USER MOD reduce.3.24.130724 H: found=0, std=0, add=817, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 816 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 529 ASN : amide:sc= 0 K(o=-0.2,f=-0.89) USER MOD Set 1.2: A 533 MET CE :methyl -168:sc= -0.203 (180deg=-0.601) USER MOD Set 2.1: A 446 CYS SG : rot 11:sc= -2.41! USER MOD Set 2.2: A 528 MET CE :methyl -134:sc= -0.172 (180deg=-1.03) USER MOD Set 3.1: A 474 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 475 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 438 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 441 THR OG1 : rot 180:sc= 0 USER MOD Single : A 442 ASN : amide:sc= -1.33 K(o=-1.3,f=-2.9!) USER MOD Single : A 454 TYR OH : rot 180:sc= 0 USER MOD Single : A 457 THR OG1 : rot 124:sc= 0.76 USER MOD Single : A 470 THR OG1 : rot 180:sc= 0 USER MOD Single : A 478 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 479 MET CE :methyl -162:sc= -0.128 (180deg=-0.539) USER MOD Single : A 482 ASN : amide:sc= -0.174 K(o=-0.17,f=-2) USER MOD Single : A 483 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 484 GLN : amide:sc= -1.25 K(o=-1.3,f=-4.9!) USER MOD Single : A 488 SER OG : rot 180:sc= 0 USER MOD Single : A 494 GLN : amide:sc= -0.549 X(o=-0.55,f=-0.1) USER MOD Single : A 495 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 496 LYS NZ :NH3+ -174:sc= 1.18 (180deg=1.03) USER MOD Single : A 497 SER OG : rot -160:sc= 0 USER MOD Single : A 503 MET CE :methyl 165:sc= -0.0748 (180deg=-0.473) USER MOD Single : A 506 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 507 LYS NZ :NH3+ 158:sc= 0.0111 (180deg=0) USER MOD Single : A 508 CYS SG : rot -120:sc= 0.0302 USER MOD Single : A 509 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 510 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 511 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.00531) USER MOD Single : A 512 ASN : amide:sc= 0.57 K(o=0.57,f=0) USER MOD Single : A 513 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 514 LYS NZ :NH3+ 178:sc= 1.08 (180deg=1.01) USER MOD Single : A 517 TYR OH : rot 180:sc= 0 USER MOD Single : A 522 GLN : amide:sc= 0.591 K(o=0.59,f=-2.9!) USER MOD Single : A 523 CYS SG : rot -9:sc= 0.718 USER MOD Single : A 524 SER OG : rot 85:sc= -0.991! USER MOD Single : A 536 THR OG1 : rot 180:sc= -0.0523 USER MOD Single : A 538 ASN : amide:sc= 0 X(o=0,f=-0.051) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 438 14.839 10.853 -10.149 1.00 0.00 N ATOM 2 CA MET A 438 14.405 10.989 -8.758 1.00 52.33 C ATOM 3 C MET A 438 13.404 9.891 -8.478 1.00 44.12 C ATOM 4 O MET A 438 12.796 9.389 -9.413 1.00 64.11 O ATOM 5 CB MET A 438 13.760 12.380 -8.495 1.00 71.52 C ATOM 6 CG MET A 438 12.408 12.639 -9.176 1.00 63.11 C ATOM 7 SD MET A 438 12.499 12.685 -10.974 1.00 4.24 S ATOM 8 CE MET A 438 10.779 12.979 -11.390 1.00 5.34 C ATOM 0 HA MET A 438 15.269 10.906 -8.098 1.00 52.33 H new ATOM 0 HB2 MET A 438 13.631 12.500 -7.419 1.00 71.52 H new ATOM 0 HB3 MET A 438 14.460 13.150 -8.820 1.00 71.52 H new ATOM 0 HG2 MET A 438 11.706 11.861 -8.877 1.00 63.11 H new ATOM 0 HG3 MET A 438 12.006 13.587 -8.817 1.00 63.11 H new ATOM 0 HE1 MET A 438 10.671 13.033 -12.473 1.00 5.34 H new ATOM 0 HE2 MET A 438 10.167 12.164 -11.005 1.00 5.34 H new ATOM 0 HE3 MET A 438 10.453 13.919 -10.945 1.00 5.34 H new ATOM 20 N PRO A 439 13.245 9.457 -7.214 1.00 1.21 N ATOM 21 CA PRO A 439 12.248 8.449 -6.861 1.00 32.31 C ATOM 22 C PRO A 439 10.839 8.929 -7.234 1.00 32.35 C ATOM 23 O PRO A 439 10.525 10.116 -7.054 1.00 41.03 O ATOM 24 CB PRO A 439 12.380 8.312 -5.331 1.00 10.00 C ATOM 25 CG PRO A 439 13.134 9.522 -4.898 1.00 64.51 C ATOM 26 CD PRO A 439 14.028 9.880 -6.044 1.00 32.52 C ATOM 0 HA PRO A 439 12.403 7.506 -7.385 1.00 32.31 H new ATOM 0 HB2 PRO A 439 11.401 8.265 -4.853 1.00 10.00 H new ATOM 0 HB3 PRO A 439 12.911 7.399 -5.061 1.00 10.00 H new ATOM 0 HG2 PRO A 439 12.455 10.341 -4.661 1.00 64.51 H new ATOM 0 HG3 PRO A 439 13.715 9.319 -3.998 1.00 64.51 H new ATOM 0 HD2 PRO A 439 14.246 10.948 -6.068 1.00 32.52 H new ATOM 0 HD3 PRO A 439 14.984 9.360 -5.988 1.00 32.52 H new ATOM 34 N PRO A 440 10.002 8.045 -7.804 1.00 72.24 N ATOM 35 CA PRO A 440 8.632 8.396 -8.192 1.00 13.45 C ATOM 36 C PRO A 440 7.812 8.895 -7.004 1.00 43.01 C ATOM 37 O PRO A 440 7.544 8.136 -6.050 1.00 44.12 O ATOM 38 CB PRO A 440 8.048 7.078 -8.725 1.00 45.34 C ATOM 39 CG PRO A 440 9.233 6.260 -9.101 1.00 73.11 C ATOM 40 CD PRO A 440 10.325 6.643 -8.143 1.00 11.12 C ATOM 0 HA PRO A 440 8.614 9.205 -8.922 1.00 13.45 H new ATOM 0 HB2 PRO A 440 7.446 6.577 -7.967 1.00 45.34 H new ATOM 0 HB3 PRO A 440 7.399 7.252 -9.583 1.00 45.34 H new ATOM 0 HG2 PRO A 440 9.009 5.195 -9.032 1.00 73.11 H new ATOM 0 HG3 PRO A 440 9.531 6.457 -10.131 1.00 73.11 H new ATOM 0 HD2 PRO A 440 10.327 6.005 -7.259 1.00 11.12 H new ATOM 0 HD3 PRO A 440 11.311 6.556 -8.601 1.00 11.12 H new ATOM 48 N THR A 441 7.476 10.174 -7.034 1.00 60.42 N ATOM 49 CA THR A 441 6.678 10.792 -6.011 1.00 20.02 C ATOM 50 C THR A 441 5.259 10.225 -6.064 1.00 5.13 C ATOM 51 O THR A 441 4.490 10.525 -6.986 1.00 2.25 O ATOM 52 CB THR A 441 6.620 12.318 -6.235 1.00 73.24 C ATOM 53 OG1 THR A 441 7.949 12.812 -6.492 1.00 30.04 O ATOM 54 CG2 THR A 441 6.055 13.025 -5.006 1.00 0.24 C ATOM 0 H THR A 441 7.757 10.811 -7.780 1.00 60.42 H new ATOM 0 HA THR A 441 7.126 10.587 -5.038 1.00 20.02 H new ATOM 0 HB THR A 441 5.970 12.519 -7.086 1.00 73.24 H new ATOM 0 HG1 THR A 441 7.916 13.781 -6.636 1.00 30.04 H new ATOM 0 HG21 THR A 441 6.023 14.099 -5.187 1.00 0.24 H new ATOM 0 HG22 THR A 441 5.047 12.661 -4.808 1.00 0.24 H new ATOM 0 HG23 THR A 441 6.691 12.821 -4.144 1.00 0.24 H new ATOM 62 N ASN A 442 4.939 9.384 -5.129 1.00 33.12 N ATOM 63 CA ASN A 442 3.637 8.781 -5.084 1.00 52.34 C ATOM 64 C ASN A 442 3.019 9.042 -3.741 1.00 61.22 C ATOM 65 O ASN A 442 3.726 9.377 -2.785 1.00 0.30 O ATOM 66 CB ASN A 442 3.696 7.277 -5.408 1.00 14.20 C ATOM 67 CG ASN A 442 4.473 6.445 -4.403 1.00 72.22 C ATOM 68 OD1 ASN A 442 3.911 5.895 -3.464 1.00 52.43 O ATOM 69 ND2 ASN A 442 5.763 6.344 -4.591 1.00 61.03 N ATOM 0 H ASN A 442 5.567 9.096 -4.379 1.00 33.12 H new ATOM 0 HA ASN A 442 3.009 9.232 -5.852 1.00 52.34 H new ATOM 0 HB2 ASN A 442 2.678 6.892 -5.470 1.00 14.20 H new ATOM 0 HB3 ASN A 442 4.146 7.148 -6.392 1.00 14.20 H new ATOM 0 HD21 ASN A 442 6.331 5.795 -3.946 1.00 61.03 H new ATOM 0 HD22 ASN A 442 6.201 6.814 -5.383 1.00 61.03 H new ATOM 76 N VAL A 443 1.729 8.921 -3.665 1.00 54.31 N ATOM 77 CA VAL A 443 0.994 9.236 -2.464 1.00 21.23 C ATOM 78 C VAL A 443 0.324 7.954 -1.981 1.00 44.52 C ATOM 79 O VAL A 443 0.275 6.958 -2.728 1.00 75.13 O ATOM 80 CB VAL A 443 -0.082 10.346 -2.766 1.00 34.45 C ATOM 81 CG1 VAL A 443 -0.689 10.906 -1.495 1.00 53.43 C ATOM 82 CG2 VAL A 443 0.510 11.479 -3.599 1.00 63.10 C ATOM 0 H VAL A 443 1.146 8.599 -4.437 1.00 54.31 H new ATOM 0 HA VAL A 443 1.662 9.622 -1.694 1.00 21.23 H new ATOM 0 HB VAL A 443 -0.875 9.865 -3.339 1.00 34.45 H new ATOM 0 HG11 VAL A 443 -1.426 11.668 -1.749 1.00 53.43 H new ATOM 0 HG12 VAL A 443 -1.174 10.104 -0.939 1.00 53.43 H new ATOM 0 HG13 VAL A 443 0.095 11.350 -0.882 1.00 53.43 H new ATOM 0 HG21 VAL A 443 -0.257 12.229 -3.791 1.00 63.10 H new ATOM 0 HG22 VAL A 443 1.337 11.936 -3.056 1.00 63.10 H new ATOM 0 HG23 VAL A 443 0.874 11.082 -4.547 1.00 63.10 H new ATOM 92 N ARG A 444 -0.155 7.934 -0.756 1.00 35.43 N ATOM 93 CA ARG A 444 -0.836 6.761 -0.261 1.00 71.32 C ATOM 94 C ARG A 444 -2.304 6.784 -0.656 1.00 40.21 C ATOM 95 O ARG A 444 -3.200 6.943 0.178 1.00 4.20 O ATOM 96 CB ARG A 444 -0.672 6.559 1.248 1.00 13.34 C ATOM 97 CG ARG A 444 0.762 6.434 1.707 1.00 1.23 C ATOM 98 CD ARG A 444 0.848 6.072 3.177 1.00 3.22 C ATOM 99 NE ARG A 444 0.338 7.125 4.069 1.00 53.14 N ATOM 100 CZ ARG A 444 -0.219 6.903 5.278 1.00 1.43 C ATOM 101 NH1 ARG A 444 -0.420 5.657 5.705 1.00 32.03 N ATOM 102 NH2 ARG A 444 -0.575 7.921 6.056 1.00 52.45 N ATOM 0 H ARG A 444 -0.086 8.706 -0.093 1.00 35.43 H new ATOM 0 HA ARG A 444 -0.359 5.903 -0.733 1.00 71.32 H new ATOM 0 HB2 ARG A 444 -1.136 7.398 1.767 1.00 13.34 H new ATOM 0 HB3 ARG A 444 -1.215 5.661 1.544 1.00 13.34 H new ATOM 0 HG2 ARG A 444 1.269 5.673 1.114 1.00 1.23 H new ATOM 0 HG3 ARG A 444 1.284 7.375 1.532 1.00 1.23 H new ATOM 0 HD2 ARG A 444 0.285 5.155 3.351 1.00 3.22 H new ATOM 0 HD3 ARG A 444 1.887 5.862 3.432 1.00 3.22 H new ATOM 0 HE ARG A 444 0.411 8.091 3.751 1.00 53.14 H new ATOM 0 HH11 ARG A 444 -0.153 4.867 5.118 1.00 32.03 H new ATOM 0 HH12 ARG A 444 -0.841 5.493 6.619 1.00 32.03 H new ATOM 0 HH21 ARG A 444 -0.428 8.880 5.741 1.00 52.45 H new ATOM 0 HH22 ARG A 444 -0.995 7.743 6.968 1.00 52.45 H new ATOM 116 N ASP A 445 -2.532 6.670 -1.928 1.00 71.12 N ATOM 117 CA ASP A 445 -3.866 6.698 -2.489 1.00 22.13 C ATOM 118 C ASP A 445 -4.299 5.329 -2.927 1.00 31.43 C ATOM 119 O ASP A 445 -5.357 5.163 -3.524 1.00 53.42 O ATOM 120 CB ASP A 445 -3.965 7.693 -3.660 1.00 32.54 C ATOM 121 CG ASP A 445 -2.909 7.495 -4.736 1.00 61.05 C ATOM 122 OD1 ASP A 445 -2.602 6.352 -5.119 1.00 64.35 O ATOM 123 OD2 ASP A 445 -2.352 8.517 -5.224 1.00 71.13 O ATOM 0 H ASP A 445 -1.794 6.553 -2.622 1.00 71.12 H new ATOM 0 HA ASP A 445 -4.540 7.036 -1.702 1.00 22.13 H new ATOM 0 HB2 ASP A 445 -4.952 7.605 -4.114 1.00 32.54 H new ATOM 0 HB3 ASP A 445 -3.883 8.707 -3.269 1.00 32.54 H new ATOM 128 N CYS A 446 -3.517 4.336 -2.609 1.00 55.14 N ATOM 129 CA CYS A 446 -3.863 3.022 -3.008 1.00 44.13 C ATOM 130 C CYS A 446 -4.341 2.265 -1.814 1.00 45.33 C ATOM 131 O CYS A 446 -3.773 2.352 -0.723 1.00 31.10 O ATOM 132 CB CYS A 446 -2.693 2.320 -3.627 1.00 0.43 C ATOM 133 SG CYS A 446 -1.822 3.307 -4.864 1.00 74.34 S ATOM 0 H CYS A 446 -2.648 4.420 -2.081 1.00 55.14 H new ATOM 0 HA CYS A 446 -4.653 3.076 -3.757 1.00 44.13 H new ATOM 0 HB2 CYS A 446 -1.992 2.039 -2.841 1.00 0.43 H new ATOM 0 HB3 CYS A 446 -3.039 1.396 -4.091 1.00 0.43 H new ATOM 0 HG CYS A 446 -2.251 4.534 -4.821 1.00 74.34 H new ATOM 139 N ILE A 447 -5.364 1.552 -2.001 1.00 50.34 N ATOM 140 CA ILE A 447 -5.944 0.795 -0.957 1.00 35.31 C ATOM 141 C ILE A 447 -5.807 -0.658 -1.320 1.00 44.12 C ATOM 142 O ILE A 447 -6.111 -1.049 -2.448 1.00 55.22 O ATOM 143 CB ILE A 447 -7.443 1.075 -0.815 1.00 25.13 C ATOM 144 CG1 ILE A 447 -7.791 2.496 -1.263 1.00 50.00 C ATOM 145 CG2 ILE A 447 -7.823 0.890 0.640 1.00 2.24 C ATOM 146 CD1 ILE A 447 -9.254 2.863 -1.090 1.00 4.02 C ATOM 0 H ILE A 447 -5.842 1.467 -2.898 1.00 50.34 H new ATOM 0 HA ILE A 447 -5.442 1.056 -0.025 1.00 35.31 H new ATOM 0 HB ILE A 447 -7.997 0.385 -1.451 1.00 25.13 H new ATOM 0 HG12 ILE A 447 -7.182 3.202 -0.699 1.00 50.00 H new ATOM 0 HG13 ILE A 447 -7.521 2.610 -2.313 1.00 50.00 H new ATOM 0 HG21 ILE A 447 -8.888 1.085 0.765 1.00 2.24 H new ATOM 0 HG22 ILE A 447 -7.602 -0.132 0.947 1.00 2.24 H new ATOM 0 HG23 ILE A 447 -7.252 1.585 1.256 1.00 2.24 H new ATOM 0 HD11 ILE A 447 -9.415 3.886 -1.431 1.00 4.02 H new ATOM 0 HD12 ILE A 447 -9.872 2.183 -1.677 1.00 4.02 H new ATOM 0 HD13 ILE A 447 -9.527 2.784 -0.038 1.00 4.02 H new ATOM 158 N ARG A 448 -5.367 -1.428 -0.406 1.00 71.24 N ATOM 159 CA ARG A 448 -5.206 -2.820 -0.602 1.00 74.54 C ATOM 160 C ARG A 448 -6.327 -3.527 0.107 1.00 11.21 C ATOM 161 O ARG A 448 -6.562 -3.302 1.298 1.00 70.11 O ATOM 162 CB ARG A 448 -3.862 -3.289 -0.061 1.00 41.45 C ATOM 163 CG ARG A 448 -3.620 -4.772 -0.258 1.00 32.14 C ATOM 164 CD ARG A 448 -2.287 -5.189 0.307 1.00 25.34 C ATOM 165 NE ARG A 448 -2.065 -6.612 0.136 1.00 54.43 N ATOM 166 CZ ARG A 448 -1.067 -7.308 0.673 1.00 12.51 C ATOM 167 NH1 ARG A 448 -0.024 -6.692 1.246 1.00 15.00 N ATOM 168 NH2 ARG A 448 -1.095 -8.616 0.592 1.00 2.43 N ATOM 0 H ARG A 448 -5.101 -1.105 0.524 1.00 71.24 H new ATOM 0 HA ARG A 448 -5.231 -3.047 -1.668 1.00 74.54 H new ATOM 0 HB2 ARG A 448 -3.066 -2.730 -0.552 1.00 41.45 H new ATOM 0 HB3 ARG A 448 -3.805 -3.057 1.003 1.00 41.45 H new ATOM 0 HG2 ARG A 448 -4.416 -5.340 0.225 1.00 32.14 H new ATOM 0 HG3 ARG A 448 -3.658 -5.011 -1.321 1.00 32.14 H new ATOM 0 HD2 ARG A 448 -1.490 -4.632 -0.186 1.00 25.34 H new ATOM 0 HD3 ARG A 448 -2.243 -4.937 1.366 1.00 25.34 H new ATOM 0 HE ARG A 448 -2.730 -7.122 -0.445 1.00 54.43 H new ATOM 0 HH11 ARG A 448 0.013 -5.673 1.275 1.00 15.00 H new ATOM 0 HH12 ARG A 448 0.733 -7.242 1.653 1.00 15.00 H new ATOM 0 HH21 ARG A 448 -1.872 -9.081 0.124 1.00 2.43 H new ATOM 0 HH22 ARG A 448 -0.339 -9.168 0.997 1.00 2.43 H new ATOM 182 N LEU A 449 -7.019 -4.328 -0.604 1.00 52.04 N ATOM 183 CA LEU A 449 -8.100 -5.091 -0.075 1.00 1.32 C ATOM 184 C LEU A 449 -7.589 -6.507 0.042 1.00 53.03 C ATOM 185 O LEU A 449 -6.832 -6.948 -0.810 1.00 24.15 O ATOM 186 CB LEU A 449 -9.256 -5.076 -1.050 1.00 73.25 C ATOM 187 CG LEU A 449 -9.606 -3.725 -1.693 1.00 63.11 C ATOM 188 CD1 LEU A 449 -10.702 -3.906 -2.706 1.00 54.30 C ATOM 189 CD2 LEU A 449 -10.025 -2.706 -0.649 1.00 75.51 C ATOM 0 H LEU A 449 -6.852 -4.482 -1.598 1.00 52.04 H new ATOM 0 HA LEU A 449 -8.439 -4.691 0.881 1.00 1.32 H new ATOM 0 HB2 LEU A 449 -9.036 -5.785 -1.848 1.00 73.25 H new ATOM 0 HB3 LEU A 449 -10.141 -5.445 -0.532 1.00 73.25 H new ATOM 0 HG LEU A 449 -8.712 -3.348 -2.190 1.00 63.11 H new ATOM 0 HD11 LEU A 449 -10.944 -2.943 -3.157 1.00 54.30 H new ATOM 0 HD12 LEU A 449 -10.370 -4.597 -3.481 1.00 54.30 H new ATOM 0 HD13 LEU A 449 -11.588 -4.309 -2.215 1.00 54.30 H new ATOM 0 HD21 LEU A 449 -10.266 -1.762 -1.138 1.00 75.51 H new ATOM 0 HD22 LEU A 449 -10.902 -3.072 -0.115 1.00 75.51 H new ATOM 0 HD23 LEU A 449 -9.209 -2.551 0.057 1.00 75.51 H new ATOM 201 N ARG A 450 -7.984 -7.206 1.051 1.00 34.51 N ATOM 202 CA ARG A 450 -7.458 -8.527 1.288 1.00 44.44 C ATOM 203 C ARG A 450 -8.471 -9.365 2.035 1.00 74.12 C ATOM 204 O ARG A 450 -9.185 -8.861 2.905 1.00 54.22 O ATOM 205 CB ARG A 450 -6.174 -8.379 2.085 1.00 13.41 C ATOM 206 CG ARG A 450 -5.410 -9.638 2.386 1.00 32.44 C ATOM 207 CD ARG A 450 -4.174 -9.269 3.170 1.00 61.10 C ATOM 208 NE ARG A 450 -3.352 -10.414 3.530 1.00 12.24 N ATOM 209 CZ ARG A 450 -2.695 -10.517 4.691 1.00 64.33 C ATOM 210 NH1 ARG A 450 -2.925 -9.636 5.676 1.00 51.11 N ATOM 211 NH2 ARG A 450 -1.823 -11.508 4.882 1.00 33.32 N ATOM 0 H ARG A 450 -8.673 -6.892 1.734 1.00 34.51 H new ATOM 0 HA ARG A 450 -7.249 -9.034 0.346 1.00 44.44 H new ATOM 0 HB2 ARG A 450 -5.514 -7.703 1.541 1.00 13.41 H new ATOM 0 HB3 ARG A 450 -6.416 -7.895 3.031 1.00 13.41 H new ATOM 0 HG2 ARG A 450 -6.029 -10.330 2.957 1.00 32.44 H new ATOM 0 HG3 ARG A 450 -5.135 -10.145 1.461 1.00 32.44 H new ATOM 0 HD2 ARG A 450 -3.576 -8.572 2.583 1.00 61.10 H new ATOM 0 HD3 ARG A 450 -4.472 -8.746 4.079 1.00 61.10 H new ATOM 0 HE ARG A 450 -3.272 -11.180 2.861 1.00 12.24 H new ATOM 0 HH11 ARG A 450 -3.602 -8.885 5.541 1.00 51.11 H new ATOM 0 HH12 ARG A 450 -2.423 -9.717 6.560 1.00 51.11 H new ATOM 0 HH21 ARG A 450 -1.656 -12.190 4.142 1.00 33.32 H new ATOM 0 HH22 ARG A 450 -1.324 -11.584 5.768 1.00 33.32 H new ATOM 225 N GLY A 451 -8.556 -10.622 1.672 1.00 71.14 N ATOM 226 CA GLY A 451 -9.499 -11.523 2.298 1.00 25.53 C ATOM 227 C GLY A 451 -10.851 -11.420 1.637 1.00 22.33 C ATOM 228 O GLY A 451 -11.878 -11.762 2.227 1.00 11.14 O ATOM 0 H GLY A 451 -7.982 -11.047 0.944 1.00 71.14 H new ATOM 0 HA2 GLY A 451 -9.132 -12.547 2.230 1.00 25.53 H new ATOM 0 HA3 GLY A 451 -9.588 -11.286 3.358 1.00 25.53 H new ATOM 232 N LEU A 452 -10.828 -10.969 0.398 1.00 64.01 N ATOM 233 CA LEU A 452 -12.022 -10.726 -0.403 1.00 23.24 C ATOM 234 C LEU A 452 -12.868 -11.984 -0.612 1.00 33.35 C ATOM 235 O LEU A 452 -12.346 -13.112 -0.567 1.00 11.15 O ATOM 236 CB LEU A 452 -11.627 -10.152 -1.770 1.00 71.21 C ATOM 237 CG LEU A 452 -10.960 -8.780 -1.768 1.00 22.01 C ATOM 238 CD1 LEU A 452 -10.567 -8.385 -3.179 1.00 51.44 C ATOM 239 CD2 LEU A 452 -11.895 -7.746 -1.172 1.00 61.23 C ATOM 0 H LEU A 452 -9.961 -10.755 -0.095 1.00 64.01 H new ATOM 0 HA LEU A 452 -12.630 -10.012 0.153 1.00 23.24 H new ATOM 0 HB2 LEU A 452 -10.952 -10.858 -2.254 1.00 71.21 H new ATOM 0 HB3 LEU A 452 -12.524 -10.094 -2.387 1.00 71.21 H new ATOM 0 HG LEU A 452 -10.058 -8.829 -1.157 1.00 22.01 H new ATOM 0 HD11 LEU A 452 -10.092 -7.404 -3.163 1.00 51.44 H new ATOM 0 HD12 LEU A 452 -9.869 -9.119 -3.581 1.00 51.44 H new ATOM 0 HD13 LEU A 452 -11.457 -8.347 -3.807 1.00 51.44 H new ATOM 0 HD21 LEU A 452 -11.409 -6.771 -1.176 1.00 61.23 H new ATOM 0 HD22 LEU A 452 -12.809 -7.698 -1.764 1.00 61.23 H new ATOM 0 HD23 LEU A 452 -12.141 -8.025 -0.147 1.00 61.23 H new ATOM 251 N PRO A 453 -14.205 -11.803 -0.780 1.00 21.32 N ATOM 252 CA PRO A 453 -15.103 -12.878 -1.124 1.00 71.20 C ATOM 253 C PRO A 453 -14.733 -13.473 -2.459 1.00 72.22 C ATOM 254 O PRO A 453 -14.203 -12.786 -3.358 1.00 24.41 O ATOM 255 CB PRO A 453 -16.472 -12.217 -1.249 1.00 10.12 C ATOM 256 CG PRO A 453 -16.364 -10.935 -0.533 1.00 4.33 C ATOM 257 CD PRO A 453 -14.925 -10.537 -0.593 1.00 63.44 C ATOM 0 HA PRO A 453 -15.073 -13.676 -0.382 1.00 71.20 H new ATOM 0 HB2 PRO A 453 -16.737 -12.060 -2.295 1.00 10.12 H new ATOM 0 HB3 PRO A 453 -17.250 -12.844 -0.814 1.00 10.12 H new ATOM 0 HG2 PRO A 453 -16.996 -10.177 -0.996 1.00 4.33 H new ATOM 0 HG3 PRO A 453 -16.695 -11.038 0.500 1.00 4.33 H new ATOM 0 HD2 PRO A 453 -14.737 -9.847 -1.416 1.00 63.44 H new ATOM 0 HD3 PRO A 453 -14.613 -10.034 0.322 1.00 63.44 H new ATOM 265 N TYR A 454 -15.046 -14.701 -2.603 1.00 25.44 N ATOM 266 CA TYR A 454 -14.742 -15.431 -3.769 1.00 60.51 C ATOM 267 C TYR A 454 -15.710 -15.081 -4.862 1.00 73.40 C ATOM 268 O TYR A 454 -16.838 -15.591 -4.922 1.00 65.31 O ATOM 269 CB TYR A 454 -14.690 -16.925 -3.515 1.00 15.13 C ATOM 270 CG TYR A 454 -14.075 -17.709 -4.663 1.00 63.42 C ATOM 271 CD1 TYR A 454 -12.696 -17.809 -4.785 1.00 34.14 C ATOM 272 CD2 TYR A 454 -14.862 -18.333 -5.623 1.00 31.10 C ATOM 273 CE1 TYR A 454 -12.118 -18.504 -5.824 1.00 71.22 C ATOM 274 CE2 TYR A 454 -14.288 -19.033 -6.667 1.00 2.32 C ATOM 275 CZ TYR A 454 -12.917 -19.113 -6.762 1.00 10.12 C ATOM 276 OH TYR A 454 -12.340 -19.805 -7.798 1.00 53.14 O ATOM 0 H TYR A 454 -15.536 -15.243 -1.891 1.00 25.44 H new ATOM 0 HA TYR A 454 -13.741 -15.147 -4.093 1.00 60.51 H new ATOM 0 HB2 TYR A 454 -14.116 -17.112 -2.608 1.00 15.13 H new ATOM 0 HB3 TYR A 454 -15.701 -17.291 -3.334 1.00 15.13 H new ATOM 0 HD1 TYR A 454 -12.064 -17.332 -4.051 1.00 34.14 H new ATOM 0 HD2 TYR A 454 -15.938 -18.270 -5.552 1.00 31.10 H new ATOM 0 HE1 TYR A 454 -11.043 -18.570 -5.901 1.00 71.22 H new ATOM 0 HE2 TYR A 454 -14.912 -19.515 -7.405 1.00 2.32 H new ATOM 0 HH TYR A 454 -13.041 -20.177 -8.373 1.00 53.14 H new ATOM 286 N ALA A 455 -15.279 -14.120 -5.606 1.00 30.34 N ATOM 287 CA ALA A 455 -15.913 -13.600 -6.817 1.00 25.30 C ATOM 288 C ALA A 455 -16.879 -12.471 -6.525 1.00 35.24 C ATOM 289 O ALA A 455 -17.943 -12.364 -7.145 1.00 43.41 O ATOM 290 CB ALA A 455 -16.525 -14.691 -7.715 1.00 34.02 C ATOM 0 H ALA A 455 -14.413 -13.627 -5.387 1.00 30.34 H new ATOM 0 HA ALA A 455 -15.103 -13.171 -7.406 1.00 25.30 H new ATOM 0 HB1 ALA A 455 -16.976 -14.229 -8.593 1.00 34.02 H new ATOM 0 HB2 ALA A 455 -15.744 -15.383 -8.030 1.00 34.02 H new ATOM 0 HB3 ALA A 455 -17.288 -15.235 -7.158 1.00 34.02 H new ATOM 296 N ALA A 456 -16.524 -11.647 -5.541 1.00 4.12 N ATOM 297 CA ALA A 456 -17.219 -10.383 -5.327 1.00 12.44 C ATOM 298 C ALA A 456 -17.097 -9.568 -6.600 1.00 1.34 C ATOM 299 O ALA A 456 -15.983 -9.342 -7.105 1.00 65.44 O ATOM 300 CB ALA A 456 -16.605 -9.624 -4.161 1.00 44.33 C ATOM 0 H ALA A 456 -15.765 -11.831 -4.885 1.00 4.12 H new ATOM 0 HA ALA A 456 -18.266 -10.568 -5.088 1.00 12.44 H new ATOM 0 HB1 ALA A 456 -17.138 -8.684 -4.018 1.00 44.33 H new ATOM 0 HB2 ALA A 456 -16.681 -10.226 -3.255 1.00 44.33 H new ATOM 0 HB3 ALA A 456 -15.556 -9.418 -4.373 1.00 44.33 H new ATOM 306 N THR A 457 -18.212 -9.167 -7.127 1.00 12.02 N ATOM 307 CA THR A 457 -18.268 -8.478 -8.343 1.00 21.51 C ATOM 308 C THR A 457 -17.830 -7.035 -8.120 1.00 30.11 C ATOM 309 O THR A 457 -18.005 -6.491 -7.012 1.00 2.14 O ATOM 310 CB THR A 457 -19.692 -8.610 -8.896 1.00 20.24 C ATOM 311 OG1 THR A 457 -20.632 -8.404 -7.832 1.00 22.41 O ATOM 312 CG2 THR A 457 -19.917 -9.988 -9.494 1.00 65.43 C ATOM 0 H THR A 457 -19.124 -9.323 -6.698 1.00 12.02 H new ATOM 0 HA THR A 457 -17.587 -8.895 -9.085 1.00 21.51 H new ATOM 0 HB THR A 457 -19.830 -7.863 -9.677 1.00 20.24 H new ATOM 0 HG1 THR A 457 -21.249 -7.682 -8.075 1.00 22.41 H new ATOM 0 HG21 THR A 457 -20.934 -10.056 -9.879 1.00 65.43 H new ATOM 0 HG22 THR A 457 -19.210 -10.152 -10.307 1.00 65.43 H new ATOM 0 HG23 THR A 457 -19.769 -10.747 -8.726 1.00 65.43 H new ATOM 320 N ILE A 458 -17.251 -6.416 -9.128 1.00 70.43 N ATOM 321 CA ILE A 458 -16.673 -5.098 -8.956 1.00 50.30 C ATOM 322 C ILE A 458 -17.673 -4.024 -8.551 1.00 70.21 C ATOM 323 O ILE A 458 -17.349 -3.135 -7.790 1.00 53.33 O ATOM 324 CB ILE A 458 -15.722 -4.640 -10.127 1.00 34.03 C ATOM 325 CG1 ILE A 458 -16.342 -4.793 -11.545 1.00 45.40 C ATOM 326 CG2 ILE A 458 -14.394 -5.377 -10.053 1.00 54.43 C ATOM 327 CD1 ILE A 458 -17.487 -3.851 -11.879 1.00 2.23 C ATOM 0 H ILE A 458 -17.168 -6.800 -10.069 1.00 70.43 H new ATOM 0 HA ILE A 458 -16.018 -5.223 -8.094 1.00 50.30 H new ATOM 0 HB ILE A 458 -15.565 -3.571 -9.980 1.00 34.03 H new ATOM 0 HG12 ILE A 458 -15.552 -4.648 -12.282 1.00 45.40 H new ATOM 0 HG13 ILE A 458 -16.697 -5.818 -11.655 1.00 45.40 H new ATOM 0 HG21 ILE A 458 -13.750 -5.049 -10.869 1.00 54.43 H new ATOM 0 HG22 ILE A 458 -13.911 -5.162 -9.100 1.00 54.43 H new ATOM 0 HG23 ILE A 458 -14.568 -6.450 -10.137 1.00 54.43 H new ATOM 0 HD11 ILE A 458 -17.838 -4.050 -12.892 1.00 2.23 H new ATOM 0 HD12 ILE A 458 -18.304 -4.007 -11.174 1.00 2.23 H new ATOM 0 HD13 ILE A 458 -17.141 -2.820 -11.811 1.00 2.23 H new ATOM 339 N GLU A 459 -18.899 -4.158 -8.972 1.00 40.14 N ATOM 340 CA GLU A 459 -19.874 -3.142 -8.658 1.00 70.13 C ATOM 341 C GLU A 459 -20.416 -3.355 -7.244 1.00 45.45 C ATOM 342 O GLU A 459 -20.887 -2.432 -6.594 1.00 71.41 O ATOM 343 CB GLU A 459 -20.988 -3.014 -9.742 1.00 72.41 C ATOM 344 CG GLU A 459 -22.020 -4.138 -9.813 1.00 63.54 C ATOM 345 CD GLU A 459 -21.417 -5.506 -9.877 1.00 70.11 C ATOM 346 OE1 GLU A 459 -21.380 -6.162 -8.839 1.00 43.34 O ATOM 347 OE2 GLU A 459 -20.946 -5.934 -10.945 1.00 14.03 O ATOM 0 H GLU A 459 -19.247 -4.943 -9.523 1.00 40.14 H new ATOM 0 HA GLU A 459 -19.374 -2.173 -8.673 1.00 70.13 H new ATOM 0 HB2 GLU A 459 -21.519 -2.077 -9.573 1.00 72.41 H new ATOM 0 HB3 GLU A 459 -20.505 -2.936 -10.716 1.00 72.41 H new ATOM 0 HG2 GLU A 459 -22.670 -4.078 -8.940 1.00 63.54 H new ATOM 0 HG3 GLU A 459 -22.649 -3.987 -10.690 1.00 63.54 H new ATOM 354 N ASP A 460 -20.291 -4.582 -6.774 1.00 4.43 N ATOM 355 CA ASP A 460 -20.719 -4.976 -5.451 1.00 75.00 C ATOM 356 C ASP A 460 -19.728 -4.464 -4.437 1.00 71.51 C ATOM 357 O ASP A 460 -20.094 -3.974 -3.366 1.00 41.05 O ATOM 358 CB ASP A 460 -20.779 -6.500 -5.337 1.00 71.34 C ATOM 359 CG ASP A 460 -21.457 -6.956 -4.088 1.00 61.32 C ATOM 360 OD1 ASP A 460 -20.776 -7.375 -3.157 1.00 32.44 O ATOM 361 OD2 ASP A 460 -22.714 -6.932 -4.033 1.00 61.15 O ATOM 0 H ASP A 460 -19.881 -5.345 -7.313 1.00 4.43 H new ATOM 0 HA ASP A 460 -21.710 -4.560 -5.269 1.00 75.00 H new ATOM 0 HB2 ASP A 460 -21.306 -6.905 -6.201 1.00 71.34 H new ATOM 0 HB3 ASP A 460 -19.767 -6.903 -5.364 1.00 71.34 H new ATOM 366 N ILE A 461 -18.465 -4.556 -4.792 1.00 30.02 N ATOM 367 CA ILE A 461 -17.412 -4.130 -3.921 1.00 32.03 C ATOM 368 C ILE A 461 -17.318 -2.594 -3.910 1.00 21.22 C ATOM 369 O ILE A 461 -17.017 -1.986 -2.883 1.00 43.44 O ATOM 370 CB ILE A 461 -16.049 -4.814 -4.277 1.00 71.21 C ATOM 371 CG1 ILE A 461 -15.085 -4.728 -3.097 1.00 45.53 C ATOM 372 CG2 ILE A 461 -15.412 -4.195 -5.522 1.00 31.10 C ATOM 373 CD1 ILE A 461 -13.815 -5.517 -3.302 1.00 13.41 C ATOM 0 H ILE A 461 -18.149 -4.927 -5.688 1.00 30.02 H new ATOM 0 HA ILE A 461 -17.651 -4.452 -2.908 1.00 32.03 H new ATOM 0 HB ILE A 461 -16.256 -5.862 -4.495 1.00 71.21 H new ATOM 0 HG12 ILE A 461 -14.830 -3.683 -2.921 1.00 45.53 H new ATOM 0 HG13 ILE A 461 -15.588 -5.089 -2.200 1.00 45.53 H new ATOM 0 HG21 ILE A 461 -14.468 -4.697 -5.736 1.00 31.10 H new ATOM 0 HG22 ILE A 461 -16.085 -4.311 -6.371 1.00 31.10 H new ATOM 0 HG23 ILE A 461 -15.228 -3.135 -5.348 1.00 31.10 H new ATOM 0 HD11 ILE A 461 -13.176 -5.412 -2.425 1.00 13.41 H new ATOM 0 HD12 ILE A 461 -14.060 -6.569 -3.448 1.00 13.41 H new ATOM 0 HD13 ILE A 461 -13.291 -5.141 -4.181 1.00 13.41 H new ATOM 385 N LEU A 462 -17.639 -1.960 -5.046 1.00 13.23 N ATOM 386 CA LEU A 462 -17.653 -0.508 -5.112 1.00 60.11 C ATOM 387 C LEU A 462 -18.849 0.019 -4.340 1.00 11.34 C ATOM 388 O LEU A 462 -18.816 1.122 -3.786 1.00 11.40 O ATOM 389 CB LEU A 462 -17.653 0.019 -6.558 1.00 31.41 C ATOM 390 CG LEU A 462 -16.436 -0.344 -7.431 1.00 53.11 C ATOM 391 CD1 LEU A 462 -16.565 0.275 -8.813 1.00 14.11 C ATOM 392 CD2 LEU A 462 -15.123 0.072 -6.776 1.00 75.13 C ATOM 0 H LEU A 462 -17.888 -2.430 -5.916 1.00 13.23 H new ATOM 0 HA LEU A 462 -16.733 -0.142 -4.656 1.00 60.11 H new ATOM 0 HB2 LEU A 462 -18.550 -0.352 -7.054 1.00 31.41 H new ATOM 0 HB3 LEU A 462 -17.734 1.105 -6.523 1.00 31.41 H new ATOM 0 HG LEU A 462 -16.420 -1.429 -7.534 1.00 53.11 H new ATOM 0 HD11 LEU A 462 -15.696 0.007 -9.414 1.00 14.11 H new ATOM 0 HD12 LEU A 462 -17.469 -0.097 -9.295 1.00 14.11 H new ATOM 0 HD13 LEU A 462 -16.623 1.360 -8.722 1.00 14.11 H new ATOM 0 HD21 LEU A 462 -14.290 -0.202 -7.424 1.00 75.13 H new ATOM 0 HD22 LEU A 462 -15.121 1.151 -6.619 1.00 75.13 H new ATOM 0 HD23 LEU A 462 -15.018 -0.435 -5.817 1.00 75.13 H new ATOM 404 N ASP A 463 -19.899 -0.786 -4.304 1.00 32.25 N ATOM 405 CA ASP A 463 -21.077 -0.501 -3.495 1.00 15.41 C ATOM 406 C ASP A 463 -20.681 -0.493 -2.055 1.00 11.23 C ATOM 407 O ASP A 463 -20.896 0.483 -1.348 1.00 11.43 O ATOM 408 CB ASP A 463 -22.132 -1.573 -3.700 1.00 42.32 C ATOM 409 CG ASP A 463 -23.333 -1.398 -2.796 1.00 11.12 C ATOM 410 OD1 ASP A 463 -23.464 -2.168 -1.816 1.00 10.42 O ATOM 411 OD2 ASP A 463 -24.157 -0.488 -3.031 1.00 61.43 O ATOM 0 H ASP A 463 -19.960 -1.655 -4.834 1.00 32.25 H new ATOM 0 HA ASP A 463 -21.485 0.466 -3.790 1.00 15.41 H new ATOM 0 HB2 ASP A 463 -22.461 -1.558 -4.739 1.00 42.32 H new ATOM 0 HB3 ASP A 463 -21.688 -2.552 -3.520 1.00 42.32 H new ATOM 416 N PHE A 464 -20.048 -1.581 -1.654 1.00 10.12 N ATOM 417 CA PHE A 464 -19.553 -1.776 -0.281 1.00 73.23 C ATOM 418 C PHE A 464 -18.679 -0.608 0.168 1.00 71.12 C ATOM 419 O PHE A 464 -18.793 -0.132 1.299 1.00 52.51 O ATOM 420 CB PHE A 464 -18.776 -3.103 -0.165 1.00 61.20 C ATOM 421 CG PHE A 464 -18.064 -3.294 1.154 1.00 12.11 C ATOM 422 CD1 PHE A 464 -18.777 -3.538 2.319 1.00 32.11 C ATOM 423 CD2 PHE A 464 -16.678 -3.224 1.223 1.00 34.14 C ATOM 424 CE1 PHE A 464 -18.121 -3.703 3.524 1.00 24.24 C ATOM 425 CE2 PHE A 464 -16.020 -3.391 2.424 1.00 63.05 C ATOM 426 CZ PHE A 464 -16.741 -3.631 3.576 1.00 60.54 C ATOM 0 H PHE A 464 -19.855 -2.370 -2.271 1.00 10.12 H new ATOM 0 HA PHE A 464 -20.420 -1.820 0.378 1.00 73.23 H new ATOM 0 HB2 PHE A 464 -19.470 -3.931 -0.313 1.00 61.20 H new ATOM 0 HB3 PHE A 464 -18.043 -3.153 -0.971 1.00 61.20 H new ATOM 0 HD1 PHE A 464 -19.855 -3.600 2.284 1.00 32.11 H new ATOM 0 HD2 PHE A 464 -16.108 -3.036 0.325 1.00 34.14 H new ATOM 0 HE1 PHE A 464 -18.686 -3.888 4.425 1.00 24.24 H new ATOM 0 HE2 PHE A 464 -14.942 -3.334 2.463 1.00 63.05 H new ATOM 0 HZ PHE A 464 -16.228 -3.762 4.517 1.00 60.54 H new ATOM 436 N LEU A 465 -17.832 -0.152 -0.724 1.00 43.50 N ATOM 437 CA LEU A 465 -16.972 0.976 -0.447 1.00 0.02 C ATOM 438 C LEU A 465 -17.779 2.263 -0.337 1.00 31.45 C ATOM 439 O LEU A 465 -17.498 3.118 0.500 1.00 41.34 O ATOM 440 CB LEU A 465 -15.898 1.115 -1.519 1.00 24.01 C ATOM 441 CG LEU A 465 -14.844 0.001 -1.578 1.00 30.13 C ATOM 442 CD1 LEU A 465 -13.897 0.231 -2.744 1.00 53.32 C ATOM 443 CD2 LEU A 465 -14.060 -0.071 -0.271 1.00 1.41 C ATOM 0 H LEU A 465 -17.719 -0.549 -1.657 1.00 43.50 H new ATOM 0 HA LEU A 465 -16.483 0.795 0.510 1.00 0.02 H new ATOM 0 HB2 LEU A 465 -16.390 1.172 -2.490 1.00 24.01 H new ATOM 0 HB3 LEU A 465 -15.384 2.064 -1.366 1.00 24.01 H new ATOM 0 HG LEU A 465 -15.359 -0.948 -1.724 1.00 30.13 H new ATOM 0 HD11 LEU A 465 -13.155 -0.567 -2.773 1.00 53.32 H new ATOM 0 HD12 LEU A 465 -14.462 0.235 -3.676 1.00 53.32 H new ATOM 0 HD13 LEU A 465 -13.394 1.190 -2.620 1.00 53.32 H new ATOM 0 HD21 LEU A 465 -13.318 -0.867 -0.335 1.00 1.41 H new ATOM 0 HD22 LEU A 465 -13.557 0.880 -0.096 1.00 1.41 H new ATOM 0 HD23 LEU A 465 -14.744 -0.277 0.553 1.00 1.41 H new ATOM 455 N GLY A 466 -18.788 2.386 -1.152 1.00 40.44 N ATOM 456 CA GLY A 466 -19.593 3.557 -1.129 1.00 51.32 C ATOM 457 C GLY A 466 -18.936 4.701 -1.808 1.00 71.11 C ATOM 458 O GLY A 466 -18.258 4.539 -2.822 1.00 71.12 O ATOM 0 H GLY A 466 -19.067 1.685 -1.838 1.00 40.44 H new ATOM 0 HA2 GLY A 466 -20.548 3.349 -1.612 1.00 51.32 H new ATOM 0 HA3 GLY A 466 -19.811 3.826 -0.095 1.00 51.32 H new ATOM 462 N GLU A 467 -19.113 5.831 -1.210 1.00 34.32 N ATOM 463 CA GLU A 467 -18.599 7.140 -1.651 1.00 43.54 C ATOM 464 C GLU A 467 -17.107 7.112 -2.011 1.00 13.14 C ATOM 465 O GLU A 467 -16.666 7.823 -2.916 1.00 10.11 O ATOM 466 CB GLU A 467 -18.830 8.163 -0.539 1.00 44.41 C ATOM 467 CG GLU A 467 -20.272 8.240 -0.068 1.00 2.42 C ATOM 468 CD GLU A 467 -20.445 9.145 1.118 1.00 61.43 C ATOM 469 OE1 GLU A 467 -20.182 8.712 2.254 1.00 33.13 O ATOM 470 OE2 GLU A 467 -20.876 10.300 0.946 1.00 22.41 O ATOM 0 H GLU A 467 -19.649 5.899 -0.345 1.00 34.32 H new ATOM 0 HA GLU A 467 -19.139 7.411 -2.558 1.00 43.54 H new ATOM 0 HB2 GLU A 467 -18.193 7.914 0.310 1.00 44.41 H new ATOM 0 HB3 GLU A 467 -18.520 9.146 -0.892 1.00 44.41 H new ATOM 0 HG2 GLU A 467 -20.899 8.595 -0.886 1.00 2.42 H new ATOM 0 HG3 GLU A 467 -20.620 7.240 0.189 1.00 2.42 H new ATOM 477 N PHE A 468 -16.345 6.270 -1.333 1.00 74.42 N ATOM 478 CA PHE A 468 -14.906 6.180 -1.551 1.00 22.43 C ATOM 479 C PHE A 468 -14.588 5.639 -2.934 1.00 5.12 C ATOM 480 O PHE A 468 -13.534 5.925 -3.498 1.00 2.41 O ATOM 481 CB PHE A 468 -14.253 5.286 -0.502 1.00 42.15 C ATOM 482 CG PHE A 468 -14.556 5.682 0.906 1.00 43.01 C ATOM 483 CD1 PHE A 468 -15.246 4.825 1.741 1.00 61.32 C ATOM 484 CD2 PHE A 468 -14.167 6.910 1.392 1.00 21.20 C ATOM 485 CE1 PHE A 468 -15.537 5.182 3.032 1.00 53.30 C ATOM 486 CE2 PHE A 468 -14.457 7.273 2.683 1.00 15.04 C ATOM 487 CZ PHE A 468 -15.145 6.407 3.506 1.00 11.24 C ATOM 0 H PHE A 468 -16.701 5.633 -0.620 1.00 74.42 H new ATOM 0 HA PHE A 468 -14.505 7.190 -1.467 1.00 22.43 H new ATOM 0 HB2 PHE A 468 -14.582 4.259 -0.659 1.00 42.15 H new ATOM 0 HB3 PHE A 468 -13.173 5.300 -0.648 1.00 42.15 H new ATOM 0 HD1 PHE A 468 -15.561 3.860 1.372 1.00 61.32 H new ATOM 0 HD2 PHE A 468 -13.629 7.593 0.752 1.00 21.20 H new ATOM 0 HE1 PHE A 468 -16.074 4.500 3.674 1.00 53.30 H new ATOM 0 HE2 PHE A 468 -14.146 8.238 3.055 1.00 15.04 H new ATOM 0 HZ PHE A 468 -15.375 6.693 4.522 1.00 11.24 H new ATOM 497 N ALA A 469 -15.527 4.916 -3.503 1.00 63.44 N ATOM 498 CA ALA A 469 -15.329 4.283 -4.778 1.00 50.22 C ATOM 499 C ALA A 469 -15.389 5.285 -5.911 1.00 25.21 C ATOM 500 O ALA A 469 -14.955 5.005 -7.001 1.00 53.53 O ATOM 501 CB ALA A 469 -16.337 3.184 -4.987 1.00 23.23 C ATOM 0 H ALA A 469 -16.446 4.753 -3.092 1.00 63.44 H new ATOM 0 HA ALA A 469 -14.331 3.844 -4.778 1.00 50.22 H new ATOM 0 HB1 ALA A 469 -16.170 2.717 -5.958 1.00 23.23 H new ATOM 0 HB2 ALA A 469 -16.228 2.436 -4.201 1.00 23.23 H new ATOM 0 HB3 ALA A 469 -17.343 3.602 -4.953 1.00 23.23 H new ATOM 507 N THR A 470 -15.906 6.463 -5.638 1.00 42.53 N ATOM 508 CA THR A 470 -16.012 7.482 -6.648 1.00 62.21 C ATOM 509 C THR A 470 -14.640 8.162 -6.874 1.00 62.32 C ATOM 510 O THR A 470 -14.398 8.792 -7.905 1.00 75.32 O ATOM 511 CB THR A 470 -17.054 8.531 -6.211 1.00 14.24 C ATOM 512 OG1 THR A 470 -18.228 7.847 -5.741 1.00 55.34 O ATOM 513 CG2 THR A 470 -17.446 9.425 -7.380 1.00 52.40 C ATOM 0 H THR A 470 -16.259 6.735 -4.721 1.00 42.53 H new ATOM 0 HA THR A 470 -16.329 7.023 -7.584 1.00 62.21 H new ATOM 0 HB THR A 470 -16.621 9.149 -5.424 1.00 14.24 H new ATOM 0 HG1 THR A 470 -18.898 8.504 -5.458 1.00 55.34 H new ATOM 0 HG21 THR A 470 -18.182 10.157 -7.047 1.00 52.40 H new ATOM 0 HG22 THR A 470 -16.563 9.943 -7.754 1.00 52.40 H new ATOM 0 HG23 THR A 470 -17.874 8.816 -8.176 1.00 52.40 H new ATOM 521 N ASP A 471 -13.730 7.978 -5.926 1.00 43.01 N ATOM 522 CA ASP A 471 -12.437 8.641 -5.973 1.00 73.43 C ATOM 523 C ASP A 471 -11.438 7.859 -6.831 1.00 61.31 C ATOM 524 O ASP A 471 -10.382 8.390 -7.218 1.00 43.45 O ATOM 525 CB ASP A 471 -11.884 8.824 -4.558 1.00 35.42 C ATOM 526 CG ASP A 471 -10.736 9.807 -4.491 1.00 42.23 C ATOM 527 OD1 ASP A 471 -9.585 9.441 -4.714 1.00 33.40 O ATOM 528 OD2 ASP A 471 -10.993 10.988 -4.200 1.00 0.45 O ATOM 0 H ASP A 471 -13.865 7.374 -5.115 1.00 43.01 H new ATOM 0 HA ASP A 471 -12.581 9.619 -6.431 1.00 73.43 H new ATOM 0 HB2 ASP A 471 -12.685 9.165 -3.903 1.00 35.42 H new ATOM 0 HB3 ASP A 471 -11.550 7.859 -4.177 1.00 35.42 H new ATOM 533 N ILE A 472 -11.810 6.625 -7.173 1.00 53.11 N ATOM 534 CA ILE A 472 -10.968 5.689 -7.925 1.00 44.30 C ATOM 535 C ILE A 472 -10.428 6.319 -9.227 1.00 71.12 C ATOM 536 O ILE A 472 -11.090 7.184 -9.847 1.00 53.13 O ATOM 537 CB ILE A 472 -11.777 4.382 -8.275 1.00 62.04 C ATOM 538 CG1 ILE A 472 -10.852 3.315 -8.868 1.00 23.32 C ATOM 539 CG2 ILE A 472 -12.919 4.691 -9.254 1.00 41.13 C ATOM 540 CD1 ILE A 472 -11.548 2.021 -9.273 1.00 1.42 C ATOM 0 H ILE A 472 -12.723 6.239 -6.931 1.00 53.11 H new ATOM 0 HA ILE A 472 -10.119 5.439 -7.289 1.00 44.30 H new ATOM 0 HB ILE A 472 -12.207 3.998 -7.350 1.00 62.04 H new ATOM 0 HG12 ILE A 472 -10.353 3.732 -9.743 1.00 23.32 H new ATOM 0 HG13 ILE A 472 -10.076 3.081 -8.139 1.00 23.32 H new ATOM 0 HG21 ILE A 472 -13.462 3.774 -9.480 1.00 41.13 H new ATOM 0 HG22 ILE A 472 -13.599 5.414 -8.803 1.00 41.13 H new ATOM 0 HG23 ILE A 472 -12.507 5.105 -10.174 1.00 41.13 H new ATOM 0 HD11 ILE A 472 -10.815 1.326 -9.682 1.00 1.42 H new ATOM 0 HD12 ILE A 472 -12.023 1.575 -8.399 1.00 1.42 H new ATOM 0 HD13 ILE A 472 -12.305 2.236 -10.028 1.00 1.42 H new ATOM 552 N ARG A 473 -9.220 5.945 -9.604 1.00 24.54 N ATOM 553 CA ARG A 473 -8.670 6.368 -10.867 1.00 14.50 C ATOM 554 C ARG A 473 -9.338 5.557 -11.968 1.00 30.24 C ATOM 555 O ARG A 473 -9.870 4.470 -11.695 1.00 24.24 O ATOM 556 CB ARG A 473 -7.146 6.168 -10.910 1.00 34.32 C ATOM 557 CG ARG A 473 -6.383 6.934 -9.846 1.00 53.21 C ATOM 558 CD ARG A 473 -4.885 6.819 -10.038 1.00 53.41 C ATOM 559 NE ARG A 473 -4.124 7.433 -8.935 1.00 73.25 N ATOM 560 CZ ARG A 473 -2.851 7.857 -9.018 1.00 23.23 C ATOM 561 NH1 ARG A 473 -2.226 7.863 -10.197 1.00 24.10 N ATOM 562 NH2 ARG A 473 -2.208 8.270 -7.928 1.00 14.32 N ATOM 0 H ARG A 473 -8.605 5.349 -9.050 1.00 24.54 H new ATOM 0 HA ARG A 473 -8.860 7.432 -11.006 1.00 14.50 H new ATOM 0 HB2 ARG A 473 -6.928 5.105 -10.802 1.00 34.32 H new ATOM 0 HB3 ARG A 473 -6.780 6.470 -11.891 1.00 34.32 H new ATOM 0 HG2 ARG A 473 -6.674 7.984 -9.875 1.00 53.21 H new ATOM 0 HG3 ARG A 473 -6.654 6.555 -8.860 1.00 53.21 H new ATOM 0 HD2 ARG A 473 -4.613 5.767 -10.121 1.00 53.41 H new ATOM 0 HD3 ARG A 473 -4.605 7.296 -10.977 1.00 53.41 H new ATOM 0 HE ARG A 473 -4.600 7.545 -8.040 1.00 73.25 H new ATOM 0 HH11 ARG A 473 -2.714 7.546 -11.035 1.00 24.10 H new ATOM 0 HH12 ARG A 473 -1.260 8.185 -10.261 1.00 24.10 H new ATOM 0 HH21 ARG A 473 -2.681 8.266 -7.024 1.00 14.32 H new ATOM 0 HH22 ARG A 473 -1.242 8.591 -7.996 1.00 14.32 H new ATOM 576 N THR A 474 -9.322 6.065 -13.178 1.00 72.21 N ATOM 577 CA THR A 474 -9.945 5.392 -14.302 1.00 44.22 C ATOM 578 C THR A 474 -9.348 3.965 -14.502 1.00 2.32 C ATOM 579 O THR A 474 -8.165 3.800 -14.844 1.00 60.25 O ATOM 580 CB THR A 474 -9.882 6.265 -15.608 1.00 65.33 C ATOM 581 OG1 THR A 474 -10.480 5.588 -16.726 1.00 52.11 O ATOM 582 CG2 THR A 474 -8.455 6.681 -15.951 1.00 3.15 C ATOM 0 H THR A 474 -8.879 6.953 -13.414 1.00 72.21 H new ATOM 0 HA THR A 474 -11.003 5.263 -14.073 1.00 44.22 H new ATOM 0 HB THR A 474 -10.456 7.168 -15.402 1.00 65.33 H new ATOM 0 HG1 THR A 474 -10.426 6.158 -17.521 1.00 52.11 H new ATOM 0 HG21 THR A 474 -8.460 7.282 -16.860 1.00 3.15 H new ATOM 0 HG22 THR A 474 -8.040 7.267 -15.131 1.00 3.15 H new ATOM 0 HG23 THR A 474 -7.844 5.792 -16.107 1.00 3.15 H new ATOM 590 N HIS A 475 -10.179 2.949 -14.211 1.00 34.22 N ATOM 591 CA HIS A 475 -9.803 1.516 -14.255 1.00 70.24 C ATOM 592 C HIS A 475 -8.687 1.205 -13.242 1.00 13.11 C ATOM 593 O HIS A 475 -7.962 0.223 -13.384 1.00 22.33 O ATOM 594 CB HIS A 475 -9.388 1.063 -15.682 1.00 24.23 C ATOM 595 CG HIS A 475 -10.474 1.169 -16.723 1.00 32.13 C ATOM 596 ND1 HIS A 475 -11.279 0.117 -17.116 1.00 54.32 N ATOM 597 CD2 HIS A 475 -10.866 2.231 -17.467 1.00 75.40 C ATOM 598 CE1 HIS A 475 -12.110 0.561 -18.059 1.00 1.01 C ATOM 599 NE2 HIS A 475 -11.901 1.842 -18.311 1.00 32.34 N ATOM 0 H HIS A 475 -11.149 3.098 -13.933 1.00 34.22 H new ATOM 0 HA HIS A 475 -10.691 0.947 -13.978 1.00 70.24 H new ATOM 0 HB2 HIS A 475 -8.536 1.662 -16.004 1.00 24.23 H new ATOM 0 HB3 HIS A 475 -9.050 0.028 -15.635 1.00 24.23 H new ATOM 0 HD2 HIS A 475 -10.442 3.223 -17.413 1.00 75.40 H new ATOM 0 HE1 HIS A 475 -12.855 -0.045 -18.552 1.00 1.01 H new ATOM 0 HE2 HIS A 475 -12.397 2.425 -18.985 1.00 32.34 H new ATOM 607 N GLY A 476 -8.627 2.000 -12.170 1.00 40.02 N ATOM 608 CA GLY A 476 -7.583 1.886 -11.155 1.00 13.22 C ATOM 609 C GLY A 476 -7.722 0.701 -10.210 1.00 23.43 C ATOM 610 O GLY A 476 -7.143 0.699 -9.126 1.00 54.30 O ATOM 0 H GLY A 476 -9.303 2.741 -11.984 1.00 40.02 H new ATOM 0 HA2 GLY A 476 -6.617 1.819 -11.656 1.00 13.22 H new ATOM 0 HA3 GLY A 476 -7.572 2.802 -10.564 1.00 13.22 H new ATOM 614 N VAL A 477 -8.481 -0.280 -10.598 1.00 71.24 N ATOM 615 CA VAL A 477 -8.632 -1.472 -9.826 1.00 21.53 C ATOM 616 C VAL A 477 -7.622 -2.532 -10.304 1.00 33.55 C ATOM 617 O VAL A 477 -7.691 -3.028 -11.436 1.00 10.23 O ATOM 618 CB VAL A 477 -10.109 -1.997 -9.864 1.00 24.04 C ATOM 619 CG1 VAL A 477 -10.618 -2.222 -11.291 1.00 15.54 C ATOM 620 CG2 VAL A 477 -10.279 -3.255 -9.016 1.00 72.41 C ATOM 0 H VAL A 477 -9.016 -0.273 -11.466 1.00 71.24 H new ATOM 0 HA VAL A 477 -8.417 -1.247 -8.781 1.00 21.53 H new ATOM 0 HB VAL A 477 -10.725 -1.210 -9.429 1.00 24.04 H new ATOM 0 HG11 VAL A 477 -11.645 -2.585 -11.258 1.00 15.54 H new ATOM 0 HG12 VAL A 477 -10.583 -1.282 -11.842 1.00 15.54 H new ATOM 0 HG13 VAL A 477 -9.988 -2.959 -11.790 1.00 15.54 H new ATOM 0 HG21 VAL A 477 -11.315 -3.590 -9.066 1.00 72.41 H new ATOM 0 HG22 VAL A 477 -9.625 -4.040 -9.395 1.00 72.41 H new ATOM 0 HG23 VAL A 477 -10.019 -3.034 -7.981 1.00 72.41 H new ATOM 630 N HIS A 478 -6.657 -2.810 -9.471 1.00 51.34 N ATOM 631 CA HIS A 478 -5.621 -3.778 -9.768 1.00 23.45 C ATOM 632 C HIS A 478 -5.861 -4.984 -8.895 1.00 43.53 C ATOM 633 O HIS A 478 -5.482 -4.997 -7.739 1.00 44.23 O ATOM 634 CB HIS A 478 -4.218 -3.203 -9.455 1.00 23.24 C ATOM 635 CG HIS A 478 -3.923 -1.859 -10.068 1.00 43.34 C ATOM 636 ND1 HIS A 478 -4.145 -0.659 -9.417 1.00 41.22 N ATOM 637 CD2 HIS A 478 -3.398 -1.535 -11.273 1.00 71.15 C ATOM 638 CE1 HIS A 478 -3.759 0.327 -10.222 1.00 31.41 C ATOM 639 NE2 HIS A 478 -3.293 -0.146 -11.367 1.00 3.12 N ATOM 0 H HIS A 478 -6.561 -2.370 -8.556 1.00 51.34 H new ATOM 0 HA HIS A 478 -5.655 -4.036 -10.827 1.00 23.45 H new ATOM 0 HB2 HIS A 478 -4.109 -3.123 -8.373 1.00 23.24 H new ATOM 0 HB3 HIS A 478 -3.467 -3.914 -9.799 1.00 23.24 H new ATOM 0 HD2 HIS A 478 -3.107 -2.238 -12.039 1.00 71.15 H new ATOM 0 HE1 HIS A 478 -3.818 1.376 -9.974 1.00 31.41 H new ATOM 0 HE2 HIS A 478 -2.932 0.392 -12.155 1.00 3.12 H new ATOM 647 N MET A 479 -6.535 -5.955 -9.404 1.00 43.14 N ATOM 648 CA MET A 479 -6.850 -7.115 -8.614 1.00 51.51 C ATOM 649 C MET A 479 -5.730 -8.116 -8.712 1.00 53.41 C ATOM 650 O MET A 479 -5.144 -8.307 -9.785 1.00 22.21 O ATOM 651 CB MET A 479 -8.181 -7.728 -9.057 1.00 1.12 C ATOM 652 CG MET A 479 -8.631 -8.941 -8.244 1.00 52.41 C ATOM 653 SD MET A 479 -10.222 -9.611 -8.793 1.00 2.51 S ATOM 654 CE MET A 479 -11.330 -8.234 -8.461 1.00 42.20 C ATOM 0 H MET A 479 -6.883 -5.979 -10.362 1.00 43.14 H new ATOM 0 HA MET A 479 -6.958 -6.816 -7.571 1.00 51.51 H new ATOM 0 HB2 MET A 479 -8.955 -6.962 -8.999 1.00 1.12 H new ATOM 0 HB3 MET A 479 -8.100 -8.020 -10.104 1.00 1.12 H new ATOM 0 HG2 MET A 479 -7.872 -9.720 -8.313 1.00 52.41 H new ATOM 0 HG3 MET A 479 -8.704 -8.660 -7.193 1.00 52.41 H new ATOM 0 HE1 MET A 479 -12.359 -8.592 -8.441 1.00 42.20 H new ATOM 0 HE2 MET A 479 -11.081 -7.791 -7.497 1.00 42.20 H new ATOM 0 HE3 MET A 479 -11.222 -7.483 -9.244 1.00 42.20 H new ATOM 664 N VAL A 480 -5.408 -8.727 -7.604 1.00 11.05 N ATOM 665 CA VAL A 480 -4.369 -9.718 -7.576 1.00 1.12 C ATOM 666 C VAL A 480 -4.940 -11.038 -8.049 1.00 2.11 C ATOM 667 O VAL A 480 -5.654 -11.747 -7.310 1.00 1.11 O ATOM 668 CB VAL A 480 -3.707 -9.868 -6.172 1.00 74.14 C ATOM 669 CG1 VAL A 480 -2.615 -10.938 -6.190 1.00 2.34 C ATOM 670 CG2 VAL A 480 -3.129 -8.534 -5.710 1.00 21.33 C ATOM 0 H VAL A 480 -5.854 -8.554 -6.703 1.00 11.05 H new ATOM 0 HA VAL A 480 -3.573 -9.391 -8.245 1.00 1.12 H new ATOM 0 HB VAL A 480 -4.479 -10.181 -5.469 1.00 74.14 H new ATOM 0 HG11 VAL A 480 -2.171 -11.021 -5.198 1.00 2.34 H new ATOM 0 HG12 VAL A 480 -3.049 -11.896 -6.475 1.00 2.34 H new ATOM 0 HG13 VAL A 480 -1.845 -10.660 -6.910 1.00 2.34 H new ATOM 0 HG21 VAL A 480 -2.671 -8.656 -4.729 1.00 21.33 H new ATOM 0 HG22 VAL A 480 -2.376 -8.197 -6.423 1.00 21.33 H new ATOM 0 HG23 VAL A 480 -3.927 -7.794 -5.648 1.00 21.33 H new ATOM 680 N LEU A 481 -4.710 -11.304 -9.298 1.00 42.00 N ATOM 681 CA LEU A 481 -5.146 -12.508 -9.928 1.00 73.51 C ATOM 682 C LEU A 481 -3.995 -13.469 -9.928 1.00 35.30 C ATOM 683 O LEU A 481 -2.833 -13.053 -9.892 1.00 72.13 O ATOM 684 CB LEU A 481 -5.558 -12.239 -11.380 1.00 72.33 C ATOM 685 CG LEU A 481 -6.642 -11.177 -11.614 1.00 41.11 C ATOM 686 CD1 LEU A 481 -6.839 -10.945 -13.102 1.00 34.01 C ATOM 687 CD2 LEU A 481 -7.953 -11.596 -10.977 1.00 4.03 C ATOM 0 H LEU A 481 -4.202 -10.675 -9.920 1.00 42.00 H new ATOM 0 HA LEU A 481 -6.003 -12.911 -9.389 1.00 73.51 H new ATOM 0 HB2 LEU A 481 -4.668 -11.942 -11.935 1.00 72.33 H new ATOM 0 HB3 LEU A 481 -5.905 -13.177 -11.813 1.00 72.33 H new ATOM 0 HG LEU A 481 -6.313 -10.247 -11.149 1.00 41.11 H new ATOM 0 HD11 LEU A 481 -7.610 -10.190 -13.254 1.00 34.01 H new ATOM 0 HD12 LEU A 481 -5.903 -10.602 -13.544 1.00 34.01 H new ATOM 0 HD13 LEU A 481 -7.145 -11.877 -13.578 1.00 34.01 H new ATOM 0 HD21 LEU A 481 -8.706 -10.828 -11.156 1.00 4.03 H new ATOM 0 HD22 LEU A 481 -8.285 -12.538 -11.413 1.00 4.03 H new ATOM 0 HD23 LEU A 481 -7.812 -11.723 -9.904 1.00 4.03 H new ATOM 699 N ASN A 482 -4.295 -14.716 -9.961 1.00 64.43 N ATOM 700 CA ASN A 482 -3.278 -15.728 -10.022 1.00 61.44 C ATOM 701 C ASN A 482 -3.072 -16.044 -11.504 1.00 11.10 C ATOM 702 O ASN A 482 -3.843 -15.543 -12.326 1.00 33.35 O ATOM 703 CB ASN A 482 -3.738 -16.957 -9.215 1.00 74.34 C ATOM 704 CG ASN A 482 -2.650 -17.989 -9.004 1.00 35.12 C ATOM 705 OD1 ASN A 482 -1.462 -17.669 -8.978 1.00 24.21 O ATOM 706 ND2 ASN A 482 -3.038 -19.214 -8.832 1.00 22.13 N ATOM 0 H ASN A 482 -5.250 -15.075 -9.947 1.00 64.43 H new ATOM 0 HA ASN A 482 -2.333 -15.403 -9.586 1.00 61.44 H new ATOM 0 HB2 ASN A 482 -4.106 -16.626 -8.244 1.00 74.34 H new ATOM 0 HB3 ASN A 482 -4.576 -17.426 -9.730 1.00 74.34 H new ATOM 0 HD21 ASN A 482 -2.350 -19.949 -8.669 1.00 22.13 H new ATOM 0 HD22 ASN A 482 -4.032 -19.443 -8.860 1.00 22.13 H new ATOM 713 N HIS A 483 -2.086 -16.861 -11.864 1.00 55.30 N ATOM 714 CA HIS A 483 -1.784 -17.144 -13.288 1.00 35.40 C ATOM 715 C HIS A 483 -3.001 -17.768 -14.020 1.00 74.11 C ATOM 716 O HIS A 483 -3.176 -17.603 -15.237 1.00 41.34 O ATOM 717 CB HIS A 483 -0.538 -18.044 -13.414 1.00 53.11 C ATOM 718 CG HIS A 483 -0.060 -18.227 -14.821 1.00 33.33 C ATOM 719 ND1 HIS A 483 -0.285 -19.355 -15.577 1.00 12.31 N ATOM 720 CD2 HIS A 483 0.642 -17.387 -15.603 1.00 54.01 C ATOM 721 CE1 HIS A 483 0.277 -19.168 -16.774 1.00 63.31 C ATOM 722 NE2 HIS A 483 0.856 -17.979 -16.842 1.00 42.12 N ATOM 0 H HIS A 483 -1.478 -17.343 -11.202 1.00 55.30 H new ATOM 0 HA HIS A 483 -1.568 -16.193 -13.775 1.00 35.40 H new ATOM 0 HB2 HIS A 483 0.269 -17.615 -12.820 1.00 53.11 H new ATOM 0 HB3 HIS A 483 -0.764 -19.021 -12.988 1.00 53.11 H new ATOM 0 HD2 HIS A 483 0.986 -16.405 -15.313 1.00 54.01 H new ATOM 0 HE1 HIS A 483 0.261 -19.889 -17.578 1.00 63.31 H new ATOM 0 HE2 HIS A 483 1.355 -17.581 -17.638 1.00 42.12 H new ATOM 730 N GLN A 484 -3.837 -18.454 -13.260 1.00 23.42 N ATOM 731 CA GLN A 484 -5.074 -19.055 -13.752 1.00 33.25 C ATOM 732 C GLN A 484 -6.130 -17.966 -14.093 1.00 24.15 C ATOM 733 O GLN A 484 -7.146 -18.236 -14.747 1.00 21.20 O ATOM 734 CB GLN A 484 -5.604 -20.059 -12.709 1.00 62.21 C ATOM 735 CG GLN A 484 -6.857 -20.822 -13.111 1.00 34.24 C ATOM 736 CD GLN A 484 -7.246 -21.859 -12.088 1.00 41.04 C ATOM 737 OE1 GLN A 484 -7.988 -21.587 -11.155 1.00 75.22 O ATOM 738 NE2 GLN A 484 -6.752 -23.043 -12.250 1.00 3.51 N ATOM 0 H GLN A 484 -3.676 -18.614 -12.266 1.00 23.42 H new ATOM 0 HA GLN A 484 -4.869 -19.592 -14.678 1.00 33.25 H new ATOM 0 HB2 GLN A 484 -4.816 -20.779 -12.491 1.00 62.21 H new ATOM 0 HB3 GLN A 484 -5.809 -19.521 -11.784 1.00 62.21 H new ATOM 0 HG2 GLN A 484 -7.680 -20.120 -13.245 1.00 34.24 H new ATOM 0 HG3 GLN A 484 -6.692 -21.307 -14.073 1.00 34.24 H new ATOM 0 HE21 GLN A 484 -6.136 -23.235 -13.040 1.00 3.51 H new ATOM 0 HE22 GLN A 484 -6.978 -23.785 -11.588 1.00 3.51 H new ATOM 747 N GLY A 485 -5.863 -16.751 -13.675 1.00 12.12 N ATOM 748 CA GLY A 485 -6.742 -15.653 -13.944 1.00 4.04 C ATOM 749 C GLY A 485 -7.878 -15.580 -12.972 1.00 4.34 C ATOM 750 O GLY A 485 -8.960 -15.125 -13.307 1.00 32.43 O ATOM 0 H GLY A 485 -5.030 -16.503 -13.140 1.00 12.12 H new ATOM 0 HA2 GLY A 485 -6.177 -14.722 -13.909 1.00 4.04 H new ATOM 0 HA3 GLY A 485 -7.138 -15.747 -14.955 1.00 4.04 H new ATOM 754 N ARG A 486 -7.646 -16.047 -11.777 1.00 23.34 N ATOM 755 CA ARG A 486 -8.649 -15.999 -10.737 1.00 44.04 C ATOM 756 C ARG A 486 -8.078 -15.253 -9.558 1.00 10.31 C ATOM 757 O ARG A 486 -6.886 -15.393 -9.276 1.00 71.45 O ATOM 758 CB ARG A 486 -9.135 -17.410 -10.347 1.00 21.41 C ATOM 759 CG ARG A 486 -9.839 -18.128 -11.487 1.00 3.24 C ATOM 760 CD ARG A 486 -10.350 -19.500 -11.092 1.00 65.34 C ATOM 761 NE ARG A 486 -10.957 -20.177 -12.243 1.00 42.01 N ATOM 762 CZ ARG A 486 -11.246 -21.481 -12.330 1.00 32.24 C ATOM 763 NH1 ARG A 486 -11.046 -22.287 -11.298 1.00 63.21 N ATOM 764 NH2 ARG A 486 -11.744 -21.959 -13.459 1.00 11.52 N ATOM 0 H ARG A 486 -6.763 -16.471 -11.492 1.00 23.34 H new ATOM 0 HA ARG A 486 -9.530 -15.472 -11.104 1.00 44.04 H new ATOM 0 HB2 ARG A 486 -8.282 -18.005 -10.021 1.00 21.41 H new ATOM 0 HB3 ARG A 486 -9.814 -17.333 -9.498 1.00 21.41 H new ATOM 0 HG2 ARG A 486 -10.675 -17.520 -11.832 1.00 3.24 H new ATOM 0 HG3 ARG A 486 -9.151 -18.230 -12.326 1.00 3.24 H new ATOM 0 HD2 ARG A 486 -9.529 -20.101 -10.701 1.00 65.34 H new ATOM 0 HD3 ARG A 486 -11.084 -19.404 -10.292 1.00 65.34 H new ATOM 0 HE ARG A 486 -11.180 -19.599 -13.054 1.00 42.01 H new ATOM 0 HH11 ARG A 486 -10.668 -21.915 -10.426 1.00 63.21 H new ATOM 0 HH12 ARG A 486 -11.270 -23.279 -11.375 1.00 63.21 H new ATOM 0 HH21 ARG A 486 -11.903 -21.336 -14.250 1.00 11.52 H new ATOM 0 HH22 ARG A 486 -11.968 -22.951 -13.538 1.00 11.52 H new ATOM 778 N PRO A 487 -8.889 -14.408 -8.898 1.00 2.43 N ATOM 779 CA PRO A 487 -8.434 -13.580 -7.775 1.00 34.34 C ATOM 780 C PRO A 487 -7.975 -14.386 -6.565 1.00 20.45 C ATOM 781 O PRO A 487 -8.648 -15.336 -6.132 1.00 34.21 O ATOM 782 CB PRO A 487 -9.672 -12.750 -7.405 1.00 23.52 C ATOM 783 CG PRO A 487 -10.828 -13.510 -7.956 1.00 64.03 C ATOM 784 CD PRO A 487 -10.319 -14.181 -9.196 1.00 30.34 C ATOM 0 HA PRO A 487 -7.564 -12.990 -8.063 1.00 34.34 H new ATOM 0 HB2 PRO A 487 -9.758 -12.630 -6.325 1.00 23.52 H new ATOM 0 HB3 PRO A 487 -9.618 -11.749 -7.833 1.00 23.52 H new ATOM 0 HG2 PRO A 487 -11.194 -14.243 -7.236 1.00 64.03 H new ATOM 0 HG3 PRO A 487 -11.661 -12.845 -8.185 1.00 64.03 H new ATOM 0 HD2 PRO A 487 -10.843 -15.117 -9.391 1.00 30.34 H new ATOM 0 HD3 PRO A 487 -10.451 -13.552 -10.077 1.00 30.34 H new ATOM 792 N SER A 488 -6.841 -13.999 -6.020 1.00 33.34 N ATOM 793 CA SER A 488 -6.316 -14.606 -4.822 1.00 64.24 C ATOM 794 C SER A 488 -7.094 -14.095 -3.594 1.00 52.31 C ATOM 795 O SER A 488 -7.118 -14.726 -2.530 1.00 4.44 O ATOM 796 CB SER A 488 -4.835 -14.270 -4.704 1.00 12.33 C ATOM 797 OG SER A 488 -4.154 -14.619 -5.900 1.00 51.30 O ATOM 0 H SER A 488 -6.258 -13.252 -6.399 1.00 33.34 H new ATOM 0 HA SER A 488 -6.431 -15.689 -4.871 1.00 64.24 H new ATOM 0 HB2 SER A 488 -4.711 -13.206 -4.504 1.00 12.33 H new ATOM 0 HB3 SER A 488 -4.400 -14.805 -3.860 1.00 12.33 H new ATOM 0 HG SER A 488 -3.204 -14.397 -5.812 1.00 51.30 H new ATOM 803 N GLY A 489 -7.775 -12.984 -3.775 1.00 31.35 N ATOM 804 CA GLY A 489 -8.535 -12.396 -2.699 1.00 13.44 C ATOM 805 C GLY A 489 -7.866 -11.164 -2.175 1.00 71.53 C ATOM 806 O GLY A 489 -8.193 -10.683 -1.095 1.00 32.11 O ATOM 0 H GLY A 489 -7.817 -12.472 -4.656 1.00 31.35 H new ATOM 0 HA2 GLY A 489 -9.536 -12.148 -3.051 1.00 13.44 H new ATOM 0 HA3 GLY A 489 -8.651 -13.121 -1.893 1.00 13.44 H new ATOM 810 N ASP A 490 -6.941 -10.658 -2.945 1.00 61.35 N ATOM 811 CA ASP A 490 -6.193 -9.471 -2.602 1.00 13.54 C ATOM 812 C ASP A 490 -6.332 -8.545 -3.801 1.00 3.41 C ATOM 813 O ASP A 490 -6.552 -9.041 -4.934 1.00 11.53 O ATOM 814 CB ASP A 490 -4.716 -9.850 -2.376 1.00 61.33 C ATOM 815 CG ASP A 490 -3.924 -8.841 -1.555 1.00 21.34 C ATOM 816 OD1 ASP A 490 -3.681 -7.724 -2.012 1.00 53.23 O ATOM 817 OD2 ASP A 490 -3.487 -9.203 -0.433 1.00 13.23 O ATOM 0 H ASP A 490 -6.679 -11.063 -3.844 1.00 61.35 H new ATOM 0 HA ASP A 490 -6.555 -8.995 -1.691 1.00 13.54 H new ATOM 0 HB2 ASP A 490 -4.675 -10.818 -1.877 1.00 61.33 H new ATOM 0 HB3 ASP A 490 -4.232 -9.970 -3.345 1.00 61.33 H new ATOM 822 N ALA A 491 -6.264 -7.263 -3.597 1.00 3.11 N ATOM 823 CA ALA A 491 -6.443 -6.298 -4.667 1.00 33.32 C ATOM 824 C ALA A 491 -5.962 -4.944 -4.226 1.00 51.52 C ATOM 825 O ALA A 491 -5.947 -4.651 -3.057 1.00 1.34 O ATOM 826 CB ALA A 491 -7.918 -6.201 -5.066 1.00 11.42 C ATOM 0 H ALA A 491 -6.083 -6.845 -2.684 1.00 3.11 H new ATOM 0 HA ALA A 491 -5.862 -6.633 -5.527 1.00 33.32 H new ATOM 0 HB1 ALA A 491 -8.031 -5.473 -5.869 1.00 11.42 H new ATOM 0 HB2 ALA A 491 -8.267 -7.175 -5.408 1.00 11.42 H new ATOM 0 HB3 ALA A 491 -8.508 -5.886 -4.205 1.00 11.42 H new ATOM 832 N PHE A 492 -5.572 -4.141 -5.154 1.00 31.21 N ATOM 833 CA PHE A 492 -5.153 -2.798 -4.889 1.00 75.11 C ATOM 834 C PHE A 492 -5.960 -1.861 -5.753 1.00 53.54 C ATOM 835 O PHE A 492 -5.927 -1.949 -6.979 1.00 34.33 O ATOM 836 CB PHE A 492 -3.678 -2.613 -5.240 1.00 14.53 C ATOM 837 CG PHE A 492 -2.689 -3.360 -4.400 1.00 21.32 C ATOM 838 CD1 PHE A 492 -2.036 -2.726 -3.361 1.00 14.32 C ATOM 839 CD2 PHE A 492 -2.388 -4.685 -4.668 1.00 72.31 C ATOM 840 CE1 PHE A 492 -1.104 -3.395 -2.603 1.00 42.33 C ATOM 841 CE2 PHE A 492 -1.461 -5.362 -3.911 1.00 40.52 C ATOM 842 CZ PHE A 492 -0.817 -4.714 -2.878 1.00 52.40 C ATOM 0 H PHE A 492 -5.533 -4.399 -6.140 1.00 31.21 H new ATOM 0 HA PHE A 492 -5.301 -2.588 -3.830 1.00 75.11 H new ATOM 0 HB2 PHE A 492 -3.535 -2.910 -6.279 1.00 14.53 H new ATOM 0 HB3 PHE A 492 -3.444 -1.550 -5.177 1.00 14.53 H new ATOM 0 HD1 PHE A 492 -2.260 -1.693 -3.141 1.00 14.32 H new ATOM 0 HD2 PHE A 492 -2.887 -5.192 -5.481 1.00 72.31 H new ATOM 0 HE1 PHE A 492 -0.598 -2.888 -1.794 1.00 42.33 H new ATOM 0 HE2 PHE A 492 -1.238 -6.397 -4.125 1.00 40.52 H new ATOM 0 HZ PHE A 492 -0.086 -5.242 -2.283 1.00 52.40 H new ATOM 852 N ILE A 493 -6.668 -0.984 -5.151 1.00 24.42 N ATOM 853 CA ILE A 493 -7.407 -0.006 -5.892 1.00 15.32 C ATOM 854 C ILE A 493 -6.705 1.308 -5.709 1.00 4.32 C ATOM 855 O ILE A 493 -6.355 1.672 -4.589 1.00 60.22 O ATOM 856 CB ILE A 493 -8.882 0.107 -5.437 1.00 50.40 C ATOM 857 CG1 ILE A 493 -9.575 -1.253 -5.534 1.00 61.45 C ATOM 858 CG2 ILE A 493 -9.614 1.122 -6.298 1.00 41.44 C ATOM 859 CD1 ILE A 493 -11.030 -1.245 -5.097 1.00 54.11 C ATOM 0 H ILE A 493 -6.760 -0.913 -4.138 1.00 24.42 H new ATOM 0 HA ILE A 493 -7.441 -0.304 -6.940 1.00 15.32 H new ATOM 0 HB ILE A 493 -8.902 0.437 -4.398 1.00 50.40 H new ATOM 0 HG12 ILE A 493 -9.519 -1.604 -6.565 1.00 61.45 H new ATOM 0 HG13 ILE A 493 -9.028 -1.971 -4.923 1.00 61.45 H new ATOM 0 HG21 ILE A 493 -10.651 1.196 -5.971 1.00 41.44 H new ATOM 0 HG22 ILE A 493 -9.133 2.095 -6.201 1.00 41.44 H new ATOM 0 HG23 ILE A 493 -9.584 0.804 -7.340 1.00 41.44 H new ATOM 0 HD11 ILE A 493 -11.445 -2.248 -5.197 1.00 54.11 H new ATOM 0 HD12 ILE A 493 -11.096 -0.927 -4.056 1.00 54.11 H new ATOM 0 HD13 ILE A 493 -11.594 -0.554 -5.724 1.00 54.11 H new ATOM 871 N GLN A 494 -6.451 1.977 -6.783 1.00 14.33 N ATOM 872 CA GLN A 494 -5.735 3.212 -6.732 1.00 3.24 C ATOM 873 C GLN A 494 -6.692 4.382 -6.924 1.00 63.33 C ATOM 874 O GLN A 494 -7.361 4.505 -7.973 1.00 41.01 O ATOM 875 CB GLN A 494 -4.613 3.220 -7.779 1.00 72.34 C ATOM 876 CG GLN A 494 -3.631 4.369 -7.622 1.00 74.52 C ATOM 877 CD GLN A 494 -2.466 4.322 -8.606 1.00 20.51 C ATOM 878 OE1 GLN A 494 -1.364 4.759 -8.300 1.00 52.00 O ATOM 879 NE2 GLN A 494 -2.699 3.842 -9.799 1.00 75.41 N ATOM 0 H GLN A 494 -6.732 1.686 -7.720 1.00 14.33 H new ATOM 0 HA GLN A 494 -5.272 3.318 -5.751 1.00 3.24 H new ATOM 0 HB2 GLN A 494 -4.067 2.278 -7.719 1.00 72.34 H new ATOM 0 HB3 GLN A 494 -5.058 3.268 -8.773 1.00 72.34 H new ATOM 0 HG2 GLN A 494 -4.165 5.311 -7.750 1.00 74.52 H new ATOM 0 HG3 GLN A 494 -3.237 4.361 -6.606 1.00 74.52 H new ATOM 0 HE21 GLN A 494 -3.625 3.483 -10.032 1.00 75.41 H new ATOM 0 HE22 GLN A 494 -1.955 3.826 -10.497 1.00 75.41 H new ATOM 888 N MET A 495 -6.784 5.194 -5.912 1.00 23.14 N ATOM 889 CA MET A 495 -7.604 6.381 -5.912 1.00 34.43 C ATOM 890 C MET A 495 -6.799 7.565 -6.348 1.00 24.51 C ATOM 891 O MET A 495 -5.593 7.461 -6.586 1.00 72.22 O ATOM 892 CB MET A 495 -8.221 6.628 -4.527 1.00 44.20 C ATOM 893 CG MET A 495 -9.542 5.909 -4.276 1.00 44.31 C ATOM 894 SD MET A 495 -9.464 4.126 -4.471 1.00 32.14 S ATOM 895 CE MET A 495 -11.174 3.698 -4.165 1.00 1.33 C ATOM 0 H MET A 495 -6.279 5.049 -5.038 1.00 23.14 H new ATOM 0 HA MET A 495 -8.420 6.231 -6.619 1.00 34.43 H new ATOM 0 HB2 MET A 495 -7.505 6.318 -3.766 1.00 44.20 H new ATOM 0 HB3 MET A 495 -8.377 7.699 -4.401 1.00 44.20 H new ATOM 0 HG2 MET A 495 -9.880 6.137 -3.265 1.00 44.31 H new ATOM 0 HG3 MET A 495 -10.293 6.305 -4.960 1.00 44.31 H new ATOM 0 HE1 MET A 495 -11.299 2.618 -4.248 1.00 1.33 H new ATOM 0 HE2 MET A 495 -11.456 4.020 -3.163 1.00 1.33 H new ATOM 0 HE3 MET A 495 -11.810 4.194 -4.898 1.00 1.33 H new ATOM 905 N LYS A 496 -7.453 8.662 -6.533 1.00 12.01 N ATOM 906 CA LYS A 496 -6.815 9.842 -6.912 1.00 11.41 C ATOM 907 C LYS A 496 -6.350 10.607 -5.693 1.00 72.21 C ATOM 908 O LYS A 496 -5.291 11.249 -5.714 1.00 15.01 O ATOM 909 CB LYS A 496 -7.746 10.658 -7.759 1.00 52.40 C ATOM 910 CG LYS A 496 -7.987 10.078 -9.146 1.00 10.40 C ATOM 911 CD LYS A 496 -8.773 11.018 -10.051 1.00 53.10 C ATOM 912 CE LYS A 496 -10.133 11.366 -9.490 1.00 51.54 C ATOM 913 NZ LYS A 496 -10.976 10.181 -9.283 1.00 32.12 N ATOM 0 H LYS A 496 -8.463 8.748 -6.419 1.00 12.01 H new ATOM 0 HA LYS A 496 -5.929 9.608 -7.502 1.00 11.41 H new ATOM 0 HB2 LYS A 496 -8.702 10.752 -7.244 1.00 52.40 H new ATOM 0 HB3 LYS A 496 -7.340 11.664 -7.862 1.00 52.40 H new ATOM 0 HG2 LYS A 496 -7.028 9.851 -9.611 1.00 10.40 H new ATOM 0 HG3 LYS A 496 -8.527 9.136 -9.052 1.00 10.40 H new ATOM 0 HD2 LYS A 496 -8.201 11.934 -10.201 1.00 53.10 H new ATOM 0 HD3 LYS A 496 -8.896 10.555 -11.030 1.00 53.10 H new ATOM 0 HE2 LYS A 496 -10.008 11.889 -8.542 1.00 51.54 H new ATOM 0 HE3 LYS A 496 -10.638 12.053 -10.169 1.00 51.54 H new ATOM 0 HZ1 LYS A 496 -11.930 10.479 -8.995 1.00 32.12 H new ATOM 0 HZ2 LYS A 496 -11.036 9.639 -10.168 1.00 32.12 H new ATOM 0 HZ3 LYS A 496 -10.560 9.585 -8.539 1.00 32.12 H new ATOM 927 N SER A 497 -7.123 10.543 -4.638 1.00 4.53 N ATOM 928 CA SER A 497 -6.783 11.205 -3.437 1.00 2.32 C ATOM 929 C SER A 497 -6.548 10.233 -2.297 1.00 24.20 C ATOM 930 O SER A 497 -7.289 9.262 -2.113 1.00 30.23 O ATOM 931 CB SER A 497 -7.855 12.201 -3.060 1.00 12.12 C ATOM 932 OG SER A 497 -7.982 13.211 -4.048 1.00 44.10 O ATOM 0 H SER A 497 -8.002 10.027 -4.603 1.00 4.53 H new ATOM 0 HA SER A 497 -5.847 11.735 -3.615 1.00 2.32 H new ATOM 0 HB2 SER A 497 -8.808 11.686 -2.937 1.00 12.12 H new ATOM 0 HB3 SER A 497 -7.612 12.656 -2.100 1.00 12.12 H new ATOM 0 HG SER A 497 -8.427 13.993 -3.661 1.00 44.10 H new ATOM 938 N ALA A 498 -5.555 10.544 -1.491 1.00 15.34 N ATOM 939 CA ALA A 498 -5.196 9.735 -0.343 1.00 70.44 C ATOM 940 C ALA A 498 -6.214 9.885 0.764 1.00 25.10 C ATOM 941 O ALA A 498 -6.248 9.100 1.700 1.00 54.40 O ATOM 942 CB ALA A 498 -3.825 10.118 0.155 1.00 32.02 C ATOM 0 H ALA A 498 -4.970 11.370 -1.614 1.00 15.34 H new ATOM 0 HA ALA A 498 -5.182 8.690 -0.653 1.00 70.44 H new ATOM 0 HB1 ALA A 498 -3.566 9.504 1.017 1.00 32.02 H new ATOM 0 HB2 ALA A 498 -3.093 9.959 -0.637 1.00 32.02 H new ATOM 0 HB3 ALA A 498 -3.824 11.169 0.445 1.00 32.02 H new ATOM 948 N ASP A 499 -7.019 10.914 0.659 1.00 32.30 N ATOM 949 CA ASP A 499 -8.062 11.215 1.636 1.00 13.32 C ATOM 950 C ASP A 499 -9.052 10.091 1.680 1.00 14.13 C ATOM 951 O ASP A 499 -9.262 9.465 2.721 1.00 42.13 O ATOM 952 CB ASP A 499 -8.814 12.490 1.252 1.00 73.23 C ATOM 953 CG ASP A 499 -7.918 13.648 0.964 1.00 31.15 C ATOM 954 OD1 ASP A 499 -7.633 14.434 1.876 1.00 75.21 O ATOM 955 OD2 ASP A 499 -7.479 13.791 -0.197 1.00 22.41 O ATOM 0 H ASP A 499 -6.976 11.580 -0.113 1.00 32.30 H new ATOM 0 HA ASP A 499 -7.584 11.348 2.607 1.00 13.32 H new ATOM 0 HB2 ASP A 499 -9.428 12.289 0.374 1.00 73.23 H new ATOM 0 HB3 ASP A 499 -9.493 12.759 2.061 1.00 73.23 H new ATOM 960 N ARG A 500 -9.611 9.795 0.527 1.00 62.33 N ATOM 961 CA ARG A 500 -10.614 8.777 0.423 1.00 53.12 C ATOM 962 C ARG A 500 -10.031 7.413 0.656 1.00 61.51 C ATOM 963 O ARG A 500 -10.682 6.552 1.213 1.00 52.20 O ATOM 964 CB ARG A 500 -11.396 8.857 -0.892 1.00 61.41 C ATOM 965 CG ARG A 500 -12.592 9.816 -0.856 1.00 3.21 C ATOM 966 CD ARG A 500 -12.219 11.275 -0.607 1.00 63.10 C ATOM 967 NE ARG A 500 -11.583 11.914 -1.764 1.00 44.31 N ATOM 968 CZ ARG A 500 -11.321 13.224 -1.877 1.00 71.01 C ATOM 969 NH1 ARG A 500 -11.477 14.042 -0.842 1.00 62.43 N ATOM 970 NH2 ARG A 500 -10.902 13.702 -3.039 1.00 52.22 N ATOM 0 H ARG A 500 -9.380 10.254 -0.354 1.00 62.33 H new ATOM 0 HA ARG A 500 -11.340 8.960 1.215 1.00 53.12 H new ATOM 0 HB2 ARG A 500 -10.718 9.170 -1.686 1.00 61.41 H new ATOM 0 HB3 ARG A 500 -11.752 7.860 -1.151 1.00 61.41 H new ATOM 0 HG2 ARG A 500 -13.127 9.746 -1.803 1.00 3.21 H new ATOM 0 HG3 ARG A 500 -13.280 9.491 -0.076 1.00 3.21 H new ATOM 0 HD2 ARG A 500 -13.117 11.832 -0.340 1.00 63.10 H new ATOM 0 HD3 ARG A 500 -11.544 11.330 0.247 1.00 63.10 H new ATOM 0 HE ARG A 500 -11.319 11.314 -2.545 1.00 44.31 H new ATOM 0 HH11 ARG A 500 -11.800 13.676 0.053 1.00 62.43 H new ATOM 0 HH12 ARG A 500 -11.274 15.036 -0.943 1.00 62.43 H new ATOM 0 HH21 ARG A 500 -10.782 13.075 -3.835 1.00 52.22 H new ATOM 0 HH22 ARG A 500 -10.699 14.697 -3.138 1.00 52.22 H new ATOM 984 N ALA A 501 -8.778 7.247 0.285 1.00 24.25 N ATOM 985 CA ALA A 501 -8.087 5.998 0.501 1.00 63.20 C ATOM 986 C ALA A 501 -7.880 5.748 1.986 1.00 3.45 C ATOM 987 O ALA A 501 -8.109 4.639 2.472 1.00 12.51 O ATOM 988 CB ALA A 501 -6.766 5.974 -0.243 1.00 72.22 C ATOM 0 H ALA A 501 -8.217 7.967 -0.170 1.00 24.25 H new ATOM 0 HA ALA A 501 -8.708 5.194 0.106 1.00 63.20 H new ATOM 0 HB1 ALA A 501 -6.265 5.023 -0.064 1.00 72.22 H new ATOM 0 HB2 ALA A 501 -6.948 6.093 -1.311 1.00 72.22 H new ATOM 0 HB3 ALA A 501 -6.134 6.789 0.111 1.00 72.22 H new ATOM 994 N PHE A 502 -7.494 6.790 2.707 1.00 0.34 N ATOM 995 CA PHE A 502 -7.267 6.683 4.130 1.00 25.04 C ATOM 996 C PHE A 502 -8.566 6.409 4.848 1.00 23.23 C ATOM 997 O PHE A 502 -8.646 5.525 5.703 1.00 51.11 O ATOM 998 CB PHE A 502 -6.619 7.970 4.673 1.00 73.41 C ATOM 999 CG PHE A 502 -6.405 7.970 6.163 1.00 23.34 C ATOM 1000 CD1 PHE A 502 -7.214 8.737 6.991 1.00 54.44 C ATOM 1001 CD2 PHE A 502 -5.417 7.193 6.735 1.00 41.00 C ATOM 1002 CE1 PHE A 502 -7.037 8.727 8.356 1.00 42.01 C ATOM 1003 CE2 PHE A 502 -5.233 7.179 8.099 1.00 72.41 C ATOM 1004 CZ PHE A 502 -6.044 7.946 8.912 1.00 22.31 C ATOM 0 H PHE A 502 -7.332 7.721 2.323 1.00 0.34 H new ATOM 0 HA PHE A 502 -6.585 5.851 4.309 1.00 25.04 H new ATOM 0 HB2 PHE A 502 -5.658 8.117 4.179 1.00 73.41 H new ATOM 0 HB3 PHE A 502 -7.247 8.820 4.407 1.00 73.41 H new ATOM 0 HD1 PHE A 502 -7.992 9.349 6.559 1.00 54.44 H new ATOM 0 HD2 PHE A 502 -4.781 6.589 6.105 1.00 41.00 H new ATOM 0 HE1 PHE A 502 -7.673 9.328 8.989 1.00 42.01 H new ATOM 0 HE2 PHE A 502 -4.455 6.569 8.533 1.00 72.41 H new ATOM 0 HZ PHE A 502 -5.901 7.935 9.982 1.00 22.31 H new ATOM 1014 N MET A 503 -9.589 7.127 4.465 1.00 1.45 N ATOM 1015 CA MET A 503 -10.853 7.023 5.136 1.00 42.54 C ATOM 1016 C MET A 503 -11.528 5.687 4.828 1.00 64.33 C ATOM 1017 O MET A 503 -12.194 5.103 5.690 1.00 45.30 O ATOM 1018 CB MET A 503 -11.748 8.210 4.796 1.00 15.05 C ATOM 1019 CG MET A 503 -13.003 8.300 5.653 1.00 74.32 C ATOM 1020 SD MET A 503 -12.647 8.358 7.426 1.00 2.52 S ATOM 1021 CE MET A 503 -11.583 9.806 7.509 1.00 74.50 C ATOM 0 H MET A 503 -9.569 7.790 3.690 1.00 1.45 H new ATOM 0 HA MET A 503 -10.675 7.051 6.211 1.00 42.54 H new ATOM 0 HB2 MET A 503 -11.175 9.130 4.911 1.00 15.05 H new ATOM 0 HB3 MET A 503 -12.039 8.145 3.748 1.00 15.05 H new ATOM 0 HG2 MET A 503 -13.565 9.191 5.372 1.00 74.32 H new ATOM 0 HG3 MET A 503 -13.641 7.441 5.444 1.00 74.32 H new ATOM 0 HE1 MET A 503 -11.494 10.133 8.545 1.00 74.50 H new ATOM 0 HE2 MET A 503 -10.596 9.555 7.122 1.00 74.50 H new ATOM 0 HE3 MET A 503 -12.014 10.609 6.911 1.00 74.50 H new ATOM 1031 N ALA A 504 -11.317 5.181 3.617 1.00 33.34 N ATOM 1032 CA ALA A 504 -11.850 3.887 3.242 1.00 4.22 C ATOM 1033 C ALA A 504 -11.147 2.804 4.021 1.00 63.50 C ATOM 1034 O ALA A 504 -11.773 1.873 4.509 1.00 34.32 O ATOM 1035 CB ALA A 504 -11.687 3.634 1.756 1.00 71.11 C ATOM 0 H ALA A 504 -10.782 5.649 2.885 1.00 33.34 H new ATOM 0 HA ALA A 504 -12.915 3.878 3.474 1.00 4.22 H new ATOM 0 HB1 ALA A 504 -12.097 2.655 1.506 1.00 71.11 H new ATOM 0 HB2 ALA A 504 -12.218 4.403 1.196 1.00 71.11 H new ATOM 0 HB3 ALA A 504 -10.629 3.661 1.496 1.00 71.11 H new ATOM 1041 N ALA A 505 -9.846 2.956 4.176 1.00 2.20 N ATOM 1042 CA ALA A 505 -9.054 1.986 4.880 1.00 13.45 C ATOM 1043 C ALA A 505 -9.362 1.986 6.356 1.00 34.33 C ATOM 1044 O ALA A 505 -9.248 0.966 7.007 1.00 3.42 O ATOM 1045 CB ALA A 505 -7.577 2.205 4.630 1.00 62.02 C ATOM 0 H ALA A 505 -9.318 3.752 3.818 1.00 2.20 H new ATOM 0 HA ALA A 505 -9.318 1.002 4.492 1.00 13.45 H new ATOM 0 HB1 ALA A 505 -7.001 1.457 5.175 1.00 62.02 H new ATOM 0 HB2 ALA A 505 -7.371 2.115 3.563 1.00 62.02 H new ATOM 0 HB3 ALA A 505 -7.294 3.201 4.972 1.00 62.02 H new ATOM 1051 N GLN A 506 -9.743 3.115 6.879 1.00 42.34 N ATOM 1052 CA GLN A 506 -10.091 3.201 8.268 1.00 54.33 C ATOM 1053 C GLN A 506 -11.470 2.605 8.510 1.00 43.32 C ATOM 1054 O GLN A 506 -11.669 1.866 9.474 1.00 73.12 O ATOM 1055 CB GLN A 506 -9.979 4.642 8.776 1.00 43.41 C ATOM 1056 CG GLN A 506 -10.223 4.817 10.267 1.00 51.12 C ATOM 1057 CD GLN A 506 -9.999 6.247 10.714 1.00 71.43 C ATOM 1058 OE1 GLN A 506 -8.886 6.623 11.073 1.00 74.24 O ATOM 1059 NE2 GLN A 506 -11.046 7.036 10.731 1.00 21.23 N ATOM 0 H GLN A 506 -9.821 3.992 6.363 1.00 42.34 H new ATOM 0 HA GLN A 506 -9.378 2.611 8.844 1.00 54.33 H new ATOM 0 HB2 GLN A 506 -8.984 5.019 8.539 1.00 43.41 H new ATOM 0 HB3 GLN A 506 -10.692 5.260 8.231 1.00 43.41 H new ATOM 0 HG2 GLN A 506 -11.244 4.518 10.505 1.00 51.12 H new ATOM 0 HG3 GLN A 506 -9.559 4.155 10.823 1.00 51.12 H new ATOM 0 HE21 GLN A 506 -11.954 6.686 10.425 1.00 21.23 H new ATOM 0 HE22 GLN A 506 -10.953 8.000 11.051 1.00 21.23 H new ATOM 1068 N LYS A 507 -12.399 2.873 7.614 1.00 35.44 N ATOM 1069 CA LYS A 507 -13.737 2.339 7.758 1.00 30.21 C ATOM 1070 C LYS A 507 -13.741 0.839 7.532 1.00 52.34 C ATOM 1071 O LYS A 507 -14.343 0.078 8.294 1.00 55.41 O ATOM 1072 CB LYS A 507 -14.733 3.009 6.791 1.00 10.01 C ATOM 1073 CG LYS A 507 -16.158 2.451 6.918 1.00 43.20 C ATOM 1074 CD LYS A 507 -17.136 3.055 5.917 1.00 41.31 C ATOM 1075 CE LYS A 507 -17.357 4.542 6.148 1.00 41.21 C ATOM 1076 NZ LYS A 507 -18.360 5.094 5.218 1.00 24.33 N ATOM 0 H LYS A 507 -12.254 3.452 6.787 1.00 35.44 H new ATOM 0 HA LYS A 507 -14.057 2.555 8.777 1.00 30.21 H new ATOM 0 HB2 LYS A 507 -14.750 4.082 6.982 1.00 10.01 H new ATOM 0 HB3 LYS A 507 -14.385 2.873 5.767 1.00 10.01 H new ATOM 0 HG2 LYS A 507 -16.131 1.370 6.781 1.00 43.20 H new ATOM 0 HG3 LYS A 507 -16.524 2.635 7.928 1.00 43.20 H new ATOM 0 HD2 LYS A 507 -16.760 2.899 4.906 1.00 41.31 H new ATOM 0 HD3 LYS A 507 -18.091 2.533 5.986 1.00 41.31 H new ATOM 0 HE2 LYS A 507 -17.683 4.706 7.175 1.00 41.21 H new ATOM 0 HE3 LYS A 507 -16.414 5.074 6.024 1.00 41.21 H new ATOM 0 HZ1 LYS A 507 -18.759 5.968 5.616 1.00 24.33 H new ATOM 0 HZ2 LYS A 507 -17.908 5.304 4.305 1.00 24.33 H new ATOM 0 HZ3 LYS A 507 -19.121 4.400 5.076 1.00 24.33 H new ATOM 1090 N CYS A 508 -13.037 0.417 6.531 1.00 23.43 N ATOM 1091 CA CYS A 508 -13.069 -0.939 6.128 1.00 44.05 C ATOM 1092 C CYS A 508 -11.879 -1.761 6.646 1.00 10.32 C ATOM 1093 O CYS A 508 -11.614 -2.856 6.137 1.00 14.55 O ATOM 1094 CB CYS A 508 -13.197 -1.015 4.617 1.00 2.24 C ATOM 1095 SG CYS A 508 -14.632 -0.131 3.956 1.00 23.45 S ATOM 0 H CYS A 508 -12.424 1.011 5.973 1.00 23.43 H new ATOM 0 HA CYS A 508 -13.945 -1.398 6.587 1.00 44.05 H new ATOM 0 HB2 CYS A 508 -12.292 -0.608 4.165 1.00 2.24 H new ATOM 0 HB3 CYS A 508 -13.259 -2.062 4.320 1.00 2.24 H new ATOM 0 HG CYS A 508 -15.399 -0.964 3.317 1.00 23.45 H new ATOM 1101 N HIS A 509 -11.162 -1.262 7.650 1.00 60.41 N ATOM 1102 CA HIS A 509 -10.093 -2.050 8.254 1.00 14.42 C ATOM 1103 C HIS A 509 -10.683 -3.276 8.984 1.00 71.32 C ATOM 1104 O HIS A 509 -11.118 -3.182 10.143 1.00 24.23 O ATOM 1105 CB HIS A 509 -9.228 -1.207 9.209 1.00 52.23 C ATOM 1106 CG HIS A 509 -8.016 -1.928 9.729 1.00 22.21 C ATOM 1107 ND1 HIS A 509 -7.626 -1.930 11.047 1.00 42.31 N ATOM 1108 CD2 HIS A 509 -7.087 -2.661 9.064 1.00 72.53 C ATOM 1109 CE1 HIS A 509 -6.507 -2.641 11.146 1.00 75.01 C ATOM 1110 NE2 HIS A 509 -6.133 -3.112 9.966 1.00 2.23 N ATOM 0 H HIS A 509 -11.298 -0.336 8.055 1.00 60.41 H new ATOM 0 HA HIS A 509 -9.440 -2.396 7.453 1.00 14.42 H new ATOM 0 HB2 HIS A 509 -8.907 -0.304 8.691 1.00 52.23 H new ATOM 0 HB3 HIS A 509 -9.840 -0.890 10.053 1.00 52.23 H new ATOM 0 HD2 HIS A 509 -7.090 -2.861 8.003 1.00 72.53 H new ATOM 0 HE1 HIS A 509 -5.972 -2.812 12.069 1.00 75.01 H new ATOM 0 HE2 HIS A 509 -5.315 -3.686 9.762 1.00 2.23 H new ATOM 1118 N LYS A 510 -10.770 -4.389 8.242 1.00 40.04 N ATOM 1119 CA LYS A 510 -11.289 -5.673 8.712 1.00 33.21 C ATOM 1120 C LYS A 510 -12.775 -5.584 8.983 1.00 52.14 C ATOM 1121 O LYS A 510 -13.311 -6.211 9.902 1.00 4.11 O ATOM 1122 CB LYS A 510 -10.497 -6.214 9.904 1.00 23.11 C ATOM 1123 CG LYS A 510 -9.060 -6.539 9.542 1.00 50.42 C ATOM 1124 CD LYS A 510 -8.310 -7.136 10.704 1.00 14.32 C ATOM 1125 CE LYS A 510 -6.899 -7.509 10.301 1.00 42.22 C ATOM 1126 NZ LYS A 510 -6.157 -8.146 11.396 1.00 3.41 N ATOM 0 H LYS A 510 -10.470 -4.417 7.267 1.00 40.04 H new ATOM 0 HA LYS A 510 -11.152 -6.403 7.915 1.00 33.21 H new ATOM 0 HB2 LYS A 510 -10.509 -5.479 10.709 1.00 23.11 H new ATOM 0 HB3 LYS A 510 -10.985 -7.111 10.284 1.00 23.11 H new ATOM 0 HG2 LYS A 510 -9.045 -7.236 8.704 1.00 50.42 H new ATOM 0 HG3 LYS A 510 -8.555 -5.632 9.211 1.00 50.42 H new ATOM 0 HD2 LYS A 510 -8.281 -6.423 11.528 1.00 14.32 H new ATOM 0 HD3 LYS A 510 -8.835 -8.020 11.066 1.00 14.32 H new ATOM 0 HE2 LYS A 510 -6.934 -8.186 9.447 1.00 42.22 H new ATOM 0 HE3 LYS A 510 -6.367 -6.614 9.977 1.00 42.22 H new ATOM 0 HZ1 LYS A 510 -5.197 -8.383 11.073 1.00 3.41 H new ATOM 0 HZ2 LYS A 510 -6.099 -7.492 12.203 1.00 3.41 H new ATOM 0 HZ3 LYS A 510 -6.648 -9.015 11.689 1.00 3.41 H new ATOM 1140 N LYS A 511 -13.435 -4.810 8.157 1.00 63.03 N ATOM 1141 CA LYS A 511 -14.850 -4.614 8.241 1.00 25.23 C ATOM 1142 C LYS A 511 -15.557 -5.792 7.593 1.00 42.12 C ATOM 1143 O LYS A 511 -15.024 -6.421 6.663 1.00 61.21 O ATOM 1144 CB LYS A 511 -15.244 -3.279 7.566 1.00 14.33 C ATOM 1145 CG LYS A 511 -16.746 -2.976 7.515 1.00 74.13 C ATOM 1146 CD LYS A 511 -17.016 -1.623 6.866 1.00 11.32 C ATOM 1147 CE LYS A 511 -18.512 -1.371 6.648 1.00 53.13 C ATOM 1148 NZ LYS A 511 -19.305 -1.397 7.902 1.00 40.10 N ATOM 0 H LYS A 511 -12.991 -4.293 7.398 1.00 63.03 H new ATOM 0 HA LYS A 511 -15.155 -4.558 9.286 1.00 25.23 H new ATOM 0 HB2 LYS A 511 -14.746 -2.466 8.094 1.00 14.33 H new ATOM 0 HB3 LYS A 511 -14.858 -3.281 6.547 1.00 14.33 H new ATOM 0 HG2 LYS A 511 -17.258 -3.759 6.956 1.00 74.13 H new ATOM 0 HG3 LYS A 511 -17.156 -2.986 8.525 1.00 74.13 H new ATOM 0 HD2 LYS A 511 -16.604 -0.833 7.494 1.00 11.32 H new ATOM 0 HD3 LYS A 511 -16.498 -1.572 5.908 1.00 11.32 H new ATOM 0 HE2 LYS A 511 -18.643 -0.403 6.165 1.00 53.13 H new ATOM 0 HE3 LYS A 511 -18.903 -2.124 5.964 1.00 53.13 H new ATOM 0 HZ1 LYS A 511 -20.297 -1.170 7.690 1.00 40.10 H new ATOM 0 HZ2 LYS A 511 -19.250 -2.344 8.328 1.00 40.10 H new ATOM 0 HZ3 LYS A 511 -18.924 -0.695 8.568 1.00 40.10 H new ATOM 1162 N ASN A 512 -16.704 -6.115 8.110 1.00 1.25 N ATOM 1163 CA ASN A 512 -17.505 -7.182 7.583 1.00 3.21 C ATOM 1164 C ASN A 512 -18.164 -6.755 6.294 1.00 64.04 C ATOM 1165 O ASN A 512 -18.918 -5.785 6.263 1.00 24.15 O ATOM 1166 CB ASN A 512 -18.583 -7.625 8.581 1.00 4.20 C ATOM 1167 CG ASN A 512 -18.041 -8.394 9.763 1.00 72.22 C ATOM 1168 OD1 ASN A 512 -17.626 -7.816 10.769 1.00 74.25 O ATOM 1169 ND2 ASN A 512 -18.081 -9.701 9.678 1.00 42.23 N ATOM 0 H ASN A 512 -17.115 -5.643 8.915 1.00 1.25 H new ATOM 0 HA ASN A 512 -16.841 -8.026 7.396 1.00 3.21 H new ATOM 0 HB2 ASN A 512 -19.112 -6.744 8.944 1.00 4.20 H new ATOM 0 HB3 ASN A 512 -19.314 -8.244 8.061 1.00 4.20 H new ATOM 0 HD21 ASN A 512 -17.762 -10.273 10.460 1.00 42.23 H new ATOM 0 HD22 ASN A 512 -18.431 -10.146 8.830 1.00 42.23 H new ATOM 1176 N MET A 513 -17.874 -7.461 5.249 1.00 21.45 N ATOM 1177 CA MET A 513 -18.493 -7.239 3.983 1.00 65.33 C ATOM 1178 C MET A 513 -19.520 -8.309 3.832 1.00 11.10 C ATOM 1179 O MET A 513 -19.189 -9.436 3.443 1.00 21.13 O ATOM 1180 CB MET A 513 -17.483 -7.303 2.827 1.00 43.34 C ATOM 1181 CG MET A 513 -18.110 -7.105 1.449 1.00 52.12 C ATOM 1182 SD MET A 513 -16.907 -7.197 0.108 1.00 74.14 S ATOM 1183 CE MET A 513 -17.981 -6.952 -1.308 1.00 22.23 C ATOM 0 H MET A 513 -17.191 -8.219 5.251 1.00 21.45 H new ATOM 0 HA MET A 513 -18.932 -6.242 3.946 1.00 65.33 H new ATOM 0 HB2 MET A 513 -16.720 -6.541 2.981 1.00 43.34 H new ATOM 0 HB3 MET A 513 -16.978 -8.269 2.851 1.00 43.34 H new ATOM 0 HG2 MET A 513 -18.878 -7.862 1.293 1.00 52.12 H new ATOM 0 HG3 MET A 513 -18.607 -6.135 1.418 1.00 52.12 H new ATOM 0 HE1 MET A 513 -17.389 -6.981 -2.223 1.00 22.23 H new ATOM 0 HE2 MET A 513 -18.732 -7.742 -1.336 1.00 22.23 H new ATOM 0 HE3 MET A 513 -18.475 -5.984 -1.227 1.00 22.23 H new ATOM 1193 N LYS A 514 -20.737 -7.988 4.235 1.00 65.52 N ATOM 1194 CA LYS A 514 -21.872 -8.909 4.242 1.00 44.12 C ATOM 1195 C LYS A 514 -21.676 -10.020 5.275 1.00 1.41 C ATOM 1196 O LYS A 514 -22.258 -9.992 6.354 1.00 53.42 O ATOM 1197 CB LYS A 514 -22.145 -9.484 2.845 1.00 2.10 C ATOM 1198 CG LYS A 514 -22.465 -8.428 1.807 1.00 73.14 C ATOM 1199 CD LYS A 514 -22.666 -9.043 0.445 1.00 42.44 C ATOM 1200 CE LYS A 514 -22.898 -7.976 -0.603 1.00 50.11 C ATOM 1201 NZ LYS A 514 -23.107 -8.558 -1.937 1.00 42.40 N ATOM 0 H LYS A 514 -20.975 -7.057 4.576 1.00 65.52 H new ATOM 0 HA LYS A 514 -22.754 -8.338 4.533 1.00 44.12 H new ATOM 0 HB2 LYS A 514 -21.273 -10.051 2.518 1.00 2.10 H new ATOM 0 HB3 LYS A 514 -22.977 -10.186 2.906 1.00 2.10 H new ATOM 0 HG2 LYS A 514 -23.365 -7.887 2.101 1.00 73.14 H new ATOM 0 HG3 LYS A 514 -21.655 -7.700 1.764 1.00 73.14 H new ATOM 0 HD2 LYS A 514 -21.792 -9.637 0.177 1.00 42.44 H new ATOM 0 HD3 LYS A 514 -23.517 -9.723 0.471 1.00 42.44 H new ATOM 0 HE2 LYS A 514 -23.767 -7.378 -0.327 1.00 50.11 H new ATOM 0 HE3 LYS A 514 -22.042 -7.301 -0.631 1.00 50.11 H new ATOM 0 HZ1 LYS A 514 -23.296 -7.798 -2.622 1.00 42.40 H new ATOM 0 HZ2 LYS A 514 -22.255 -9.080 -2.226 1.00 42.40 H new ATOM 0 HZ3 LYS A 514 -23.918 -9.208 -1.909 1.00 42.40 H new ATOM 1215 N ASP A 515 -20.863 -10.971 4.934 1.00 73.43 N ATOM 1216 CA ASP A 515 -20.535 -12.093 5.791 1.00 34.35 C ATOM 1217 C ASP A 515 -19.019 -12.212 5.971 1.00 44.44 C ATOM 1218 O ASP A 515 -18.525 -12.771 6.946 1.00 51.51 O ATOM 1219 CB ASP A 515 -21.138 -13.390 5.201 1.00 65.43 C ATOM 1220 CG ASP A 515 -20.720 -14.668 5.908 1.00 24.31 C ATOM 1221 OD1 ASP A 515 -19.676 -15.253 5.548 1.00 43.04 O ATOM 1222 OD2 ASP A 515 -21.459 -15.142 6.794 1.00 74.42 O ATOM 0 H ASP A 515 -20.391 -10.999 4.030 1.00 73.43 H new ATOM 0 HA ASP A 515 -20.967 -11.929 6.778 1.00 34.35 H new ATOM 0 HB2 ASP A 515 -22.225 -13.314 5.231 1.00 65.43 H new ATOM 0 HB3 ASP A 515 -20.852 -13.462 4.152 1.00 65.43 H new ATOM 1227 N ARG A 516 -18.308 -11.591 5.087 1.00 13.23 N ATOM 1228 CA ARG A 516 -16.870 -11.739 4.976 1.00 4.40 C ATOM 1229 C ARG A 516 -16.174 -10.694 5.830 1.00 13.44 C ATOM 1230 O ARG A 516 -16.774 -9.715 6.208 1.00 31.31 O ATOM 1231 CB ARG A 516 -16.496 -11.511 3.508 1.00 1.33 C ATOM 1232 CG ARG A 516 -15.103 -11.927 3.095 1.00 73.45 C ATOM 1233 CD ARG A 516 -14.949 -13.425 3.160 1.00 75.42 C ATOM 1234 NE ARG A 516 -13.666 -13.855 2.617 1.00 22.24 N ATOM 1235 CZ ARG A 516 -13.301 -15.127 2.443 1.00 1.30 C ATOM 1236 NH1 ARG A 516 -14.057 -16.114 2.918 1.00 11.24 N ATOM 1237 NH2 ARG A 516 -12.180 -15.408 1.787 1.00 43.11 N ATOM 0 H ARG A 516 -18.707 -10.950 4.401 1.00 13.23 H new ATOM 0 HA ARG A 516 -16.565 -12.730 5.313 1.00 4.40 H new ATOM 0 HB2 ARG A 516 -17.211 -12.049 2.886 1.00 1.33 H new ATOM 0 HB3 ARG A 516 -16.615 -10.450 3.286 1.00 1.33 H new ATOM 0 HG2 ARG A 516 -14.901 -11.580 2.082 1.00 73.45 H new ATOM 0 HG3 ARG A 516 -14.369 -11.453 3.747 1.00 73.45 H new ATOM 0 HD2 ARG A 516 -15.037 -13.756 4.195 1.00 75.42 H new ATOM 0 HD3 ARG A 516 -15.758 -13.899 2.604 1.00 75.42 H new ATOM 0 HE ARG A 516 -12.999 -13.131 2.351 1.00 22.24 H new ATOM 0 HH11 ARG A 516 -14.920 -15.900 3.418 1.00 11.24 H new ATOM 0 HH12 ARG A 516 -13.773 -17.084 2.782 1.00 11.24 H new ATOM 0 HH21 ARG A 516 -11.602 -14.653 1.418 1.00 43.11 H new ATOM 0 HH22 ARG A 516 -11.898 -16.379 1.652 1.00 43.11 H new ATOM 1251 N TYR A 517 -14.937 -10.917 6.144 1.00 1.45 N ATOM 1252 CA TYR A 517 -14.134 -9.927 6.807 1.00 74.54 C ATOM 1253 C TYR A 517 -13.064 -9.532 5.833 1.00 42.15 C ATOM 1254 O TYR A 517 -12.248 -10.362 5.427 1.00 73.51 O ATOM 1255 CB TYR A 517 -13.463 -10.479 8.044 1.00 43.03 C ATOM 1256 CG TYR A 517 -14.385 -10.919 9.163 1.00 62.12 C ATOM 1257 CD1 TYR A 517 -15.123 -12.094 9.078 1.00 22.01 C ATOM 1258 CD2 TYR A 517 -14.502 -10.156 10.317 1.00 11.22 C ATOM 1259 CE1 TYR A 517 -15.953 -12.486 10.103 1.00 61.00 C ATOM 1260 CE2 TYR A 517 -15.328 -10.546 11.349 1.00 65.43 C ATOM 1261 CZ TYR A 517 -16.052 -11.712 11.237 1.00 15.13 C ATOM 1262 OH TYR A 517 -16.890 -12.092 12.258 1.00 14.10 O ATOM 0 H TYR A 517 -14.450 -11.792 5.949 1.00 1.45 H new ATOM 0 HA TYR A 517 -14.765 -9.093 7.115 1.00 74.54 H new ATOM 0 HB2 TYR A 517 -12.849 -11.331 7.750 1.00 43.03 H new ATOM 0 HB3 TYR A 517 -12.787 -9.719 8.436 1.00 43.03 H new ATOM 0 HD1 TYR A 517 -15.044 -12.709 8.194 1.00 22.01 H new ATOM 0 HD2 TYR A 517 -13.936 -9.241 10.408 1.00 11.22 H new ATOM 0 HE1 TYR A 517 -16.525 -13.398 10.018 1.00 61.00 H new ATOM 0 HE2 TYR A 517 -15.407 -9.941 12.240 1.00 65.43 H new ATOM 0 HH TYR A 517 -16.840 -11.435 12.984 1.00 14.10 H new ATOM 1272 N VAL A 518 -13.079 -8.326 5.439 1.00 63.42 N ATOM 1273 CA VAL A 518 -12.153 -7.847 4.462 1.00 4.11 C ATOM 1274 C VAL A 518 -11.176 -6.887 5.104 1.00 62.25 C ATOM 1275 O VAL A 518 -11.577 -5.885 5.700 1.00 34.32 O ATOM 1276 CB VAL A 518 -12.897 -7.150 3.303 1.00 45.34 C ATOM 1277 CG1 VAL A 518 -11.920 -6.566 2.288 1.00 15.23 C ATOM 1278 CG2 VAL A 518 -13.845 -8.123 2.610 1.00 23.15 C ATOM 0 H VAL A 518 -13.735 -7.623 5.779 1.00 63.42 H new ATOM 0 HA VAL A 518 -11.605 -8.698 4.057 1.00 4.11 H new ATOM 0 HB VAL A 518 -13.477 -6.332 3.730 1.00 45.34 H new ATOM 0 HG11 VAL A 518 -12.476 -6.082 1.485 1.00 15.23 H new ATOM 0 HG12 VAL A 518 -11.280 -5.833 2.779 1.00 15.23 H new ATOM 0 HG13 VAL A 518 -11.305 -7.365 1.874 1.00 15.23 H new ATOM 0 HG21 VAL A 518 -14.360 -7.612 1.796 1.00 23.15 H new ATOM 0 HG22 VAL A 518 -13.276 -8.962 2.210 1.00 23.15 H new ATOM 0 HG23 VAL A 518 -14.578 -8.491 3.328 1.00 23.15 H new ATOM 1288 N GLU A 519 -9.911 -7.196 5.010 1.00 4.41 N ATOM 1289 CA GLU A 519 -8.903 -6.328 5.522 1.00 22.31 C ATOM 1290 C GLU A 519 -8.582 -5.310 4.455 1.00 64.33 C ATOM 1291 O GLU A 519 -8.027 -5.643 3.410 1.00 23.35 O ATOM 1292 CB GLU A 519 -7.632 -7.108 5.915 1.00 75.23 C ATOM 1293 CG GLU A 519 -6.493 -6.212 6.409 1.00 63.22 C ATOM 1294 CD GLU A 519 -5.221 -6.967 6.735 1.00 42.55 C ATOM 1295 OE1 GLU A 519 -4.564 -7.482 5.813 1.00 1.32 O ATOM 1296 OE2 GLU A 519 -4.814 -6.993 7.911 1.00 21.03 O ATOM 0 H GLU A 519 -9.559 -8.051 4.579 1.00 4.41 H new ATOM 0 HA GLU A 519 -9.270 -5.838 6.424 1.00 22.31 H new ATOM 0 HB2 GLU A 519 -7.883 -7.826 6.695 1.00 75.23 H new ATOM 0 HB3 GLU A 519 -7.286 -7.680 5.054 1.00 75.23 H new ATOM 0 HG2 GLU A 519 -6.275 -5.463 5.647 1.00 63.22 H new ATOM 0 HG3 GLU A 519 -6.824 -5.675 7.298 1.00 63.22 H new ATOM 1303 N VAL A 520 -8.973 -4.105 4.687 1.00 2.13 N ATOM 1304 CA VAL A 520 -8.679 -3.026 3.803 1.00 12.31 C ATOM 1305 C VAL A 520 -7.582 -2.197 4.451 1.00 50.01 C ATOM 1306 O VAL A 520 -7.711 -1.776 5.607 1.00 1.41 O ATOM 1307 CB VAL A 520 -9.952 -2.181 3.548 1.00 21.41 C ATOM 1308 CG1 VAL A 520 -9.661 -0.981 2.693 1.00 52.11 C ATOM 1309 CG2 VAL A 520 -11.019 -3.039 2.885 1.00 12.22 C ATOM 0 H VAL A 520 -9.514 -3.835 5.508 1.00 2.13 H new ATOM 0 HA VAL A 520 -8.342 -3.393 2.834 1.00 12.31 H new ATOM 0 HB VAL A 520 -10.313 -1.825 4.513 1.00 21.41 H new ATOM 0 HG11 VAL A 520 -10.579 -0.414 2.537 1.00 52.11 H new ATOM 0 HG12 VAL A 520 -8.925 -0.350 3.191 1.00 52.11 H new ATOM 0 HG13 VAL A 520 -9.268 -1.307 1.730 1.00 52.11 H new ATOM 0 HG21 VAL A 520 -11.911 -2.438 2.709 1.00 12.22 H new ATOM 0 HG22 VAL A 520 -10.643 -3.418 1.935 1.00 12.22 H new ATOM 0 HG23 VAL A 520 -11.269 -3.877 3.536 1.00 12.22 H new ATOM 1319 N PHE A 521 -6.506 -2.006 3.744 1.00 24.54 N ATOM 1320 CA PHE A 521 -5.340 -1.361 4.287 1.00 3.23 C ATOM 1321 C PHE A 521 -4.857 -0.324 3.290 1.00 51.11 C ATOM 1322 O PHE A 521 -4.865 -0.575 2.107 1.00 21.04 O ATOM 1323 CB PHE A 521 -4.272 -2.436 4.479 1.00 15.15 C ATOM 1324 CG PHE A 521 -3.220 -2.136 5.507 1.00 21.53 C ATOM 1325 CD1 PHE A 521 -1.995 -1.614 5.144 1.00 13.14 C ATOM 1326 CD2 PHE A 521 -3.460 -2.408 6.845 1.00 22.44 C ATOM 1327 CE1 PHE A 521 -1.024 -1.367 6.095 1.00 32.10 C ATOM 1328 CE2 PHE A 521 -2.497 -2.161 7.801 1.00 1.13 C ATOM 1329 CZ PHE A 521 -1.278 -1.642 7.425 1.00 41.41 C ATOM 0 H PHE A 521 -6.410 -2.294 2.770 1.00 24.54 H new ATOM 0 HA PHE A 521 -5.556 -0.871 5.236 1.00 3.23 H new ATOM 0 HB2 PHE A 521 -4.767 -3.368 4.754 1.00 15.15 H new ATOM 0 HB3 PHE A 521 -3.779 -2.607 3.522 1.00 15.15 H new ATOM 0 HD1 PHE A 521 -1.793 -1.396 4.106 1.00 13.14 H new ATOM 0 HD2 PHE A 521 -4.413 -2.819 7.143 1.00 22.44 H new ATOM 0 HE1 PHE A 521 -0.068 -0.960 5.800 1.00 32.10 H new ATOM 0 HE2 PHE A 521 -2.698 -2.374 8.841 1.00 1.13 H new ATOM 0 HZ PHE A 521 -0.520 -1.450 8.170 1.00 41.41 H new ATOM 1339 N GLN A 522 -4.469 0.824 3.758 1.00 53.21 N ATOM 1340 CA GLN A 522 -3.983 1.878 2.881 1.00 60.30 C ATOM 1341 C GLN A 522 -2.501 1.644 2.567 1.00 73.41 C ATOM 1342 O GLN A 522 -1.777 1.067 3.383 1.00 35.21 O ATOM 1343 CB GLN A 522 -4.164 3.231 3.557 1.00 13.41 C ATOM 1344 CG GLN A 522 -3.613 4.390 2.763 1.00 13.55 C ATOM 1345 CD GLN A 522 -3.551 5.649 3.551 1.00 21.51 C ATOM 1346 OE1 GLN A 522 -3.417 5.629 4.770 1.00 3.41 O ATOM 1347 NE2 GLN A 522 -3.587 6.739 2.878 1.00 1.41 N ATOM 0 H GLN A 522 -4.475 1.068 4.748 1.00 53.21 H new ATOM 0 HA GLN A 522 -4.551 1.866 1.951 1.00 60.30 H new ATOM 0 HB2 GLN A 522 -5.226 3.398 3.735 1.00 13.41 H new ATOM 0 HB3 GLN A 522 -3.677 3.207 4.532 1.00 13.41 H new ATOM 0 HG2 GLN A 522 -2.613 4.139 2.408 1.00 13.55 H new ATOM 0 HG3 GLN A 522 -4.234 4.549 1.881 1.00 13.55 H new ATOM 0 HE21 GLN A 522 -3.700 6.709 1.865 1.00 1.41 H new ATOM 0 HE22 GLN A 522 -3.503 7.636 3.356 1.00 1.41 H new ATOM 1356 N CYS A 523 -2.055 2.130 1.428 1.00 41.11 N ATOM 1357 CA CYS A 523 -0.700 1.938 0.975 1.00 74.42 C ATOM 1358 C CYS A 523 -0.373 2.932 -0.106 1.00 30.04 C ATOM 1359 O CYS A 523 -1.254 3.663 -0.589 1.00 52.41 O ATOM 1360 CB CYS A 523 -0.497 0.507 0.467 1.00 50.43 C ATOM 1361 SG CYS A 523 -1.786 -0.056 -0.668 1.00 60.24 S ATOM 0 H CYS A 523 -2.631 2.675 0.786 1.00 41.11 H new ATOM 0 HA CYS A 523 -0.025 2.098 1.816 1.00 74.42 H new ATOM 0 HB2 CYS A 523 0.469 0.443 -0.035 1.00 50.43 H new ATOM 0 HB3 CYS A 523 -0.458 -0.169 1.321 1.00 50.43 H new ATOM 0 HG CYS A 523 -2.756 0.809 -0.686 1.00 60.24 H new ATOM 1367 N SER A 524 0.857 2.973 -0.471 1.00 54.23 N ATOM 1368 CA SER A 524 1.315 3.879 -1.475 1.00 35.24 C ATOM 1369 C SER A 524 1.388 3.165 -2.798 1.00 24.43 C ATOM 1370 O SER A 524 1.436 1.918 -2.846 1.00 72.42 O ATOM 1371 CB SER A 524 2.689 4.391 -1.099 1.00 11.34 C ATOM 1372 OG SER A 524 2.799 4.559 0.309 1.00 73.35 O ATOM 0 H SER A 524 1.586 2.375 -0.081 1.00 54.23 H new ATOM 0 HA SER A 524 0.623 4.718 -1.554 1.00 35.24 H new ATOM 0 HB2 SER A 524 3.450 3.692 -1.447 1.00 11.34 H new ATOM 0 HB3 SER A 524 2.877 5.341 -1.599 1.00 11.34 H new ATOM 0 HG SER A 524 3.053 3.707 0.721 1.00 73.35 H new ATOM 1378 N ALA A 525 1.402 3.937 -3.860 1.00 4.25 N ATOM 1379 CA ALA A 525 1.531 3.388 -5.217 1.00 71.24 C ATOM 1380 C ALA A 525 2.836 2.606 -5.385 1.00 71.42 C ATOM 1381 O ALA A 525 2.962 1.763 -6.283 1.00 21.33 O ATOM 1382 CB ALA A 525 1.432 4.481 -6.261 1.00 45.31 C ATOM 0 H ALA A 525 1.326 4.954 -3.824 1.00 4.25 H new ATOM 0 HA ALA A 525 0.702 2.696 -5.364 1.00 71.24 H new ATOM 0 HB1 ALA A 525 1.531 4.045 -7.255 1.00 45.31 H new ATOM 0 HB2 ALA A 525 0.465 4.978 -6.177 1.00 45.31 H new ATOM 0 HB3 ALA A 525 2.228 5.208 -6.103 1.00 45.31 H new ATOM 1388 N GLU A 526 3.806 2.893 -4.533 1.00 2.14 N ATOM 1389 CA GLU A 526 5.057 2.185 -4.536 1.00 44.32 C ATOM 1390 C GLU A 526 4.849 0.735 -4.098 1.00 41.43 C ATOM 1391 O GLU A 526 5.217 -0.179 -4.823 1.00 3.31 O ATOM 1392 CB GLU A 526 6.073 2.873 -3.648 1.00 24.14 C ATOM 1393 CG GLU A 526 7.439 2.225 -3.688 1.00 1.23 C ATOM 1394 CD GLU A 526 8.436 2.941 -2.842 1.00 54.05 C ATOM 1395 OE1 GLU A 526 8.839 4.069 -3.207 1.00 25.14 O ATOM 1396 OE2 GLU A 526 8.879 2.396 -1.819 1.00 72.03 O ATOM 0 H GLU A 526 3.740 3.624 -3.824 1.00 2.14 H new ATOM 0 HA GLU A 526 5.447 2.187 -5.554 1.00 44.32 H new ATOM 0 HB2 GLU A 526 6.164 3.916 -3.952 1.00 24.14 H new ATOM 0 HB3 GLU A 526 5.708 2.871 -2.621 1.00 24.14 H new ATOM 0 HG2 GLU A 526 7.357 1.192 -3.351 1.00 1.23 H new ATOM 0 HG3 GLU A 526 7.794 2.198 -4.718 1.00 1.23 H new ATOM 1403 N GLU A 527 4.230 0.537 -2.930 1.00 32.45 N ATOM 1404 CA GLU A 527 3.945 -0.807 -2.418 1.00 14.04 C ATOM 1405 C GLU A 527 3.060 -1.557 -3.385 1.00 21.41 C ATOM 1406 O GLU A 527 3.241 -2.743 -3.603 1.00 75.31 O ATOM 1407 CB GLU A 527 3.273 -0.810 -1.026 1.00 55.44 C ATOM 1408 CG GLU A 527 4.045 -0.114 0.090 1.00 54.04 C ATOM 1409 CD GLU A 527 3.907 1.379 0.049 1.00 43.23 C ATOM 1410 OE1 GLU A 527 4.655 2.044 -0.673 1.00 43.51 O ATOM 1411 OE2 GLU A 527 3.018 1.920 0.745 1.00 50.41 O ATOM 0 H GLU A 527 3.916 1.292 -2.320 1.00 32.45 H new ATOM 0 HA GLU A 527 4.913 -1.297 -2.314 1.00 14.04 H new ATOM 0 HB2 GLU A 527 2.296 -0.336 -1.115 1.00 55.44 H new ATOM 0 HB3 GLU A 527 3.100 -1.845 -0.730 1.00 55.44 H new ATOM 0 HG2 GLU A 527 3.691 -0.481 1.054 1.00 54.04 H new ATOM 0 HG3 GLU A 527 5.100 -0.379 0.016 1.00 54.04 H new ATOM 1418 N MET A 528 2.116 -0.846 -3.971 1.00 72.41 N ATOM 1419 CA MET A 528 1.220 -1.420 -4.964 1.00 33.11 C ATOM 1420 C MET A 528 2.014 -1.962 -6.148 1.00 33.22 C ATOM 1421 O MET A 528 1.806 -3.100 -6.575 1.00 32.12 O ATOM 1422 CB MET A 528 0.141 -0.380 -5.371 1.00 61.22 C ATOM 1423 CG MET A 528 -0.798 -0.770 -6.526 1.00 61.54 C ATOM 1424 SD MET A 528 -0.095 -0.510 -8.179 1.00 5.21 S ATOM 1425 CE MET A 528 0.120 1.273 -8.183 1.00 53.22 C ATOM 0 H MET A 528 1.947 0.141 -3.776 1.00 72.41 H new ATOM 0 HA MET A 528 0.690 -2.271 -4.536 1.00 33.11 H new ATOM 0 HB2 MET A 528 -0.470 -0.164 -4.495 1.00 61.22 H new ATOM 0 HB3 MET A 528 0.647 0.546 -5.643 1.00 61.22 H new ATOM 0 HG2 MET A 528 -1.069 -1.821 -6.420 1.00 61.54 H new ATOM 0 HG3 MET A 528 -1.719 -0.193 -6.441 1.00 61.54 H new ATOM 0 HE1 MET A 528 -0.252 1.682 -9.122 1.00 53.22 H new ATOM 0 HE2 MET A 528 -0.435 1.708 -7.352 1.00 53.22 H new ATOM 0 HE3 MET A 528 1.178 1.512 -8.077 1.00 53.22 H new ATOM 1435 N ASN A 529 2.974 -1.187 -6.608 1.00 24.12 N ATOM 1436 CA ASN A 529 3.813 -1.599 -7.720 1.00 34.11 C ATOM 1437 C ASN A 529 4.720 -2.744 -7.279 1.00 44.55 C ATOM 1438 O ASN A 529 4.905 -3.723 -7.995 1.00 2.33 O ATOM 1439 CB ASN A 529 4.666 -0.427 -8.225 1.00 71.53 C ATOM 1440 CG ASN A 529 5.493 -0.775 -9.455 1.00 21.20 C ATOM 1441 OD1 ASN A 529 5.067 -1.547 -10.320 1.00 10.02 O ATOM 1442 ND2 ASN A 529 6.678 -0.224 -9.542 1.00 32.20 N ATOM 0 H ASN A 529 3.195 -0.266 -6.230 1.00 24.12 H new ATOM 0 HA ASN A 529 3.170 -1.932 -8.535 1.00 34.11 H new ATOM 0 HB2 ASN A 529 4.014 0.414 -8.459 1.00 71.53 H new ATOM 0 HB3 ASN A 529 5.333 -0.101 -7.427 1.00 71.53 H new ATOM 0 HD21 ASN A 529 7.278 -0.428 -10.341 1.00 32.20 H new ATOM 0 HD22 ASN A 529 7.001 0.410 -8.811 1.00 32.20 H new ATOM 1449 N PHE A 530 5.230 -2.622 -6.075 1.00 13.10 N ATOM 1450 CA PHE A 530 6.131 -3.591 -5.483 1.00 14.31 C ATOM 1451 C PHE A 530 5.479 -4.965 -5.386 1.00 2.12 C ATOM 1452 O PHE A 530 6.087 -5.970 -5.774 1.00 24.02 O ATOM 1453 CB PHE A 530 6.599 -3.082 -4.108 1.00 53.53 C ATOM 1454 CG PHE A 530 7.584 -3.952 -3.373 1.00 33.13 C ATOM 1455 CD1 PHE A 530 8.921 -3.965 -3.731 1.00 13.04 C ATOM 1456 CD2 PHE A 530 7.174 -4.729 -2.299 1.00 43.41 C ATOM 1457 CE1 PHE A 530 9.831 -4.738 -3.036 1.00 54.31 C ATOM 1458 CE2 PHE A 530 8.077 -5.508 -1.604 1.00 30.04 C ATOM 1459 CZ PHE A 530 9.407 -5.511 -1.972 1.00 23.23 C ATOM 0 H PHE A 530 5.027 -1.830 -5.465 1.00 13.10 H new ATOM 0 HA PHE A 530 7.004 -3.705 -6.126 1.00 14.31 H new ATOM 0 HB2 PHE A 530 7.046 -2.097 -4.242 1.00 53.53 H new ATOM 0 HB3 PHE A 530 5.721 -2.950 -3.475 1.00 53.53 H new ATOM 0 HD1 PHE A 530 9.257 -3.364 -4.563 1.00 13.04 H new ATOM 0 HD2 PHE A 530 6.135 -4.724 -2.003 1.00 43.41 H new ATOM 0 HE1 PHE A 530 10.872 -4.738 -3.324 1.00 54.31 H new ATOM 0 HE2 PHE A 530 7.743 -6.114 -0.774 1.00 30.04 H new ATOM 0 HZ PHE A 530 10.116 -6.117 -1.428 1.00 23.23 H new ATOM 1469 N VAL A 531 4.232 -5.007 -4.944 1.00 61.04 N ATOM 1470 CA VAL A 531 3.548 -6.274 -4.803 1.00 54.24 C ATOM 1471 C VAL A 531 3.164 -6.827 -6.175 1.00 30.22 C ATOM 1472 O VAL A 531 3.253 -8.029 -6.416 1.00 15.41 O ATOM 1473 CB VAL A 531 2.317 -6.191 -3.853 1.00 23.44 C ATOM 1474 CG1 VAL A 531 1.616 -7.545 -3.736 1.00 41.45 C ATOM 1475 CG2 VAL A 531 2.756 -5.716 -2.471 1.00 42.30 C ATOM 0 H VAL A 531 3.683 -4.189 -4.681 1.00 61.04 H new ATOM 0 HA VAL A 531 4.244 -6.968 -4.332 1.00 54.24 H new ATOM 0 HB VAL A 531 1.611 -5.477 -4.277 1.00 23.44 H new ATOM 0 HG11 VAL A 531 0.761 -7.455 -3.066 1.00 41.45 H new ATOM 0 HG12 VAL A 531 1.274 -7.864 -4.721 1.00 41.45 H new ATOM 0 HG13 VAL A 531 2.313 -8.282 -3.338 1.00 41.45 H new ATOM 0 HG21 VAL A 531 1.889 -5.661 -1.813 1.00 42.30 H new ATOM 0 HG22 VAL A 531 3.481 -6.418 -2.058 1.00 42.30 H new ATOM 0 HG23 VAL A 531 3.212 -4.730 -2.553 1.00 42.30 H new ATOM 1485 N LEU A 532 2.825 -5.940 -7.103 1.00 20.10 N ATOM 1486 CA LEU A 532 2.468 -6.368 -8.448 1.00 35.04 C ATOM 1487 C LEU A 532 3.687 -6.872 -9.215 1.00 41.35 C ATOM 1488 O LEU A 532 3.560 -7.618 -10.188 1.00 32.23 O ATOM 1489 CB LEU A 532 1.734 -5.279 -9.241 1.00 15.22 C ATOM 1490 CG LEU A 532 0.343 -4.871 -8.727 1.00 74.33 C ATOM 1491 CD1 LEU A 532 -0.258 -3.802 -9.622 1.00 50.33 C ATOM 1492 CD2 LEU A 532 -0.590 -6.078 -8.643 1.00 64.41 C ATOM 0 H LEU A 532 2.790 -4.932 -6.951 1.00 20.10 H new ATOM 0 HA LEU A 532 1.771 -7.198 -8.330 1.00 35.04 H new ATOM 0 HB2 LEU A 532 2.364 -4.390 -9.261 1.00 15.22 H new ATOM 0 HB3 LEU A 532 1.630 -5.620 -10.271 1.00 15.22 H new ATOM 0 HG LEU A 532 0.461 -4.465 -7.722 1.00 74.33 H new ATOM 0 HD11 LEU A 532 -1.242 -3.523 -9.246 1.00 50.33 H new ATOM 0 HD12 LEU A 532 0.390 -2.925 -9.627 1.00 50.33 H new ATOM 0 HD13 LEU A 532 -0.354 -4.189 -10.637 1.00 50.33 H new ATOM 0 HD21 LEU A 532 -1.566 -5.759 -8.277 1.00 64.41 H new ATOM 0 HD22 LEU A 532 -0.701 -6.521 -9.632 1.00 64.41 H new ATOM 0 HD23 LEU A 532 -0.170 -6.816 -7.960 1.00 64.41 H new ATOM 1504 N MET A 533 4.871 -6.458 -8.794 1.00 62.04 N ATOM 1505 CA MET A 533 6.095 -6.949 -9.403 1.00 13.01 C ATOM 1506 C MET A 533 6.575 -8.216 -8.722 1.00 61.44 C ATOM 1507 O MET A 533 7.578 -8.819 -9.124 1.00 73.33 O ATOM 1508 CB MET A 533 7.203 -5.889 -9.450 1.00 53.43 C ATOM 1509 CG MET A 533 6.872 -4.665 -10.297 1.00 62.52 C ATOM 1510 SD MET A 533 8.219 -3.455 -10.360 1.00 0.14 S ATOM 1511 CE MET A 533 8.427 -3.060 -8.620 1.00 41.44 C ATOM 0 H MET A 533 5.010 -5.788 -8.038 1.00 62.04 H new ATOM 0 HA MET A 533 5.853 -7.188 -10.438 1.00 13.01 H new ATOM 0 HB2 MET A 533 7.420 -5.563 -8.433 1.00 53.43 H new ATOM 0 HB3 MET A 533 8.112 -6.349 -9.838 1.00 53.43 H new ATOM 0 HG2 MET A 533 6.633 -4.987 -11.311 1.00 62.52 H new ATOM 0 HG3 MET A 533 5.979 -4.185 -9.897 1.00 62.52 H new ATOM 0 HE1 MET A 533 9.065 -2.182 -8.520 1.00 41.44 H new ATOM 0 HE2 MET A 533 7.454 -2.854 -8.175 1.00 41.44 H new ATOM 0 HE3 MET A 533 8.889 -3.904 -8.108 1.00 41.44 H new ATOM 1521 N GLY A 534 5.837 -8.628 -7.733 1.00 51.30 N ATOM 1522 CA GLY A 534 6.153 -9.811 -6.975 1.00 60.04 C ATOM 1523 C GLY A 534 7.311 -9.604 -6.021 1.00 64.24 C ATOM 1524 O GLY A 534 8.023 -10.546 -5.695 1.00 42.21 O ATOM 0 H GLY A 534 4.990 -8.150 -7.424 1.00 51.30 H new ATOM 0 HA2 GLY A 534 5.274 -10.121 -6.410 1.00 60.04 H new ATOM 0 HA3 GLY A 534 6.394 -10.623 -7.661 1.00 60.04 H new ATOM 1528 N GLY A 535 7.505 -8.377 -5.585 1.00 5.44 N ATOM 1529 CA GLY A 535 8.553 -8.070 -4.684 1.00 41.53 C ATOM 1530 C GLY A 535 8.305 -8.662 -3.317 1.00 22.23 C ATOM 1531 O GLY A 535 7.167 -8.690 -2.841 1.00 72.41 O ATOM 0 H GLY A 535 6.932 -7.578 -5.855 1.00 5.44 H new ATOM 0 HA2 GLY A 535 9.496 -8.449 -5.079 1.00 41.53 H new ATOM 0 HA3 GLY A 535 8.655 -6.988 -4.599 1.00 41.53 H new ATOM 1535 N THR A 536 9.335 -9.161 -2.703 1.00 42.21 N ATOM 1536 CA THR A 536 9.250 -9.743 -1.396 1.00 42.10 C ATOM 1537 C THR A 536 10.599 -9.580 -0.709 1.00 53.30 C ATOM 1538 O THR A 536 11.641 -9.900 -1.291 1.00 1.34 O ATOM 1539 CB THR A 536 8.894 -11.252 -1.464 1.00 61.13 C ATOM 1540 OG1 THR A 536 7.716 -11.445 -2.269 1.00 11.43 O ATOM 1541 CG2 THR A 536 8.632 -11.820 -0.071 1.00 4.03 C ATOM 0 H THR A 536 10.274 -9.176 -3.102 1.00 42.21 H new ATOM 0 HA THR A 536 8.461 -9.237 -0.840 1.00 42.10 H new ATOM 0 HB THR A 536 9.743 -11.773 -1.907 1.00 61.13 H new ATOM 0 HG1 THR A 536 7.499 -12.400 -2.308 1.00 11.43 H new ATOM 0 HG21 THR A 536 8.385 -12.879 -0.150 1.00 4.03 H new ATOM 0 HG22 THR A 536 9.524 -11.700 0.544 1.00 4.03 H new ATOM 0 HG23 THR A 536 7.800 -11.287 0.389 1.00 4.03 H new ATOM 1549 N LEU A 537 10.588 -9.073 0.490 1.00 24.03 N ATOM 1550 CA LEU A 537 11.810 -8.900 1.236 1.00 61.40 C ATOM 1551 C LEU A 537 12.190 -10.234 1.840 1.00 51.12 C ATOM 1552 O LEU A 537 11.648 -10.643 2.858 1.00 1.24 O ATOM 1553 CB LEU A 537 11.641 -7.835 2.327 1.00 34.31 C ATOM 1554 CG LEU A 537 11.260 -6.427 1.850 1.00 65.54 C ATOM 1555 CD1 LEU A 537 11.052 -5.504 3.039 1.00 34.12 C ATOM 1556 CD2 LEU A 537 12.327 -5.860 0.917 1.00 74.32 C ATOM 0 H LEU A 537 9.745 -8.770 0.977 1.00 24.03 H new ATOM 0 HA LEU A 537 12.602 -8.555 0.571 1.00 61.40 H new ATOM 0 HB2 LEU A 537 10.877 -8.178 3.025 1.00 34.31 H new ATOM 0 HB3 LEU A 537 12.575 -7.766 2.885 1.00 34.31 H new ATOM 0 HG LEU A 537 10.325 -6.498 1.294 1.00 65.54 H new ATOM 0 HD11 LEU A 537 10.782 -4.509 2.685 1.00 34.12 H new ATOM 0 HD12 LEU A 537 10.252 -5.895 3.667 1.00 34.12 H new ATOM 0 HD13 LEU A 537 11.973 -5.445 3.619 1.00 34.12 H new ATOM 0 HD21 LEU A 537 12.034 -4.862 0.593 1.00 74.32 H new ATOM 0 HD22 LEU A 537 13.279 -5.805 1.444 1.00 74.32 H new ATOM 0 HD23 LEU A 537 12.431 -6.508 0.047 1.00 74.32 H new ATOM 1568 N ASN A 538 13.067 -10.939 1.190 1.00 71.12 N ATOM 1569 CA ASN A 538 13.436 -12.255 1.649 1.00 11.02 C ATOM 1570 C ASN A 538 14.610 -12.232 2.606 1.00 33.42 C ATOM 1571 O ASN A 538 15.706 -12.679 2.314 1.00 50.05 O ATOM 1572 CB ASN A 538 13.578 -13.295 0.503 1.00 30.44 C ATOM 1573 CG ASN A 538 14.607 -12.941 -0.565 1.00 11.34 C ATOM 1574 OD1 ASN A 538 15.769 -13.332 -0.491 1.00 53.10 O ATOM 1575 ND2 ASN A 538 14.184 -12.231 -1.582 1.00 40.11 N ATOM 0 H ASN A 538 13.542 -10.631 0.342 1.00 71.12 H new ATOM 0 HA ASN A 538 12.591 -12.613 2.236 1.00 11.02 H new ATOM 0 HB2 ASN A 538 13.845 -14.258 0.938 1.00 30.44 H new ATOM 0 HB3 ASN A 538 12.607 -13.420 0.023 1.00 30.44 H new ATOM 0 HD21 ASN A 538 14.825 -11.990 -2.338 1.00 40.11 H new ATOM 0 HD22 ASN A 538 13.213 -11.919 -1.618 1.00 40.11 H new ATOM 1582 N ARG A 539 14.369 -11.628 3.728 1.00 23.42 N ATOM 1583 CA ARG A 539 15.301 -11.587 4.812 1.00 62.45 C ATOM 1584 C ARG A 539 14.505 -11.754 6.074 1.00 52.05 C ATOM 1585 O ARG A 539 13.911 -10.787 6.600 1.00 13.51 O ATOM 1586 CB ARG A 539 16.099 -10.282 4.843 1.00 71.21 C ATOM 1587 CG ARG A 539 17.114 -10.221 5.977 1.00 61.55 C ATOM 1588 CD ARG A 539 17.859 -8.902 6.000 1.00 21.32 C ATOM 1589 NE ARG A 539 18.660 -8.700 4.801 1.00 23.44 N ATOM 1590 CZ ARG A 539 19.543 -7.719 4.615 1.00 55.10 C ATOM 1591 NH1 ARG A 539 19.737 -6.796 5.553 1.00 32.14 N ATOM 1592 NH2 ARG A 539 20.235 -7.673 3.492 1.00 3.04 N ATOM 0 H ARG A 539 13.496 -11.137 3.920 1.00 23.42 H new ATOM 0 HA ARG A 539 16.037 -12.382 4.697 1.00 62.45 H new ATOM 0 HB2 ARG A 539 16.619 -10.160 3.893 1.00 71.21 H new ATOM 0 HB3 ARG A 539 15.408 -9.444 4.938 1.00 71.21 H new ATOM 0 HG2 ARG A 539 16.603 -10.366 6.929 1.00 61.55 H new ATOM 0 HG3 ARG A 539 17.827 -11.039 5.870 1.00 61.55 H new ATOM 0 HD2 ARG A 539 17.144 -8.085 6.099 1.00 21.32 H new ATOM 0 HD3 ARG A 539 18.506 -8.868 6.877 1.00 21.32 H new ATOM 0 HE ARG A 539 18.535 -9.366 4.039 1.00 23.44 H new ATOM 0 HH11 ARG A 539 19.208 -6.835 6.424 1.00 32.14 H new ATOM 0 HH12 ARG A 539 20.415 -6.049 5.401 1.00 32.14 H new ATOM 0 HH21 ARG A 539 20.092 -8.384 2.775 1.00 3.04 H new ATOM 0 HH22 ARG A 539 20.913 -6.926 3.341 1.00 3.04 H new ATOM 1606 N LEU A 540 14.421 -12.969 6.518 1.00 44.03 N ATOM 1607 CA LEU A 540 13.627 -13.318 7.658 1.00 53.01 C ATOM 1608 C LEU A 540 14.156 -14.576 8.304 1.00 0.53 C ATOM 1609 O LEU A 540 14.550 -15.530 7.611 1.00 60.21 O ATOM 1610 CB LEU A 540 12.082 -13.402 7.322 1.00 55.24 C ATOM 1611 CG LEU A 540 11.530 -14.442 6.275 1.00 24.55 C ATOM 1612 CD1 LEU A 540 12.200 -14.369 4.911 1.00 51.22 C ATOM 1613 CD2 LEU A 540 11.498 -15.870 6.812 1.00 51.33 C ATOM 0 H LEU A 540 14.908 -13.759 6.094 1.00 44.03 H new ATOM 0 HA LEU A 540 13.716 -12.512 8.386 1.00 53.01 H new ATOM 0 HB2 LEU A 540 11.562 -13.589 8.261 1.00 55.24 H new ATOM 0 HB3 LEU A 540 11.776 -12.413 6.980 1.00 55.24 H new ATOM 0 HG LEU A 540 10.496 -14.136 6.114 1.00 24.55 H new ATOM 0 HD11 LEU A 540 11.762 -15.117 4.250 1.00 51.22 H new ATOM 0 HD12 LEU A 540 12.051 -13.377 4.485 1.00 51.22 H new ATOM 0 HD13 LEU A 540 13.268 -14.561 5.019 1.00 51.22 H new ATOM 0 HD21 LEU A 540 11.108 -16.539 6.044 1.00 51.33 H new ATOM 0 HD22 LEU A 540 12.507 -16.179 7.084 1.00 51.33 H new ATOM 0 HD23 LEU A 540 10.856 -15.914 7.691 1.00 51.33 H new ATOM 1625 N GLU A 541 14.197 -14.562 9.602 1.00 73.31 N ATOM 1626 CA GLU A 541 14.656 -15.668 10.382 1.00 4.41 C ATOM 1627 C GLU A 541 14.205 -15.452 11.810 1.00 4.13 C ATOM 1628 CB GLU A 541 16.193 -15.832 10.290 1.00 61.43 C ATOM 1629 CG GLU A 541 16.721 -17.010 11.081 1.00 44.10 C ATOM 1630 CD GLU A 541 18.181 -17.301 10.842 1.00 11.22 C ATOM 1631 OE1 GLU A 541 19.043 -16.668 11.472 1.00 4.21 O ATOM 1632 OE2 GLU A 541 18.495 -18.206 10.039 1.00 15.34 O ATOM 0 H GLU A 541 13.905 -13.760 10.161 1.00 73.31 H new ATOM 0 HA GLU A 541 14.230 -16.594 9.995 1.00 4.41 H new ATOM 0 HB2 GLU A 541 16.476 -15.950 9.244 1.00 61.43 H new ATOM 0 HB3 GLU A 541 16.670 -14.920 10.649 1.00 61.43 H new ATOM 0 HG2 GLU A 541 16.568 -16.820 12.143 1.00 44.10 H new ATOM 0 HG3 GLU A 541 16.138 -17.896 10.828 1.00 44.10 H new TER 1639 GLU A 541