3 LYS 540 1.136 -17.851 15.870 305 HG2 LYS 540 HG2 LYS 540 -0.538 -16.129 15.432 306 HG3 LYS 540 HG3 LYS 540 -1.590 -16.832 16.649 307 HD2 LYS 540 HD2 LYS 540 0.072 -16.315 18.373 308 HD3 LYS 540 HD3 LYS 540 1.131 -15.626 17.135 309 HE2 LYS 540 HE2 LYS 540 -0.600 -13.989 16.565 310 HE3 LYS 540 HE3 LYS 540 -1.647 -14.664 17.803 311 HZ1 LYS 540 HZ1 LYS 540 -0.070 -13.966 19.476 312 HZ2 LYS 540 HZ2 LYS 540 -0.543 -12.662 18.525 313 HZ3 LYS 540 HZ3 LYS 540 0.972 -13.350 18.294 314 H THR 541 H THR 541 -1.571 -20.851 16.312 315 HA THR 541 HA THR 541 -4.324 -20.016 16.022 316 HB THR 541 HB THR 541 -4.721 -22.107 17.388 317 HG1 THR 541 HG1 THR 541 -2.475 -22.115 18.124 318 HG21 THR 541 HG21 THR 541 -5.029 -22.086 15.000 319 HG22 THR 541 HG22 THR 541 -4.286 -23.613 15.481 320 HG23 THR 541 HG23 THR 541 -3.301 -22.337 14.743 321 H ILE 542 H ILE 542 -5.433 -18.984 17.545 322 HA ILE 542 HA ILE 542 -4.182 -18.522 20.154 323 HB ILE 542 HB ILE 542 -6.528 -17.203 18.804 324 HG12 ILE 542 HG12 ILE 542 -3.738 -16.089 19.122 325 HG13 ILE 542 HG13 ILE 542 -4.341 -16.834 17.646 326 HG21 ILE 542 HG21 ILE 542 -6.264 -15.451 20.539 327 HG22 ILE 542 HG22 ILE 542 -4.969 -16.393 21.274 328 HG23 ILE 542 HG23 ILE 542 -6.613 -17.030 21.247 329 HD11 ILE 542 HD11 ILE 542 -4.406 -14.377 17.618 330 HD12 ILE 542 HD12 ILE 542 -5.583 -14.426 18.943 331 HD13 ILE 542 HD13 ILE 542 -5.972 -15.140 17.372 332 H GLU 543 H GLU 543 -5.000 -19.736 21.746 333 HA GLU 543 HA GLU 543 -7.228 -21.462 21.328 334 HB2 GLU 543 HB2 GLU 543 -5.617 -20.854 23.825 335 HB3 GLU 543 HB3 GLU 543 -6.721 -22.207 23.617 336 HG2 GLU 543 HG2 GLU 543 -5.336 -23.241 22.023 337 HG3 GLU 543 HG3 GLU 543 -4.369 -21.789 21.800 338 H GLY 544 H GLY 544 -9.242 -20.804 21.477 339 HA2 GLY 544 HA2 GLY 544 -9.920 -18.428 23.070 340 HA3 GLY 544 HA3 GLY 544 -10.937 -19.158 21.829 341 H THR 545 H THR 545 -12.419 -20.644 22.400 342 HA THR 545 HA THR 545 -12.516 -21.406 25.201 343 HB THR 545 HB THR 545 -14.766 -22.373 24.531 344 HG1 THR 545 HG1 THR 545 -15.550 -21.526 22.500 345 HG21 THR 545 HG21 THR 545 -15.887 -20.208 24.350 346 HG22 THR 545 HG22 THR 545 -14.359 -19.448 23.900 347 HG23 THR 545 HG23 THR 545 -14.564 -20.121 25.515 348 H ALA 546 H ALA 546 -11.703 -22.483 22.107 349 HA ALA 546 HA ALA 546 -11.689 -25.305 22.748 350 HB1 ALA 546 HB1 ALA 546 -12.218 -24.464 20.451 351 HB2 ALA 546 HB2 ALA 546 -10.884 -25.605 20.490 352 HB3 ALA 546 HB3 ALA 546 -10.560 -23.879 20.332 353 H ARG 547 H ARG 547 -9.872 -26.426 23.372 354 HA ARG 547 HA ARG 547 -7.571 -24.783 24.060 355 HB2 ARG 547 HB2 ARG 547 -8.449 -27.500 24.962 356 HB3 ARG 547 HB3 ARG 547 -7.015 -26.662 25.553 357 HG2 ARG 547 HG2 ARG 547 -8.287 -24.927 26.435 358 HG3 ARG 547 HG3 ARG 547 -9.780 -25.510 25.692 359 HD2 ARG 547 HD2 ARG 547 -9.470 -27.619 27.061 360 HD3 ARG 547 HD3 ARG 547 -8.210 -26.747 27.936 361 HE ARG 547 HE ARG 547 -9.765 -25.402 28.903 362 HH11 ARG 547 HH11 ARG 547 -11.330 -27.587 26.574 363 HH12 ARG 547 HH12 ARG 547 -12.906 -27.319 27.133 364 HH21 ARG 547 HH21 ARG 547 -11.970 -25.041 29.707 365 HH22 ARG 547 HH22 ARG 547 -13.271 -25.849 28.963 366 H GLY 548 H GLY 548 -5.519 -25.279 23.527 367 HA2 GLY 548 HA2 GLY 548 -5.207 -26.816 21.083 368 HA3 GLY 548 HA3 GLY 548 -4.012 -25.764 21.840 369 H GLY 549 H GLY 549 -2.344 -27.347 21.654 370 HA2 GLY 549 HA2 GLY 549 -1.003 -28.930 22.586 371 HA3 GLY 549 HA3 GLY 549 -2.146 -29.043 23.916 372 H GLY 550 H GLY 550 -3.887 -29.558 21.207 373 HA2 GLY 550 HA2 GLY 550 -4.375 -31.499 19.961 374 HA3 GLY 550 HA3 GLY 550 -3.287 -32.408 21.006 375 H GLU 551 H GLU 551 -5.641 -30.210 22.318 376 HA GLU 551 HA GLU 551 -7.000 -32.506 23.468 377 HB2 GLU 551 HB2 GLU 551 -6.035 -30.752 24.955 378 HB3 GLU 551 HB3 GLU 551 -7.185 -29.609 24.275 379 HG2 GLU 551 HG2 GLU 551 -9.000 -30.662 25.265 380 HG3 GLU 551 HG3 GLU 551 -8.102 -32.145 25.552 381 H ASP 552 H ASP 552 -8.127 -29.238 22.442 382 HA ASP 552 HA ASP 552 -10.498 -30.557 21.321 383 HB2 ASP 552 HB2 ASP 552 -9.839 -27.614 21.664 384 HB3 ASP 552 HB3 ASP 552 -11.267 -28.194 20.821 385 H PHE 553 H PHE 553 -7.874 -28.461 20.464 386 HA PHE 553 HA PHE 553 -8.024 -29.612 17.816 387 HB2 PHE 553 HB2 PHE 553 -7.720 -27.501 16.682 388 HB3 PHE 553 HB3 PHE 553 -9.137 -27.366 17.704 389 HD1 PHE 553 HD1 PHE 553 -8.942 -26.066 19.853 390 HD2 PHE 553 HD2 PHE 553 -5.905 -26.053 16.894 391 HE1 PHE 553 HE1 PHE 553 -8.012 -24.004 20.816 392 HE2 PHE 553 HE2 PHE 553 -4.966 -24.008 17.854 393 HZ PHE 553 HZ PHE 553 -6.018 -22.971 19.816 394 H GLU 554 H GLU 554 -6.054 -29.406 16.687 395 HA GLU 554 HA GLU 554 -3.765 -29.686 18.433 396 HB2 GLU 554 HB2 GLU 554 -4.466 -30.992 16.208 397 HB3 GLU 554 HB3 GLU 554 -3.689 -29.599 15.465 398 HG2 GLU 554 HG2 GLU 554 -1.695 -30.196 17.000 399 HG3 GLU 554 HG3 GLU 554 -2.571 -31.713 17.161 400 H ASP 555 H ASP 555 -2.819 -27.750 18.992 401 HA ASP 555 HA ASP 555 -3.454 -25.409 17.485 402 HB2 ASP 555 HB2 ASP 555 -2.190 -24.138 19.092 403 HB3 ASP 555 HB3 ASP 555 -3.087 -25.358 19.982 404 H THR 556 H THR 556 -2.014 -24.113 16.325 405 HA THR 556 HA THR 556 0.398 -25.459 15.521 406 HB THR 556 HB THR 556 -1.390 -26.390 14.049 407 HG1 THR 556 HG1 THR 556 -0.234 -26.170 12.205 408 HG21 THR 556 HG21 THR 556 -2.380 -24.923 12.287 409 HG22 THR 556 HG22 THR 556 -1.686 -23.522 13.110 410 HG23 THR 556 HG23 THR 556 -2.908 -24.496 13.906 411 H CYS 557 H CYS 557 1.539 -24.128 13.867 412 HA CYS 557 HA CYS 557 1.082 -21.380 13.665 413 HB2 CYS 557 HB2 CYS 557 3.212 -20.732 14.879 414 HB3 CYS 557 HB3 CYS 557 1.946 -21.318 15.926 415 HG CYS 557 HG CYS 557 4.130 -23.672 14.902 416 H GLY 558 H GLY 558 2.903 -20.505 12.243 417 HA2 GLY 558 HA2 GLY 558 4.854 -22.067 11.136 418 HA3 GLY 558 HA3 GLY 558 3.386 -22.421 10.232 419 H GLU 559 H GLU 559 4.877 -21.443 8.560 420 HA GLU 559 HA GLU 559 4.346 -18.585 8.464 421 HB2 GLU 559 HB2 GLU 559 6.947 -19.956 7.854 422 HB3 GLU 559 HB3 GLU 559 6.579 -18.315 7.342 423 HG2 GLU 559 HG2 GLU 559 6.267 -17.730 9.750 424 HG3 GLU 559 HG3 GLU 559 6.841 -19.344 10.160 425 H LEU 560 H LEU 560 3.234 -18.062 6.796 426 HA LEU 560 HA LEU 560 2.881 -19.857 4.535 427 HB2 LEU 560 HB2 LEU 560 1.707 -17.175 5.211 428 HB3 LEU 560 HB3 LEU 560 1.255 -18.122 3.819 429 HG LEU 560 HG LEU 560 0.798 -18.840 6.702 430 HD11 LEU 560 HD11 LEU 560 -1.556 -18.556 6.107 431 HD12 LEU 560 HD12 LEU 560 -1.074 -18.004 4.503 432 HD13 LEU 560 HD13 LEU 560 -0.637 -17.064 5.931 433 HD21 LEU 560 HD21 LEU 560 1.189 -20.856 5.413 434 HD22 LEU 560 HD22 LEU 560 0.066 -20.310 4.175 435 HD23 LEU 560 HD23 LEU 560 -0.531 -20.719 5.786 436 H GLU 561 H GLU 561 3.713 -19.513 2.572 437 HA GLU 561 HA GLU 561 5.514 -17.255 2.336 438 HB2 GLU 561 HB2 GLU 561 6.358 -19.616 2.107 439 HB3 GLU 561 HB3 GLU 561 5.376 -19.727 0.650 440 HG2 GLU 561 HG2 GLU 561 6.668 -17.785 -0.270 441 HG3 GLU 561 HG3 GLU 561 7.620 -17.836 1.170 442 H PHE 562 H PHE 562 4.813 -15.618 1.166 443 HA PHE 562 HA PHE 562 3.000 -16.192 -1.064 444 HB2 PHE 562 HB2 PHE 562 3.107 -13.792 0.757 445 HB3 PHE 562 HB3 PHE 562 2.256 -13.792 -0.781 446 HD1 PHE 562 HD1 PHE 562 0.249 -15.115 -1.080 447 HD2 PHE 562 HD2 PHE 562 2.238 -14.953 2.672 448 HE1 PHE 562 HE1 PHE 562 -1.755 -15.985 0.005 449 HE2 PHE 562 HE2 PHE 562 0.224 -15.833 3.775 450 HZ PHE 562 HZ PHE 562 -1.777 -16.350 2.441 451 H GLN 563 H GLN 563 3.518 -15.315 -2.993 452 HA GLN 563 HA GLN 563 5.859 -13.569 -3.079 453 HB2 GLN 563 HB2 GLN 563 5.514 -15.831 -5.055 454 HB3 GLN 563 HB3 GLN 563 6.917 -14.805 -4.821 455 HG2 GLN 563 HG2 GLN 563 7.096 -15.850 -2.505 456 HG3 GLN 563 HG3 GLN 563 5.930 -17.035 -3.068 457 HE21 GLN 563 HE21 GLN 563 8.557 -15.579 -4.939 458 HE22 GLN 563 HE22 GLN 563 9.413 -17.045 -5.122 459 H ASN 564 H ASN 564 6.074 -12.667 -5.339 460 HA ASN 564 HA ASN 564 3.752 -11.343 -6.142 461 HB2 ASN 564 HB2 ASN 564 5.040 -10.492 -8.008 462 HB3 ASN 564 HB3 ASN 564 6.093 -10.590 -6.606 463 HD21 ASN 564 HD21 ASN 564 5.529 -11.649 -9.821 464 HD22 ASN 564 HD22 ASN 564 6.926 -12.630 -9.977 465 H ASP 565 H ASP 565 5.163 -14.324 -7.073 466 HA ASP 565 HA ASP 565 3.491 -14.750 -9.392 467 HB2 ASP 565 HB2 ASP 565 5.804 -15.369 -9.540 468 HB3 ASP 565 HB3 ASP 565 5.674 -16.370 -8.103 469 H GLU 566 H GLU 566 3.472 -15.667 -6.011 470 HA GLU 566 HA GLU 566 1.862 -17.993 -6.349 471 HB2 GLU 566 HB2 GLU 566 2.639 -16.331 -3.989 472 HB3 GLU 566 HB3 GLU 566 1.551 -17.690 -3.854 473 HG2 GLU 566 HG2 GLU 566 4.409 -17.757 -4.782 474 HG3 GLU 566 HG3 GLU 566 3.788 -18.359 -3.242 475 H ILE 567 H ILE 567 -0.256 -18.031 -4.940 476 HA ILE 567 HA ILE 567 -1.760 -15.686 -5.766 477 HB ILE 567 HB ILE 567 -3.755 -17.290 -5.973 478 HG12 ILE 567 HG12 ILE 567 -1.635 -19.339 -6.581 479 HG13 ILE 567 HG13 ILE 567 -2.331 -19.284 -4.980 480 HG21 ILE 567 HG21 ILE 567 -1.481 -17.370 -7.956 481 HG22 ILE 567 HG22 ILE 567 -2.732 -16.134 -7.849 482 HG23 ILE 567 HG23 ILE 567 -3.158 -17.785 -8.311 483 HD11 ILE 567 HD11 ILE 567 -4.514 -19.616 -5.930 484 HD12 ILE 567 HD12 ILE 567 -3.411 -20.936 -6.318 485 HD13 ILE 567 HD13 ILE 567 -3.820 -19.726 -7.551 486 H VAL 568 H VAL 568 -2.634 -18.459 -3.677 487 HA VAL 568 HA VAL 568 -3.083 -16.627 -1.478 488 HB VAL 568 HB VAL 568 -5.226 -16.818 -2.790 489 HG11 VAL 568 HG11 VAL 568 -6.538 -18.873 -2.725 490 HG12 VAL 568 HG12 VAL 568 -5.203 -19.693 -1.937 491 HG13 VAL 568 HG13 VAL 568 -5.017 -19.115 -3.603 492 HG21 VAL 568 HG21 VAL 568 -5.366 -16.287 -0.438 493 HG22 VAL 568 HG22 VAL 568 -5.316 -17.993 -0.020 494 HG23 VAL 568 HG23 VAL 568 -6.702 -17.342 -0.896 495 H LYS 569 H LYS 569 -3.119 -17.814 0.519 496 HA LYS 569 HA LYS 569 -2.270 -20.597 0.217 497 HB2 LYS 569 HB2 LYS 569 -1.235 -18.628 2.200 498 HB3 LYS 569 HB3 LYS 569 -1.028 -20.364 2.357 499 HG2 LYS 569 HG2 LYS 569 -0.089 -20.063 -0.125 500 HG3 LYS 569 HG3 LYS 569 0.257 -18.454 0.516 501 HD2 LYS 569 HD2 LYS 569 2.079 -19.800 0.840 502 HD3 LYS 569 HD3 LYS 569 1.356 -19.575 2.450 503 HE2 LYS 569 HE2 LYS 569 1.989 -21.871 2.297 504 HE3 LYS 569 HE3 LYS 569 0.252 -21.852 2.026 505 HZ1 LYS 569 HZ1 LYS 569 1.336 -23.262 0.408 506 HZ2 LYS 569 HZ2 LYS 569 2.356 -22.019 -0.041 507 HZ3 LYS 569 HZ3 LYS 569 0.736 -21.909 -0.413 508 H THR 570 H THR 570 -2.565 -21.843 2.283 509 HA THR 570 HA THR 570 -5.006 -21.018 3.642 510 HB THR 570 HB THR 570 -5.343 -23.651 3.635 511 HG1 THR 570 HG1 THR 570 -4.359 -23.327 1.043 512 HG21 THR 570 HG21 THR 570 -6.839 -23.406 1.665 513 HG22 THR 570 HG22 THR 570 -6.145 -21.808 1.353 514 HG23 THR 570 HG23 THR 570 -7.035 -22.121 2.839 515 H ILE 571 H ILE 571 -5.161 -21.590 5.741 516 HA ILE 571 HA ILE 571 -2.804 -22.725 7.068 517 HB ILE 571 HB ILE 571 -5.317 -21.392 8.146 518 HG12 ILE 571 HG12 ILE 571 -3.700 -19.890 9.325 519 HG13 ILE 571 HG13 ILE 571 -2.399 -20.685 8.458 520 HG21 ILE 571 HG21 ILE 571 -4.900 -23.260 9.559 521 HG22 ILE 571 HG22 ILE 571 -4.543 -21.760 10.427 522 HG23 ILE 571 HG23 ILE 571 -3.226 -22.763 9.807 523 HD11 ILE 571 HD11 ILE 571 -4.651 -19.149 7.238 524 HD12 ILE 571 HD12 ILE 571 -3.298 -19.899 6.378 525 HD13 ILE 571 HD13 ILE 571 -3.010 -18.569 7.510 526 H SER 572 H SER 572 -2.795 -24.828 7.624 527 HA SER 572 HA SER 572 -5.323 -26.277 7.551 528 HB2 SER 572 HB2 SER 572 -3.706 -28.257 7.349 529 HB3 SER 572 HB3 SER 572 -3.811 -27.176 5.960 530 HG SER 572 HG SER 572 -1.668 -27.887 7.164 531 H VAL 573 H VAL 573 -6.168 -26.618 9.450 532 HA VAL 573 HA VAL 573 -4.409 -27.030 11.794 533 HB VAL 573 HB VAL 573 -7.162 -25.760 11.703 534 HG11 VAL 573 HG11 VAL 573 -5.535 -26.442 14.164 535 HG12 VAL 573 HG12 VAL 573 -7.067 -27.179 13.673 536 HG13 VAL 573 HG13 VAL 573 -7.016 -25.479 14.130 537 HG21 VAL 573 HG21 VAL 573 -6.019 -23.830 12.705 538 HG22 VAL 573 HG22 VAL 573 -5.361 -24.277 11.126 539 HG23 VAL 573 HG23 VAL 573 -4.496 -24.715 12.596 540 H LYS 574 H LYS 574 -4.683 -28.795 12.965 541 HA LYS 574 HA LYS 574 -6.543 -30.817 12.055 542 HB2 LYS 574 HB2 LYS 574 -4.213 -31.413 12.385 543 HB3 LYS 574 HB3 LYS 574 -4.240 -30.788 14.012 544 HG2 LYS 574 HG2 LYS 574 -4.258 -33.170 14.066 545 HG3 LYS 574 HG3 LYS 574 -5.831 -32.592 14.629 546 HD2 LYS 574 HD2 LYS 574 -6.791 -33.053 12.488 547 HD3 LYS 574 HD3 LYS 574 -5.197 -33.488 11.853 548 HE2 LYS 574 HE2 LYS 574 -6.665 -34.945 14.053 549 HE3 LYS 574 HE3 LYS 574 -6.558 -35.462 12.368 550 HZ1 LYS 574 HZ1 LYS 574 -4.139 -35.584 12.626 551 HZ2 LYS 574 HZ2 LYS 574 -4.943 -36.627 13.642 552 HZ3 LYS 574 HZ3 LYS 574 -4.288 -35.212 14.269 553 H VAL 575 H VAL 575 -8.426 -31.066 13.058 554 HA VAL 575 HA VAL 575 -8.693 -29.921 15.725 555 HB VAL 575 HB VAL 575 -10.938 -30.983 13.963 556 HG11 VAL 575 HG11 VAL 575 -11.503 -30.885 16.309 557 HG12 VAL 575 HG12 VAL 575 -12.362 -29.589 15.457 558 HG13 VAL 575 HG13 VAL 575 -10.931 -29.224 16.409 559 HG21 VAL 575 HG21 VAL 575 -10.004 -28.122 14.266 560 HG22 VAL 575 HG22 VAL 575 -11.453 -28.639 13.402 561 HG23 VAL 575 HG23 VAL 575 -9.858 -29.112 12.814 562 H ILE 576 H ILE 576 -9.182 -31.260 17.457 563 HA ILE 576 HA ILE 576 -8.293 -33.966 17.009 564 HB ILE 576 HB ILE 576 -8.955 -32.543 19.576 565 HG12 ILE 576 HG12 ILE 576 -7.157 -31.391 18.407 566 HG13 ILE 576 HG13 ILE 576 -6.540 -32.197 19.835 567 HG21 ILE 576 HG21 ILE 576 -7.416 -35.091 19.116 568 HG22 ILE 576 HG22 ILE 576 -9.006 -34.941 19.870 569 HG23 ILE 576 HG23 ILE 576 -7.586 -34.257 20.662 570 HD11 ILE 576 HD11 ILE 576 -6.258 -33.145 16.985 571 HD12 ILE 576 HD12 ILE 576 -5.617 -33.971 18.409 572 HD13 ILE 576 HD13 ILE 576 -5.000 -32.380 17.956 573 H ASP 577 H ASP 577 -9.435 -35.709 17.260 574 HA ASP 577 HA ASP 577 -12.358 -35.482 17.444 575 HB2 ASP 577 HB2 ASP 577 -11.318 -36.596 15.449 576 HB3 ASP 577 HB3 ASP 577 -10.624 -37.794 16.521 577 H ASP 578 H ASP 578 -12.184 -35.214 19.825 578 HA ASP 578 HA ASP 578 -12.893 -37.518 21.209 579 HB2 ASP 578 HB2 ASP 578 -10.379 -37.996 21.040 580 HB3 ASP 578 HB3 ASP 578 -10.122 -36.583 22.054 581 H GLU 579 H GLU 579 -13.297 -37.068 23.487 582 HA GLU 579 HA GLU 579 -14.202 -35.851 25.133 583 HB2 GLU 579 HB2 GLU 579 -12.054 -33.873 24.355 584 HB3 GLU 579 HB3 GLU 579 -13.089 -33.665 25.762 585 HG2 GLU 579 HG2 GLU 579 -12.295 -35.812 26.636 586 HG3 GLU 579 HG3 GLU 579 -11.207 -35.954 25.259 587 H GLU 580 H GLU 580 -15.262 -35.630 22.504 588 HA GLU 580 HA GLU 580 -16.322 -32.998 22.130 589 HB2 GLU 580 HB2 GLU 580 -17.883 -34.590 20.522 590 HB3 GLU 580 HB3 GLU 580 -16.378 -33.837 20.045 591 HG2 GLU 580 HG2 GLU 580 -16.537 -36.213 19.390 592 HG3 GLU 580 HG3 GLU 580 -15.167 -35.884 20.440 593 H TYR 581 H TYR 581 -16.907 -34.242 24.653 594 HA TYR 581 HA TYR 581 -19.765 -34.735 24.721 595 HB2 TYR 581 HB2 TYR 581 -18.243 -35.977 26.196 596 HB3 TYR 581 HB3 TYR 581 -17.698 -34.475 26.921 597 HD1 TYR 581 HD1 TYR 581 -20.582 -36.745 26.573 598 HD2 TYR 581 HD2 TYR 581 -18.897 -33.511 28.741 599 HE1 TYR 581 HE1 TYR 581 -22.314 -37.010 28.295 600 HE2 TYR 581 HE2 TYR 581 -20.623 -33.758 30.473 601 HH TYR 581 HH TYR 581 -22.520 -36.483 30.715 602 H GLU 582 H GLU 582 -17.665 -32.077 24.831 603 HA GLU 582 HA GLU 582 -19.381 -30.411 26.466 604 HB2 GLU 582 HB2 GLU 582 -16.820 -29.804 25.006 605 HB3 GLU 582 HB3 GLU 582 -17.694 -28.619 25.959 606 HG2 GLU 582 HG2 GLU 582 -17.448 -30.125 27.923 607 HG3 GLU 582 HG3 GLU 582 -16.413 -31.147 26.930 608 H LYS 583 H LYS 583 -18.927 -27.938 24.991 609 HA LYS 583 HA LYS 583 -21.053 -28.320 23.007 610 HB2 LYS 583 HB2 LYS 583 -21.623 -27.133 25.173 611 HB3 LYS 583 HB3 LYS 583 -20.446 -25.913 24.749 612 HG2 LYS 583 HG2 LYS 583 -21.813 -25.310 22.784 613 HG3 LYS 583 HG3 LYS 583 -22.993 -26.539 23.262 614 HD2 LYS 583 HD2 LYS 583 -23.305 -25.347 25.398 615 HD3 LYS 583 HD3 LYS 583 -22.153 -24.133 24.851 616 HE2 LYS 583 HE2 LYS 583 -24.435 -23.351 24.521 617 HE3 LYS 583 HE3 LYS 583 -23.614 -23.567 22.978 618 HZ1 LYS 583 HZ1 LYS 583 -25.497 -25.520 24.184 619 HZ2 LYS 583 HZ2 LYS 583 -24.796 -25.634 22.648 620 HZ3 LYS 583 HZ3 LYS 583 -25.892 -24.406 22.988 621 H ASN 584 H ASN 584 -20.986 -26.183 21.572 622 HA ASN 584 HA ASN 584 -19.113 -26.137 19.692 623 HB2 ASN 584 HB2 ASN 584 -21.185 -24.776 19.709 624 HB3 ASN 584 HB3 ASN 584 -20.395 -23.642 20.788 625 HD21 ASN 584 HD21 ASN 584 -20.490 -24.927 17.587 626 HD22 ASN 584 HD22 ASN 584 -19.621 -23.645 16.824 627 H LYS 585 H LYS 585 -17.085 -25.600 19.385 628 HA LYS 585 HA LYS 585 -15.546 -24.326 21.575 629 HB2 LYS 585 HB2 LYS 585 -14.304 -25.794 19.285 630 HB3 LYS 585 HB3 LYS 585 -13.758 -25.616 20.930 631 HG2 LYS 585 HG2 LYS 585 -16.129 -27.307 20.293 632 HG3 LYS 585 HG3 LYS 585 -14.488 -27.944 20.149 633 HD2 LYS 585 HD2 LYS 585 -14.181 -27.337 22.529 634 HD3 LYS 585 HD3 LYS 585 -15.891 -26.878 22.579 635 HE2 LYS 585 HE2 LYS 585 -15.567 -29.176 23.385 636 HE3 LYS 585 HE3 LYS 585 -16.534 -29.136 21.912 637 HZ1 LYS 585 HZ1 LYS 585 -13.631 -29.683 22.027 638 HZ2 LYS 585 HZ2 LYS 585 -14.633 -29.821 20.630 639 HZ3 LYS 585 HZ3 LYS 585 -14.802 -30.893 21.907 640 H THR 586 H THR 586 -14.215 -22.511 20.884 641 HA THR 586 HA THR 586 -13.812 -22.226 18.072 642 HB THR 586 HB THR 586 -15.872 -20.961 18.231 643 HG1 THR 586 HG1 THR 586 -14.102 -20.069 17.006 644 HG21 THR 586 HG21 THR 586 -15.880 -20.475 20.610 645 HG22 THR 586 HG22 THR 586 -16.157 -19.030 19.636 646 HG23 THR 586 HG23 THR 586 -14.574 -19.299 20.385 647 H PHE 587 H PHE 587 -12.058 -20.976 17.490 648 HA PHE 587 HA PHE 587 -10.467 -19.848 19.607 649 HB2 PHE 587 HB2 PHE 587 -8.435 -21.024 18.892 650 HB3 PHE 587 HB3 PHE 587 -9.648 -22.193 19.376 651 HD1 PHE 587 HD1 PHE 587 -10.768 -23.556 17.617 652 HD2 PHE 587 HD2 PHE 587 -7.540 -20.948 16.736 653 HE1 PHE 587 HE1 PHE 587 -10.364 -24.758 15.492 654 HE2 PHE 587 HE2 PHE 587 -7.143 -22.132 14.625 655 HZ PHE 587 HZ PHE 587 -8.557 -24.041 14.006 656 H PHE 588 H PHE 588 -8.464 -18.800 18.371 657 HA PHE 588 HA PHE 588 -9.677 -17.485 16.049 658 HB2 PHE 588 HB2 PHE 588 -7.998 -16.211 18.238 659 HB3 PHE 588 HB3 PHE 588 -8.453 -15.427 16.738 660 HD1 PHE 588 HD1 PHE 588 -9.754 -16.854 19.887 661 HD2 PHE 588 HD2 PHE 588 -10.538 -14.429 16.488 662 HE1 PHE 588 HE1 PHE 588 -11.826 -16.054 20.946 663 HE2 PHE 588 HE2 PHE 588 -12.590 -13.615 17.522 664 HZ PHE 588 HZ PHE 588 -13.255 -14.436 19.769 665 H LEU 589 H LEU 589 -8.259 -16.773 14.508 666 HA LEU 589 HA LEU 589 -5.617 -18.059 14.590 667 HB2 LEU 589 HB2 LEU 589 -7.641 -18.727 12.862 668 HB3 LEU 589 HB3 LEU 589 -6.860 -17.437 11.974 669 HG LEU 589 HG LEU 589 -6.028 -19.514 11.171 670 HD11 LEU 589 HD11 LEU 589 -3.947 -18.243 12.918 671 HD12 LEU 589 HD12 LEU 589 -4.346 -17.797 11.259 672 HD13 LEU 589 HD13 LEU 589 -3.630 -19.369 11.602 673 HD21 LEU 589 HD21 LEU 589 -4.888 -21.128 12.640 674 HD22 LEU 589 HD22 LEU 589 -6.602 -20.924 13.000 675 HD23 LEU 589 HD23 LEU 589 -5.394 -20.165 14.032 676 H GLU 590 H GLU 590 -4.054 -16.568 14.452 677 HA GLU 590 HA GLU 590 -4.775 -14.004 13.258 678 HB2 GLU 590 HB2 GLU 590 -4.637 -13.828 15.711 679 HB3 GLU 590 HB3 GLU 590 -2.975 -14.410 15.652 680 HG2 GLU 590 HG2 GLU 590 -2.438 -12.423 14.227 681 HG3 GLU 590 HG3 GLU 590 -4.069 -11.836 14.536 682 H ILE 591 H ILE 591 -3.350 -13.267 11.863 683 HA ILE 591 HA ILE 591 -0.969 -14.857 11.459 684 HB ILE 591 HB ILE 591 -0.831 -13.672 9.231 685 HG12 ILE 591 HG12 ILE 591 -3.627 -12.804 9.989 686 HG13 ILE 591 HG13 ILE 591 -2.249 -11.739 9.729 687 HG21 ILE 591 HG21 ILE 591 -1.630 -15.945 9.405 688 HG22 ILE 591 HG22 ILE 591 -2.544 -15.083 8.166 689 HG23 ILE 591 HG23 ILE 591 -3.259 -15.372 9.755 690 HD11 ILE 591 HD11 ILE 591 -3.628 -13.439 7.672 691 HD12 ILE 591 HD12 ILE 591 -2.223 -12.411 7.360 692 HD13 ILE 591 HD13 ILE 591 -3.764 -11.692 7.850 693 H GLY 592 H GLY 592 0.959 -13.955 11.418 694 HA2 GLY 592 HA2 GLY 592 1.202 -11.614 13.103 695 HA3 GLY 592 HA3 GLY 592 2.500 -12.691 12.603 696 H GLU 593 H GLU 593 3.120 -10.176 12.525 697 HA GLU 593 HA GLU 593 2.310 -8.871 10.178 698 HB2 GLU 593 HB2 GLU 593 4.612 -8.282 12.026 699 HB3 GLU 593 HB3 GLU 593 4.105 -7.229 10.709 700 HG2 GLU 593 HG2 GLU 593 1.843 -7.189 11.731 701 HG3 GLU 593 HG3 GLU 593 2.515 -8.015 13.131 702 HA PRO 594 HA PRO 594 4.528 -11.103 7.224 703 HB2 PRO 594 HB2 PRO 594 4.403 -9.242 5.208 704 HB3 PRO 594 HB3 PRO 594 3.084 -10.329 5.637 705 HG2 PRO 594 HG2 PRO 594 3.515 -7.489 6.384 706 HG3 PRO 594 HG3 PRO 594 2.008 -8.304 5.946 707 HD2 PRO 594 HD2 PRO 594 2.662 -7.730 8.476 708 HD3 PRO 594 HD3 PRO 594 1.738 -9.185 8.082 709 H ARG 595 H ARG 595 6.503 -11.323 6.535 710 HA ARG 595 HA ARG 595 8.435 -9.150 6.980 711 HB2 ARG 595 HB2 ARG 595 10.072 -10.993 7.476 712 HB3 ARG 595 HB3 ARG 595 8.755 -10.883 8.636 713 HG2 ARG 595 HG2 ARG 595 7.600 -12.717 7.416 714 HG3 ARG 595 HG3 ARG 595 9.024 -12.829 6.383 715 HD2 ARG 595 HD2 ARG 595 9.042 -13.214 9.366 716 HD3 ARG 595 HD3 ARG 595 8.933 -14.526 8.199 717 HE ARG 595 HE ARG 595 11.171 -12.708 7.965 718 HH11 ARG 595 HH11 ARG 595 9.991 -15.954 8.945 719 HH12 ARG 595 HH12 ARG 595 11.546 -16.557 9.167 720 HH21 ARG 595 HH21 ARG 595 13.299 -13.621 8.265 721 HH22 ARG 595 HH22 ARG 595 13.455 -15.234 8.765 722 H LEU 596 H LEU 596 9.580 -8.549 5.223 723 HA LEU 596 HA LEU 596 9.108 -9.751 2.687 724 HB2 LEU 596 HB2 LEU 596 9.684 -7.243 3.398 725 HB3 LEU 596 HB3 LEU 596 11.328 -7.812 3.281 726 HG LEU 596 HG LEU 596 10.651 -6.601 1.283 727 HD11 LEU 596 HD11 LEU 596 11.218 -8.198 -0.448 728 HD12 LEU 596 HD12 LEU 596 10.977 -9.522 0.692 729 HD13 LEU 596 HD13 LEU 596 12.272 -8.356 0.956 730 HD21 LEU 596 HD21 LEU 596 8.270 -7.113 1.446 731 HD22 LEU 596 HD22 LEU 596 8.635 -8.750 0.881 732 HD23 LEU 596 HD23 LEU 596 8.925 -7.365 -0.179 733 H VAL 597 H VAL 597 10.406 -11.197 1.641 734 HA VAL 597 HA VAL 597 12.723 -12.222 3.101 735 HB VAL 597 HB VAL 597 11.380 -13.348 0.636 736 HG11 VAL 597 HG11 VAL 597 13.292 -14.620 2.588 737 HG12 VAL 597 HG12 VAL 597 13.662 -14.130 0.937 738 HG13 VAL 597 HG13 VAL 597 12.511 -15.437 1.233 739 HG21 VAL 597 HG21 VAL 597 10.299 -14.945 2.126 740 HG22 VAL 597 HG22 VAL 597 9.786 -13.287 2.444 741 HG23 VAL 597 HG23 VAL 597 10.944 -14.080 3.522 742 H GLU 598 H GLU 598 14.437 -10.938 2.613 743 HA GLU 598 HA GLU 598 15.211 -10.797 -0.164 744 HB2 GLU 598 HB2 GLU 598 14.342 -8.513 1.389 745 HB3 GLU 598 HB3 GLU 598 15.999 -8.338 0.833 746 HG2 GLU 598 HG2 GLU 598 13.598 -8.890 -0.886 747 HG3 GLU 598 HG3 GLU 598 14.498 -7.373 -0.776 748 H MET 599 H MET 599 17.405 -10.384 -0.458 749 HA MET 599 HA MET 599 19.026 -10.849 1.933 750 HB2 MET 599 HB2 MET 599 19.579 -11.542 -0.959 751 HB3 MET 599 HB3 MET 599 20.753 -11.716 0.333 752 HG2 MET 599 HG2 MET 599 19.380 -13.360 1.435 753 HG3 MET 599 HG3 MET 599 18.092 -13.126 0.257 754 HE1 MET 599 HE1 MET 599 18.208 -13.901 -2.246 755 HE2 MET 599 HE2 MET 599 19.626 -14.623 -2.999 756 HE3 MET 599 HE3 MET 599 19.662 -12.934 -2.504 757 H SER 600 H SER 600 18.089 -8.491 -0.241 758 HA SER 600 HA SER 600 20.325 -6.867 0.619 759 HB2 SER 600 HB2 SER 600 19.522 -7.084 -2.294 760 HB3 SER 600 HB3 SER 600 20.695 -5.947 -1.635 761 HG SER 600 HG SER 600 21.365 -8.336 -0.772 762 H GLU 601 H GLU 601 17.488 -6.422 -1.616 763 HA GLU 601 HA GLU 601 16.466 -4.353 0.107 764 HB2 GLU 601 HB2 GLU 601 18.316 -3.233 -1.146 765 HB3 GLU 601 HB3 GLU 601 17.508 -3.640 -2.650 766 HG2 GLU 601 HG2 GLU 601 17.148 -1.315 -1.964 767 HG3 GLU 601 HG3 GLU 601 15.639 -2.225 -2.075 768 H LYS 602 H LYS 602 14.381 -3.644 -0.569 769 HA LYS 602 HA LYS 602 13.091 -5.543 -2.423 770 HB2 LYS 602 HB2 LYS 602 11.067 -5.529 -1.021 771 HB3 LYS 602 HB3 LYS 602 12.454 -6.181 -0.178 772 HG2 LYS 602 HG2 LYS 602 11.598 -3.326 0.181 773 HG3 LYS 602 HG3 LYS 602 10.859 -4.616 1.120 774 HD2 LYS 602 HD2 LYS 602 13.050 -5.233 1.996 775 HD3 LYS 602 HD3 LYS 602 13.813 -3.986 1.014 776 HE2 LYS 602 HE2 LYS 602 12.475 -2.294 2.223 777 HE3 LYS 602 HE3 LYS 602 11.844 -3.578 3.249 778 HZ1 LYS 602 HZ1 LYS 602 14.039 -4.058 4.011 779 HZ2 LYS 602 HZ2 LYS 602 13.781 -2.404 4.221 780 HZ3 LYS 602 HZ3 LYS 602 14.711 -2.964 2.938 781 H LYS 603 H LYS 603 10.661 -4.700 -2.750 782 HA LYS 603 HA LYS 603 10.704 -1.850 -3.353 783 HB2 LYS 603 HB2 LYS 603 9.825 -4.092 -5.193 784 HB3 LYS 603 HB3 LYS 603 9.425 -2.409 -5.455 785 HG2 LYS 603 HG2 LYS 603 12.217 -3.556 -5.424 786 HG3 LYS 603 HG3 LYS 603 11.281 -3.173 -6.868 787 HD2 LYS 603 HD2 LYS 603 11.208 -0.805 -6.156 788 HD3 LYS 603 HD3 LYS 603 12.216 -1.211 -4.765 789 HE2 LYS 603 HE2 LYS 603 13.592 -0.267 -6.514 790 HE3 LYS 603 HE3 LYS 603 13.989 -1.969 -6.328 791 HZ1 LYS 603 HZ1 LYS 603 13.840 -1.356 -8.632 792 HZ2 LYS 603 HZ2 LYS 603 12.279 -0.791 -8.451 793 HZ3 LYS 603 HZ3 LYS 603 12.597 -2.434 -8.291 794 H GLY 604 H GLY 604 8.512 -0.992 -3.537 795 HA2 GLY 604 HA2 GLY 604 6.649 -2.491 -1.832 796 HA3 GLY 604 HA3 GLY 604 6.661 -0.742 -2.041 797 H GLY 605 H GLY 605 4.294 -1.818 -2.346 798 HA2 GLY 605 HA2 GLY 605 3.916 -2.301 -5.226 799 HA3 GLY 605 HA3 GLY 605 2.773 -2.746 -3.963 800 H PHE 606 H PHE 606 3.011 -0.288 -2.541 801 HA PHE 606 HA PHE 606 1.942 1.614 -2.275 802 HB2 PHE 606 HB2 PHE 606 2.880 2.143 -5.100 803 HB3 PHE 606 HB3 PHE 606 2.156 3.366 -4.060 804 HD1 PHE 606 HD1 PHE 606 3.303 4.037 -1.967 805 HD2 PHE 606 HD2 PHE 606 5.149 1.491 -4.833 806 HE1 PHE 606 HE1 PHE 606 5.492 4.490 -0.951 807 HE2 PHE 606 HE2 PHE 606 7.344 1.941 -3.822 808 HZ PHE 606 HZ PHE 606 7.520 3.441 -1.878 809 H THR 607 H THR 607 -0.018 0.962 -1.861 810 HA THR 607 HA THR 607 -2.020 1.514 -3.828 811 HB THR 607 HB THR 607 -1.603 -0.928 -4.115 812 HG1 THR 607 HG1 THR 607 -3.714 -0.514 -4.421 813 HG21 THR 607 HG21 THR 607 -2.033 -2.502 -2.269 814 HG22 THR 607 HG22 THR 607 -2.260 -1.142 -1.171 815 HG23 THR 607 HG23 THR 607 -0.683 -1.427 -1.903 816 H ILE 608 H ILE 608 -4.143 1.587 -2.648 817 HA ILE 608 HA ILE 608 -3.710 2.931 -0.144 818 HB ILE 608 HB ILE 608 -5.221 3.814 -1.945 819 HG12 ILE 608 HG12 ILE 608 -5.533 4.542 0.465 820 HG13 ILE 608 HG13 ILE 608 -6.933 4.756 -0.558 821 HG21 ILE 608 HG21 ILE 608 -6.202 1.836 -2.794 822 HG22 ILE 608 HG22 ILE 608 -7.482 2.924 -2.259 823 HG23 ILE 608 HG23 ILE 608 -7.037 1.533 -1.271 824 HD11 ILE 608 HD11 ILE 608 -6.523 2.574 1.477 825 HD12 ILE 608 HD12 ILE 608 -7.942 2.758 0.447 826 HD13 ILE 608 HD13 ILE 608 -7.559 3.994 1.648 827 H THR 609 H THR 609 -4.219 2.136 1.836 828 HA THR 609 HA THR 609 -4.559 -0.648 2.029 829 HB THR 609 HB THR 609 -4.667 -0.079 4.560 830 HG1 THR 609 HG1 THR 609 -5.025 2.014 4.642 831 HG21 THR 609 HG21 THR 609 -2.222 0.190 4.626 832 HG22 THR 609 HG22 THR 609 -2.224 0.582 2.908 833 HG23 THR 609 HG23 THR 609 -2.702 -1.028 3.443 834 H GLU 610 H GLU 610 -6.468 -1.266 1.269 835 HA GLU 610 HA GLU 610 -8.938 -0.055 1.880 836 HB2 GLU 610 HB2 GLU 610 -8.268 -2.741 0.701 837 HB3 GLU 610 HB3 GLU 610 -9.905 -2.121 0.851 838 HG2 GLU 610 HG2 GLU 610 -7.709 -0.742 -0.672 839 HG3 GLU 610 HG3 GLU 610 -8.902 -1.822 -1.394 840 H GLU 611 H GLU 611 -10.281 -0.354 3.471 841 HA GLU 611 HA GLU 611 -9.796 -2.552 5.330 842 HB2 GLU 611 HB2 GLU 611 -10.446 -1.014 7.154 843 HB3 GLU 611 HB3 GLU 611 -9.013 -0.450 6.312 844 HG2 GLU 611 HG2 GLU 611 -10.573 1.037 4.968 845 HG3 GLU 611 HG3 GLU 611 -11.810 0.617 6.144 846 H TYR 612 H TYR 612 -11.649 -3.455 6.231 847 HA TYR 612 HA TYR 612 -13.941 -3.351 4.487 848 HB2 TYR 612 HB2 TYR 612 -13.486 -4.939 7.027 849 HB3 TYR 612 HB3 TYR 612 -14.789 -5.183 5.876 850 HD1 TYR 612 HD1 TYR 612 -14.265 -6.061 3.608 851 HD2 TYR 612 HD2 TYR 612 -11.320 -5.858 6.663 852 HE1 TYR 612 HE1 TYR 612 -12.861 -7.635 2.354 853 HE2 TYR 612 HE2 TYR 612 -9.908 -7.432 5.417 854 HH TYR 612 HH TYR 612 -10.207 -9.191 3.702 855 H ASP 613 H ASP 613 -12.991 -2.303 7.612 856 HA ASP 613 HA ASP 613 -15.417 -0.749 7.959 857 HB2 ASP 613 HB2 ASP 613 -15.911 -2.905 9.024 858 HB3 ASP 613 HB3 ASP 613 -14.394 -2.823 9.902 859 H ASP 614 H ASP 614 -14.981 1.068 9.264 860 HA ASP 614 HA ASP 614 -12.330 1.977 9.359 861 HB2 ASP 614 HB2 ASP 614 -13.143 3.914 10.606 862 HB3 ASP 614 HB3 ASP 614 -14.316 3.523 9.363 863 H LYS 615 H LYS 615 -10.797 1.173 10.551 864 HA LYS 615 HA LYS 615 -11.398 0.465 13.314 865 HB2 LYS 615 HB2 LYS 615 -10.078 -1.337 11.286 866 HB3 LYS 615 HB3 LYS 615 -9.980 -1.600 13.011 867 HG2 LYS 615 HG2 LYS 615 -12.680 -1.408 11.746 868 HG3 LYS 615 HG3 LYS 615 -11.734 -2.869 11.493 869 HD2 LYS 615 HD2 LYS 615 -13.172 -3.268 13.366 870 HD3 LYS 615 HD3 LYS 615 -11.547 -3.080 13.988 871 HE2 LYS 615 HE2 LYS 615 -13.131 -1.976 15.426 872 HE3 LYS 615 HE3 LYS 615 -12.106 -0.767 14.672 873 HZ1 LYS 615 HZ1 LYS 615 -13.867 -0.191 13.185 874 HZ2 LYS 615 HZ2 LYS 615 -14.550 -0.226 14.719 875 HZ3 LYS 615 HZ3 LYS 615 -14.797 -1.496 13.642 876 H GLN 616 H GLN 616 -9.587 0.436 14.648 877 HA GLN 616 HA GLN 616 -7.082 1.318 13.473 878 HB2 GLN 616 HB2 GLN 616 -8.198 2.079 16.196 879 HB3 GLN 616 HB3 GLN 616 -6.598 2.505 15.611 880 HG2 GLN 616 HG2 GLN 616 -7.734 3.753 13.740 881 HG3 GLN 616 HG3 GLN 616 -9.253 3.474 14.583 882 HE21 GLN 616 HE21 GLN 616 -7.921 5.947 13.953 883 HE22 GLN 616 HE22 GLN 616 -7.668 6.773 15.448 884 HA PRO 617 HA PRO 617 -6.001 -2.720 14.556 885 HB2 PRO 617 HB2 PRO 617 -3.277 -2.276 15.072 886 HB3 PRO 617 HB3 PRO 617 -4.005 -2.704 13.525 887 HG2 PRO 617 HG2 PRO 617 -3.151 -0.057 14.539 888 HG3 PRO 617 HG3 PRO 617 -3.188 -0.669 12.883 889 HD2 PRO 617 HD2 PRO 617 -5.000 1.101 13.807 890 HD3 PRO 617 HD3 PRO 617 -5.403 -0.118 12.581 891 H LEU 618 H LEU 618 -6.107 -3.918 16.242 892 HA LEU 618 HA LEU 618 -5.972 -2.759 18.889 893 HB2 LEU 618 HB2 LEU 618 -6.569 -5.600 18.045 894 HB3 LEU 618 HB3 LEU 618 -6.770 -4.946 19.653 895 HG LEU 618 HG LEU 618 -8.363 -4.168 17.212 896 HD11 LEU 618 HD11 LEU 618 -8.914 -6.382 18.048 897 HD12 LEU 618 HD12 LEU 618 -10.221 -5.246 18.373 898 HD13 LEU 618 HD13 LEU 618 -9.129 -5.730 19.671 899 HD21 LEU 618 HD21 LEU 618 -9.745 -2.876 18.775 900 HD22 LEU 618 HD22 LEU 618 -8.098 -2.261 18.711 901 HD23 LEU 618 HD23 LEU 618 -8.617 -3.250 20.080 902 H THR 619 H THR 619 -3.971 -4.475 16.752 903 HA THR 619 HA THR 619 -2.309 -5.805 18.595 904 HB THR 619 HB THR 619 -0.752 -5.725 16.525 905 HG1 THR 619 HG1 THR 619 -2.213 -5.283 14.602 906 HG21 THR 619 HG21 THR 619 -2.090 -7.460 15.391 907 HG22 THR 619 HG22 THR 619 -3.506 -6.973 16.324 908 HG23 THR 619 HG23 THR 619 -2.116 -7.690 17.141 909 H SER 620 H SER 620 -1.530 -3.078 16.463 910 HA SER 620 HA SER 620 -0.365 -1.566 18.602 911 HB2 SER 620 HB2 SER 620 1.905 -1.571 17.441 912 HB3 SER 620 HB3 SER 620 1.464 -3.053 18.293 913 HG SER 620 HG SER 620 1.093 -2.584 15.526 914 H LYS 621 H LYS 621 -0.754 0.513 18.123 915 HA LYS 621 HA LYS 621 -0.527 1.351 15.348 916 HB2 LYS 621 HB2 LYS 621 -2.401 2.908 15.620 917 HB3 LYS 621 HB3 LYS 621 -2.944 1.284 15.962 918 HG2 LYS 621 HG2 LYS 621 -2.869 1.745 18.352 919 HG3 LYS 621 HG3 LYS 621 -2.297 3.383 18.017 920 HD2 LYS 621 HD2 LYS 621 -4.365 3.767 16.681 921 HD3 LYS 621 HD3 LYS 621 -4.937 2.179 17.190 922 HE2 LYS 621 HE2 LYS 621 -4.262 4.466 19.030 923 HE3 LYS 621 HE3 LYS 621 -5.888 4.015 18.528 924 HZ1 LYS 621 HZ1 LYS 621 -5.568 1.870 19.640 925 HZ2 LYS 621 HZ2 LYS 621 -5.371 3.134 20.709 926 HZ3 LYS 621 HZ3 LYS 621 -4.029 2.330 20.128 927 H GLU 622 H GLU 622 0.227 3.621 15.183 928 HA GLU 622 HA GLU 622 1.424 4.636 17.641 929 HB2 GLU 622 HB2 GLU 622 3.692 4.582 16.784 930 HB3 GLU 622 HB3 GLU 622 3.031 2.954 16.862 931 HG2 GLU 622 HG2 GLU 622 2.624 2.961 14.478 932 HG3 GLU 622 HG3 GLU 622 3.143 4.641 14.386 933 H GLU 623 H GLU 623 2.833 6.502 17.109 934 HA GLU 623 HA GLU 623 2.382 7.838 14.594 935 HB2 GLU 623 HB2 GLU 623 2.006 9.181 17.291 936 HB3 GLU 623 HB3 GLU 623 2.133 10.036 15.764 937 HG2 GLU 623 HG2 GLU 623 0.090 8.927 15.001 938 HG3 GLU 623 HG3 GLU 623 -0.027 8.115 16.564 939 H GLU 624 H GLU 624 4.410 7.102 14.173 940 HA GLU 624 HA GLU 624 6.584 8.589 15.303 941 HB2 GLU 624 HB2 GLU 624 5.950 6.123 16.429 942 HB3 GLU 624 HB3 GLU 624 7.124 5.691 15.204 943 HG2 GLU 624 HG2 GLU 624 7.522 7.602 17.497 944 HG3 GLU 624 HG3 GLU 624 8.212 5.991 17.333 945 H GLU 625 H GLU 625 8.626 7.300 14.034 946 HA GLU 625 HA GLU 625 8.047 7.891 11.291 947 HB2 GLU 625 HB2 GLU 625 10.550 6.894 12.609 948 HB3 GLU 625 HB3 GLU 625 10.416 7.473 10.961 949 HG2 GLU 625 HG2 GLU 625 9.786 9.681 11.815 950 HG3 GLU 625 HG3 GLU 625 10.016 9.075 13.461 951 H ARG 626 H ARG 626 8.032 5.130 13.241 952 HA ARG 626 HA ARG 626 8.874 3.280 11.246 953 HB2 ARG 626 HB2 ARG 626 7.530 2.902 13.927 954 HB3 ARG 626 HB3 ARG 626 7.781 1.551 12.836 955 HG2 ARG 626 HG2 ARG 626 9.543 1.609 14.496 956 HG3 ARG 626 HG3 ARG 626 10.212 1.950 12.910 957 HD2 ARG 626 HD2 ARG 626 10.124 4.390 13.496 958 HD3 ARG 626 HD3 ARG 626 9.649 3.922 15.129 959 HE ARG 626 HE ARG 626 11.922 2.496 14.584 960 HH11 ARG 626 HH11 ARG 626 11.135 5.988 14.924 961 HH12 ARG 626 HH12 ARG 626 12.760 6.405 15.205 962 HH21 ARG 626 HH21 ARG 626 14.071 3.154 15.047 963 HH22 ARG 626 HH22 ARG 626 14.437 4.798 15.358 964 H ARG 627 H ARG 627 5.869 4.576 12.304 965 HA ARG 627 HA ARG 627 4.150 3.167 10.576 966 HB2 ARG 627 HB2 ARG 627 3.426 4.579 12.435 967 HB3 ARG 627 HB3 ARG 627 3.947 6.004 11.550 968 HG2 ARG 627 HG2 ARG 627 2.268 5.633 9.872 969 HG3 ARG 627 HG3 ARG 627 1.826 4.086 10.605 970 HD2 ARG 627 HD2 ARG 627 1.224 5.192 12.618 971 HD3 ARG 627 HD3 ARG 627 1.638 6.766 11.938 972 HE ARG 627 HE ARG 627 -0.271 5.432 10.327 973 HH11 ARG 627 HH11 ARG 627 -0.051 7.177 13.400 974 HH12 ARG 627 HH12 ARG 627 -1.683 7.668 13.441 975 HH21 ARG 627 HH21 ARG 627 -2.562 6.059 10.409 976 HH22 ARG 627 HH22 ARG 627 -3.141 6.982 11.713 977 H ILE 628 H ILE 628 5.988 6.170 10.119 978 HA ILE 628 HA ILE 628 5.052 6.722 7.489 979 HB ILE 628 HB ILE 628 7.779 7.405 8.657 980 HG12 ILE 628 HG12 ILE 628 5.216 9.020 8.714 981 HG13 ILE 628 HG13 ILE 628 5.885 8.151 10.087 982 HG21 ILE 628 HG21 ILE 628 7.752 9.275 7.053 983 HG22 ILE 628 HG22 ILE 628 6.209 8.704 6.419 984 HG23 ILE 628 HG23 ILE 628 7.658 7.718 6.228 985 HD11 ILE 628 HD11 ILE 628 7.851 9.592 10.047 986 HD12 ILE 628 HD12 ILE 628 6.366 10.538 10.190 987 HD13 ILE 628 HD13 ILE 628 7.204 10.432 8.641 988 H ALA 629 H ALA 629 7.681 4.781 8.661 989 HA ALA 629 HA ALA 629 8.846 4.141 6.169 990 HB1 ALA 629 HB1 ALA 629 9.056 2.642 8.762 991 HB2 ALA 629 HB2 ALA 629 10.053 4.015 8.289 992 HB3 ALA 629 HB3 ALA 629 10.141 2.507 7.380 993 H GLU 630 H GLU 630 5.945 3.028 7.536 994 HA GLU 630 HA GLU 630 5.764 0.311 7.000 995 HB2 GLU 630 HB2 GLU 630 3.408 0.586 7.150 996 HB3 GLU 630 HB3 GLU 630 4.056 1.911 8.112 997 HG2 GLU 630 HG2 GLU 630 3.872 3.277 5.938 998 HG3 GLU 630 HG3 GLU 630 2.821 1.978 5.400 999 H MET 631 H MET 631 5.791 2.967 4.819 1000 HA MET 631 HA MET 631 4.486 1.799 2.620 1001 HB2 MET 631 HB2 MET 631 5.251 3.732 1.329 1002 HB3 MET 631 HB3 MET 631 4.568 4.178 2.882 1003 HG2 MET 631 HG2 MET 631 6.376 5.580 2.493 1004 HG3 MET 631 HG3 MET 631 6.880 4.467 3.754 1005 HE1 MET 631 HE1 MET 631 9.388 5.252 3.430 1006 HE2 MET 631 HE2 MET 631 8.877 6.380 2.174 1007 HE3 MET 631 HE3 MET 631 10.227 5.280 1.879 1008 H GLY 632 H GLY 632 7.601 1.250 3.812 1009 HA2 GLY 632 HA2 GLY 632 8.500 0.367 1.149 1010 HA3 GLY 632 HA3 GLY 632 9.565 0.846 2.462 1011 H ARG 633 H ARG 633 6.991 -1.002 3.579 1012 HA ARG 633 HA ARG 633 8.549 -3.494 3.387 1013 HB2 ARG 633 HB2 ARG 633 8.381 -3.896 5.749 1014 HB3 ARG 633 HB3 ARG 633 9.008 -2.268 5.566 1015 HG2 ARG 633 HG2 ARG 633 6.820 -1.330 6.071 1016 HG3 ARG 633 HG3 ARG 633 6.140 -2.947 6.148 1017 HD2 ARG 633 HD2 ARG 633 7.704 -3.489 7.981 1018 HD3 ARG 633 HD3 ARG 633 8.264 -1.820 7.958 1019 HE ARG 633 HE ARG 633 5.581 -2.738 8.690 1020 HH11 ARG 633 HH11 ARG 633 8.113 -0.249 8.822 1021 HH12 ARG 633 HH12 ARG 633 7.248 0.737 9.911 1022 HH21 ARG 633 HH21 ARG 633 4.446 -1.378 10.251 1023 HH22 ARG 633 HH22 ARG 633 5.181 0.050 10.779 1024 HA PRO 634 HA PRO 634 4.441 -5.106 2.894 1025 HB2 PRO 634 HB2 PRO 634 4.673 -7.642 3.767 1026 HB3 PRO 634 HB3 PRO 634 5.423 -7.121 2.253 1027 HG2 PRO 634 HG2 PRO 634 6.659 -7.540 4.933 1028 HG3 PRO 634 HG3 PRO 634 7.312 -7.909 3.329 1029 HD2 PRO 634 HD2 PRO 634 7.975 -5.682 4.813 1030 HD3 PRO 634 HD3 PRO 634 8.119 -5.777 3.050 1031 H ILE 635 H ILE 635 2.682 -4.834 4.009 1032 HA ILE 635 HA ILE 635 2.789 -5.322 6.849 1033 HB ILE 635 HB ILE 635 1.354 -3.312 7.229 1034 HG12 ILE 635 HG12 ILE 635 1.656 -1.448 5.420 1035 HG13 ILE 635 HG13 ILE 635 1.934 -2.782 4.314 1036 HG21 ILE 635 HG21 ILE 635 4.050 -2.830 6.046 1037 HG22 ILE 635 HG22 ILE 635 3.694 -3.202 7.738 1038 HG23 ILE 635 HG23 ILE 635 3.191 -1.654 7.043 1039 HD11 ILE 635 HD11 ILE 635 -0.296 -3.645 4.820 1040 HD12 ILE 635 HD12 ILE 635 -0.353 -1.994 4.203 1041 HD13 ILE 635 HD13 ILE 635 -0.560 -2.299 5.928 1042 H LEU 636 H LEU 636 0.690 -5.640 7.804 1043 HA LEU 636 HA LEU 636 -0.955 -7.073 5.907 1044 HB2 LEU 636 HB2 LEU 636 -2.038 -8.007 8.051 1045 HB3 LEU 636 HB3 LEU 636 -0.475 -8.604 7.557 1046 HG LEU 636 HG LEU 636 0.596 -7.227 9.313 1047 HD11 LEU 636 HD11 LEU 636 -0.723 -6.155 11.041 1048 HD12 LEU 636 HD12 LEU 636 -2.206 -6.540 10.168 1049 HD13 LEU 636 HD13 LEU 636 -1.040 -5.416 9.471 1050 HD21 LEU 636 HD21 LEU 636 -0.019 -9.515 9.773 1051 HD22 LEU 636 HD22 LEU 636 -1.626 -8.987 10.280 1052 HD23 LEU 636 HD23 LEU 636 -0.208 -8.515 11.218 1053 H GLY 637 H GLY 637 -3.388 -7.145 6.752 1054 HA2 GLY 637 HA2 GLY 637 -4.340 -4.523 6.250 1055 HA3 GLY 637 HA3 GLY 637 -5.340 -5.896 6.669 1056 H GLU 638 H GLU 638 -6.139 -3.734 7.660 1057 HA GLU 638 HA GLU 638 -5.036 -2.622 9.935 1058 HB2 GLU 638 HB2 GLU 638 -7.025 -1.985 8.424 1059 HB3 GLU 638 HB3 GLU 638 -7.960 -2.981 9.532 1060 HG2 GLU 638 HG2 GLU 638 -8.104 -0.675 10.225 1061 HG3 GLU 638 HG3 GLU 638 -7.095 -1.537 11.395 1062 H HIS 639 H HIS 639 -7.456 -5.165 9.626 1063 HA HIS 639 HA HIS 639 -6.693 -6.170 12.256 1064 HB2 HIS 639 HB2 HIS 639 -9.458 -5.825 11.121 1065 HB3 HIS 639 HB3 HIS 639 -9.139 -7.123 12.262 1066 HD1 HIS 639 HD1 HIS 639 -10.411 -6.220 14.284 1067 HD2 HIS 639 HD2 HIS 639 -7.787 -3.441 12.652 1068 HE1 HIS 639 HE1 HIS 639 -10.308 -4.316 15.911 1069 H THR 640 H THR 640 -5.938 -8.128 12.228 1070 HA THR 640 HA THR 640 -6.686 -9.863 10.024 1071 HB THR 640 HB THR 640 -4.399 -10.905 10.356 1072 HG1 THR 640 HG1 THR 640 -2.971 -9.924 11.639 1073 HG21 THR 640 HG21 THR 640 -5.018 -9.468 8.472 1074 HG22 THR 640 HG22 THR 640 -3.317 -9.322 8.900 1075 HG23 THR 640 HG23 THR 640 -4.463 -8.054 9.370 1076 H LYS 641 H LYS 641 -8.195 -11.066 11.002 1077 HA LYS 641 HA LYS 641 -7.348 -12.837 13.064 1078 HB2 LYS 641 HB2 LYS 641 -7.899 -10.870 14.436 1079 HB3 LYS 641 HB3 LYS 641 -9.501 -10.802 13.715 1080 HG2 LYS 641 HG2 LYS 641 -10.026 -13.001 14.689 1081 HG3 LYS 641 HG3 LYS 641 -8.429 -13.047 15.428 1082 HD2 LYS 641 HD2 LYS 641 -10.575 -10.992 15.992 1083 HD3 LYS 641 HD3 LYS 641 -10.183 -12.362 17.025 1084 HE2 LYS 641 HE2 LYS 641 -7.875 -11.461 17.244 1085 HE3 LYS 641 HE3 LYS 641 -8.404 -10.059 16.309 1086 HZ1 LYS 641 HZ1 LYS 641 -8.473 -9.583 18.666 1087 HZ2 LYS 641 HZ2 LYS 641 -9.468 -10.898 18.941 1088 HZ3 LYS 641 HZ3 LYS 641 -10.044 -9.594 18.040 1089 H LEU 642 H LEU 642 -8.479 -14.606 13.028 1090 HA LEU 642 HA LEU 642 -10.912 -14.721 11.396 1091 HB2 LEU 642 HB2 LEU 642 -8.972 -15.791 10.373 1092 HB3 LEU 642 HB3 LEU 642 -8.723 -16.712 11.839 1093 HG LEU 642 HG LEU 642 -10.993 -17.751 11.425 1094 HD11 LEU 642 HD11 LEU 642 -11.794 -17.720 9.136 1095 HD12 LEU 642 HD12 LEU 642 -10.611 -16.466 8.748 1096 HD13 LEU 642 HD13 LEU 642 -11.894 -16.138 9.908 1097 HD21 LEU 642 HD21 LEU 642 -8.977 -18.958 11.068 1098 HD22 LEU 642 HD22 LEU 642 -8.703 -18.142 9.542 1099 HD23 LEU 642 HD23 LEU 642 -10.074 -19.261 9.718 1100 H GLU 643 H GLU 643 -12.583 -15.414 12.562 1101 HA GLU 643 HA GLU 643 -12.112 -16.635 15.174 1102 HB2 GLU 643 HB2 GLU 643 -13.766 -14.718 14.841 1103 HB3 GLU 643 HB3 GLU 643 -14.730 -15.824 13.891 1104 HG2 GLU 643 HG2 GLU 643 -15.074 -17.247 15.811 1105 HG3 GLU 643 HG3 GLU 643 -14.021 -16.220 16.789 1106 H VAL 644 H VAL 644 -11.834 -18.797 15.063 1107 HA VAL 644 HA VAL 644 -13.175 -20.256 12.915 1108 HB VAL 644 HB VAL 644 -11.017 -21.255 14.785 1109 HG11 VAL 644 HG11 VAL 644 -10.797 -23.091 13.200 1110 HG12 VAL 644 HG12 VAL 644 -12.092 -22.413 12.215 1111 HG13 VAL 644 HG13 VAL 644 -12.437 -23.002 13.844 1112 HG21 VAL 644 HG21 VAL 644 -10.124 -19.478 13.392 1113 HG22 VAL 644 HG22 VAL 644 -10.798 -20.258 11.962 1114 HG23 VAL 644 HG23 VAL 644 -9.496 -21.046 12.862 1115 H ILE 645 H ILE 645 -15.064 -20.944 13.511 1116 HA ILE 645 HA ILE 645 -15.523 -21.765 16.273 1117 HB ILE 645 HB ILE 645 -17.441 -21.351 13.974 1118 HG12 ILE 645 HG12 ILE 645 -16.935 -19.542 16.329 1119 HG13 ILE 645 HG13 ILE 645 -16.215 -19.303 14.742 1120 HG21 ILE 645 HG21 ILE 645 -17.931 -21.730 16.918 1121 HG22 ILE 645 HG22 ILE 645 -18.310 -22.886 15.638 1122 HG23 ILE 645 HG23 ILE 645 -19.161 -21.340 15.717 1123 HD11 ILE 645 HD11 ILE 645 -18.408 -19.061 13.776 1124 HD12 ILE 645 HD12 ILE 645 -18.152 -17.892 15.072 1125 HD13 ILE 645 HD13 ILE 645 -19.158 -19.323 15.353 1126 H ILE 646 H ILE 646 -15.520 -23.857 16.746 1127 HA ILE 646 HA ILE 646 -15.438 -25.808 14.564 1128 HB ILE 646 HB ILE 646 -14.804 -26.329 17.488 1129 HG12 ILE 646 HG12 ILE 646 -12.815 -25.696 15.291 1130 HG13 ILE 646 HG13 ILE 646 -13.245 -24.592 16.593 1131 HG21 ILE 646 HG21 ILE 646 -14.124 -27.821 14.988 1132 HG22 ILE 646 HG22 ILE 646 -15.355 -28.251 16.174 1133 HG23 ILE 646 HG23 ILE 646 -13.652 -28.263 16.632 1134 HD11 ILE 646 HD11 ILE 646 -11.138 -25.724 17.072 1135 HD12 ILE 646 HD12 ILE 646 -11.937 -27.286 16.925 1136 HD13 ILE 646 HD13 ILE 646 -12.377 -26.194 18.232 1137 H GLU 647 H GLU 647 -17.405 -26.498 14.156 1138 HA GLU 647 HA GLU 647 -19.194 -27.081 16.394 1139 HB2 GLU 647 HB2 GLU 647 -20.994 -27.029 14.616 1140 HB3 GLU 647 HB3 GLU 647 -20.324 -25.484 15.121 1141 HG2 GLU 647 HG2 GLU 647 -18.947 -25.385 13.121 1142 HG3 GLU 647 HG3 GLU 647 -19.491 -26.985 12.637 1143 H GLU 648 H GLU 648 -19.513 -29.100 16.812 1144 HA GLU 648 HA GLU 648 -18.483 -31.129 15.082 1145 HB2 GLU 648 HB2 GLU 648 -18.186 -31.520 17.442 1146 HB3 GLU 648 HB3 GLU 648 -19.897 -31.292 17.749 1147 HG2 GLU 648 HG2 GLU 648 -19.277 -33.653 17.886 1148 HG3 GLU 648 HG3 GLU 648 -20.422 -33.365 16.592 1149 H SER 649 H SER 649 -19.376 -31.847 13.594 1150 HA SER 649 HA SER 649 -22.276 -31.856 13.362 1151 HB2 SER 649 HB2 SER 649 -20.034 -31.734 11.377 1152 HB3 SER 649 HB3 SER 649 -21.769 -31.720 10.915 1153 HG SER 649 HG SER 649 -20.635 -29.868 12.709 1154 H TYR 650 H TYR 650 -22.879 -33.863 13.923 1155 HA TYR 650 HA TYR 650 -21.037 -35.992 14.114 1156 HB2 TYR 650 HB2 TYR 650 -24.016 -35.914 14.485 1157 HB3 TYR 650 HB3 TYR 650 -23.040 -37.349 14.734 1158 HD1 TYR 650 HD2 TYR 650 -23.422 -33.869 15.836 1159 HD2 TYR 650 HD1 TYR 650 -22.035 -37.728 16.718 1160 HE1 TYR 650 HE2 TYR 650 -23.004 -33.135 18.166 1161 HE2 TYR 650 HE1 TYR 650 -21.582 -37.053 19.080 1162 HH TYR 650 HH TYR 650 -21.183 -35.026 20.331 1163 H GLU 651 H GLU 651 -23.794 -35.409 12.001 1164 HA GLU 651 HA GLU 651 -23.339 -37.848 10.691 1165 HB2 GLU 651 HB2 GLU 651 -24.950 -35.511 9.638 1166 HB3 GLU 651 HB3 GLU 651 -25.030 -37.159 9.056 1167 HG2 GLU 651 HG2 GLU 651 -25.918 -36.142 11.743 1168 HG3 GLU 651 HG3 GLU 651 -26.925 -36.752 10.435 1169 H PHE 652 H PHE 652 -22.333 -34.631 10.391 1170 HA PHE 652 HA PHE 652 -20.611 -33.583 9.431 1171 HB2 PHE 652 HB2 PHE 652 -19.399 -35.793 9.706 1172 HB3 PHE 652 HB3 PHE 652 -19.851 -36.172 8.051 1173 HD1 PHE 652 HD2 PHE 652 -18.053 -33.662 10.099 1174 HD2 PHE 652 HD1 PHE 652 -18.458 -35.520 6.302 1175 HE1 PHE 652 HE2 PHE 652 -16.035 -32.494 9.319 1176 HE2 PHE 652 HE1 PHE 652 -16.455 -34.362 5.517 1177 HZ PHE 652 HZ PHE 652 -15.233 -32.843 7.021 1178 H LYS 653 H LYS 653 -23.236 -34.425 8.078 1179 HA LYS 653 HA LYS 653 -22.623 -33.703 5.343 1180 HB2 LYS 653 HB2 LYS 653 -24.427 -35.399 5.958 1181 HB3 LYS 653 HB3 LYS 653 -25.354 -34.064 6.619 1182 HG2 LYS 653 HG2 LYS 653 -26.167 -34.620 4.405 1183 HG3 LYS 653 HG3 LYS 653 -25.418 -33.025 4.387 1184 HD2 LYS 653 HD2 LYS 653 -23.389 -33.966 3.418 1185 HD3 LYS 653 HD3 LYS 653 -24.083 -35.587 3.495 1186 HE2 LYS 653 HE2 LYS 653 -25.826 -34.932 1.936 1187 HE3 LYS 653 HE3 LYS 653 -25.213 -33.285 1.903 1188 HZ1 LYS 653 HZ1 LYS 653 -23.758 -35.697 0.959 1189 HZ2 LYS 653 HZ2 LYS 653 -23.158 -34.119 0.891 1190 HZ3 LYS 653 HZ3 LYS 653 -24.501 -34.558 -0.018 1191 H SER 654 H SER 654 -22.071 -31.649 5.141 1192 HA SER 654 HA SER 654 -22.897 -29.686 7.003 1193 HB2 SER 654 HB2 SER 654 -21.229 -29.410 4.504 1194 HB3 SER 654 HB3 SER 654 -21.405 -28.188 5.767 1195 HG SER 654 HG SER 654 -20.696 -30.731 6.590 1196 H THR 655 H THR 655 -25.056 -29.632 6.752 1197 HA THR 655 HA THR 655 -25.882 -27.490 5.153 1198 HB THR 655 HB THR 655 -26.346 -29.074 3.419 1199 HG1 THR 655 HG1 THR 655 -28.918 -29.164 4.343 1200 HG21 THR 655 HG21 THR 655 -27.661 -31.140 3.722 1201 HG22 THR 655 HG22 THR 655 -27.758 -30.800 5.452 1202 HG23 THR 655 HG23 THR 655 -26.196 -31.143 4.710 1203 H VAL 656 H VAL 656 -26.236 -26.467 6.913 1204 HA VAL 656 HA VAL 656 -26.874 -25.841 8.879 1205 HB VAL 656 HB VAL 656 -28.820 -25.118 7.599 1206 HG11 VAL 656 HG11 VAL 656 -29.716 -27.174 6.780 1207 HG12 VAL 656 HG12 VAL 656 -30.970 -26.277 7.637 1208 HG13 VAL 656 HG13 VAL 656 -30.193 -27.659 8.409 1209 HG21 VAL 656 HG21 VAL 656 -28.754 -24.478 9.922 1210 HG22 VAL 656 HG22 VAL 656 -29.556 -25.975 10.393 1211 HG23 VAL 656 HG23 VAL 656 -30.425 -24.770 9.441 1212 H ASP 657 H ASP 657 -25.564 -27.319 9.827 1213 HA ASP 657 HA ASP 657 -26.699 -28.356 12.189 1214 HB2 ASP 657 HB2 ASP 657 -27.255 -30.315 10.757 1215 HB3 ASP 657 HB3 ASP 657 -25.562 -30.443 10.292 Start of MODEL 20 1 H HIS 501 H HIS 501 3.083 0.454 0.051 2 HA HIS 501 HA HIS 501 1.390 -0.845 1.785 3 HB2 HIS 501 HB2 HIS 501 0.021 1.212 1.672 4 HB3 HIS 501 HB3 HIS 501 -0.050 1.064 -0.078 5 HD1 HIS 501 HD1 HIS 501 -1.868 0.081 2.980 6 HD2 HIS 501 HD2 HIS 501 -1.512 -1.295 -0.923 7 HE1 HIS 501 HE1 HIS 501 -3.883 -1.355 2.563 8 H ALA 502 H ALA 502 2.165 -2.635 0.905 9 HA ALA 502 HA ALA 502 2.303 -3.122 -1.908 10 HB1 ALA 502 HB1 ALA 502 3.791 -4.235 -0.246 11 HB2 ALA 502 HB2 ALA 502 2.975 -5.350 -1.343 12 HB3 ALA 502 HB3 ALA 502 2.379 -5.156 0.302 13 H GLY 503 H GLY 503 -0.044 -3.823 0.620 14 HA2 GLY 503 HA2 GLY 503 -2.233 -3.916 -0.903 15 HA3 GLY 503 HA3 GLY 503 -1.585 -5.552 -1.034 16 H ILE 504 H ILE 504 -3.505 -6.253 0.092 17 HA ILE 504 HA ILE 504 -3.467 -5.569 2.919 18 HB ILE 504 HB ILE 504 -5.770 -6.474 1.162 19 HG12 ILE 504 HG12 ILE 504 -6.771 -4.240 2.013 20 HG13 ILE 504 HG13 ILE 504 -5.111 -3.810 2.385 21 HG21 ILE 504 HG21 ILE 504 -5.971 -7.444 3.310 22 HG22 ILE 504 HG22 ILE 504 -7.208 -6.207 3.045 23 HG23 ILE 504 HG23 ILE 504 -5.806 -5.859 4.077 24 HD11 ILE 504 HD11 ILE 504 -5.802 -2.896 0.239 25 HD12 ILE 504 HD12 ILE 504 -6.185 -4.520 -0.343 26 HD13 ILE 504 HD13 ILE 504 -4.519 -4.088 0.023 27 H PHE 505 H PHE 505 -2.399 -7.209 3.941 28 HA PHE 505 HA PHE 505 -3.128 -9.963 3.291 29 HB2 PHE 505 HB2 PHE 505 -0.868 -8.782 4.860 30 HB3 PHE 505 HB3 PHE 505 -1.500 -10.318 5.438 31 HD1 PHE 505 HD2 PHE 505 -1.836 -12.096 3.533 32 HD2 PHE 505 HD1 PHE 505 0.872 -8.850 3.358 33 HE1 PHE 505 HE2 PHE 505 -0.558 -13.287 1.818 34 HE2 PHE 505 HE1 PHE 505 2.179 -10.037 1.620 35 HZ PHE 505 HZ PHE 505 1.422 -12.274 0.829 36 H THR 506 H THR 506 -4.759 -10.891 4.269 37 HA THR 506 HA THR 506 -5.206 -10.746 7.028 38 HB THR 506 HB THR 506 -6.156 -8.480 6.413 39 HG1 THR 506 HG1 THR 506 -7.495 -8.838 8.003 40 HG21 THR 506 HG21 THR 506 -7.002 -9.068 4.156 41 HG22 THR 506 HG22 THR 506 -8.272 -8.369 5.160 42 HG23 THR 506 HG23 THR 506 -8.214 -10.111 4.899 43 H PHE 507 H PHE 507 -7.593 -11.692 7.338 44 HA PHE 507 HA PHE 507 -7.568 -14.161 5.815 45 HB2 PHE 507 HB2 PHE 507 -9.121 -13.221 8.222 46 HB3 PHE 507 HB3 PHE 507 -9.463 -14.758 7.420 47 HD1 PHE 507 HD2 PHE 507 -7.723 -16.486 7.367 48 HD2 PHE 507 HD1 PHE 507 -7.306 -12.956 9.684 49 HE1 PHE 507 HE2 PHE 507 -6.009 -17.588 8.697 50 HE2 PHE 507 HE1 PHE 507 -5.568 -14.043 11.039 51 HZ PHE 507 HZ PHE 507 -4.913 -16.362 10.550 52 H GLU 508 H GLU 508 -9.477 -14.964 4.700 53 HA GLU 508 HA GLU 508 -10.706 -12.956 3.102 54 HB2 GLU 508 HB2 GLU 508 -11.597 -15.820 3.435 55 HB3 GLU 508 HB3 GLU 508 -12.042 -14.737 2.131 56 HG2 GLU 508 HG2 GLU 508 -9.592 -14.663 1.539 57 HG3 GLU 508 HG3 GLU 508 -9.384 -16.000 2.675 58 H GLU 509 H GLU 509 -11.666 -14.779 5.876 59 HA GLU 509 HA GLU 509 -13.960 -13.043 6.178 60 HB2 GLU 509 HB2 GLU 509 -15.215 -14.988 7.153 61 HB3 GLU 509 HB3 GLU 509 -14.921 -15.116 5.432 62 HG2 GLU 509 HG2 GLU 509 -13.234 -16.521 7.487 63 HG3 GLU 509 HG3 GLU 509 -14.686 -17.230 6.789 64 HA PRO 510 HA PRO 510 -12.090 -12.532 10.145 65 HB2 PRO 510 HB2 PRO 510 -14.182 -11.592 11.589 66 HB3 PRO 510 HB3 PRO 510 -13.370 -10.616 10.364 67 HG2 PRO 510 HG2 PRO 510 -15.931 -12.147 10.170 68 HG3 PRO 510 HG3 PRO 510 -15.551 -10.530 9.553 69 HD2 PRO 510 HD2 PRO 510 -15.562 -12.749 7.972 70 HD3 PRO 510 HD3 PRO 510 -14.508 -11.354 7.677 71 H VAL 511 H VAL 511 -14.947 -14.504 9.766 72 HA VAL 511 HA VAL 511 -14.163 -16.103 12.092 73 HB VAL 511 HB VAL 511 -17.026 -15.425 11.336 74 HG11 VAL 511 HG11 VAL 511 -15.950 -16.930 13.707 75 HG12 VAL 511 HG12 VAL 511 -16.812 -17.618 12.334 76 HG13 VAL 511 HG13 VAL 511 -17.641 -16.513 13.434 77 HG21 VAL 511 HG21 VAL 511 -15.991 -13.456 12.280 78 HG22 VAL 511 HG22 VAL 511 -15.398 -14.379 13.655 79 HG23 VAL 511 HG23 VAL 511 -17.128 -14.138 13.441 80 H THR 512 H THR 512 -14.186 -18.279 11.622 81 HA THR 512 HA THR 512 -15.580 -19.057 9.190 82 HB THR 512 HB THR 512 -13.095 -18.856 8.747 83 HG1 THR 512 HG1 THR 512 -13.100 -20.577 7.495 84 HG21 THR 512 HG21 THR 512 -12.905 -21.176 10.673 85 HG22 THR 512 HG22 THR 512 -12.259 -19.560 10.935 86 HG23 THR 512 HG23 THR 512 -11.591 -20.581 9.659 87 H HIS 513 H HIS 513 -16.635 -20.975 9.304 88 HA HIS 513 HA HIS 513 -16.724 -22.282 11.927 89 HB2 HIS 513 HB2 HIS 513 -18.693 -22.285 9.621 90 HB3 HIS 513 HB3 HIS 513 -18.864 -23.285 11.048 91 HD1 HIS 513 HD1 HIS 513 -20.473 -22.339 12.679 92 HD2 HIS 513 HD2 HIS 513 -18.625 -19.371 10.419 93 HE1 HIS 513 HE1 HIS 513 -21.523 -20.162 13.385 94 H VAL 514 H VAL 514 -15.767 -24.227 12.036 95 HA VAL 514 HA VAL 514 -15.362 -25.577 9.488 96 HB VAL 514 HB VAL 514 -13.354 -26.646 10.347 97 HG11 VAL 514 HG11 VAL 514 -13.309 -23.658 10.694 98 HG12 VAL 514 HG12 VAL 514 -13.064 -24.556 9.198 99 HG13 VAL 514 HG13 VAL 514 -11.883 -24.673 10.500 100 HG21 VAL 514 HG21 VAL 514 -13.914 -26.776 12.727 101 HG22 VAL 514 HG22 VAL 514 -13.789 -25.023 12.868 102 HG23 VAL 514 HG23 VAL 514 -12.354 -25.984 12.510 103 H SER 515 H SER 515 -15.497 -27.824 9.454 104 HA SER 515 HA SER 515 -17.707 -28.828 10.806 105 HB2 SER 515 HB2 SER 515 -15.933 -30.688 9.516 106 HB3 SER 515 HB3 SER 515 -17.569 -30.267 9.105 107 HG SER 515 HG SER 515 -16.239 -29.619 7.449 108 H GLU 516 H GLU 516 -17.692 -30.733 12.096 109 HA GLU 516 HA GLU 516 -15.410 -31.102 13.755 110 HB2 GLU 516 HB2 GLU 516 -17.576 -31.254 14.796 111 HB3 GLU 516 HB3 GLU 516 -18.120 -32.404 13.604 112 HG2 GLU 516 HG2 GLU 516 -15.918 -33.098 15.529 113 HG3 GLU 516 HG3 GLU 516 -17.611 -33.218 16.000 114 H SER 517 H SER 517 -17.235 -32.854 11.331 115 HA SER 517 HA SER 517 -15.573 -35.180 11.230 116 HB2 SER 517 HB2 SER 517 -17.715 -34.266 9.328 117 HB3 SER 517 HB3 SER 517 -17.205 -35.919 9.680 118 HG SER 517 HG SER 517 -17.961 -35.588 11.831 119 H ILE 518 H ILE 518 -14.232 -32.570 10.474 120 HA ILE 518 HA ILE 518 -13.983 -32.841 7.569 121 HB ILE 518 HB ILE 518 -14.505 -30.617 8.372 122 HG12 ILE 518 HG12 ILE 518 -11.702 -30.718 7.285 123 HG13 ILE 518 HG13 ILE 518 -13.179 -30.833 6.328 124 HG21 ILE 518 HG21 ILE 518 -11.891 -30.721 9.868 125 HG22 ILE 518 HG22 ILE 518 -13.526 -30.646 10.549 126 HG23 ILE 518 HG23 ILE 518 -12.886 -29.281 9.640 127 HD11 ILE 518 HD11 ILE 518 -13.825 -28.619 7.067 128 HD12 ILE 518 HD12 ILE 518 -12.236 -28.597 6.249 129 HD13 ILE 518 HD13 ILE 518 -12.340 -28.507 8.017 130 H GLY 519 H GLY 519 -12.061 -33.193 10.485 131 HA2 GLY 519 HA2 GLY 519 -10.015 -34.308 10.622 132 HA3 GLY 519 HA3 GLY 519 -9.923 -34.265 8.867 133 H ILE 520 H ILE 520 -9.559 -32.169 7.901 134 HA ILE 520 HA ILE 520 -7.763 -30.542 9.573 135 HB ILE 520 HB ILE 520 -7.304 -31.403 6.721 136 HG12 ILE 520 HG12 ILE 520 -6.887 -33.269 8.286 137 HG13 ILE 520 HG13 ILE 520 -5.423 -32.738 7.469 138 HG21 ILE 520 HG21 ILE 520 -5.071 -30.341 6.979 139 HG22 ILE 520 HG22 ILE 520 -5.561 -29.778 8.581 140 HG23 ILE 520 HG23 ILE 520 -6.401 -29.191 7.149 141 HD11 ILE 520 HD11 ILE 520 -6.235 -32.056 10.268 142 HD12 ILE 520 HD12 ILE 520 -4.743 -31.543 9.473 143 HD13 ILE 520 HD13 ILE 520 -5.032 -33.253 9.806 144 H MET 521 H MET 521 -8.230 -28.450 9.334 145 HA MET 521 HA MET 521 -9.972 -27.717 7.086 146 HB2 MET 521 HB2 MET 521 -10.809 -25.894 8.409 147 HB3 MET 521 HB3 MET 521 -10.906 -27.356 9.369 148 HG2 MET 521 HG2 MET 521 -10.078 -25.864 10.968 149 HG3 MET 521 HG3 MET 521 -8.588 -26.435 10.253 150 HE1 MET 521 HE1 MET 521 -9.277 -23.602 11.807 151 HE2 MET 521 HE2 MET 521 -8.235 -22.481 10.930 152 HE3 MET 521 HE3 MET 521 -7.610 -24.053 11.433 153 H GLU 522 H GLU 522 -9.459 -25.927 5.820 154 HA GLU 522 HA GLU 522 -6.835 -24.715 6.273 155 HB2 GLU 522 HB2 GLU 522 -8.067 -25.625 3.698 156 HB3 GLU 522 HB3 GLU 522 -6.973 -24.267 3.713 157 HG2 GLU 522 HG2 GLU 522 -5.672 -26.082 3.093 158 HG3 GLU 522 HG3 GLU 522 -5.300 -25.839 4.791 159 H VAL 523 H VAL 523 -6.935 -22.651 6.547 160 HA VAL 523 HA VAL 523 -9.190 -21.141 5.406 161 HB VAL 523 HB VAL 523 -7.345 -20.365 7.697 162 HG11 VAL 523 HG11 VAL 523 -8.873 -18.479 8.011 163 HG12 VAL 523 HG12 VAL 523 -9.784 -18.970 6.585 164 HG13 VAL 523 HG13 VAL 523 -8.108 -18.430 6.426 165 HG21 VAL 523 HG21 VAL 523 -9.247 -20.712 9.137 166 HG22 VAL 523 HG22 VAL 523 -8.935 -22.179 8.217 167 HG23 VAL 523 HG23 VAL 523 -10.261 -21.112 7.750 168 H LYS 524 H LYS 524 -8.718 -19.638 3.863 169 HA LYS 524 HA LYS 524 -5.961 -19.494 2.990 170 HB2 LYS 524 HB2 LYS 524 -8.418 -18.358 1.693 171 HB3 LYS 524 HB3 LYS 524 -6.825 -18.561 0.981 172 HG2 LYS 524 HG2 LYS 524 -7.180 -21.069 1.452 173 HG3 LYS 524 HG3 LYS 524 -8.881 -20.636 1.608 174 HD2 LYS 524 HD2 LYS 524 -7.083 -20.216 -0.743 175 HD3 LYS 524 HD3 LYS 524 -8.438 -21.357 -0.629 176 HE2 LYS 524 HE2 LYS 524 -9.933 -19.343 -0.329 177 HE3 LYS 524 HE3 LYS 524 -8.463 -18.392 -0.628 178 HZ1 LYS 524 HZ1 LYS 524 -9.461 -20.344 -2.618 179 HZ2 LYS 524 HZ2 LYS 524 -8.319 -19.142 -2.828 180 HZ3 LYS 524 HZ3 LYS 524 -9.938 -18.743 -2.620 181 H VAL 525 H VAL 525 -4.823 -17.652 2.881 182 HA VAL 525 HA VAL 525 -5.922 -15.341 4.314 183 HB VAL 525 HB VAL 525 -3.021 -16.051 3.817 184 HG11 VAL 525 HG11 VAL 525 -3.377 -13.658 4.133 185 HG12 VAL 525 HG12 VAL 525 -2.529 -14.355 5.515 186 HG13 VAL 525 HG13 VAL 525 -4.251 -13.987 5.631 187 HG21 VAL 525 HG21 VAL 525 -2.943 -16.683 6.186 188 HG22 VAL 525 HG22 VAL 525 -4.057 -17.689 5.258 189 HG23 VAL 525 HG23 VAL 525 -4.684 -16.417 6.301 190 H LEU 526 H LEU 526 -6.190 -13.514 3.254 191 HA LEU 526 HA LEU 526 -5.907 -13.352 0.442 192 HB2 LEU 526 HB2 LEU 526 -6.520 -11.236 2.503 193 HB3 LEU 526 HB3 LEU 526 -6.564 -10.962 0.776 194 HG LEU 526 HG LEU 526 -8.349 -12.890 2.268 195 HD11 LEU 526 HD11 LEU 526 -10.114 -11.252 1.805 196 HD12 LEU 526 HD12 LEU 526 -8.911 -10.160 1.117 197 HD13 LEU 526 HD13 LEU 526 -8.851 -10.574 2.829 198 HD21 LEU 526 HD21 LEU 526 -8.345 -11.967 -0.605 199 HD22 LEU 526 HD22 LEU 526 -9.601 -12.942 0.146 200 HD23 LEU 526 HD23 LEU 526 -7.971 -13.593 -0.031 201 H ARG 527 H ARG 527 -4.165 -13.064 -0.547 202 HA ARG 527 HA ARG 527 -1.702 -12.115 0.515 203 HB2 ARG 527 HB2 ARG 527 -1.766 -13.810 -1.183 204 HB3 ARG 527 HB3 ARG 527 -2.714 -12.790 -2.236 205 HG2 ARG 527 HG2 ARG 527 -0.710 -11.284 -2.436 206 HG3 ARG 527 HG3 ARG 527 0.209 -12.510 -1.544 207 HD2 ARG 527 HD2 ARG 527 -0.204 -14.151 -3.191 208 HD3 ARG 527 HD3 ARG 527 -1.432 -13.141 -3.932 209 HE ARG 527 HE ARG 527 1.434 -13.028 -4.299 210 HH11 ARG 527 HH11 ARG 527 -1.570 -11.149 -4.762 211 HH12 ARG 527 HH12 ARG 527 -1.089 -10.517 -6.264 212 HH21 ARG 527 HH21 ARG 527 2.038 -12.100 -6.416 213 HH22 ARG 527 HH22 ARG 527 0.980 -11.035 -7.199 214 H THR 528 H THR 528 -0.576 -10.181 -0.125 215 HA THR 528 HA THR 528 -1.973 -7.821 -0.303 216 HB THR 528 HB THR 528 0.329 -7.090 -1.309 217 HG1 THR 528 HG1 THR 528 0.857 -9.265 -1.795 218 HG21 THR 528 HG21 THR 528 -0.370 -6.589 0.982 219 HG22 THR 528 HG22 THR 528 1.319 -7.103 0.963 220 HG23 THR 528 HG23 THR 528 0.058 -8.224 1.477 221 H SER 529 H SER 529 -2.907 -6.847 -1.934 222 HA SER 529 HA SER 529 -3.485 -7.708 -4.389 223 HB2 SER 529 HB2 SER 529 -4.514 -5.819 -3.222 224 HB3 SER 529 HB3 SER 529 -3.056 -4.877 -3.407 225 HG SER 529 HG SER 529 -4.849 -5.725 -5.438 226 H GLY 530 H GLY 530 -0.548 -5.960 -3.433 227 HA2 GLY 530 HA2 GLY 530 0.658 -6.603 -6.043 228 HA3 GLY 530 HA3 GLY 530 0.937 -5.088 -5.194 229 H ALA 531 H ALA 531 1.447 -8.549 -5.051 230 HA ALA 531 HA ALA 531 3.162 -8.259 -2.731 231 HB1 ALA 531 HB1 ALA 531 1.773 -10.282 -2.945 232 HB2 ALA 531 HB2 ALA 531 3.491 -10.680 -2.910 233 HB3 ALA 531 HB3 ALA 531 2.612 -10.689 -4.439 234 H ARG 532 H ARG 532 4.940 -7.268 -3.153 235 HA ARG 532 HA ARG 532 6.315 -7.770 -5.676 236 HB2 ARG 532 HB2 ARG 532 6.719 -5.540 -3.672 237 HB3 ARG 532 HB3 ARG 532 7.424 -5.638 -5.281 238 HG2 ARG 532 HG2 ARG 532 4.484 -5.384 -4.651 239 HG3 ARG 532 HG3 ARG 532 5.505 -4.064 -5.191 240 HD2 ARG 532 HD2 ARG 532 5.890 -5.235 -7.308 241 HD3 ARG 532 HD3 ARG 532 4.905 -6.584 -6.742 242 HE ARG 532 HE ARG 532 3.406 -4.227 -6.574 243 HH11 ARG 532 HH11 ARG 532 4.764 -6.324 -9.044 244 HH12 ARG 532 HH12 ARG 532 3.550 -6.038 -10.192 245 HH21 ARG 532 HH21 ARG 532 1.743 -3.797 -8.107 246 HH22 ARG 532 HH22 ARG 532 1.786 -4.543 -9.653 247 H GLY 533 H GLY 533 7.468 -9.624 -5.255 248 HA2 GLY 533 HA2 GLY 533 9.764 -10.187 -4.707 249 HA3 GLY 533 HA3 GLY 533 9.529 -9.348 -3.183 250 H ASN 534 H ASN 534 10.018 -11.037 -1.877 251 HA ASN 534 HA ASN 534 8.167 -13.310 -1.871 252 HB2 ASN 534 HB2 ASN 534 10.450 -14.033 -2.433 253 HB3 ASN 534 HB3 ASN 534 11.095 -13.154 -1.063 254 HD21 ASN 534 HD21 ASN 534 8.143 -15.151 -0.870 255 HD22 ASN 534 HD22 ASN 534 8.879 -16.350 0.114 256 H VAL 535 H VAL 535 7.077 -13.570 0.077 257 HA VAL 535 HA VAL 535 7.831 -11.735 2.226 258 HB VAL 535 HB VAL 535 5.024 -12.186 1.194 259 HG11 VAL 535 HG11 VAL 535 5.080 -11.710 3.536 260 HG12 VAL 535 HG12 VAL 535 4.403 -10.335 2.653 261 HG13 VAL 535 HG13 VAL 535 6.066 -10.276 3.250 262 HG21 VAL 535 HG21 VAL 535 6.845 -9.828 0.783 263 HG22 VAL 535 HG22 VAL 535 5.118 -9.825 0.401 264 HG23 VAL 535 HG23 VAL 535 6.221 -10.917 -0.451 265 H ILE 536 H ILE 536 7.511 -12.633 4.244 266 HA ILE 536 HA ILE 536 6.154 -15.237 4.354 267 HB ILE 536 HB ILE 536 8.323 -14.153 6.173 268 HG12 ILE 536 HG12 ILE 536 9.227 -15.019 4.116 269 HG13 ILE 536 HG13 ILE 536 9.620 -16.131 5.421 270 HG21 ILE 536 HG21 ILE 536 6.776 -16.700 6.376 271 HG22 ILE 536 HG22 ILE 536 6.692 -15.340 7.487 272 HG23 ILE 536 HG23 ILE 536 8.172 -16.308 7.387 273 HD11 ILE 536 HD11 ILE 536 7.663 -17.511 4.669 274 HD12 ILE 536 HD12 ILE 536 9.014 -17.423 3.538 275 HD13 ILE 536 HD13 ILE 536 7.572 -16.462 3.247 276 H VAL 537 H VAL 537 4.440 -15.430 5.665 277 HA VAL 537 HA VAL 537 3.912 -13.207 7.475 278 HB VAL 537 HB VAL 537 1.804 -14.916 6.112 279 HG11 VAL 537 HG11 VAL 537 1.536 -12.409 7.763 280 HG12 VAL 537 HG12 VAL 537 1.077 -14.038 8.260 281 HG13 VAL 537 HG13 VAL 537 0.212 -13.242 6.944 282 HG21 VAL 537 HG21 VAL 537 2.659 -12.098 5.495 283 HG22 VAL 537 HG22 VAL 537 1.305 -12.946 4.733 284 HG23 VAL 537 HG23 VAL 537 2.963 -13.516 4.500 285 HA PRO 538 HA PRO 538 4.181 -16.776 10.286 286 HB2 PRO 538 HB2 PRO 538 4.307 -15.289 12.561 287 HB3 PRO 538 HB3 PRO 538 5.716 -15.682 11.571 288 HG2 PRO 538 HG2 PRO 538 4.192 -13.142 11.812 289 HG3 PRO 538 HG3 PRO 538 5.898 -13.385 11.422 290 HD2 PRO 538 HD2 PRO 538 3.894 -12.762 9.598 291 HD3 PRO 538 HD3 PRO 538 5.474 -13.451 9.190 292 H TYR 539 H TYR 539 2.736 -17.755 11.686 293 HA TYR 539 HA TYR 539 0.425 -16.240 12.575 294 HB2 TYR 539 HB2 TYR 539 -1.222 -17.791 11.678 295 HB3 TYR 539 HB3 TYR 539 -0.222 -17.123 10.393 296 HD1 TYR 539 HD1 TYR 539 -0.894 -20.188 12.378 297 HD2 TYR 539 HD2 TYR 539 1.059 -18.527 8.993 298 HE1 TYR 539 HE1 TYR 539 -0.473 -22.453 11.521 299 HE2 TYR 539 HE2 TYR 539 1.484 -20.794 8.130 300 HH TYR 539 HH TYR 539 1.641 -23.050 8.889 301 H LYS 540 H LYS 540 -0.989 -17.556 13.969 302 HA LYS 540 HA LYS 540 0.119 -19.908 15.210 303 HB2 LYS 540 HB2 LYS 540 0.280 -18.955 17.446 304 HB3 LYS 540 HB3 LYS 540 1.411 -18.170 16.355 305 HG2 LYS 540 HG2 LYS 540 -0.017 -16.261 16.164 306 HG3 LYS 540 HG3 LYS 540 -1.274 -17.063 17.101 307 HD2 LYS 540 HD2 LYS 540 0.238 -17.125 19.031 308 HD3 LYS 540 HD3 LYS 540 1.458 -16.257 18.088 309 HE2 LYS 540 HE2 LYS 540 -1.315 -15.294 18.558 310 HE3 LYS 540 HE3 LYS 540 0.049 -14.823 19.592 311 HZ1 LYS 540 HZ1 LYS 540 -0.526 -13.191 17.761 312 HZ2 LYS 540 HZ2 LYS 540 -0.045 -14.352 16.647 313 HZ3 LYS 540 HZ3 LYS 540 1.062 -13.740 17.746 314 H THR 541 H THR 541 -1.408 -21.046 16.330 315 HA THR 541 HA THR 541 -4.129 -20.144 16.184 316 HB THR 541 HB THR 541 -4.502 -22.304 17.483 317 HG1 THR 541 HG1 THR 541 -2.199 -22.275 18.161 318 HG21 THR 541 HG21 THR 541 -4.803 -22.207 15.057 319 HG22 THR 541 HG22 THR 541 -4.101 -23.751 15.523 320 HG23 THR 541 HG23 THR 541 -3.077 -22.481 14.831 321 H ILE 542 H ILE 542 -5.279 -19.343 17.838 322 HA ILE 542 HA ILE 542 -3.865 -18.815 20.339 323 HB ILE 542 HB ILE 542 -6.340 -17.577 19.151 324 HG12 ILE 542 HG12 ILE 542 -3.563 -16.400 19.395 325 HG13 ILE 542 HG13 ILE 542 -4.229 -17.085 17.917 326 HG21 ILE 542 HG21 ILE 542 -4.740 -16.786 21.599 327 HG22 ILE 542 HG22 ILE 542 -6.368 -17.467 21.594 328 HG23 ILE 542 HG23 ILE 542 -6.082 -15.859 20.924 329 HD11 ILE 542 HD11 ILE 542 -5.317 -14.698 19.395 330 HD12 ILE 542 HD12 ILE 542 -5.938 -15.364 17.877 331 HD13 ILE 542 HD13 ILE 542 -4.327 -14.655 17.935 332 H GLU 543 H GLU 543 -4.346 -20.213 21.860 333 HA GLU 543 HA GLU 543 -6.656 -21.890 21.873 334 HB2 GLU 543 HB2 GLU 543 -4.568 -21.321 23.979 335 HB3 GLU 543 HB3 GLU 543 -5.804 -22.563 24.119 336 HG2 GLU 543 HG2 GLU 543 -4.869 -23.802 22.321 337 HG3 GLU 543 HG3 GLU 543 -3.778 -22.481 21.902 338 H GLY 544 H GLY 544 -8.536 -20.826 22.071 339 HA2 GLY 544 HA2 GLY 544 -8.785 -18.892 24.281 340 HA3 GLY 544 HA3 GLY 544 -9.748 -18.832 22.805 341 H THR 545 H THR 545 -11.604 -19.840 22.715 342 HA THR 545 HA THR 545 -12.603 -21.087 25.085 343 HB THR 545 HB THR 545 -14.170 -20.891 22.577 344 HG1 THR 545 HG1 THR 545 -14.166 -18.697 22.551 345 HG21 THR 545 HG21 THR 545 -15.775 -19.889 24.112 346 HG22 THR 545 HG22 THR 545 -14.537 -19.837 25.364 347 HG23 THR 545 HG23 THR 545 -15.149 -21.400 24.797 348 H ALA 546 H ALA 546 -10.571 -22.629 23.874 349 HA ALA 546 HA ALA 546 -11.900 -25.067 23.317 350 HB1 ALA 546 HB1 ALA 546 -11.934 -24.075 21.066 351 HB2 ALA 546 HB2 ALA 546 -10.886 -25.493 21.126 352 HB3 ALA 546 HB3 ALA 546 -10.183 -23.875 21.136 353 H ARG 547 H ARG 547 -10.532 -26.867 23.617 354 HA ARG 547 HA ARG 547 -8.190 -26.328 25.152 355 HB2 ARG 547 HB2 ARG 547 -9.632 -28.819 24.335 356 HB3 ARG 547 HB3 ARG 547 -8.039 -28.885 25.073 357 HG2 ARG 547 HG2 ARG 547 -8.837 -27.784 27.013 358 HG3 ARG 547 HG3 ARG 547 -10.441 -27.574 26.301 359 HD2 ARG 547 HD2 ARG 547 -9.268 -30.314 26.491 360 HD3 ARG 547 HD3 ARG 547 -9.964 -29.593 27.936 361 HE ARG 547 HE ARG 547 -12.085 -29.480 26.781 362 HH11 ARG 547 HH11 ARG 547 -9.757 -31.607 25.184 363 HH12 ARG 547 HH12 ARG 547 -10.985 -32.589 24.489 364 HH21 ARG 547 HH21 ARG 547 -13.631 -30.824 25.906 365 HH22 ARG 547 HH22 ARG 547 -13.208 -32.117 24.833 366 H GLY 548 H GLY 548 -6.302 -26.074 24.415 367 HA2 GLY 548 HA2 GLY 548 -5.616 -26.767 21.685 368 HA3 GLY 548 HA3 GLY 548 -4.586 -25.913 22.833 369 H GLY 549 H GLY 549 -2.917 -27.375 22.001 370 HA2 GLY 549 HA2 GLY 549 -1.487 -29.092 22.366 371 HA3 GLY 549 HA3 GLY 549 -2.394 -29.423 23.832 372 H GLY 550 H GLY 550 -3.878 -29.486 20.693 373 HA2 GLY 550 HA2 GLY 550 -4.660 -31.199 19.390 374 HA3 GLY 550 HA3 GLY 550 -3.476 -32.236 20.168 375 H GLU 551 H GLU 551 -6.084 -30.431 21.685 376 HA GLU 551 HA GLU 551 -7.147 -33.035 22.503 377 HB2 GLU 551 HB2 GLU 551 -6.196 -31.166 24.146 378 HB3 GLU 551 HB3 GLU 551 -7.865 -30.617 23.996 379 HG2 GLU 551 HG2 GLU 551 -7.622 -32.107 25.927 380 HG3 GLU 551 HG3 GLU 551 -8.667 -32.805 24.688 381 H ASP 552 H ASP 552 -8.318 -29.647 21.987 382 HA ASP 552 HA ASP 552 -10.707 -30.836 20.753 383 HB2 ASP 552 HB2 ASP 552 -10.058 -27.985 21.547 384 HB3 ASP 552 HB3 ASP 552 -11.358 -28.334 20.421 385 H PHE 553 H PHE 553 -7.953 -28.860 20.188 386 HA PHE 553 HA PHE 553 -8.124 -29.515 17.367 387 HB2 PHE 553 HB2 PHE 553 -7.754 -27.247 16.604 388 HB3 PHE 553 HB3 PHE 553 -9.183 -27.257 17.621 389 HD1 PHE 553 HD1 PHE 553 -8.990 -26.350 19.980 390 HD2 PHE 553 HD2 PHE 553 -5.908 -25.890 17.086 391 HE1 PHE 553 HE1 PHE 553 -8.018 -24.512 21.299 392 HE2 PHE 553 HE2 PHE 553 -4.937 -24.066 18.400 393 HZ PHE 553 HZ PHE 553 -5.987 -23.371 20.504 394 H GLU 554 H GLU 554 -6.132 -29.547 16.367 395 HA GLU 554 HA GLU 554 -3.878 -29.791 18.153 396 HB2 GLU 554 HB2 GLU 554 -4.646 -31.273 16.091 397 HB3 GLU 554 HB3 GLU 554 -3.889 -30.009 15.162 398 HG2 GLU 554 HG2 GLU 554 -2.494 -31.611 17.263 399 HG3 GLU 554 HG3 GLU 554 -2.525 -32.026 15.556 400 H ASP 555 H ASP 555 -2.824 -27.972 18.611 401 HA ASP 555 HA ASP 555 -3.418 -25.566 17.162 402 HB2 ASP 555 HB2 ASP 555 -2.362 -24.346 18.893 403 HB3 ASP 555 HB3 ASP 555 -3.114 -25.704 19.710 404 H THR 556 H THR 556 -1.883 -24.194 16.158 405 HA THR 556 HA THR 556 0.509 -25.545 15.292 406 HB THR 556 HB THR 556 -1.251 -26.379 13.776 407 HG1 THR 556 HG1 THR 556 0.506 -26.361 12.672 408 HG21 THR 556 HG21 THR 556 -2.314 -24.862 12.140 409 HG22 THR 556 HG22 THR 556 -1.632 -23.484 13.009 410 HG23 THR 556 HG23 THR 556 -2.806 -24.533 13.798 411 H CYS 557 H CYS 557 1.971 -24.180 14.280 412 HA CYS 557 HA CYS 557 1.456 -21.378 14.009 413 HB2 CYS 557 HB2 CYS 557 3.421 -20.821 15.541 414 HB3 CYS 557 HB3 CYS 557 1.933 -21.304 16.343 415 HG CYS 557 HG CYS 557 4.060 -23.818 15.728 416 H GLY 558 H GLY 558 2.832 -20.500 12.486 417 HA2 GLY 558 HA2 GLY 558 5.257 -21.609 11.775 418 HA3 GLY 558 HA3 GLY 558 3.991 -22.282 10.746 419 H GLU 559 H GLU 559 5.261 -21.127 9.126 420 HA GLU 559 HA GLU 559 4.474 -18.318 8.984 421 HB2 GLU 559 HB2 GLU 559 7.068 -19.645 8.281 422 HB3 GLU 559 HB3 GLU 559 6.662 -17.987 7.836 423 HG2 GLU 559 HG2 GLU 559 6.618 -17.331 10.132 424 HG3 GLU 559 HG3 GLU 559 6.747 -19.005 10.661 425 H LEU 560 H LEU 560 3.481 -17.802 7.131 426 HA LEU 560 HA LEU 560 3.277 -19.821 5.038 427 HB2 LEU 560 HB2 LEU 560 1.802 -17.233 5.469 428 HB3 LEU 560 HB3 LEU 560 1.540 -18.306 4.114 429 HG LEU 560 HG LEU 560 1.000 -18.928 7.004 430 HD11 LEU 560 HD11 LEU 560 -0.854 -18.443 4.687 431 HD12 LEU 560 HD12 LEU 560 -0.591 -17.374 6.065 432 HD13 LEU 560 HD13 LEU 560 -1.335 -18.958 6.301 433 HD21 LEU 560 HD21 LEU 560 1.674 -20.947 5.936 434 HD22 LEU 560 HD22 LEU 560 0.725 -20.599 4.517 435 HD23 LEU 560 HD23 LEU 560 -0.088 -20.988 6.043 436 H GLU 561 H GLU 561 4.199 -19.598 3.134 437 HA GLU 561 HA GLU 561 5.898 -17.274 2.743 438 HB2 GLU 561 HB2 GLU 561 6.863 -19.550 2.677 439 HB3 GLU 561 HB3 GLU 561 5.836 -19.922 1.306 440 HG2 GLU 561 HG2 GLU 561 7.006 -17.814 0.264 441 HG3 GLU 561 HG3 GLU 561 8.195 -18.140 1.494 442 H PHE 562 H PHE 562 5.216 -15.742 1.424 443 HA PHE 562 HA PHE 562 3.458 -16.449 -0.815 444 HB2 PHE 562 HB2 PHE 562 3.487 -13.942 0.873 445 HB3 PHE 562 HB3 PHE 562 2.664 -14.058 -0.672 446 HD1 PHE 562 HD2 PHE 562 2.650 -15.086 2.837 447 HD2 PHE 562 HD1 PHE 562 0.629 -15.294 -0.895 448 HE1 PHE 562 HE2 PHE 562 0.625 -15.883 3.983 449 HE2 PHE 562 HE1 PHE 562 -1.402 -16.085 0.244 450 HZ PHE 562 HZ PHE 562 -1.403 -16.381 2.683 451 H GLN 563 H GLN 563 3.806 -15.111 -2.710 452 HA GLN 563 HA GLN 563 6.208 -13.524 -2.780 453 HB2 GLN 563 HB2 GLN 563 5.885 -15.886 -4.663 454 HB3 GLN 563 HB3 GLN 563 7.163 -14.687 -4.668 455 HG2 GLN 563 HG2 GLN 563 7.856 -15.481 -2.453 456 HG3 GLN 563 HG3 GLN 563 6.675 -16.782 -2.576 457 HE21 GLN 563 HE21 GLN 563 8.679 -15.561 -5.225 458 HE22 GLN 563 HE22 GLN 563 9.618 -17.001 -5.311 459 H ASN 564 H ASN 564 6.434 -12.895 -5.227 460 HA ASN 564 HA ASN 564 4.070 -11.616 -6.073 461 HB2 ASN 564 HB2 ASN 564 6.308 -10.802 -6.699 462 HB3 ASN 564 HB3 ASN 564 6.601 -12.278 -7.609 463 HD21 ASN 564 HD21 ASN 564 6.952 -11.173 -9.520 464 HD22 ASN 564 HD22 ASN 564 5.676 -10.404 -10.386 465 H ASP 565 H ASP 565 5.730 -14.545 -7.027 466 HA ASP 565 HA ASP 565 3.795 -15.197 -9.045 467 HB2 ASP 565 HB2 ASP 565 6.116 -15.755 -9.404 468 HB3 ASP 565 HB3 ASP 565 6.139 -16.738 -7.950 469 H GLU 566 H GLU 566 4.121 -15.979 -5.641 470 HA GLU 566 HA GLU 566 2.570 -18.351 -5.783 471 HB2 GLU 566 HB2 GLU 566 3.490 -16.649 -3.496 472 HB3 GLU 566 HB3 GLU 566 2.520 -18.096 -3.298 473 HG2 GLU 566 HG2 GLU 566 5.292 -17.899 -4.445 474 HG3 GLU 566 HG3 GLU 566 4.807 -18.644 -2.917 475 H ILE 567 H ILE 567 0.493 -18.686 -5.058 476 HA ILE 567 HA ILE 567 -1.149 -16.352 -5.434 477 HB ILE 567 HB ILE 567 -3.104 -18.008 -5.529 478 HG12 ILE 567 HG12 ILE 567 -0.919 -19.983 -6.156 479 HG13 ILE 567 HG13 ILE 567 -1.667 -19.966 -4.570 480 HG21 ILE 567 HG21 ILE 567 -2.215 -16.847 -7.461 481 HG22 ILE 567 HG22 ILE 567 -2.614 -18.517 -7.871 482 HG23 ILE 567 HG23 ILE 567 -0.935 -18.052 -7.613 483 HD11 ILE 567 HD11 ILE 567 -3.027 -20.457 -7.209 484 HD12 ILE 567 HD12 ILE 567 -3.820 -20.405 -5.625 485 HD13 ILE 567 HD13 ILE 567 -2.627 -21.656 -5.970 486 H VAL 568 H VAL 568 -2.210 -19.055 -3.356 487 HA VAL 568 HA VAL 568 -2.428 -17.125 -1.210 488 HB VAL 568 HB VAL 568 -4.589 -17.232 -2.430 489 HG11 VAL 568 HG11 VAL 568 -6.044 -19.195 -2.187 490 HG12 VAL 568 HG12 VAL 568 -4.669 -20.110 -1.577 491 HG13 VAL 568 HG13 VAL 568 -4.651 -19.492 -3.239 492 HG21 VAL 568 HG21 VAL 568 -6.046 -17.598 -0.530 493 HG22 VAL 568 HG22 VAL 568 -4.619 -16.644 -0.095 494 HG23 VAL 568 HG23 VAL 568 -4.718 -18.353 0.349 495 H LYS 569 H LYS 569 -2.326 -18.035 0.821 496 HA LYS 569 HA LYS 569 -1.479 -20.835 0.869 497 HB2 LYS 569 HB2 LYS 569 -0.619 -18.511 2.562 498 HB3 LYS 569 HB3 LYS 569 -0.331 -20.193 2.991 499 HG2 LYS 569 HG2 LYS 569 0.507 -19.521 0.311 500 HG3 LYS 569 HG3 LYS 569 1.355 -18.580 1.544 501 HD2 LYS 569 HD2 LYS 569 2.654 -20.583 1.104 502 HD3 LYS 569 HD3 LYS 569 1.903 -20.767 2.673 503 HE2 LYS 569 HE2 LYS 569 0.194 -22.202 1.751 504 HE3 LYS 569 HE3 LYS 569 0.811 -21.953 0.122 505 HZ1 LYS 569 HZ1 LYS 569 2.247 -23.315 2.348 506 HZ2 LYS 569 HZ2 LYS 569 2.886 -23.046 0.822 507 HZ3 LYS 569 HZ3 LYS 569 1.560 -24.065 1.003 508 H THR 570 H THR 570 -1.964 -21.996 2.793 509 HA THR 570 HA THR 570 -4.434 -21.093 4.058 510 HB THR 570 HB THR 570 -4.864 -23.643 4.079 511 HG1 THR 570 HG1 THR 570 -3.472 -23.604 1.634 512 HG21 THR 570 HG21 THR 570 -5.171 -21.980 1.573 513 HG22 THR 570 HG22 THR 570 -6.280 -22.060 2.954 514 HG23 THR 570 HG23 THR 570 -6.061 -23.472 1.930 515 H ILE 571 H ILE 571 -4.741 -21.747 6.149 516 HA ILE 571 HA ILE 571 -2.446 -22.941 7.505 517 HB ILE 571 HB ILE 571 -4.896 -21.564 8.707 518 HG12 ILE 571 HG12 ILE 571 -3.089 -20.020 9.690 519 HG13 ILE 571 HG13 ILE 571 -2.017 -20.752 8.506 520 HG21 ILE 571 HG21 ILE 571 -3.858 -21.856 10.893 521 HG22 ILE 571 HG22 ILE 571 -2.526 -22.735 10.145 522 HG23 ILE 571 HG23 ILE 571 -4.150 -23.414 10.111 523 HD11 ILE 571 HD11 ILE 571 -2.873 -18.606 7.774 524 HD12 ILE 571 HD12 ILE 571 -4.526 -19.225 7.880 525 HD13 ILE 571 HD13 ILE 571 -3.394 -19.916 6.713 526 H SER 572 H SER 572 -2.545 -25.027 7.926 527 HA SER 572 HA SER 572 -5.106 -26.425 7.690 528 HB2 SER 572 HB2 SER 572 -2.248 -27.429 7.603 529 HB3 SER 572 HB3 SER 572 -3.678 -28.450 7.457 530 HG SER 572 HG SER 572 -4.194 -27.535 5.587 531 H VAL 573 H VAL 573 -6.096 -26.835 9.505 532 HA VAL 573 HA VAL 573 -4.489 -27.420 11.913 533 HB VAL 573 HB VAL 573 -7.173 -26.003 11.841 534 HG11 VAL 573 HG11 VAL 573 -6.984 -27.371 13.831 535 HG12 VAL 573 HG12 VAL 573 -6.895 -25.650 14.216 536 HG13 VAL 573 HG13 VAL 573 -5.420 -26.621 14.209 537 HG21 VAL 573 HG21 VAL 573 -5.929 -24.070 12.739 538 HG22 VAL 573 HG22 VAL 573 -5.428 -24.543 11.114 539 HG23 VAL 573 HG23 VAL 573 -4.430 -24.974 12.506 540 H LYS 574 H LYS 574 -4.835 -29.356 12.802 541 HA LYS 574 HA LYS 574 -6.920 -31.065 11.798 542 HB2 LYS 574 HB2 LYS 574 -4.742 -32.064 12.221 543 HB3 LYS 574 HB3 LYS 574 -4.751 -31.495 13.874 544 HG2 LYS 574 HG2 LYS 574 -5.173 -33.898 13.795 545 HG3 LYS 574 HG3 LYS 574 -6.589 -33.035 14.396 546 HD2 LYS 574 HD2 LYS 574 -7.686 -33.268 12.248 547 HD3 LYS 574 HD3 LYS 574 -6.236 -33.963 11.541 548 HE2 LYS 574 HE2 LYS 574 -7.872 -35.714 11.992 549 HE3 LYS 574 HE3 LYS 574 -6.451 -35.902 13.014 550 HZ1 LYS 574 HZ1 LYS 574 -8.915 -34.560 14.011 551 HZ2 LYS 574 HZ2 LYS 574 -7.655 -35.282 14.911 552 HZ3 LYS 574 HZ3 LYS 574 -8.733 -36.214 14.078 553 H VAL 575 H VAL 575 -8.851 -31.024 12.530 554 HA VAL 575 HA VAL 575 -9.476 -29.961 15.143 555 HB VAL 575 HB VAL 575 -11.285 -31.344 13.111 556 HG11 VAL 575 HG11 VAL 575 -12.010 -29.629 15.496 557 HG12 VAL 575 HG12 VAL 575 -12.201 -31.375 15.384 558 HG13 VAL 575 HG13 VAL 575 -13.140 -30.316 14.336 559 HG21 VAL 575 HG21 VAL 575 -10.846 -28.391 13.582 560 HG22 VAL 575 HG22 VAL 575 -12.036 -29.087 12.483 561 HG23 VAL 575 HG23 VAL 575 -10.313 -29.306 12.172 562 H ILE 576 H ILE 576 -9.372 -31.210 16.894 563 HA ILE 576 HA ILE 576 -8.624 -33.946 16.537 564 HB ILE 576 HB ILE 576 -8.990 -32.292 19.036 565 HG12 ILE 576 HG12 ILE 576 -7.191 -31.519 17.571 566 HG13 ILE 576 HG13 ILE 576 -6.577 -32.154 19.088 567 HG21 ILE 576 HG21 ILE 576 -9.248 -34.690 19.547 568 HG22 ILE 576 HG22 ILE 576 -7.777 -34.018 20.243 569 HG23 ILE 576 HG23 ILE 576 -7.681 -35.012 18.788 570 HD11 ILE 576 HD11 ILE 576 -5.170 -32.855 17.256 571 HD12 ILE 576 HD12 ILE 576 -6.558 -33.538 16.412 572 HD13 ILE 576 HD13 ILE 576 -6.006 -34.255 17.923 573 H ASP 577 H ASP 577 -9.683 -35.626 17.042 574 HA ASP 577 HA ASP 577 -12.529 -35.432 17.149 575 HB2 ASP 577 HB2 ASP 577 -10.651 -37.814 17.072 576 HB3 ASP 577 HB3 ASP 577 -12.405 -37.930 17.028 577 H ASP 578 H ASP 578 -12.593 -34.388 19.113 578 HA ASP 578 HA ASP 578 -11.682 -35.700 21.490 579 HB2 ASP 578 HB2 ASP 578 -11.650 -33.237 21.266 580 HB3 ASP 578 HB3 ASP 578 -13.404 -33.236 21.165 581 H GLU 579 H GLU 579 -12.914 -36.813 22.911 582 HA GLU 579 HA GLU 579 -15.376 -37.830 21.807 583 HB2 GLU 579 HB2 GLU 579 -13.516 -39.264 22.704 584 HB3 GLU 579 HB3 GLU 579 -13.875 -38.670 24.303 585 HG2 GLU 579 HG2 GLU 579 -15.768 -40.278 22.579 586 HG3 GLU 579 HG3 GLU 579 -14.735 -40.938 23.834 587 H GLU 580 H GLU 580 -14.297 -36.010 24.665 588 HA GLU 580 HA GLU 580 -16.849 -36.132 25.912 589 HB2 GLU 580 HB2 GLU 580 -15.929 -34.499 27.529 590 HB3 GLU 580 HB3 GLU 580 -14.886 -35.895 27.318 591 HG2 GLU 580 HG2 GLU 580 -13.458 -34.523 25.826 592 HG3 GLU 580 HG3 GLU 580 -14.509 -33.157 26.149 593 H TYR 581 H TYR 581 -17.936 -34.053 26.593 594 HA TYR 581 HA TYR 581 -17.939 -32.112 24.449 595 HB2 TYR 581 HB2 TYR 581 -20.482 -32.153 24.465 596 HB3 TYR 581 HB3 TYR 581 -19.717 -33.559 23.740 597 HD1 TYR 581 HD1 TYR 581 -21.626 -32.332 26.628 598 HD2 TYR 581 HD2 TYR 581 -19.925 -35.746 24.753 599 HE1 TYR 581 HE1 TYR 581 -22.889 -33.782 28.134 600 HE2 TYR 581 HE2 TYR 581 -21.194 -37.211 26.262 601 HH TYR 581 HH TYR 581 -22.194 -37.074 28.448 602 H GLU 582 H GLU 582 -18.167 -30.121 25.141 603 HA GLU 582 HA GLU 582 -18.930 -29.697 27.951 604 HB2 GLU 582 HB2 GLU 582 -16.638 -28.409 26.471 605 HB3 GLU 582 HB3 GLU 582 -17.160 -28.006 28.100 606 HG2 GLU 582 HG2 GLU 582 -16.425 -30.091 28.941 607 HG3 GLU 582 HG3 GLU 582 -16.192 -30.739 27.315 608 H LYS 583 H LYS 583 -18.034 -27.853 25.018 609 HA LYS 583 HA LYS 583 -20.510 -26.377 25.032 610 HB2 LYS 583 HB2 LYS 583 -18.907 -25.427 26.841 611 HB3 LYS 583 HB3 LYS 583 -17.901 -24.927 25.501 612 HG2 LYS 583 HG2 LYS 583 -19.170 -23.047 26.175 613 HG3 LYS 583 HG3 LYS 583 -19.861 -23.608 24.654 614 HD2 LYS 583 HD2 LYS 583 -21.664 -24.715 25.829 615 HD3 LYS 583 HD3 LYS 583 -20.929 -24.325 27.382 616 HE2 LYS 583 HE2 LYS 583 -21.928 -22.316 25.373 617 HE3 LYS 583 HE3 LYS 583 -22.784 -22.827 26.827 618 HZ1 LYS 583 HZ1 LYS 583 -21.602 -20.739 27.150 619 HZ2 LYS 583 HZ2 LYS 583 -20.132 -21.463 26.805 620 HZ3 LYS 583 HZ3 LYS 583 -20.997 -21.923 28.169 621 H ASN 584 H ASN 584 -20.307 -24.754 23.152 622 HA ASN 584 HA ASN 584 -19.116 -25.866 20.868 623 HB2 ASN 584 HB2 ASN 584 -21.003 -24.325 20.660 624 HB3 ASN 584 HB3 ASN 584 -20.058 -23.031 21.383 625 HD21 ASN 584 HD21 ASN 584 -20.542 -24.971 18.501 626 HD22 ASN 584 HD22 ASN 584 -19.648 -23.947 17.450 627 H LYS 585 H LYS 585 -17.098 -25.918 20.299 628 HA LYS 585 HA LYS 585 -15.182 -24.338 21.804 629 HB2 LYS 585 HB2 LYS 585 -14.785 -26.654 19.917 630 HB3 LYS 585 HB3 LYS 585 -13.510 -25.864 20.837 631 HG2 LYS 585 HG2 LYS 585 -15.879 -27.305 22.014 632 HG3 LYS 585 HG3 LYS 585 -14.234 -27.939 21.900 633 HD2 LYS 585 HD2 LYS 585 -13.425 -26.152 23.318 634 HD3 LYS 585 HD3 LYS 585 -15.041 -25.451 23.422 635 HE2 LYS 585 HE2 LYS 585 -14.453 -26.725 25.401 636 HE3 LYS 585 HE3 LYS 585 -15.825 -27.436 24.557 637 HZ1 LYS 585 HZ1 LYS 585 -14.423 -29.143 23.695 638 HZ2 LYS 585 HZ2 LYS 585 -14.061 -29.004 25.358 639 HZ3 LYS 585 HZ3 LYS 585 -13.037 -28.355 24.188 640 H THR 586 H THR 586 -13.894 -22.834 21.012 641 HA THR 586 HA THR 586 -13.603 -22.539 18.201 642 HB THR 586 HB THR 586 -15.720 -21.396 18.398 643 HG1 THR 586 HG1 THR 586 -13.890 -20.387 17.209 644 HG21 THR 586 HG21 THR 586 -16.065 -19.461 19.832 645 HG22 THR 586 HG22 THR 586 -14.467 -19.692 20.547 646 HG23 THR 586 HG23 THR 586 -15.730 -20.910 20.779 647 H PHE 587 H PHE 587 -11.799 -21.532 17.660 648 HA PHE 587 HA PHE 587 -10.246 -20.298 19.798 649 HB2 PHE 587 HB2 PHE 587 -8.201 -21.402 19.016 650 HB3 PHE 587 HB3 PHE 587 -9.393 -22.603 19.472 651 HD1 PHE 587 HD1 PHE 587 -10.580 -23.877 17.673 652 HD2 PHE 587 HD2 PHE 587 -7.316 -21.285 16.850 653 HE1 PHE 587 HE1 PHE 587 -10.237 -24.990 15.498 654 HE2 PHE 587 HE2 PHE 587 -6.975 -22.391 14.680 655 HZ PHE 587 HZ PHE 587 -8.443 -24.247 14.009 656 H PHE 588 H PHE 588 -8.253 -19.176 18.626 657 HA PHE 588 HA PHE 588 -9.468 -17.758 16.362 658 HB2 PHE 588 HB2 PHE 588 -7.820 -16.533 18.611 659 HB3 PHE 588 HB3 PHE 588 -8.471 -15.684 17.217 660 HD1 PHE 588 HD1 PHE 588 -9.292 -17.335 20.391 661 HD2 PHE 588 HD2 PHE 588 -10.778 -15.077 17.106 662 HE1 PHE 588 HE1 PHE 588 -11.399 -16.930 21.632 663 HE2 PHE 588 HE2 PHE 588 -12.860 -14.668 18.330 664 HZ PHE 588 HZ PHE 588 -13.174 -15.591 20.594 665 H LEU 589 H LEU 589 -8.033 -16.920 14.878 666 HA LEU 589 HA LEU 589 -5.353 -18.152 14.924 667 HB2 LEU 589 HB2 LEU 589 -7.362 -18.748 13.143 668 HB3 LEU 589 HB3 LEU 589 -6.578 -17.411 12.339 669 HG LEU 589 HG LEU 589 -5.720 -19.425 11.428 670 HD11 LEU 589 HD11 LEU 589 -3.338 -19.295 11.875 671 HD12 LEU 589 HD12 LEU 589 -3.656 -18.301 13.294 672 HD13 LEU 589 HD13 LEU 589 -4.046 -17.691 11.690 673 HD21 LEU 589 HD21 LEU 589 -5.117 -20.244 14.245 674 HD22 LEU 589 HD22 LEU 589 -4.598 -21.116 12.803 675 HD23 LEU 589 HD23 LEU 589 -6.321 -20.949 13.168 676 H GLU 590 H GLU 590 -3.782 -16.623 14.753 677 HA GLU 590 HA GLU 590 -4.609 -14.043 13.678 678 HB2 GLU 590 HB2 GLU 590 -4.447 -13.842 16.096 679 HB3 GLU 590 HB3 GLU 590 -2.793 -14.450 16.060 680 HG2 GLU 590 HG2 GLU 590 -2.150 -12.493 14.704 681 HG3 GLU 590 HG3 GLU 590 -3.800 -11.892 14.835 682 H ILE 591 H ILE 591 -3.276 -13.199 12.222 683 HA ILE 591 HA ILE 591 -0.753 -14.569 11.735 684 HB ILE 591 HB ILE 591 -0.848 -13.533 9.456 685 HG12 ILE 591 HG12 ILE 591 -3.701 -12.855 10.226 686 HG13 ILE 591 HG13 ILE 591 -2.402 -11.694 9.980 687 HG21 ILE 591 HG21 ILE 591 -1.441 -15.829 9.727 688 HG22 ILE 591 HG22 ILE 591 -2.547 -15.107 8.553 689 HG23 ILE 591 HG23 ILE 591 -3.072 -15.398 10.215 690 HD11 ILE 591 HD11 ILE 591 -3.577 -13.510 7.889 691 HD12 ILE 591 HD12 ILE 591 -2.287 -12.332 7.628 692 HD13 ILE 591 HD13 ILE 591 -3.906 -11.791 8.086 693 H GLY 592 H GLY 592 1.060 -13.403 11.584 694 HA2 GLY 592 HA2 GLY 592 0.948 -10.856 12.964 695 HA3 GLY 592 HA3 GLY 592 2.401 -11.786 12.600 696 H GLU 593 H GLU 593 2.928 -9.442 12.114 697 HA GLU 593 HA GLU 593 1.923 -8.421 9.676 698 HB2 GLU 593 HB2 GLU 593 4.341 -7.631 11.288 699 HB3 GLU 593 HB3 GLU 593 3.744 -6.745 9.889 700 HG2 GLU 593 HG2 GLU 593 1.603 -6.431 11.023 701 HG3 GLU 593 HG3 GLU 593 2.248 -7.236 12.451 702 HA PRO 594 HA PRO 594 4.270 -10.799 6.891 703 HB2 PRO 594 HB2 PRO 594 4.193 -9.116 4.744 704 HB3 PRO 594 HB3 PRO 594 2.822 -10.114 5.221 705 HG2 PRO 594 HG2 PRO 594 3.353 -7.234 5.749 706 HG3 PRO 594 HG3 PRO 594 1.822 -8.015 5.336 707 HD2 PRO 594 HD2 PRO 594 2.463 -7.276 7.847 708 HD3 PRO 594 HD3 PRO 594 1.446 -8.686 7.525 709 H ARG 595 H ARG 595 6.341 -10.937 6.243 710 HA ARG 595 HA ARG 595 7.990 -8.549 6.562 711 HB2 ARG 595 HB2 ARG 595 9.829 -10.032 7.381 712 HB3 ARG 595 HB3 ARG 595 8.458 -9.925 8.470 713 HG2 ARG 595 HG2 ARG 595 7.667 -12.117 7.582 714 HG3 ARG 595 HG3 ARG 595 9.148 -12.209 6.630 715 HD2 ARG 595 HD2 ARG 595 9.332 -13.484 8.722 716 HD3 ARG 595 HD3 ARG 595 10.481 -12.145 8.662 717 HE ARG 595 HE ARG 595 8.280 -11.129 9.913 718 HH11 ARG 595 HH11 ARG 595 10.401 -13.880 10.612 719 HH12 ARG 595 HH12 ARG 595 10.268 -13.699 12.301 720 HH21 ARG 595 HH21 ARG 595 8.121 -10.905 12.216 721 HH22 ARG 595 HH22 ARG 595 8.968 -12.014 13.219 722 H LEU 596 H LEU 596 8.985 -7.969 4.806 723 HA LEU 596 HA LEU 596 8.948 -9.476 2.470 724 HB2 LEU 596 HB2 LEU 596 9.147 -6.893 2.856 725 HB3 LEU 596 HB3 LEU 596 10.838 -7.242 3.073 726 HG LEU 596 HG LEU 596 10.123 -6.382 0.773 727 HD11 LEU 596 HD11 LEU 596 11.652 -7.819 -0.436 728 HD12 LEU 596 HD12 LEU 596 11.612 -8.975 0.899 729 HD13 LEU 596 HD13 LEU 596 12.314 -7.368 1.143 730 HD21 LEU 596 HD21 LEU 596 9.211 -7.969 -0.777 731 HD22 LEU 596 HD22 LEU 596 8.152 -7.850 0.654 732 HD23 LEU 596 HD23 LEU 596 9.230 -9.219 0.470 733 H VAL 597 H VAL 597 10.243 -10.987 1.867 734 HA VAL 597 HA VAL 597 12.696 -11.547 3.341 735 HB VAL 597 HB VAL 597 11.488 -13.138 1.074 736 HG11 VAL 597 HG11 VAL 597 13.475 -13.893 3.211 737 HG12 VAL 597 HG12 VAL 597 13.823 -13.610 1.506 738 HG13 VAL 597 HG13 VAL 597 12.827 -14.984 1.984 739 HG21 VAL 597 HG21 VAL 597 10.550 -14.637 2.727 740 HG22 VAL 597 HG22 VAL 597 9.842 -13.020 2.830 741 HG23 VAL 597 HG23 VAL 597 11.042 -13.541 4.022 742 H GLU 598 H GLU 598 14.256 -10.429 2.613 743 HA GLU 598 HA GLU 598 14.279 -9.068 0.182 744 HB2 GLU 598 HB2 GLU 598 16.599 -9.720 2.028 745 HB3 GLU 598 HB3 GLU 598 16.540 -8.402 0.858 746 HG2 GLU 598 HG2 GLU 598 14.679 -7.378 2.080 747 HG3 GLU 598 HG3 GLU 598 14.703 -8.690 3.239 748 H MET 599 H MET 599 14.479 -9.938 -1.731 749 HA MET 599 HA MET 599 15.244 -12.646 -2.104 750 HB2 MET 599 HB2 MET 599 14.917 -12.269 -4.512 751 HB3 MET 599 HB3 MET 599 13.571 -11.677 -3.557 752 HG2 MET 599 HG2 MET 599 14.414 -9.437 -3.740 753 HG3 MET 599 HG3 MET 599 15.778 -10.021 -4.702 754 HE1 MET 599 HE1 MET 599 13.846 -7.689 -5.615 755 HE2 MET 599 HE2 MET 599 13.562 -8.102 -7.304 756 HE3 MET 599 HE3 MET 599 15.177 -8.269 -6.615 757 H SER 600 H SER 600 16.900 -9.656 -2.413 758 HA SER 600 HA SER 600 19.343 -11.144 -2.977 759 HB2 SER 600 HB2 SER 600 18.725 -8.998 -4.329 760 HB3 SER 600 HB3 SER 600 19.005 -8.122 -2.827 761 HG SER 600 HG SER 600 20.874 -9.778 -4.166 762 H GLU 601 H GLU 601 19.656 -12.024 -0.996 763 HA GLU 601 HA GLU 601 18.899 -10.461 1.328 764 HB2 GLU 601 HB2 GLU 601 18.883 -12.627 2.489 765 HB3 GLU 601 HB3 GLU 601 17.726 -12.485 1.174 766 HG2 GLU 601 HG2 GLU 601 19.090 -13.821 -0.258 767 HG3 GLU 601 HG3 GLU 601 20.398 -13.843 0.924 768 H LYS 602 H LYS 602 20.028 -10.417 3.104 769 HA LYS 602 HA LYS 602 22.901 -10.934 3.030 770 HB2 LYS 602 HB2 LYS 602 22.143 -8.668 3.652 771 HB3 LYS 602 HB3 LYS 602 21.069 -9.359 4.856 772 HG2 LYS 602 HG2 LYS 602 23.010 -10.152 6.116 773 HG3 LYS 602 HG3 LYS 602 24.075 -9.443 4.902 774 HD2 LYS 602 HD2 LYS 602 23.908 -7.964 6.809 775 HD3 LYS 602 HD3 LYS 602 23.137 -7.218 5.414 776 HE2 LYS 602 HE2 LYS 602 20.928 -7.939 6.292 777 HE3 LYS 602 HE3 LYS 602 21.735 -8.625 7.697 778 HZ1 LYS 602 HZ1 LYS 602 20.869 -6.455 8.212 779 HZ2 LYS 602 HZ2 LYS 602 21.670 -5.764 6.918 780 HZ3 LYS 602 HZ3 LYS 602 22.548 -6.366 8.223 781 H LYS 603 H LYS 603 23.559 -12.738 4.276 782 HA LYS 603 HA LYS 603 21.471 -14.251 5.481 783 HB2 LYS 603 HB2 LYS 603 23.278 -15.843 6.240 784 HB3 LYS 603 HB3 LYS 603 23.173 -15.583 4.508 785 HG2 LYS 603 HG2 LYS 603 25.111 -14.134 4.587 786 HG3 LYS 603 HG3 LYS 603 25.187 -14.295 6.343 787 HD2 LYS 603 HD2 LYS 603 26.816 -15.769 5.238 788 HD3 LYS 603 HD3 LYS 603 25.601 -16.695 6.115 789 HE2 LYS 603 HE2 LYS 603 24.407 -17.126 4.017 790 HE3 LYS 603 HE3 LYS 603 25.597 -16.171 3.134 791 HZ1 LYS 603 HZ1 LYS 603 26.171 -18.649 4.657 792 HZ2 LYS 603 HZ2 LYS 603 27.277 -17.761 3.735 793 HZ3 LYS 603 HZ3 LYS 603 25.985 -18.551 2.981 794 H GLY 604 H GLY 604 20.525 -13.312 6.997 795 HA2 GLY 604 HA2 GLY 604 20.983 -13.410 9.578 796 HA3 GLY 604 HA3 GLY 604 21.925 -11.982 9.128 797 H GLY 605 H GLY 605 20.671 -10.382 9.964 798 HA2 GLY 605 HA2 GLY 605 18.989 -8.812 9.895 799 HA3 GLY 605 HA3 GLY 605 18.334 -9.641 8.483 800 H PHE 606 H PHE 606 18.988 -11.120 11.567 801 HA PHE 606 HA PHE 606 16.239 -11.155 12.359 802 HB2 PHE 606 HB2 PHE 606 16.267 -12.985 10.723 803 HB3 PHE 606 HB3 PHE 606 17.668 -13.688 11.514 804 HD1 PHE 606 HD1 PHE 606 14.080 -12.892 11.997 805 HD2 PHE 606 HD2 PHE 606 17.406 -15.215 13.283 806 HE1 PHE 606 HE1 PHE 606 12.586 -14.251 13.398 807 HE2 PHE 606 HE2 PHE 606 15.918 -16.575 14.688 808 HZ PHE 606 HZ PHE 606 13.508 -16.094 14.748 809 H THR 607 H THR 607 16.118 -11.413 14.512 810 HA THR 607 HA THR 607 18.334 -12.610 15.912 811 HB THR 607 HB THR 607 18.775 -10.203 16.103 812 HG1 THR 607 HG1 THR 607 17.868 -10.201 18.569 813 HG21 THR 607 HG21 THR 607 16.527 -9.356 15.630 814 HG22 THR 607 HG22 THR 607 17.173 -8.645 17.109 815 HG23 THR 607 HG23 THR 607 15.971 -9.932 17.203 816 H ILE 608 H ILE 608 17.641 -13.779 17.690 817 HA ILE 608 HA ILE 608 14.878 -14.515 17.659 818 HB ILE 608 HB ILE 608 17.039 -15.348 19.634 819 HG12 ILE 608 HG12 ILE 608 16.049 -16.783 17.156 820 HG13 ILE 608 HG13 ILE 608 17.573 -15.915 17.254 821 HG21 ILE 608 HG21 ILE 608 14.764 -15.734 20.456 822 HG22 ILE 608 HG22 ILE 608 15.566 -17.260 20.088 823 HG23 ILE 608 HG23 ILE 608 14.366 -16.604 18.974 824 HD11 ILE 608 HD11 ILE 608 17.913 -18.304 17.491 825 HD12 ILE 608 HD12 ILE 608 16.796 -18.346 18.854 826 HD13 ILE 608 HD13 ILE 608 18.325 -17.478 18.994 827 H THR 609 H THR 609 13.394 -13.205 18.562 828 HA THR 609 HA THR 609 13.564 -12.495 21.282 829 HB THR 609 HB THR 609 14.972 -10.679 20.393 830 HG1 THR 609 HG1 THR 609 13.074 -8.956 20.855 831 HG21 THR 609 HG21 THR 609 12.583 -9.907 18.698 832 HG22 THR 609 HG22 THR 609 14.076 -10.616 18.092 833 HG23 THR 609 HG23 THR 609 14.099 -9.008 18.824 834 H GLU 610 H GLU 610 11.581 -12.092 22.088 835 HA GLU 610 HA GLU 610 9.311 -11.725 20.286 836 HB2 GLU 610 HB2 GLU 610 9.608 -14.170 20.959 837 HB3 GLU 610 HB3 GLU 610 9.429 -13.663 22.629 838 HG2 GLU 610 HG2 GLU 610 7.369 -14.597 21.846 839 HG3 GLU 610 HG3 GLU 610 7.153 -12.866 22.099 840 H GLU 611 H GLU 611 8.634 -9.729 20.991 841 HA GLU 611 HA GLU 611 9.567 -8.786 23.503 842 HB2 GLU 611 HB2 GLU 611 7.637 -7.419 21.625 843 HB3 GLU 611 HB3 GLU 611 8.490 -6.673 22.963 844 HG2 GLU 611 HG2 GLU 611 10.631 -7.264 21.819 845 HG3 GLU 611 HG3 GLU 611 9.672 -7.754 20.424 846 H TYR 612 H TYR 612 8.656 -8.874 25.383 847 HA TYR 612 HA TYR 612 6.029 -9.955 25.670 848 HB2 TYR 612 HB2 TYR 612 6.398 -9.753 28.099 849 HB3 TYR 612 HB3 TYR 612 7.776 -10.516 27.326 850 HD1 TYR 612 HD1 TYR 612 9.916 -9.233 27.094 851 HD2 TYR 612 HD2 TYR 612 6.601 -7.689 29.259 852 HE1 TYR 612 HE1 TYR 612 11.389 -7.600 28.186 853 HE2 TYR 612 HE2 TYR 612 8.070 -6.060 30.347 854 HH TYR 612 HH TYR 612 10.404 -5.799 30.878 855 H ASP 613 H ASP 613 4.217 -8.910 26.391 856 HA ASP 613 HA ASP 613 4.231 -5.988 26.431 857 HB2 ASP 613 HB2 ASP 613 3.914 -6.467 24.107 858 HB3 ASP 613 HB3 ASP 613 2.727 -7.708 24.468 859 H ASP 614 H ASP 614 2.888 -5.260 27.934 860 HA ASP 614 HA ASP 614 0.746 -7.039 28.917 861 HB2 ASP 614 HB2 ASP 614 2.258 -4.870 30.394 862 HB3 ASP 614 HB3 ASP 614 0.806 -5.636 31.011 863 H LYS 615 H LYS 615 1.346 -4.350 27.131 864 HA LYS 615 HA LYS 615 -1.226 -3.681 26.564 865 HB2 LYS 615 HB2 LYS 615 -1.474 -2.759 28.829 866 HB3 LYS 615 HB3 LYS 615 -0.038 -1.781 28.606 867 HG2 LYS 615 HG2 LYS 615 -1.883 -0.302 28.403 868 HG3 LYS 615 HG3 LYS 615 -1.281 -0.560 26.776 869 HD2 LYS 615 HD2 LYS 615 -3.619 -2.112 27.889 870 HD3 LYS 615 HD3 LYS 615 -3.827 -0.531 27.163 871 HE2 LYS 615 HE2 LYS 615 -2.797 -3.040 25.773 872 HE3 LYS 615 HE3 LYS 615 -4.363 -2.290 25.579 873 HZ1 LYS 615 HZ1 LYS 615 -2.990 -1.681 23.755 874 HZ2 LYS 615 HZ2 LYS 615 -1.756 -1.161 24.717 875 HZ3 LYS 615 HZ3 LYS 615 -3.208 -0.292 24.671 876 H GLN 616 H GLN 616 1.915 -2.254 27.249 877 HA GLN 616 HA GLN 616 2.393 -1.737 24.488 878 HB2 GLN 616 HB2 GLN 616 1.005 0.234 25.112 879 HB3 GLN 616 HB3 GLN 616 2.157 0.616 26.384 880 HG2 GLN 616 HG2 GLN 616 2.544 2.016 24.462 881 HG3 GLN 616 HG3 GLN 616 3.909 0.919 24.694 882 HE21 GLN 616 HE21 GLN 616 4.566 1.017 22.574 883 HE22 GLN 616 HE22 GLN 616 3.666 0.300 21.280 884 HA PRO 617 HA PRO 617 6.337 -2.280 26.619 885 HB2 PRO 617 HB2 PRO 617 7.549 -2.354 23.966 886 HB3 PRO 617 HB3 PRO 617 7.446 -3.650 25.158 887 HG2 PRO 617 HG2 PRO 617 6.063 -3.681 22.811 888 HG3 PRO 617 HG3 PRO 617 5.492 -4.478 24.287 889 HD2 PRO 617 HD2 PRO 617 4.669 -1.853 23.107 890 HD3 PRO 617 HD3 PRO 617 3.685 -3.116 23.887 891 H LEU 618 H LEU 618 6.898 -0.354 27.423 892 HA LEU 618 HA LEU 618 6.954 2.035 25.842 893 HB2 LEU 618 HB2 LEU 618 7.805 1.542 28.688 894 HB3 LEU 618 HB3 LEU 618 7.627 3.118 27.947 895 HG LEU 618 HG LEU 618 5.387 1.144 28.397 896 HD11 LEU 618 HD11 LEU 618 4.630 2.709 30.083 897 HD12 LEU 618 HD12 LEU 618 6.048 3.714 29.785 898 HD13 LEU 618 HD13 LEU 618 6.241 2.093 30.458 899 HD21 LEU 618 HD21 LEU 618 5.348 3.981 27.363 900 HD22 LEU 618 HD22 LEU 618 3.927 3.021 27.768 901 HD23 LEU 618 HD23 LEU 618 4.967 2.526 26.437 902 H THR 619 H THR 619 9.155 -0.379 26.555 903 HA THR 619 HA THR 619 11.555 1.103 26.189 904 HB THR 619 HB THR 619 11.036 -1.867 25.805 905 HG1 THR 619 HG1 THR 619 11.764 -1.926 28.047 906 HG21 THR 619 HG21 THR 619 13.415 -2.105 26.427 907 HG22 THR 619 HG22 THR 619 13.563 -0.349 26.530 908 HG23 THR 619 HG23 THR 619 13.241 -1.117 24.977 909 H SER 620 H SER 620 9.064 -0.080 24.146 910 HA SER 620 HA SER 620 10.695 0.107 21.751 911 HB2 SER 620 HB2 SER 620 9.290 -1.923 22.041 912 HB3 SER 620 HB3 SER 620 7.863 -0.902 22.193 913 HG SER 620 HG SER 620 7.941 -1.598 20.141 914 H LYS 621 H LYS 621 10.677 2.056 20.799 915 HA LYS 621 HA LYS 621 8.488 3.863 21.391 916 HB2 LYS 621 HB2 LYS 621 11.260 4.301 20.290 917 HB3 LYS 621 HB3 LYS 621 10.027 5.527 20.088 918 HG2 LYS 621 HG2 LYS 621 11.374 6.106 21.979 919 HG3 LYS 621 HG3 LYS 621 9.795 5.615 22.576 920 HD2 LYS 621 HD2 LYS 621 10.773 3.363 23.052 921 HD3 LYS 621 HD3 LYS 621 12.349 4.006 22.598 922 HE2 LYS 621 HE2 LYS 621 10.596 4.996 24.852 923 HE3 LYS 621 HE3 LYS 621 12.045 4.018 25.023 924 HZ1 LYS 621 HZ1 LYS 621 13.313 5.908 24.050 925 HZ2 LYS 621 HZ2 LYS 621 12.552 6.294 25.488 926 HZ3 LYS 621 HZ3 LYS 621 11.895 6.827 24.049 927 H GLU 622 H GLU 622 7.089 4.554 19.894 928 HA GLU 622 HA GLU 622 6.966 2.935 17.526 929 HB2 GLU 622 HB2 GLU 622 4.935 3.356 18.875 930 HB3 GLU 622 HB3 GLU 622 5.055 5.066 18.531 931 HG2 GLU 622 HG2 GLU 622 4.695 4.593 16.148 932 HG3 GLU 622 HG3 GLU 622 4.536 2.879 16.530 933 H GLU 623 H GLU 623 8.646 3.582 16.426 934 HA GLU 623 HA GLU 623 9.240 6.273 15.747 935 HB2 GLU 623 HB2 GLU 623 11.016 4.649 15.989 936 HB3 GLU 623 HB3 GLU 623 10.314 3.636 14.742 937 HG2 GLU 623 HG2 GLU 623 12.313 4.916 14.026 938 HG3 GLU 623 HG3 GLU 623 10.881 5.212 13.044 939 H GLU 624 H GLU 624 8.206 7.433 14.324 940 HA GLU 624 HA GLU 624 6.323 6.377 12.500 941 HB2 GLU 624 HB2 GLU 624 7.533 9.142 12.613 942 HB3 GLU 624 HB3 GLU 624 6.157 8.682 11.621 943 HG2 GLU 624 HG2 GLU 624 4.966 8.049 13.729 944 HG3 GLU 624 HG3 GLU 624 6.313 8.752 14.617 945 H GLU 625 H GLU 625 9.713 7.164 12.260 946 HA GLU 625 HA GLU 625 9.872 7.191 9.454 947 HB2 GLU 625 HB2 GLU 625 11.668 8.062 10.836 948 HB3 GLU 625 HB3 GLU 625 11.949 6.479 11.530 949 HG2 GLU 625 HG2 GLU 625 12.902 5.659 9.561 950 HG3 GLU 625 HG3 GLU 625 12.254 6.986 8.597 951 H ARG 626 H ARG 626 9.751 4.608 11.774 952 HA ARG 626 HA ARG 626 10.406 2.492 10.022 953 HB2 ARG 626 HB2 ARG 626 8.834 2.615 12.589 954 HB3 ARG 626 HB3 ARG 626 8.885 1.132 11.650 955 HG2 ARG 626 HG2 ARG 626 11.331 2.560 12.671 956 HG3 ARG 626 HG3 ARG 626 10.525 1.236 13.521 957 HD2 ARG 626 HD2 ARG 626 10.882 -0.232 11.616 958 HD3 ARG 626 HD3 ARG 626 11.664 1.070 10.725 959 HE ARG 626 HE ARG 626 13.067 0.840 13.044 960 HH11 ARG 626 HH11 ARG 626 12.175 -1.453 10.502 961 HH12 ARG 626 HH12 ARG 626 13.642 -2.298 10.522 962 HH21 ARG 626 HH21 ARG 626 15.127 -0.306 13.083 963 HH22 ARG 626 HH22 ARG 626 15.355 -1.623 12.030 964 H ARG 627 H ARG 627 7.359 3.978 10.955 965 HA ARG 627 HA ARG 627 5.652 2.423 9.387 966 HB2 ARG 627 HB2 ARG 627 4.875 3.935 11.136 967 HB3 ARG 627 HB3 ARG 627 5.334 5.314 10.146 968 HG2 ARG 627 HG2 ARG 627 3.719 4.769 8.504 969 HG3 ARG 627 HG3 ARG 627 3.362 3.230 9.289 970 HD2 ARG 627 HD2 ARG 627 2.564 4.375 11.207 971 HD3 ARG 627 HD3 ARG 627 2.912 5.947 10.473 972 HE ARG 627 HE ARG 627 1.331 4.604 8.678 973 HH11 ARG 627 HH11 ARG 627 0.907 5.724 12.004 974 HH12 ARG 627 HH12 ARG 627 -0.777 5.915 11.891 975 HH21 ARG 627 HH21 ARG 627 -0.987 4.829 8.519 976 HH22 ARG 627 HH22 ARG 627 -1.894 5.379 9.854 977 H ILE 628 H ILE 628 7.409 5.379 8.568 978 HA ILE 628 HA ILE 628 6.340 5.678 5.966 979 HB ILE 628 HB ILE 628 9.064 6.596 6.976 980 HG12 ILE 628 HG12 ILE 628 6.444 8.117 6.878 981 HG13 ILE 628 HG13 ILE 628 7.142 7.419 8.335 982 HG21 ILE 628 HG21 ILE 628 7.411 7.572 4.631 983 HG22 ILE 628 HG22 ILE 628 8.906 6.644 4.528 984 HG23 ILE 628 HG23 ILE 628 8.929 8.283 5.180 985 HD11 ILE 628 HD11 ILE 628 9.062 8.911 8.129 986 HD12 ILE 628 HD12 ILE 628 7.549 9.819 8.195 987 HD13 ILE 628 HD13 ILE 628 8.378 9.595 6.656 988 H ALA 629 H ALA 629 9.033 3.821 7.221 989 HA ALA 629 HA ALA 629 9.999 3.050 4.648 990 HB1 ALA 629 HB1 ALA 629 11.442 1.500 5.870 991 HB2 ALA 629 HB2 ALA 629 10.539 1.823 7.352 992 HB3 ALA 629 HB3 ALA 629 11.478 3.109 6.592 993 H GLU 630 H GLU 630 7.654 1.805 6.895 994 HA GLU 630 HA GLU 630 7.431 -0.825 5.979 995 HB2 GLU 630 HB2 GLU 630 5.268 0.916 7.167 996 HB3 GLU 630 HB3 GLU 630 5.154 -0.820 6.942 997 HG2 GLU 630 HG2 GLU 630 7.139 0.588 8.716 998 HG3 GLU 630 HG3 GLU 630 5.648 -0.181 9.244 999 H MET 631 H MET 631 6.178 2.130 4.611 1000 HA MET 631 HA MET 631 4.298 0.699 3.003 1001 HB2 MET 631 HB2 MET 631 3.766 2.837 1.875 1002 HB3 MET 631 HB3 MET 631 3.617 2.894 3.617 1003 HG2 MET 631 HG2 MET 631 4.518 4.915 2.926 1004 HG3 MET 631 HG3 MET 631 5.849 4.037 3.668 1005 HE1 MET 631 HE1 MET 631 7.578 5.733 2.592 1006 HE2 MET 631 HE2 MET 631 6.234 6.634 1.875 1007 HE3 MET 631 HE3 MET 631 7.609 6.150 0.876 1008 H GLY 632 H GLY 632 7.494 0.806 2.738 1009 HA2 GLY 632 HA2 GLY 632 7.460 0.624 -0.193 1010 HA3 GLY 632 HA3 GLY 632 8.900 0.731 0.814 1011 H ARG 633 H ARG 633 6.794 -1.314 2.296 1012 HA ARG 633 HA ARG 633 7.786 -3.733 1.002 1013 HB2 ARG 633 HB2 ARG 633 8.466 -4.635 3.246 1014 HB3 ARG 633 HB3 ARG 633 9.363 -3.200 2.805 1015 HG2 ARG 633 HG2 ARG 633 7.829 -1.891 4.217 1016 HG3 ARG 633 HG3 ARG 633 7.103 -3.407 4.755 1017 HD2 ARG 633 HD2 ARG 633 8.766 -2.684 6.350 1018 HD3 ARG 633 HD3 ARG 633 9.311 -4.151 5.540 1019 HE ARG 633 HE ARG 633 10.666 -2.602 4.081 1020 HH11 ARG 633 HH11 ARG 633 9.737 -1.555 7.332 1021 HH12 ARG 633 HH12 ARG 633 11.166 -0.659 7.566 1022 HH21 ARG 633 HH21 ARG 633 12.550 -1.305 4.391 1023 HH22 ARG 633 HH22 ARG 633 12.768 -0.487 5.882 1024 HA PRO 634 HA PRO 634 3.672 -5.373 1.714 1025 HB2 PRO 634 HB2 PRO 634 4.055 -7.704 3.094 1026 HB3 PRO 634 HB3 PRO 634 4.336 -7.553 1.354 1027 HG2 PRO 634 HG2 PRO 634 6.304 -7.347 3.604 1028 HG3 PRO 634 HG3 PRO 634 6.454 -8.276 2.119 1029 HD2 PRO 634 HD2 PRO 634 7.669 -5.946 2.205 1030 HD3 PRO 634 HD3 PRO 634 6.724 -6.351 0.768 1031 H ILE 635 H ILE 635 2.073 -5.076 3.092 1032 HA ILE 635 HA ILE 635 2.634 -4.984 5.918 1033 HB ILE 635 HB ILE 635 1.246 -2.906 6.126 1034 HG12 ILE 635 HG12 ILE 635 1.232 -1.437 3.945 1035 HG13 ILE 635 HG13 ILE 635 1.313 -2.982 3.118 1036 HG21 ILE 635 HG21 ILE 635 2.968 -1.315 5.411 1037 HG22 ILE 635 HG22 ILE 635 3.687 -2.589 4.421 1038 HG23 ILE 635 HG23 ILE 635 3.666 -2.751 6.173 1039 HD11 ILE 635 HD11 ILE 635 -0.780 -3.645 4.178 1040 HD12 ILE 635 HD12 ILE 635 -0.956 -2.155 3.251 1041 HD13 ILE 635 HD13 ILE 635 -0.845 -2.094 5.010 1042 H LEU 636 H LEU 636 0.616 -5.209 7.178 1043 HA LEU 636 HA LEU 636 -1.188 -6.860 5.651 1044 HB2 LEU 636 HB2 LEU 636 -2.189 -7.464 7.924 1045 HB3 LEU 636 HB3 LEU 636 -0.622 -8.099 7.514 1046 HG LEU 636 HG LEU 636 0.434 -6.458 9.023 1047 HD11 LEU 636 HD11 LEU 636 -1.199 -4.663 8.896 1048 HD12 LEU 636 HD12 LEU 636 -0.921 -5.147 10.572 1049 HD13 LEU 636 HD13 LEU 636 -2.388 -5.660 9.734 1050 HD21 LEU 636 HD21 LEU 636 -0.309 -7.463 11.098 1051 HD22 LEU 636 HD22 LEU 636 -0.212 -8.671 9.803 1052 HD23 LEU 636 HD23 LEU 636 -1.774 -8.028 10.297 1053 H GLY 637 H GLY 637 -3.540 -6.813 6.557 1054 HA2 GLY 637 HA2 GLY 637 -4.527 -4.369 5.485 1055 HA3 GLY 637 HA3 GLY 637 -5.452 -5.726 6.110 1056 H GLU 638 H GLU 638 -6.870 -4.210 6.915 1057 HA GLU 638 HA GLU 638 -6.179 -2.256 8.856 1058 HB2 GLU 638 HB2 GLU 638 -8.156 -2.131 7.354 1059 HB3 GLU 638 HB3 GLU 638 -8.849 -3.513 8.183 1060 HG2 GLU 638 HG2 GLU 638 -9.879 -1.475 8.946 1061 HG3 GLU 638 HG3 GLU 638 -8.943 -2.200 10.252 1062 H HIS 639 H HIS 639 -7.593 -5.479 8.915 1063 HA HIS 639 HA HIS 639 -6.912 -5.690 11.735 1064 HB2 HIS 639 HB2 HIS 639 -9.052 -6.730 12.252 1065 HB3 HIS 639 HB3 HIS 639 -9.346 -5.147 11.548 1066 HD1 HIS 639 HD1 HIS 639 -10.553 -8.507 11.392 1067 HD2 HIS 639 HD2 HIS 639 -9.974 -5.485 8.600 1068 HE1 HIS 639 HE1 HIS 639 -11.950 -9.128 9.384 1069 H THR 640 H THR 640 -6.157 -7.774 12.281 1070 HA THR 640 HA THR 640 -6.502 -9.821 10.263 1071 HB THR 640 HB THR 640 -4.165 -10.617 10.719 1072 HG1 THR 640 HG1 THR 640 -2.824 -9.491 11.880 1073 HG21 THR 640 HG21 THR 640 -4.780 -9.452 8.670 1074 HG22 THR 640 HG22 THR 640 -3.117 -9.094 9.127 1075 HG23 THR 640 HG23 THR 640 -4.396 -7.903 9.421 1076 H LYS 641 H LYS 641 -7.816 -11.215 11.247 1077 HA LYS 641 HA LYS 641 -6.921 -12.747 13.443 1078 HB2 LYS 641 HB2 LYS 641 -7.726 -10.660 14.629 1079 HB3 LYS 641 HB3 LYS 641 -9.311 -10.963 13.935 1080 HG2 LYS 641 HG2 LYS 641 -9.241 -13.225 15.099 1081 HG3 LYS 641 HG3 LYS 641 -7.833 -12.623 15.968 1082 HD2 LYS 641 HD2 LYS 641 -9.803 -12.315 17.322 1083 HD3 LYS 641 HD3 LYS 641 -9.217 -10.733 16.796 1084 HE2 LYS 641 HE2 LYS 641 -10.910 -10.690 15.027 1085 HE3 LYS 641 HE3 LYS 641 -11.446 -12.298 15.496 1086 HZ1 LYS 641 HZ1 LYS 641 -12.848 -10.540 16.303 1087 HZ2 LYS 641 HZ2 LYS 641 -11.614 -9.883 17.239 1088 HZ3 LYS 641 HZ3 LYS 641 -12.221 -11.428 17.561 1089 H LEU 642 H LEU 642 -8.281 -14.571 13.646 1090 HA LEU 642 HA LEU 642 -10.636 -14.690 11.919 1091 HB2 LEU 642 HB2 LEU 642 -8.699 -15.686 10.787 1092 HB3 LEU 642 HB3 LEU 642 -8.434 -16.699 12.188 1093 HG LEU 642 HG LEU 642 -10.744 -17.677 11.738 1094 HD11 LEU 642 HD11 LEU 642 -10.301 -16.346 9.093 1095 HD12 LEU 642 HD12 LEU 642 -11.596 -15.982 10.237 1096 HD13 LEU 642 HD13 LEU 642 -11.520 -17.558 9.450 1097 HD21 LEU 642 HD21 LEU 642 -9.848 -19.119 9.984 1098 HD22 LEU 642 HD22 LEU 642 -8.772 -18.913 11.366 1099 HD23 LEU 642 HD23 LEU 642 -8.438 -18.052 9.861 1100 H GLU 643 H GLU 643 -12.263 -15.552 13.028 1101 HA GLU 643 HA GLU 643 -11.740 -16.891 15.575 1102 HB2 GLU 643 HB2 GLU 643 -13.326 -14.933 15.422 1103 HB3 GLU 643 HB3 GLU 643 -14.308 -15.902 14.350 1104 HG2 GLU 643 HG2 GLU 643 -14.807 -17.452 16.104 1105 HG3 GLU 643 HG3 GLU 643 -13.690 -16.630 17.197 1106 H VAL 644 H VAL 644 -11.568 -19.074 15.346 1107 HA VAL 644 HA VAL 644 -12.981 -20.354 13.125 1108 HB VAL 644 HB VAL 644 -10.788 -21.500 14.866 1109 HG11 VAL 644 HG11 VAL 644 -10.657 -23.255 13.201 1110 HG12 VAL 644 HG12 VAL 644 -11.938 -22.490 12.260 1111 HG13 VAL 644 HG13 VAL 644 -12.292 -23.153 13.855 1112 HG21 VAL 644 HG21 VAL 644 -9.311 -21.185 12.922 1113 HG22 VAL 644 HG22 VAL 644 -9.916 -19.649 13.554 1114 HG23 VAL 644 HG23 VAL 644 -10.618 -20.334 12.091 1115 H ILE 645 H ILE 645 -14.862 -21.088 13.709 1116 HA ILE 645 HA ILE 645 -15.311 -22.035 16.426 1117 HB ILE 645 HB ILE 645 -17.223 -21.557 14.129 1118 HG12 ILE 645 HG12 ILE 645 -16.787 -19.892 16.609 1119 HG13 ILE 645 HG13 ILE 645 -16.060 -19.530 15.050 1120 HG21 ILE 645 HG21 ILE 645 -17.744 -22.136 17.039 1121 HG22 ILE 645 HG22 ILE 645 -18.063 -23.228 15.689 1122 HG23 ILE 645 HG23 ILE 645 -18.980 -21.726 15.842 1123 HD11 ILE 645 HD11 ILE 645 -19.007 -19.650 15.630 1124 HD12 ILE 645 HD12 ILE 645 -18.238 -19.278 14.078 1125 HD13 ILE 645 HD13 ILE 645 -18.023 -18.189 15.449 1126 H ILE 646 H ILE 646 -15.326 -24.173 16.857 1127 HA ILE 646 HA ILE 646 -15.368 -26.047 14.612 1128 HB ILE 646 HB ILE 646 -14.623 -26.592 17.520 1129 HG12 ILE 646 HG12 ILE 646 -12.766 -26.306 15.142 1130 HG13 ILE 646 HG13 ILE 646 -12.983 -25.076 16.380 1131 HG21 ILE 646 HG21 ILE 646 -13.765 -28.703 16.683 1132 HG22 ILE 646 HG22 ILE 646 -14.329 -28.291 15.063 1133 HG23 ILE 646 HG23 ILE 646 -15.492 -28.525 16.367 1134 HD11 ILE 646 HD11 ILE 646 -12.134 -26.624 18.066 1135 HD12 ILE 646 HD12 ILE 646 -10.963 -26.383 16.771 1136 HD13 ILE 646 HD13 ILE 646 -11.924 -27.861 16.828 1137 H GLU 647 H GLU 647 -17.396 -26.631 14.226 1138 HA GLU 647 HA GLU 647 -19.040 -27.246 16.553 1139 HB2 GLU 647 HB2 GLU 647 -21.019 -26.635 15.187 1140 HB3 GLU 647 HB3 GLU 647 -19.964 -25.276 15.554 1141 HG2 GLU 647 HG2 GLU 647 -19.050 -25.313 13.352 1142 HG3 GLU 647 HG3 GLU 647 -19.912 -26.811 12.997 1143 H GLU 648 H GLU 648 -20.613 -28.975 16.216 1144 HA GLU 648 HA GLU 648 -19.597 -30.844 14.314 1145 HB2 GLU 648 HB2 GLU 648 -20.247 -32.607 15.905 1146 HB3 GLU 648 HB3 GLU 648 -19.087 -31.528 16.642 1147 HG2 GLU 648 HG2 GLU 648 -22.046 -31.465 17.094 1148 HG3 GLU 648 HG3 GLU 648 -20.887 -32.255 18.168 1149 H SER 649 H SER 649 -20.942 -31.850 13.206 1150 HA SER 649 HA SER 649 -22.679 -32.131 11.934 1151 HB2 SER 649 HB2 SER 649 -24.367 -30.999 14.210 1152 HB3 SER 649 HB3 SER 649 -25.059 -31.737 12.776 1153 HG SER 649 HG SER 649 -23.217 -33.096 14.445 1154 H TYR 650 H TYR 650 -21.082 -30.185 11.480 1155 HA TYR 650 HA TYR 650 -21.822 -27.542 11.624 1156 HB2 TYR 650 HB2 TYR 650 -19.601 -27.707 11.353 1157 HB3 TYR 650 HB3 TYR 650 -19.749 -29.261 10.569 1158 HD1 TYR 650 HD1 TYR 650 -19.749 -25.681 10.072 1159 HD2 TYR 650 HD2 TYR 650 -19.673 -29.476 8.376 1160 HE1 TYR 650 HE1 TYR 650 -19.068 -24.636 7.897 1161 HE2 TYR 650 HE2 TYR 650 -19.014 -28.569 6.173 1162 HH TYR 650 HH TYR 650 -19.111 -26.429 4.956 1163 H GLU 651 H GLU 651 -22.353 -29.956 9.161 1164 HA GLU 651 HA GLU 651 -23.253 -28.165 7.143 1165 HB2 GLU 651 HB2 GLU 651 -22.754 -30.977 7.395 1166 HB3 GLU 651 HB3 GLU 651 -24.305 -30.710 6.606 1167 HG2 GLU 651 HG2 GLU 651 -21.743 -29.393 5.724 1168 HG3 GLU 651 HG3 GLU 651 -22.331 -30.919 5.070 1169 H PHE 652 H PHE 652 -24.739 -29.475 9.908 1170 HA PHE 652 HA PHE 652 -27.357 -29.240 8.750 1171 HB2 PHE 652 HB2 PHE 652 -26.522 -30.206 11.488 1172 HB3 PHE 652 HB3 PHE 652 -28.191 -30.138 10.918 1173 HD1 PHE 652 HD1 PHE 652 -28.943 -31.599 9.098 1174 HD2 PHE 652 HD2 PHE 652 -25.027 -31.925 10.730 1175 HE1 PHE 652 HE1 PHE 652 -28.685 -33.805 8.037 1176 HE2 PHE 652 HE2 PHE 652 -24.765 -34.127 9.681 1177 HZ PHE 652 HZ PHE 652 -26.594 -35.069 8.330 1178 H LYS 653 H LYS 653 -27.164 -27.106 8.324 1179 HA LYS 653 HA LYS 653 -28.542 -25.470 10.164 1180 HB2 LYS 653 HB2 LYS 653 -26.957 -23.620 10.236 1181 HB3 LYS 653 HB3 LYS 653 -26.141 -25.047 10.852 1182 HG2 LYS 653 HG2 LYS 653 -24.797 -25.257 8.930 1183 HG3 LYS 653 HG3 LYS 653 -25.844 -24.200 7.980 1184 HD2 LYS 653 HD2 LYS 653 -23.843 -22.990 8.551 1185 HD3 LYS 653 HD3 LYS 653 -25.191 -22.309 9.454 1186 HE2 LYS 653 HE2 LYS 653 -23.370 -22.458 10.962 1187 HE3 LYS 653 HE3 LYS 653 -24.473 -23.765 11.387 1188 HZ1 LYS 653 HZ1 LYS 653 -21.936 -23.948 9.893 1189 HZ2 LYS 653 HZ2 LYS 653 -23.026 -25.245 10.011 1190 HZ3 LYS 653 HZ3 LYS 653 -22.313 -24.627 11.397 1191 H SER 654 H SER 654 -28.350 -23.091 8.724 1192 HA SER 654 HA SER 654 -29.304 -23.933 6.125 1193 HB2 SER 654 HB2 SER 654 -28.996 -21.124 7.208 1194 HB3 SER 654 HB3 SER 654 -29.973 -21.639 5.835 1195 HG SER 654 HG SER 654 -30.781 -23.096 7.845 1196 H THR 655 H THR 655 -27.368 -24.703 5.167 1197 HA THR 655 HA THR 655 -25.053 -23.053 5.048 1198 HB THR 655 HB THR 655 -25.761 -25.499 3.397 1199 HG1 THR 655 HG1 THR 655 -24.559 -26.624 5.011 1200 HG21 THR 655 HG21 THR 655 -23.891 -24.193 2.492 1201 HG22 THR 655 HG22 THR 655 -23.311 -25.719 3.162 1202 HG23 THR 655 HG23 THR 655 -23.098 -24.219 4.067 1203 H VAL 656 H VAL 656 -24.877 -21.347 3.776 1204 HA VAL 656 HA VAL 656 -26.906 -20.747 1.897 1205 HB VAL 656 HB VAL 656 -25.931 -18.919 3.154 1206 HG11 VAL 656 HG11 VAL 656 -23.649 -18.099 2.774 1207 HG12 VAL 656 HG12 VAL 656 -23.324 -19.504 1.761 1208 HG13 VAL 656 HG13 VAL 656 -23.671 -19.717 3.477 1209 HG21 VAL 656 HG21 VAL 656 -25.288 -18.683 0.215 1210 HG22 VAL 656 HG22 VAL 656 -25.441 -17.330 1.332 1211 HG23 VAL 656 HG23 VAL 656 -26.840 -18.347 0.982 1212 H ASP 657 H ASP 657 -27.118 -21.467 -0.000 1213 HA ASP 657 HA ASP 657 -26.777 -22.181 -2.114 1214 HB2 ASP 657 HB2 ASP 657 -25.698 -20.049 -2.498 1215 HB3 ASP 657 HB3 ASP 657 -24.191 -20.644 -1.814
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