USER MOD reduce.3.24.130724 H: found=0, std=0, add=993, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 991 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 570 HIS : no HE2:sc= -2.88 K(o=-3.3,f=-5.9!) USER MOD Set 1.2: A 574 GLN :FLIP amide:sc= -0.454 F(o=-5.2,f=-3.3) USER MOD Set 2.1: A 535 HIS : no HE2:sc= -6.63! C(o=-11!,f=-11!) USER MOD Set 2.2: A 536 MET CE :methyl -153:sc= -1.18 (180deg=-1.02) USER MOD Set 2.3: A 554 CYS SG : rot 49:sc= -4.68 USER MOD Set 2.4: A 555 CYS SG : rot -24:sc= 1.79 USER MOD Set 3.1: A 503 ASN : amide:sc= -6.95! C(o=-11!,f=-15!) USER MOD Set 3.2: A 506 GLN : amide:sc= -3.96 K(o=-11,f=-16!) USER MOD Single : A 477 SER OG : rot 180:sc= 0 USER MOD Single : A 478 SER OG : rot 180:sc= -0.0758 USER MOD Single : A 480 SER OG : rot 180:sc= 0 USER MOD Single : A 481 SER OG : rot 180:sc= 0 USER MOD Single : A 483 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 487 THR OG1 : rot 180:sc= 0.113! USER MOD Single : A 490 SER OG : rot 180:sc= 0 USER MOD Single : A 491 TYR OH : rot 180:sc= 0 USER MOD Single : A 495 TYR OH : rot 180:sc= 0 USER MOD Single : A 497 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 498 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 499 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 500 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 501 HIS :FLIP no HD1:sc= 0.118 F(o=-1.3,f=0.12) USER MOD Single : A 504 THR OG1 : rot 180:sc= 0 USER MOD Single : A 505 GLN : amide:sc= 0.0254 X(o=0.025,f=-0.42) USER MOD Single : A 508 THR OG1 : rot 76:sc= 0.495 USER MOD Single : A 511 GLN : amide:sc= -0.536 K(o=-0.54,f=-2.3!) USER MOD Single : A 519 LYS NZ :NH3+ -124:sc= 0.00485 (180deg=0) USER MOD Single : A 520 THR OG1 : rot 180:sc= 0 USER MOD Single : A 527 SER OG : rot 180:sc= 0.0233 USER MOD Single : A 528 TYR OH : rot 180:sc= 0 USER MOD Single : A 530 TYR OH : rot 180:sc= 0 USER MOD Single : A 534 ASN : amide:sc= 0.52 K(o=0.52,f=-2.9!) USER MOD Single : A 537 MET CE :methyl 164:sc= -0.273 (180deg=-0.666) USER MOD Single : A 539 LYS NZ :NH3+ -148:sc= 0.0191 (180deg=0) USER MOD Single : A 546 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0451) USER MOD Single : A 549 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : A 556 ASN : amide:sc= 0 K(o=0,f=-2.9!) USER MOD Single : A 564 GLN : amide:sc= -0.162 X(o=-0.16,f=0) USER MOD Single : A 565 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 567 ASN : amide:sc= -0.195 X(o=-0.19,f=-0.51) USER MOD Single : A 569 MET CE :methyl 157:sc= -0.0303 (180deg=-0.679) USER MOD Single : A 575 GLN : amide:sc= 0 X(o=0,f=-0.037) USER MOD Single : A 579 MET CE :methyl 174:sc= -2.98! (180deg=-3.19!) USER MOD Single : A 583 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 584 SER OG : rot 31:sc= 0.425 USER MOD Single : A 591 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 592 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.00793) USER MOD Single : A 593 SER OG : rot 180:sc= 0 USER MOD Single : A 594 SER OG : rot 180:sc= 0 USER MOD Single : A 597 SER OG : rot 180:sc= 0.0193 USER MOD Single : A 598 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 476 29.881 -20.776 -17.614 1.00 0.00 N ATOM 2 CA GLY A 476 28.981 -20.261 -16.599 1.00 0.00 C ATOM 3 C GLY A 476 28.100 -19.142 -17.118 1.00 0.00 C ATOM 4 O GLY A 476 28.388 -17.965 -16.901 1.00 0.00 O ATOM 0 HA2 GLY A 476 28.353 -21.072 -16.230 1.00 0.00 H new ATOM 0 HA3 GLY A 476 29.563 -19.898 -15.752 1.00 0.00 H new ATOM 8 N SER A 477 27.025 -19.510 -17.808 1.00 0.00 N ATOM 9 CA SER A 477 26.102 -18.528 -18.365 1.00 0.00 C ATOM 10 C SER A 477 24.763 -18.564 -17.634 1.00 0.00 C ATOM 11 O SER A 477 24.522 -19.438 -16.801 1.00 0.00 O ATOM 12 CB SER A 477 25.888 -18.787 -19.857 1.00 0.00 C ATOM 13 OG SER A 477 26.889 -18.152 -20.634 1.00 0.00 O ATOM 0 H SER A 477 26.772 -20.480 -17.995 1.00 0.00 H new ATOM 0 HA SER A 477 26.541 -17.539 -18.234 1.00 0.00 H new ATOM 0 HB2 SER A 477 25.901 -19.860 -20.048 1.00 0.00 H new ATOM 0 HB3 SER A 477 24.905 -18.422 -20.155 1.00 0.00 H new ATOM 0 HG SER A 477 26.731 -18.334 -21.584 1.00 0.00 H new ATOM 19 N SER A 478 23.896 -17.609 -17.952 1.00 0.00 N ATOM 20 CA SER A 478 22.583 -17.528 -17.323 1.00 0.00 C ATOM 21 C SER A 478 21.766 -18.785 -17.608 1.00 0.00 C ATOM 22 O SER A 478 21.144 -19.351 -16.710 1.00 0.00 O ATOM 23 CB SER A 478 21.830 -16.294 -17.822 1.00 0.00 C ATOM 24 OG SER A 478 21.519 -16.408 -19.200 1.00 0.00 O ATOM 0 H SER A 478 24.079 -16.880 -18.642 1.00 0.00 H new ATOM 0 HA SER A 478 22.728 -17.445 -16.246 1.00 0.00 H new ATOM 0 HB2 SER A 478 20.912 -16.168 -17.248 1.00 0.00 H new ATOM 0 HB3 SER A 478 22.435 -15.403 -17.655 1.00 0.00 H new ATOM 0 HG SER A 478 21.036 -15.607 -19.494 1.00 0.00 H new ATOM 30 N GLY A 479 21.775 -19.217 -18.866 1.00 0.00 N ATOM 31 CA GLY A 479 21.032 -20.404 -19.248 1.00 0.00 C ATOM 32 C GLY A 479 19.550 -20.281 -18.951 1.00 0.00 C ATOM 33 O GLY A 479 19.147 -19.513 -18.077 1.00 0.00 O ATOM 0 H GLY A 479 22.283 -18.766 -19.627 1.00 0.00 H new ATOM 0 HA2 GLY A 479 21.172 -20.589 -20.313 1.00 0.00 H new ATOM 0 HA3 GLY A 479 21.435 -21.267 -18.719 1.00 0.00 H new ATOM 37 N SER A 480 18.738 -21.037 -19.682 1.00 0.00 N ATOM 38 CA SER A 480 17.292 -21.006 -19.496 1.00 0.00 C ATOM 39 C SER A 480 16.846 -22.085 -18.514 1.00 0.00 C ATOM 40 O SER A 480 16.422 -23.168 -18.916 1.00 0.00 O ATOM 41 CB SER A 480 16.580 -21.195 -20.837 1.00 0.00 C ATOM 42 OG SER A 480 15.235 -20.753 -20.768 1.00 0.00 O ATOM 0 H SER A 480 19.056 -21.678 -20.408 1.00 0.00 H new ATOM 0 HA SER A 480 17.025 -20.033 -19.084 1.00 0.00 H new ATOM 0 HB2 SER A 480 17.108 -20.642 -21.614 1.00 0.00 H new ATOM 0 HB3 SER A 480 16.606 -22.247 -21.121 1.00 0.00 H new ATOM 0 HG SER A 480 14.803 -20.883 -21.638 1.00 0.00 H new ATOM 48 N SER A 481 16.946 -21.780 -17.224 1.00 0.00 N ATOM 49 CA SER A 481 16.557 -22.724 -16.183 1.00 0.00 C ATOM 50 C SER A 481 15.039 -22.843 -16.097 1.00 0.00 C ATOM 51 O SER A 481 14.483 -23.934 -16.213 1.00 0.00 O ATOM 52 CB SER A 481 17.123 -22.286 -14.831 1.00 0.00 C ATOM 53 OG SER A 481 16.611 -23.087 -13.780 1.00 0.00 O ATOM 0 H SER A 481 17.293 -20.887 -16.875 1.00 0.00 H new ATOM 0 HA SER A 481 16.966 -23.701 -16.441 1.00 0.00 H new ATOM 0 HB2 SER A 481 18.211 -22.356 -14.849 1.00 0.00 H new ATOM 0 HB3 SER A 481 16.873 -21.240 -14.650 1.00 0.00 H new ATOM 0 HG SER A 481 16.989 -22.788 -12.927 1.00 0.00 H new ATOM 59 N GLY A 482 14.373 -21.710 -15.892 1.00 0.00 N ATOM 60 CA GLY A 482 12.925 -21.708 -15.793 1.00 0.00 C ATOM 61 C GLY A 482 12.434 -21.119 -14.486 1.00 0.00 C ATOM 62 O GLY A 482 12.100 -21.849 -13.553 1.00 0.00 O ATOM 0 H GLY A 482 14.811 -20.794 -15.793 1.00 0.00 H new ATOM 0 HA2 GLY A 482 12.508 -21.139 -16.624 1.00 0.00 H new ATOM 0 HA3 GLY A 482 12.556 -22.729 -15.889 1.00 0.00 H new ATOM 66 N LYS A 483 12.390 -19.792 -14.416 1.00 0.00 N ATOM 67 CA LYS A 483 11.937 -19.104 -13.214 1.00 0.00 C ATOM 68 C LYS A 483 10.856 -18.081 -13.548 1.00 0.00 C ATOM 69 O LYS A 483 10.765 -17.582 -14.669 1.00 0.00 O ATOM 70 CB LYS A 483 13.114 -18.410 -12.524 1.00 0.00 C ATOM 71 CG LYS A 483 13.886 -19.317 -11.581 1.00 0.00 C ATOM 72 CD LYS A 483 15.331 -18.869 -11.435 1.00 0.00 C ATOM 73 CE LYS A 483 15.462 -17.724 -10.442 1.00 0.00 C ATOM 74 NZ LYS A 483 16.789 -17.725 -9.767 1.00 0.00 N ATOM 0 H LYS A 483 12.663 -19.172 -15.179 1.00 0.00 H new ATOM 0 HA LYS A 483 11.514 -19.847 -12.538 1.00 0.00 H new ATOM 0 HB2 LYS A 483 13.795 -18.026 -13.284 1.00 0.00 H new ATOM 0 HB3 LYS A 483 12.742 -17.551 -11.965 1.00 0.00 H new ATOM 0 HG2 LYS A 483 13.405 -19.321 -10.603 1.00 0.00 H new ATOM 0 HG3 LYS A 483 13.857 -20.341 -11.954 1.00 0.00 H new ATOM 0 HD2 LYS A 483 15.942 -19.709 -11.106 1.00 0.00 H new ATOM 0 HD3 LYS A 483 15.716 -18.556 -12.406 1.00 0.00 H new ATOM 0 HE2 LYS A 483 15.319 -16.776 -10.960 1.00 0.00 H new ATOM 0 HE3 LYS A 483 14.674 -17.801 -9.693 1.00 0.00 H new ATOM 0 HZ1 LYS A 483 16.839 -16.930 -9.098 1.00 0.00 H new ATOM 0 HZ2 LYS A 483 16.916 -18.619 -9.252 1.00 0.00 H new ATOM 0 HZ3 LYS A 483 17.541 -17.626 -10.479 1.00 0.00 H new ATOM 88 N PRO A 484 10.016 -17.760 -12.552 1.00 0.00 N ATOM 89 CA PRO A 484 8.927 -16.792 -12.716 1.00 0.00 C ATOM 90 C PRO A 484 9.440 -15.365 -12.876 1.00 0.00 C ATOM 91 O PRO A 484 10.385 -14.955 -12.202 1.00 0.00 O ATOM 92 CB PRO A 484 8.131 -16.931 -11.416 1.00 0.00 C ATOM 93 CG PRO A 484 9.115 -17.440 -10.421 1.00 0.00 C ATOM 94 CD PRO A 484 10.066 -18.316 -11.189 1.00 0.00 C ATOM 0 HA PRO A 484 8.341 -16.986 -13.614 1.00 0.00 H new ATOM 0 HB2 PRO A 484 7.712 -15.974 -11.104 1.00 0.00 H new ATOM 0 HB3 PRO A 484 7.296 -17.621 -11.535 1.00 0.00 H new ATOM 0 HG2 PRO A 484 9.644 -16.618 -9.940 1.00 0.00 H new ATOM 0 HG3 PRO A 484 8.616 -18.003 -9.632 1.00 0.00 H new ATOM 0 HD2 PRO A 484 11.073 -18.275 -10.775 1.00 0.00 H new ATOM 0 HD3 PRO A 484 9.755 -19.361 -11.169 1.00 0.00 H new ATOM 102 N ILE A 485 8.810 -14.612 -13.772 1.00 0.00 N ATOM 103 CA ILE A 485 9.201 -13.230 -14.019 1.00 0.00 C ATOM 104 C ILE A 485 8.400 -12.267 -13.149 1.00 0.00 C ATOM 105 O ILE A 485 8.963 -11.391 -12.493 1.00 0.00 O ATOM 106 CB ILE A 485 9.012 -12.847 -15.498 1.00 0.00 C ATOM 107 CG1 ILE A 485 9.840 -13.767 -16.397 1.00 0.00 C ATOM 108 CG2 ILE A 485 9.397 -11.392 -15.722 1.00 0.00 C ATOM 109 CD1 ILE A 485 9.410 -13.745 -17.847 1.00 0.00 C ATOM 0 H ILE A 485 8.026 -14.936 -14.339 1.00 0.00 H new ATOM 0 HA ILE A 485 10.258 -13.151 -13.764 1.00 0.00 H new ATOM 0 HB ILE A 485 7.960 -12.969 -15.757 1.00 0.00 H new ATOM 0 HG12 ILE A 485 10.888 -13.476 -16.333 1.00 0.00 H new ATOM 0 HG13 ILE A 485 9.769 -14.788 -16.021 1.00 0.00 H new ATOM 0 HG21 ILE A 485 9.258 -11.136 -16.772 1.00 0.00 H new ATOM 0 HG22 ILE A 485 8.767 -10.750 -15.106 1.00 0.00 H new ATOM 0 HG23 ILE A 485 10.442 -11.246 -15.448 1.00 0.00 H new ATOM 0 HD11 ILE A 485 10.041 -14.421 -18.424 1.00 0.00 H new ATOM 0 HD12 ILE A 485 8.371 -14.065 -17.923 1.00 0.00 H new ATOM 0 HD13 ILE A 485 9.507 -12.733 -18.240 1.00 0.00 H new ATOM 121 N PHE A 486 7.082 -12.438 -13.148 1.00 0.00 N ATOM 122 CA PHE A 486 6.202 -11.585 -12.357 1.00 0.00 C ATOM 123 C PHE A 486 5.980 -12.172 -10.967 1.00 0.00 C ATOM 124 O PHE A 486 6.460 -11.634 -9.968 1.00 0.00 O ATOM 125 CB PHE A 486 4.858 -11.406 -13.068 1.00 0.00 C ATOM 126 CG PHE A 486 4.071 -10.226 -12.573 1.00 0.00 C ATOM 127 CD1 PHE A 486 4.450 -8.935 -12.905 1.00 0.00 C ATOM 128 CD2 PHE A 486 2.953 -10.407 -11.776 1.00 0.00 C ATOM 129 CE1 PHE A 486 3.728 -7.848 -12.451 1.00 0.00 C ATOM 130 CE2 PHE A 486 2.227 -9.323 -11.318 1.00 0.00 C ATOM 131 CZ PHE A 486 2.615 -8.042 -11.657 1.00 0.00 C ATOM 0 H PHE A 486 6.600 -13.159 -13.685 1.00 0.00 H new ATOM 0 HA PHE A 486 6.681 -10.612 -12.248 1.00 0.00 H new ATOM 0 HB2 PHE A 486 5.034 -11.292 -14.138 1.00 0.00 H new ATOM 0 HB3 PHE A 486 4.263 -12.310 -12.937 1.00 0.00 H new ATOM 0 HD1 PHE A 486 5.320 -8.777 -13.526 1.00 0.00 H new ATOM 0 HD2 PHE A 486 2.644 -11.407 -11.509 1.00 0.00 H new ATOM 0 HE1 PHE A 486 4.034 -6.847 -12.717 1.00 0.00 H new ATOM 0 HE2 PHE A 486 1.358 -9.478 -10.696 1.00 0.00 H new ATOM 0 HZ PHE A 486 2.049 -7.193 -11.302 1.00 0.00 H new ATOM 141 N THR A 487 5.248 -13.281 -10.908 1.00 0.00 N ATOM 142 CA THR A 487 4.961 -13.941 -9.641 1.00 0.00 C ATOM 143 C THR A 487 6.246 -14.319 -8.914 1.00 0.00 C ATOM 144 O THR A 487 7.344 -13.985 -9.360 1.00 0.00 O ATOM 145 CB THR A 487 4.110 -15.208 -9.849 1.00 0.00 C ATOM 146 OG1 THR A 487 3.822 -15.817 -8.585 1.00 0.00 O ATOM 147 CG2 THR A 487 4.831 -16.204 -10.745 1.00 0.00 C ATOM 0 H THR A 487 4.843 -13.740 -11.724 1.00 0.00 H new ATOM 0 HA THR A 487 4.400 -13.230 -9.034 1.00 0.00 H new ATOM 0 HB THR A 487 3.178 -14.917 -10.333 1.00 0.00 H new ATOM 0 HG1 THR A 487 3.279 -16.621 -8.725 1.00 0.00 H new ATOM 0 HG21 THR A 487 4.210 -17.090 -10.877 1.00 0.00 H new ATOM 0 HG22 THR A 487 5.023 -15.747 -11.716 1.00 0.00 H new ATOM 0 HG23 THR A 487 5.777 -16.489 -10.285 1.00 0.00 H new ATOM 155 N ASP A 488 6.102 -15.018 -7.794 1.00 0.00 N ATOM 156 CA ASP A 488 7.253 -15.443 -7.005 1.00 0.00 C ATOM 157 C ASP A 488 6.826 -16.388 -5.886 1.00 0.00 C ATOM 158 O ASP A 488 5.670 -16.383 -5.465 1.00 0.00 O ATOM 159 CB ASP A 488 7.972 -14.228 -6.417 1.00 0.00 C ATOM 160 CG ASP A 488 9.094 -14.619 -5.474 1.00 0.00 C ATOM 161 OD1 ASP A 488 10.017 -15.335 -5.916 1.00 0.00 O ATOM 162 OD2 ASP A 488 9.048 -14.211 -4.295 1.00 0.00 O ATOM 0 H ASP A 488 5.200 -15.303 -7.412 1.00 0.00 H new ATOM 0 HA ASP A 488 7.938 -15.976 -7.665 1.00 0.00 H new ATOM 0 HB2 ASP A 488 8.377 -13.622 -7.227 1.00 0.00 H new ATOM 0 HB3 ASP A 488 7.253 -13.607 -5.883 1.00 0.00 H new ATOM 167 N GLU A 489 7.767 -17.198 -5.411 1.00 0.00 N ATOM 168 CA GLU A 489 7.486 -18.150 -4.343 1.00 0.00 C ATOM 169 C GLU A 489 7.624 -17.489 -2.975 1.00 0.00 C ATOM 170 O GLU A 489 6.666 -17.425 -2.204 1.00 0.00 O ATOM 171 CB GLU A 489 8.429 -19.351 -4.438 1.00 0.00 C ATOM 172 CG GLU A 489 7.824 -20.643 -3.915 1.00 0.00 C ATOM 173 CD GLU A 489 8.743 -21.835 -4.102 1.00 0.00 C ATOM 174 OE1 GLU A 489 9.716 -21.962 -3.330 1.00 0.00 O ATOM 175 OE2 GLU A 489 8.488 -22.641 -5.022 1.00 0.00 O ATOM 0 H GLU A 489 8.729 -17.214 -5.749 1.00 0.00 H new ATOM 0 HA GLU A 489 6.458 -18.494 -4.460 1.00 0.00 H new ATOM 0 HB2 GLU A 489 8.721 -19.492 -5.479 1.00 0.00 H new ATOM 0 HB3 GLU A 489 9.339 -19.133 -3.878 1.00 0.00 H new ATOM 0 HG2 GLU A 489 7.594 -20.529 -2.856 1.00 0.00 H new ATOM 0 HG3 GLU A 489 6.881 -20.832 -4.428 1.00 0.00 H new ATOM 182 N SER A 490 8.823 -16.997 -2.680 1.00 0.00 N ATOM 183 CA SER A 490 9.089 -16.344 -1.404 1.00 0.00 C ATOM 184 C SER A 490 8.414 -14.978 -1.341 1.00 0.00 C ATOM 185 O SER A 490 8.991 -13.968 -1.744 1.00 0.00 O ATOM 186 CB SER A 490 10.596 -16.191 -1.189 1.00 0.00 C ATOM 187 OG SER A 490 11.229 -17.455 -1.093 1.00 0.00 O ATOM 0 H SER A 490 9.626 -17.038 -3.308 1.00 0.00 H new ATOM 0 HA SER A 490 8.678 -16.970 -0.612 1.00 0.00 H new ATOM 0 HB2 SER A 490 11.029 -15.626 -2.015 1.00 0.00 H new ATOM 0 HB3 SER A 490 10.780 -15.619 -0.280 1.00 0.00 H new ATOM 0 HG SER A 490 12.191 -17.329 -0.958 1.00 0.00 H new ATOM 193 N TYR A 491 7.186 -14.955 -0.833 1.00 0.00 N ATOM 194 CA TYR A 491 6.430 -13.714 -0.720 1.00 0.00 C ATOM 195 C TYR A 491 5.956 -13.494 0.714 1.00 0.00 C ATOM 196 O TYR A 491 6.037 -12.385 1.244 1.00 0.00 O ATOM 197 CB TYR A 491 5.229 -13.735 -1.668 1.00 0.00 C ATOM 198 CG TYR A 491 3.977 -14.309 -1.046 1.00 0.00 C ATOM 199 CD1 TYR A 491 3.801 -15.682 -0.930 1.00 0.00 C ATOM 200 CD2 TYR A 491 2.968 -13.478 -0.574 1.00 0.00 C ATOM 201 CE1 TYR A 491 2.658 -16.211 -0.363 1.00 0.00 C ATOM 202 CE2 TYR A 491 1.822 -13.998 -0.004 1.00 0.00 C ATOM 203 CZ TYR A 491 1.671 -15.365 0.098 1.00 0.00 C ATOM 204 OH TYR A 491 0.531 -15.888 0.665 1.00 0.00 O ATOM 0 H TYR A 491 6.694 -15.781 -0.493 1.00 0.00 H new ATOM 0 HA TYR A 491 7.089 -12.891 -0.997 1.00 0.00 H new ATOM 0 HB2 TYR A 491 5.024 -12.719 -2.004 1.00 0.00 H new ATOM 0 HB3 TYR A 491 5.485 -14.318 -2.553 1.00 0.00 H new ATOM 0 HD1 TYR A 491 4.572 -16.348 -1.290 1.00 0.00 H new ATOM 0 HD2 TYR A 491 3.082 -12.407 -0.654 1.00 0.00 H new ATOM 0 HE1 TYR A 491 2.538 -17.281 -0.281 1.00 0.00 H new ATOM 0 HE2 TYR A 491 1.049 -13.338 0.360 1.00 0.00 H new ATOM 0 HH TYR A 491 -0.063 -15.158 0.939 1.00 0.00 H new ATOM 214 N LEU A 492 5.460 -14.558 1.335 1.00 0.00 N ATOM 215 CA LEU A 492 4.973 -14.484 2.709 1.00 0.00 C ATOM 216 C LEU A 492 5.946 -13.709 3.591 1.00 0.00 C ATOM 217 O LEU A 492 5.536 -12.888 4.411 1.00 0.00 O ATOM 218 CB LEU A 492 4.764 -15.890 3.273 1.00 0.00 C ATOM 219 CG LEU A 492 3.738 -16.015 4.400 1.00 0.00 C ATOM 220 CD1 LEU A 492 2.324 -15.958 3.843 1.00 0.00 C ATOM 221 CD2 LEU A 492 3.955 -17.305 5.178 1.00 0.00 C ATOM 0 H LEU A 492 5.384 -15.482 0.910 1.00 0.00 H new ATOM 0 HA LEU A 492 4.019 -13.956 2.702 1.00 0.00 H new ATOM 0 HB2 LEU A 492 4.460 -16.546 2.457 1.00 0.00 H new ATOM 0 HB3 LEU A 492 5.722 -16.260 3.638 1.00 0.00 H new ATOM 0 HG LEU A 492 3.872 -15.176 5.082 1.00 0.00 H new ATOM 0 HD11 LEU A 492 1.607 -16.049 4.659 1.00 0.00 H new ATOM 0 HD12 LEU A 492 2.173 -15.008 3.331 1.00 0.00 H new ATOM 0 HD13 LEU A 492 2.177 -16.777 3.139 1.00 0.00 H new ATOM 0 HD21 LEU A 492 3.216 -17.377 5.976 1.00 0.00 H new ATOM 0 HD22 LEU A 492 3.849 -18.157 4.507 1.00 0.00 H new ATOM 0 HD23 LEU A 492 4.956 -17.306 5.609 1.00 0.00 H new ATOM 233 N GLU A 493 7.237 -13.974 3.414 1.00 0.00 N ATOM 234 CA GLU A 493 8.268 -13.300 4.194 1.00 0.00 C ATOM 235 C GLU A 493 8.019 -11.795 4.239 1.00 0.00 C ATOM 236 O GLU A 493 8.193 -11.156 5.278 1.00 0.00 O ATOM 237 CB GLU A 493 9.651 -13.581 3.603 1.00 0.00 C ATOM 238 CG GLU A 493 9.852 -12.992 2.216 1.00 0.00 C ATOM 239 CD GLU A 493 11.292 -13.079 1.749 1.00 0.00 C ATOM 240 OE1 GLU A 493 12.095 -12.205 2.136 1.00 0.00 O ATOM 241 OE2 GLU A 493 11.615 -14.021 0.995 1.00 0.00 O ATOM 0 H GLU A 493 7.593 -14.650 2.738 1.00 0.00 H new ATOM 0 HA GLU A 493 8.230 -13.688 5.212 1.00 0.00 H new ATOM 0 HB2 GLU A 493 10.411 -13.179 4.273 1.00 0.00 H new ATOM 0 HB3 GLU A 493 9.805 -14.659 3.556 1.00 0.00 H new ATOM 0 HG2 GLU A 493 9.211 -13.516 1.506 1.00 0.00 H new ATOM 0 HG3 GLU A 493 9.537 -11.948 2.219 1.00 0.00 H new ATOM 248 N LEU A 494 7.612 -11.234 3.106 1.00 0.00 N ATOM 249 CA LEU A 494 7.339 -9.804 3.015 1.00 0.00 C ATOM 250 C LEU A 494 6.256 -9.392 4.008 1.00 0.00 C ATOM 251 O LEU A 494 6.428 -8.441 4.770 1.00 0.00 O ATOM 252 CB LEU A 494 6.910 -9.436 1.593 1.00 0.00 C ATOM 253 CG LEU A 494 6.265 -8.060 1.422 1.00 0.00 C ATOM 254 CD1 LEU A 494 7.233 -6.962 1.834 1.00 0.00 C ATOM 255 CD2 LEU A 494 5.810 -7.861 -0.016 1.00 0.00 C ATOM 0 H LEU A 494 7.464 -11.748 2.237 1.00 0.00 H new ATOM 0 HA LEU A 494 8.255 -9.268 3.262 1.00 0.00 H new ATOM 0 HB2 LEU A 494 7.786 -9.488 0.946 1.00 0.00 H new ATOM 0 HB3 LEU A 494 6.208 -10.191 1.240 1.00 0.00 H new ATOM 0 HG LEU A 494 5.390 -8.006 2.070 1.00 0.00 H new ATOM 0 HD11 LEU A 494 6.757 -5.990 1.706 1.00 0.00 H new ATOM 0 HD12 LEU A 494 7.510 -7.095 2.880 1.00 0.00 H new ATOM 0 HD13 LEU A 494 8.127 -7.013 1.212 1.00 0.00 H new ATOM 0 HD21 LEU A 494 5.353 -6.877 -0.120 1.00 0.00 H new ATOM 0 HD22 LEU A 494 6.669 -7.935 -0.683 1.00 0.00 H new ATOM 0 HD23 LEU A 494 5.081 -8.629 -0.277 1.00 0.00 H new ATOM 267 N TYR A 495 5.142 -10.115 3.993 1.00 0.00 N ATOM 268 CA TYR A 495 4.031 -9.825 4.892 1.00 0.00 C ATOM 269 C TYR A 495 4.523 -9.641 6.324 1.00 0.00 C ATOM 270 O TYR A 495 4.277 -8.609 6.950 1.00 0.00 O ATOM 271 CB TYR A 495 2.995 -10.949 4.836 1.00 0.00 C ATOM 272 CG TYR A 495 1.960 -10.873 5.935 1.00 0.00 C ATOM 273 CD1 TYR A 495 1.170 -9.742 6.097 1.00 0.00 C ATOM 274 CD2 TYR A 495 1.770 -11.935 6.812 1.00 0.00 C ATOM 275 CE1 TYR A 495 0.224 -9.668 7.100 1.00 0.00 C ATOM 276 CE2 TYR A 495 0.825 -11.870 7.817 1.00 0.00 C ATOM 277 CZ TYR A 495 0.055 -10.735 7.958 1.00 0.00 C ATOM 278 OH TYR A 495 -0.888 -10.666 8.958 1.00 0.00 O ATOM 0 H TYR A 495 4.984 -10.906 3.369 1.00 0.00 H new ATOM 0 HA TYR A 495 3.565 -8.895 4.565 1.00 0.00 H new ATOM 0 HB2 TYR A 495 2.490 -10.919 3.870 1.00 0.00 H new ATOM 0 HB3 TYR A 495 3.508 -11.909 4.898 1.00 0.00 H new ATOM 0 HD1 TYR A 495 1.298 -8.905 5.426 1.00 0.00 H new ATOM 0 HD2 TYR A 495 2.371 -12.826 6.706 1.00 0.00 H new ATOM 0 HE1 TYR A 495 -0.380 -8.780 7.212 1.00 0.00 H new ATOM 0 HE2 TYR A 495 0.690 -12.704 8.489 1.00 0.00 H new ATOM 0 HH TYR A 495 -0.881 -11.500 9.473 1.00 0.00 H new ATOM 288 N ARG A 496 5.219 -10.650 6.838 1.00 0.00 N ATOM 289 CA ARG A 496 5.745 -10.602 8.196 1.00 0.00 C ATOM 290 C ARG A 496 7.210 -10.173 8.197 1.00 0.00 C ATOM 291 O ARG A 496 8.045 -10.779 8.868 1.00 0.00 O ATOM 292 CB ARG A 496 5.603 -11.968 8.870 1.00 0.00 C ATOM 293 CG ARG A 496 4.172 -12.313 9.251 1.00 0.00 C ATOM 294 CD ARG A 496 3.981 -13.814 9.398 1.00 0.00 C ATOM 295 NE ARG A 496 4.368 -14.288 10.724 1.00 0.00 N ATOM 296 CZ ARG A 496 5.606 -14.651 11.043 1.00 0.00 C ATOM 297 NH1 ARG A 496 6.571 -14.593 10.136 1.00 0.00 N ATOM 298 NH2 ARG A 496 5.879 -15.072 12.271 1.00 0.00 N ATOM 0 H ARG A 496 5.431 -11.511 6.334 1.00 0.00 H new ATOM 0 HA ARG A 496 5.168 -9.866 8.756 1.00 0.00 H new ATOM 0 HB2 ARG A 496 5.987 -12.737 8.199 1.00 0.00 H new ATOM 0 HB3 ARG A 496 6.224 -11.988 9.766 1.00 0.00 H new ATOM 0 HG2 ARG A 496 3.915 -11.819 10.188 1.00 0.00 H new ATOM 0 HG3 ARG A 496 3.490 -11.931 8.491 1.00 0.00 H new ATOM 0 HD2 ARG A 496 2.937 -14.066 9.213 1.00 0.00 H new ATOM 0 HD3 ARG A 496 4.572 -14.330 8.642 1.00 0.00 H new ATOM 0 HE ARG A 496 3.649 -14.344 11.445 1.00 0.00 H new ATOM 0 HH11 ARG A 496 6.364 -14.269 9.191 1.00 0.00 H new ATOM 0 HH12 ARG A 496 7.520 -14.872 10.383 1.00 0.00 H new ATOM 0 HH21 ARG A 496 5.139 -15.117 12.971 1.00 0.00 H new ATOM 0 HH22 ARG A 496 6.829 -15.350 12.515 1.00 0.00 H new ATOM 312 N LYS A 497 7.514 -9.124 7.440 1.00 0.00 N ATOM 313 CA LYS A 497 8.876 -8.612 7.353 1.00 0.00 C ATOM 314 C LYS A 497 9.033 -7.338 8.177 1.00 0.00 C ATOM 315 O LYS A 497 8.753 -6.240 7.697 1.00 0.00 O ATOM 316 CB LYS A 497 9.248 -8.337 5.894 1.00 0.00 C ATOM 317 CG LYS A 497 10.725 -8.525 5.597 1.00 0.00 C ATOM 318 CD LYS A 497 10.953 -8.972 4.163 1.00 0.00 C ATOM 319 CE LYS A 497 12.336 -9.579 3.982 1.00 0.00 C ATOM 320 NZ LYS A 497 13.412 -8.559 4.123 1.00 0.00 N ATOM 0 H LYS A 497 6.835 -8.612 6.878 1.00 0.00 H new ATOM 0 HA LYS A 497 9.548 -9.370 7.756 1.00 0.00 H new ATOM 0 HB2 LYS A 497 8.669 -8.999 5.249 1.00 0.00 H new ATOM 0 HB3 LYS A 497 8.962 -7.316 5.641 1.00 0.00 H new ATOM 0 HG2 LYS A 497 11.255 -7.589 5.776 1.00 0.00 H new ATOM 0 HG3 LYS A 497 11.143 -9.264 6.280 1.00 0.00 H new ATOM 0 HD2 LYS A 497 10.194 -9.703 3.884 1.00 0.00 H new ATOM 0 HD3 LYS A 497 10.838 -8.120 3.493 1.00 0.00 H new ATOM 0 HE2 LYS A 497 12.485 -10.369 4.718 1.00 0.00 H new ATOM 0 HE3 LYS A 497 12.403 -10.044 2.998 1.00 0.00 H new ATOM 0 HZ1 LYS A 497 14.339 -9.012 3.993 1.00 0.00 H new ATOM 0 HZ2 LYS A 497 13.285 -7.818 3.404 1.00 0.00 H new ATOM 0 HZ3 LYS A 497 13.365 -8.133 5.071 1.00 0.00 H new ATOM 334 N GLN A 498 9.482 -7.492 9.418 1.00 0.00 N ATOM 335 CA GLN A 498 9.676 -6.353 10.307 1.00 0.00 C ATOM 336 C GLN A 498 8.493 -5.393 10.228 1.00 0.00 C ATOM 337 O GLN A 498 8.671 -4.179 10.130 1.00 0.00 O ATOM 338 CB GLN A 498 10.970 -5.617 9.953 1.00 0.00 C ATOM 339 CG GLN A 498 11.500 -4.744 11.079 1.00 0.00 C ATOM 340 CD GLN A 498 12.591 -3.797 10.618 1.00 0.00 C ATOM 341 OE1 GLN A 498 13.773 -4.142 10.626 1.00 0.00 O ATOM 342 NE2 GLN A 498 12.199 -2.595 10.213 1.00 0.00 N ATOM 0 H GLN A 498 9.718 -8.394 9.831 1.00 0.00 H new ATOM 0 HA GLN A 498 9.748 -6.729 11.328 1.00 0.00 H new ATOM 0 HB2 GLN A 498 11.732 -6.348 9.682 1.00 0.00 H new ATOM 0 HB3 GLN A 498 10.797 -4.996 9.074 1.00 0.00 H new ATOM 0 HG2 GLN A 498 10.679 -4.167 11.504 1.00 0.00 H new ATOM 0 HG3 GLN A 498 11.888 -5.380 11.875 1.00 0.00 H new ATOM 0 HE21 GLN A 498 11.209 -2.351 10.223 1.00 0.00 H new ATOM 0 HE22 GLN A 498 12.888 -1.915 9.892 1.00 0.00 H new ATOM 351 N LYS A 499 7.286 -5.945 10.270 1.00 0.00 N ATOM 352 CA LYS A 499 6.072 -5.139 10.204 1.00 0.00 C ATOM 353 C LYS A 499 4.970 -5.745 11.067 1.00 0.00 C ATOM 354 O LYS A 499 4.930 -6.956 11.282 1.00 0.00 O ATOM 355 CB LYS A 499 5.594 -5.019 8.756 1.00 0.00 C ATOM 356 CG LYS A 499 4.510 -3.973 8.558 1.00 0.00 C ATOM 357 CD LYS A 499 5.065 -2.565 8.687 1.00 0.00 C ATOM 358 CE LYS A 499 4.014 -1.519 8.349 1.00 0.00 C ATOM 359 NZ LYS A 499 4.626 -0.262 7.835 1.00 0.00 N ATOM 0 H LYS A 499 7.121 -6.948 10.350 1.00 0.00 H new ATOM 0 HA LYS A 499 6.303 -4.145 10.587 1.00 0.00 H new ATOM 0 HB2 LYS A 499 6.445 -4.773 8.121 1.00 0.00 H new ATOM 0 HB3 LYS A 499 5.218 -5.987 8.425 1.00 0.00 H new ATOM 0 HG2 LYS A 499 4.057 -4.098 7.574 1.00 0.00 H new ATOM 0 HG3 LYS A 499 3.720 -4.123 9.294 1.00 0.00 H new ATOM 0 HD2 LYS A 499 5.424 -2.406 9.704 1.00 0.00 H new ATOM 0 HD3 LYS A 499 5.922 -2.448 8.024 1.00 0.00 H new ATOM 0 HE2 LYS A 499 3.329 -1.921 7.602 1.00 0.00 H new ATOM 0 HE3 LYS A 499 3.423 -1.298 9.238 1.00 0.00 H new ATOM 0 HZ1 LYS A 499 3.876 0.425 7.616 1.00 0.00 H new ATOM 0 HZ2 LYS A 499 5.260 0.136 8.557 1.00 0.00 H new ATOM 0 HZ3 LYS A 499 5.169 -0.468 6.972 1.00 0.00 H new ATOM 373 N LYS A 500 4.074 -4.894 11.557 1.00 0.00 N ATOM 374 CA LYS A 500 2.969 -5.345 12.394 1.00 0.00 C ATOM 375 C LYS A 500 1.975 -6.171 11.584 1.00 0.00 C ATOM 376 O LYS A 500 2.114 -6.311 10.368 1.00 0.00 O ATOM 377 CB LYS A 500 2.257 -4.145 13.023 1.00 0.00 C ATOM 378 CG LYS A 500 3.177 -3.247 13.831 1.00 0.00 C ATOM 379 CD LYS A 500 3.271 -3.701 15.278 1.00 0.00 C ATOM 380 CE LYS A 500 3.972 -2.665 16.143 1.00 0.00 C ATOM 381 NZ LYS A 500 4.134 -3.133 17.548 1.00 0.00 N ATOM 0 H LYS A 500 4.092 -3.888 11.389 1.00 0.00 H new ATOM 0 HA LYS A 500 3.378 -5.974 13.185 1.00 0.00 H new ATOM 0 HB2 LYS A 500 1.789 -3.556 12.234 1.00 0.00 H new ATOM 0 HB3 LYS A 500 1.456 -4.506 13.669 1.00 0.00 H new ATOM 0 HG2 LYS A 500 4.171 -3.246 13.384 1.00 0.00 H new ATOM 0 HG3 LYS A 500 2.810 -2.221 13.794 1.00 0.00 H new ATOM 0 HD2 LYS A 500 2.270 -3.885 15.668 1.00 0.00 H new ATOM 0 HD3 LYS A 500 3.812 -4.646 15.330 1.00 0.00 H new ATOM 0 HE2 LYS A 500 4.951 -2.441 15.720 1.00 0.00 H new ATOM 0 HE3 LYS A 500 3.401 -1.737 16.133 1.00 0.00 H new ATOM 0 HZ1 LYS A 500 4.616 -2.399 18.105 1.00 0.00 H new ATOM 0 HZ2 LYS A 500 3.198 -3.323 17.961 1.00 0.00 H new ATOM 0 HZ3 LYS A 500 4.701 -4.005 17.560 1.00 0.00 H new ATOM 395 N HIS A 501 0.972 -6.716 12.265 1.00 0.00 N ATOM 396 CA HIS A 501 -0.047 -7.527 11.608 1.00 0.00 C ATOM 397 C HIS A 501 -1.024 -6.649 10.832 1.00 0.00 C ATOM 398 O HIS A 501 -1.150 -5.454 11.103 1.00 0.00 O ATOM 399 CB HIS A 501 -0.804 -8.366 12.637 1.00 0.00 C ATOM 400 CG HIS A 501 -1.373 -7.561 13.764 1.00 0.00 C ATOM 401 ND1 HIS A 501 -0.776 -6.998 14.840 1.00 0.00 N flip ATOM 402 CD2 HIS A 501 -2.714 -7.256 13.869 1.00 0.00 C flip ATOM 403 CE1 HIS A 501 -1.756 -6.368 15.568 1.00 0.00 C flip ATOM 404 NE2 HIS A 501 -2.916 -6.539 14.960 1.00 0.00 N flip ATOM 0 H HIS A 501 0.843 -6.611 13.271 1.00 0.00 H new ATOM 0 HA HIS A 501 0.453 -8.193 10.905 1.00 0.00 H new ATOM 0 HB2 HIS A 501 -1.613 -8.897 12.136 1.00 0.00 H new ATOM 0 HB3 HIS A 501 -0.131 -9.121 13.044 1.00 0.00 H new ATOM 0 HD2 HIS A 501 -3.479 -7.556 13.169 1.00 0.00 H new ATOM 0 HE1 HIS A 501 -1.603 -5.822 16.487 1.00 0.00 H new ATOM 0 HE2 HIS A 501 -3.815 -6.179 15.279 1.00 0.00 H new ATOM 412 N LEU A 502 -1.713 -7.248 9.868 1.00 0.00 N ATOM 413 CA LEU A 502 -2.679 -6.520 9.052 1.00 0.00 C ATOM 414 C LEU A 502 -4.042 -7.205 9.080 1.00 0.00 C ATOM 415 O LEU A 502 -4.130 -8.429 9.165 1.00 0.00 O ATOM 416 CB LEU A 502 -2.180 -6.411 7.610 1.00 0.00 C ATOM 417 CG LEU A 502 -0.827 -5.726 7.419 1.00 0.00 C ATOM 418 CD1 LEU A 502 -0.335 -5.905 5.991 1.00 0.00 C ATOM 419 CD2 LEU A 502 -0.923 -4.248 7.770 1.00 0.00 C ATOM 0 H LEU A 502 -1.621 -8.236 9.632 1.00 0.00 H new ATOM 0 HA LEU A 502 -2.787 -5.519 9.469 1.00 0.00 H new ATOM 0 HB2 LEU A 502 -2.119 -7.415 7.191 1.00 0.00 H new ATOM 0 HB3 LEU A 502 -2.925 -5.868 7.029 1.00 0.00 H new ATOM 0 HG LEU A 502 -0.107 -6.193 8.091 1.00 0.00 H new ATOM 0 HD11 LEU A 502 0.629 -5.411 5.874 1.00 0.00 H new ATOM 0 HD12 LEU A 502 -0.227 -6.968 5.774 1.00 0.00 H new ATOM 0 HD13 LEU A 502 -1.054 -5.465 5.300 1.00 0.00 H new ATOM 0 HD21 LEU A 502 0.049 -3.776 7.628 1.00 0.00 H new ATOM 0 HD22 LEU A 502 -1.657 -3.767 7.123 1.00 0.00 H new ATOM 0 HD23 LEU A 502 -1.230 -4.140 8.810 1.00 0.00 H new ATOM 431 N ASN A 503 -5.102 -6.407 9.006 1.00 0.00 N ATOM 432 CA ASN A 503 -6.460 -6.937 9.021 1.00 0.00 C ATOM 433 C ASN A 503 -6.884 -7.387 7.626 1.00 0.00 C ATOM 434 O ASN A 503 -6.106 -7.316 6.675 1.00 0.00 O ATOM 435 CB ASN A 503 -7.436 -5.882 9.547 1.00 0.00 C ATOM 436 CG ASN A 503 -7.137 -4.497 9.005 1.00 0.00 C ATOM 437 OD1 ASN A 503 -6.256 -3.799 9.507 1.00 0.00 O ATOM 438 ND2 ASN A 503 -7.872 -4.094 7.975 1.00 0.00 N ATOM 0 H ASN A 503 -5.047 -5.391 8.935 1.00 0.00 H new ATOM 0 HA ASN A 503 -6.478 -7.802 9.684 1.00 0.00 H new ATOM 0 HB2 ASN A 503 -8.453 -6.164 9.275 1.00 0.00 H new ATOM 0 HB3 ASN A 503 -7.392 -5.861 10.636 1.00 0.00 H new ATOM 0 HD21 ASN A 503 -7.717 -3.172 7.568 1.00 0.00 H new ATOM 0 HD22 ASN A 503 -8.592 -4.707 7.591 1.00 0.00 H new ATOM 445 N THR A 504 -8.124 -7.852 7.512 1.00 0.00 N ATOM 446 CA THR A 504 -8.652 -8.315 6.235 1.00 0.00 C ATOM 447 C THR A 504 -8.575 -7.219 5.178 1.00 0.00 C ATOM 448 O THR A 504 -8.088 -7.445 4.071 1.00 0.00 O ATOM 449 CB THR A 504 -10.114 -8.782 6.367 1.00 0.00 C ATOM 450 OG1 THR A 504 -10.217 -9.790 7.379 1.00 0.00 O ATOM 451 CG2 THR A 504 -10.629 -9.330 5.045 1.00 0.00 C ATOM 0 H THR A 504 -8.781 -7.918 8.289 1.00 0.00 H new ATOM 0 HA THR A 504 -8.035 -9.159 5.926 1.00 0.00 H new ATOM 0 HB THR A 504 -10.722 -7.922 6.647 1.00 0.00 H new ATOM 0 HG1 THR A 504 -11.150 -10.080 7.458 1.00 0.00 H new ATOM 0 HG21 THR A 504 -11.663 -9.653 5.163 1.00 0.00 H new ATOM 0 HG22 THR A 504 -10.577 -8.552 4.284 1.00 0.00 H new ATOM 0 HG23 THR A 504 -10.016 -10.178 4.739 1.00 0.00 H new ATOM 459 N GLN A 505 -9.057 -6.031 5.528 1.00 0.00 N ATOM 460 CA GLN A 505 -9.042 -4.899 4.608 1.00 0.00 C ATOM 461 C GLN A 505 -7.612 -4.475 4.291 1.00 0.00 C ATOM 462 O GLN A 505 -7.249 -4.305 3.128 1.00 0.00 O ATOM 463 CB GLN A 505 -9.816 -3.721 5.202 1.00 0.00 C ATOM 464 CG GLN A 505 -11.326 -3.890 5.136 1.00 0.00 C ATOM 465 CD GLN A 505 -12.071 -2.718 5.743 1.00 0.00 C ATOM 466 OE1 GLN A 505 -11.643 -2.148 6.746 1.00 0.00 O ATOM 467 NE2 GLN A 505 -13.194 -2.352 5.136 1.00 0.00 N ATOM 0 H GLN A 505 -9.463 -5.827 6.441 1.00 0.00 H new ATOM 0 HA GLN A 505 -9.524 -5.210 3.681 1.00 0.00 H new ATOM 0 HB2 GLN A 505 -9.519 -3.589 6.242 1.00 0.00 H new ATOM 0 HB3 GLN A 505 -9.537 -2.810 4.673 1.00 0.00 H new ATOM 0 HG2 GLN A 505 -11.629 -4.009 4.096 1.00 0.00 H new ATOM 0 HG3 GLN A 505 -11.609 -4.805 5.657 1.00 0.00 H new ATOM 0 HE21 GLN A 505 -13.512 -2.853 4.306 1.00 0.00 H new ATOM 0 HE22 GLN A 505 -13.739 -1.570 5.499 1.00 0.00 H new ATOM 476 N GLN A 506 -6.805 -4.305 5.334 1.00 0.00 N ATOM 477 CA GLN A 506 -5.415 -3.899 5.165 1.00 0.00 C ATOM 478 C GLN A 506 -4.699 -4.809 4.173 1.00 0.00 C ATOM 479 O GLN A 506 -3.973 -4.338 3.295 1.00 0.00 O ATOM 480 CB GLN A 506 -4.689 -3.921 6.512 1.00 0.00 C ATOM 481 CG GLN A 506 -4.812 -2.621 7.290 1.00 0.00 C ATOM 482 CD GLN A 506 -3.927 -2.592 8.521 1.00 0.00 C ATOM 483 OE1 GLN A 506 -3.841 -3.573 9.261 1.00 0.00 O ATOM 484 NE2 GLN A 506 -3.263 -1.465 8.747 1.00 0.00 N ATOM 0 H GLN A 506 -7.090 -4.442 6.304 1.00 0.00 H new ATOM 0 HA GLN A 506 -5.404 -2.883 4.770 1.00 0.00 H new ATOM 0 HB2 GLN A 506 -5.087 -4.736 7.117 1.00 0.00 H new ATOM 0 HB3 GLN A 506 -3.634 -4.135 6.343 1.00 0.00 H new ATOM 0 HG2 GLN A 506 -4.551 -1.786 6.639 1.00 0.00 H new ATOM 0 HG3 GLN A 506 -5.850 -2.478 7.590 1.00 0.00 H new ATOM 0 HE21 GLN A 506 -3.364 -0.677 8.108 1.00 0.00 H new ATOM 0 HE22 GLN A 506 -2.652 -1.387 9.560 1.00 0.00 H new ATOM 493 N LEU A 507 -4.906 -6.113 4.317 1.00 0.00 N ATOM 494 CA LEU A 507 -4.280 -7.090 3.433 1.00 0.00 C ATOM 495 C LEU A 507 -4.707 -6.866 1.986 1.00 0.00 C ATOM 496 O LEU A 507 -3.869 -6.723 1.095 1.00 0.00 O ATOM 497 CB LEU A 507 -4.643 -8.510 3.871 1.00 0.00 C ATOM 498 CG LEU A 507 -3.891 -9.050 5.087 1.00 0.00 C ATOM 499 CD1 LEU A 507 -4.562 -10.310 5.613 1.00 0.00 C ATOM 500 CD2 LEU A 507 -2.436 -9.326 4.735 1.00 0.00 C ATOM 0 H LEU A 507 -5.503 -6.519 5.038 1.00 0.00 H new ATOM 0 HA LEU A 507 -3.199 -6.963 3.497 1.00 0.00 H new ATOM 0 HB2 LEU A 507 -5.711 -8.540 4.086 1.00 0.00 H new ATOM 0 HB3 LEU A 507 -4.468 -9.183 3.032 1.00 0.00 H new ATOM 0 HG LEU A 507 -3.917 -8.294 5.872 1.00 0.00 H new ATOM 0 HD11 LEU A 507 -4.013 -10.680 6.479 1.00 0.00 H new ATOM 0 HD12 LEU A 507 -5.587 -10.082 5.904 1.00 0.00 H new ATOM 0 HD13 LEU A 507 -4.567 -11.072 4.834 1.00 0.00 H new ATOM 0 HD21 LEU A 507 -1.916 -9.710 5.613 1.00 0.00 H new ATOM 0 HD22 LEU A 507 -2.389 -10.064 3.934 1.00 0.00 H new ATOM 0 HD23 LEU A 507 -1.960 -8.402 4.406 1.00 0.00 H new ATOM 512 N THR A 508 -6.016 -6.836 1.758 1.00 0.00 N ATOM 513 CA THR A 508 -6.554 -6.629 0.419 1.00 0.00 C ATOM 514 C THR A 508 -5.835 -5.489 -0.292 1.00 0.00 C ATOM 515 O THR A 508 -5.315 -5.663 -1.394 1.00 0.00 O ATOM 516 CB THR A 508 -8.063 -6.321 0.462 1.00 0.00 C ATOM 517 OG1 THR A 508 -8.750 -7.337 1.202 1.00 0.00 O ATOM 518 CG2 THR A 508 -8.638 -6.234 -0.944 1.00 0.00 C ATOM 0 H THR A 508 -6.724 -6.952 2.483 1.00 0.00 H new ATOM 0 HA THR A 508 -6.395 -7.556 -0.133 1.00 0.00 H new ATOM 0 HB THR A 508 -8.201 -5.358 0.954 1.00 0.00 H new ATOM 0 HG1 THR A 508 -8.596 -7.204 2.161 1.00 0.00 H new ATOM 0 HG21 THR A 508 -9.704 -6.016 -0.888 1.00 0.00 H new ATOM 0 HG22 THR A 508 -8.134 -5.440 -1.495 1.00 0.00 H new ATOM 0 HG23 THR A 508 -8.488 -7.184 -1.458 1.00 0.00 H new ATOM 526 N ALA A 509 -5.808 -4.323 0.345 1.00 0.00 N ATOM 527 CA ALA A 509 -5.149 -3.155 -0.227 1.00 0.00 C ATOM 528 C ALA A 509 -3.692 -3.456 -0.562 1.00 0.00 C ATOM 529 O ALA A 509 -3.220 -3.148 -1.657 1.00 0.00 O ATOM 530 CB ALA A 509 -5.240 -1.976 0.731 1.00 0.00 C ATOM 0 H ALA A 509 -6.235 -4.162 1.257 1.00 0.00 H new ATOM 0 HA ALA A 509 -5.661 -2.896 -1.154 1.00 0.00 H new ATOM 0 HB1 ALA A 509 -4.744 -1.111 0.291 1.00 0.00 H new ATOM 0 HB2 ALA A 509 -6.287 -1.738 0.917 1.00 0.00 H new ATOM 0 HB3 ALA A 509 -4.754 -2.233 1.672 1.00 0.00 H new ATOM 536 N PHE A 510 -2.984 -4.059 0.386 1.00 0.00 N ATOM 537 CA PHE A 510 -1.579 -4.400 0.192 1.00 0.00 C ATOM 538 C PHE A 510 -1.391 -5.230 -1.075 1.00 0.00 C ATOM 539 O PHE A 510 -0.559 -4.907 -1.922 1.00 0.00 O ATOM 540 CB PHE A 510 -1.047 -5.169 1.403 1.00 0.00 C ATOM 541 CG PHE A 510 0.437 -5.395 1.364 1.00 0.00 C ATOM 542 CD1 PHE A 510 1.316 -4.357 1.628 1.00 0.00 C ATOM 543 CD2 PHE A 510 0.954 -6.645 1.065 1.00 0.00 C ATOM 544 CE1 PHE A 510 2.683 -4.562 1.592 1.00 0.00 C ATOM 545 CE2 PHE A 510 2.319 -6.856 1.028 1.00 0.00 C ATOM 546 CZ PHE A 510 3.185 -5.813 1.293 1.00 0.00 C ATOM 0 H PHE A 510 -3.360 -4.322 1.297 1.00 0.00 H new ATOM 0 HA PHE A 510 -1.017 -3.472 0.084 1.00 0.00 H new ATOM 0 HB2 PHE A 510 -1.299 -4.621 2.311 1.00 0.00 H new ATOM 0 HB3 PHE A 510 -1.552 -6.133 1.462 1.00 0.00 H new ATOM 0 HD1 PHE A 510 0.929 -3.377 1.865 1.00 0.00 H new ATOM 0 HD2 PHE A 510 0.282 -7.465 0.858 1.00 0.00 H new ATOM 0 HE1 PHE A 510 3.358 -3.744 1.798 1.00 0.00 H new ATOM 0 HE2 PHE A 510 2.708 -7.835 0.792 1.00 0.00 H new ATOM 0 HZ PHE A 510 4.252 -5.976 1.266 1.00 0.00 H new ATOM 556 N GLN A 511 -2.170 -6.300 -1.195 1.00 0.00 N ATOM 557 CA GLN A 511 -2.089 -7.177 -2.357 1.00 0.00 C ATOM 558 C GLN A 511 -2.376 -6.407 -3.641 1.00 0.00 C ATOM 559 O GLN A 511 -1.642 -6.522 -4.624 1.00 0.00 O ATOM 560 CB GLN A 511 -3.073 -8.340 -2.214 1.00 0.00 C ATOM 561 CG GLN A 511 -2.750 -9.523 -3.113 1.00 0.00 C ATOM 562 CD GLN A 511 -3.292 -9.354 -4.518 1.00 0.00 C ATOM 563 OE1 GLN A 511 -4.261 -8.627 -4.739 1.00 0.00 O ATOM 564 NE2 GLN A 511 -2.667 -10.025 -5.479 1.00 0.00 N ATOM 0 H GLN A 511 -2.864 -6.580 -0.502 1.00 0.00 H new ATOM 0 HA GLN A 511 -1.075 -7.573 -2.412 1.00 0.00 H new ATOM 0 HB2 GLN A 511 -3.080 -8.674 -1.176 1.00 0.00 H new ATOM 0 HB3 GLN A 511 -4.078 -7.985 -2.441 1.00 0.00 H new ATOM 0 HG2 GLN A 511 -1.669 -9.655 -3.158 1.00 0.00 H new ATOM 0 HG3 GLN A 511 -3.164 -10.431 -2.675 1.00 0.00 H new ATOM 0 HE21 GLN A 511 -1.868 -10.616 -5.251 1.00 0.00 H new ATOM 0 HE22 GLN A 511 -2.986 -9.949 -6.445 1.00 0.00 H new ATOM 573 N LEU A 512 -3.447 -5.621 -3.627 1.00 0.00 N ATOM 574 CA LEU A 512 -3.832 -4.831 -4.792 1.00 0.00 C ATOM 575 C LEU A 512 -2.669 -3.970 -5.274 1.00 0.00 C ATOM 576 O LEU A 512 -2.330 -3.972 -6.458 1.00 0.00 O ATOM 577 CB LEU A 512 -5.034 -3.946 -4.457 1.00 0.00 C ATOM 578 CG LEU A 512 -6.382 -4.658 -4.344 1.00 0.00 C ATOM 579 CD1 LEU A 512 -7.402 -3.763 -3.658 1.00 0.00 C ATOM 580 CD2 LEU A 512 -6.879 -5.081 -5.719 1.00 0.00 C ATOM 0 H LEU A 512 -4.064 -5.514 -2.822 1.00 0.00 H new ATOM 0 HA LEU A 512 -4.107 -5.518 -5.593 1.00 0.00 H new ATOM 0 HB2 LEU A 512 -4.834 -3.438 -3.513 1.00 0.00 H new ATOM 0 HB3 LEU A 512 -5.116 -3.175 -5.223 1.00 0.00 H new ATOM 0 HG LEU A 512 -6.249 -5.554 -3.737 1.00 0.00 H new ATOM 0 HD11 LEU A 512 -8.355 -4.286 -3.586 1.00 0.00 H new ATOM 0 HD12 LEU A 512 -7.050 -3.511 -2.658 1.00 0.00 H new ATOM 0 HD13 LEU A 512 -7.532 -2.849 -4.238 1.00 0.00 H new ATOM 0 HD21 LEU A 512 -7.840 -5.586 -5.619 1.00 0.00 H new ATOM 0 HD22 LEU A 512 -6.996 -4.200 -6.350 1.00 0.00 H new ATOM 0 HD23 LEU A 512 -6.158 -5.760 -6.174 1.00 0.00 H new ATOM 592 N LEU A 513 -2.061 -3.236 -4.349 1.00 0.00 N ATOM 593 CA LEU A 513 -0.933 -2.371 -4.678 1.00 0.00 C ATOM 594 C LEU A 513 0.251 -3.188 -5.184 1.00 0.00 C ATOM 595 O LEU A 513 0.899 -2.821 -6.165 1.00 0.00 O ATOM 596 CB LEU A 513 -0.517 -1.553 -3.454 1.00 0.00 C ATOM 597 CG LEU A 513 -1.523 -0.507 -2.972 1.00 0.00 C ATOM 598 CD1 LEU A 513 -1.094 0.068 -1.632 1.00 0.00 C ATOM 599 CD2 LEU A 513 -1.678 0.599 -4.005 1.00 0.00 C ATOM 0 H LEU A 513 -2.330 -3.222 -3.365 1.00 0.00 H new ATOM 0 HA LEU A 513 -1.248 -1.692 -5.471 1.00 0.00 H new ATOM 0 HB2 LEU A 513 -0.317 -2.241 -2.633 1.00 0.00 H new ATOM 0 HB3 LEU A 513 0.421 -1.047 -3.682 1.00 0.00 H new ATOM 0 HG LEU A 513 -2.490 -0.993 -2.842 1.00 0.00 H new ATOM 0 HD11 LEU A 513 -1.822 0.811 -1.305 1.00 0.00 H new ATOM 0 HD12 LEU A 513 -1.036 -0.732 -0.894 1.00 0.00 H new ATOM 0 HD13 LEU A 513 -0.116 0.539 -1.734 1.00 0.00 H new ATOM 0 HD21 LEU A 513 -2.398 1.334 -3.645 1.00 0.00 H new ATOM 0 HD22 LEU A 513 -0.715 1.083 -4.167 1.00 0.00 H new ATOM 0 HD23 LEU A 513 -2.033 0.173 -4.944 1.00 0.00 H new ATOM 611 N PHE A 514 0.527 -4.300 -4.511 1.00 0.00 N ATOM 612 CA PHE A 514 1.632 -5.171 -4.893 1.00 0.00 C ATOM 613 C PHE A 514 1.579 -5.495 -6.383 1.00 0.00 C ATOM 614 O PHE A 514 2.556 -5.301 -7.106 1.00 0.00 O ATOM 615 CB PHE A 514 1.596 -6.465 -4.076 1.00 0.00 C ATOM 616 CG PHE A 514 2.828 -7.308 -4.234 1.00 0.00 C ATOM 617 CD1 PHE A 514 4.085 -6.771 -4.005 1.00 0.00 C ATOM 618 CD2 PHE A 514 2.731 -8.638 -4.611 1.00 0.00 C ATOM 619 CE1 PHE A 514 5.221 -7.545 -4.150 1.00 0.00 C ATOM 620 CE2 PHE A 514 3.863 -9.417 -4.758 1.00 0.00 C ATOM 621 CZ PHE A 514 5.110 -8.870 -4.526 1.00 0.00 C ATOM 0 H PHE A 514 0.000 -4.619 -3.698 1.00 0.00 H new ATOM 0 HA PHE A 514 2.564 -4.645 -4.686 1.00 0.00 H new ATOM 0 HB2 PHE A 514 1.468 -6.217 -3.022 1.00 0.00 H new ATOM 0 HB3 PHE A 514 0.725 -7.049 -4.374 1.00 0.00 H new ATOM 0 HD1 PHE A 514 4.178 -5.736 -3.710 1.00 0.00 H new ATOM 0 HD2 PHE A 514 1.758 -9.071 -4.792 1.00 0.00 H new ATOM 0 HE1 PHE A 514 6.195 -7.114 -3.970 1.00 0.00 H new ATOM 0 HE2 PHE A 514 3.773 -10.452 -5.054 1.00 0.00 H new ATOM 0 HZ PHE A 514 5.996 -9.477 -4.638 1.00 0.00 H new ATOM 631 N ALA A 515 0.432 -5.992 -6.834 1.00 0.00 N ATOM 632 CA ALA A 515 0.250 -6.342 -8.237 1.00 0.00 C ATOM 633 C ALA A 515 0.397 -5.116 -9.132 1.00 0.00 C ATOM 634 O ALA A 515 1.072 -5.164 -10.160 1.00 0.00 O ATOM 635 CB ALA A 515 -1.109 -6.991 -8.447 1.00 0.00 C ATOM 0 H ALA A 515 -0.385 -6.161 -6.248 1.00 0.00 H new ATOM 0 HA ALA A 515 1.027 -7.055 -8.512 1.00 0.00 H new ATOM 0 HB1 ALA A 515 -1.231 -7.247 -9.499 1.00 0.00 H new ATOM 0 HB2 ALA A 515 -1.177 -7.896 -7.843 1.00 0.00 H new ATOM 0 HB3 ALA A 515 -1.894 -6.296 -8.149 1.00 0.00 H new ATOM 641 N TRP A 516 -0.239 -4.020 -8.735 1.00 0.00 N ATOM 642 CA TRP A 516 -0.179 -2.781 -9.503 1.00 0.00 C ATOM 643 C TRP A 516 1.266 -2.348 -9.726 1.00 0.00 C ATOM 644 O TRP A 516 1.711 -2.206 -10.865 1.00 0.00 O ATOM 645 CB TRP A 516 -0.951 -1.674 -8.784 1.00 0.00 C ATOM 646 CG TRP A 516 -0.682 -0.307 -9.337 1.00 0.00 C ATOM 647 CD1 TRP A 516 -1.354 0.313 -10.351 1.00 0.00 C ATOM 648 CD2 TRP A 516 0.333 0.607 -8.907 1.00 0.00 C ATOM 649 NE1 TRP A 516 -0.818 1.558 -10.578 1.00 0.00 N ATOM 650 CE2 TRP A 516 0.217 1.763 -9.705 1.00 0.00 C ATOM 651 CE3 TRP A 516 1.326 0.563 -7.926 1.00 0.00 C ATOM 652 CZ2 TRP A 516 1.059 2.861 -9.550 1.00 0.00 C ATOM 653 CZ3 TRP A 516 2.161 1.654 -7.773 1.00 0.00 C ATOM 654 CH2 TRP A 516 2.023 2.790 -8.581 1.00 0.00 C ATOM 0 H TRP A 516 -0.802 -3.964 -7.886 1.00 0.00 H new ATOM 0 HA TRP A 516 -0.638 -2.962 -10.475 1.00 0.00 H new ATOM 0 HB2 TRP A 516 -2.019 -1.882 -8.852 1.00 0.00 H new ATOM 0 HB3 TRP A 516 -0.691 -1.688 -7.726 1.00 0.00 H new ATOM 0 HD1 TRP A 516 -2.185 -0.112 -10.895 1.00 0.00 H new ATOM 0 HE1 TRP A 516 -1.139 2.222 -11.283 1.00 0.00 H new ATOM 0 HE3 TRP A 516 1.440 -0.308 -7.298 1.00 0.00 H new ATOM 0 HZ2 TRP A 516 0.955 3.738 -10.172 1.00 0.00 H new ATOM 0 HZ3 TRP A 516 2.933 1.630 -7.018 1.00 0.00 H new ATOM 0 HH2 TRP A 516 2.691 3.627 -8.436 1.00 0.00 H new ATOM 665 N ARG A 517 1.993 -2.141 -8.633 1.00 0.00 N ATOM 666 CA ARG A 517 3.387 -1.724 -8.711 1.00 0.00 C ATOM 667 C ARG A 517 4.192 -2.676 -9.592 1.00 0.00 C ATOM 668 O ARG A 517 4.865 -2.250 -10.530 1.00 0.00 O ATOM 669 CB ARG A 517 4.003 -1.663 -7.312 1.00 0.00 C ATOM 670 CG ARG A 517 5.444 -1.179 -7.301 1.00 0.00 C ATOM 671 CD ARG A 517 6.199 -1.706 -6.090 1.00 0.00 C ATOM 672 NE ARG A 517 6.437 -3.144 -6.177 1.00 0.00 N ATOM 673 CZ ARG A 517 7.303 -3.793 -5.407 1.00 0.00 C ATOM 674 NH1 ARG A 517 8.009 -3.136 -4.497 1.00 0.00 N ATOM 675 NH2 ARG A 517 7.464 -5.103 -5.545 1.00 0.00 N ATOM 0 H ARG A 517 1.639 -2.255 -7.683 1.00 0.00 H new ATOM 0 HA ARG A 517 3.418 -0.730 -9.158 1.00 0.00 H new ATOM 0 HB2 ARG A 517 3.402 -1.002 -6.688 1.00 0.00 H new ATOM 0 HB3 ARG A 517 3.958 -2.654 -6.861 1.00 0.00 H new ATOM 0 HG2 ARG A 517 5.945 -1.503 -8.213 1.00 0.00 H new ATOM 0 HG3 ARG A 517 5.463 -0.089 -7.297 1.00 0.00 H new ATOM 0 HD2 ARG A 517 7.153 -1.185 -6.003 1.00 0.00 H new ATOM 0 HD3 ARG A 517 5.632 -1.486 -5.185 1.00 0.00 H new ATOM 0 HE ARG A 517 5.909 -3.679 -6.867 1.00 0.00 H new ATOM 0 HH11 ARG A 517 7.888 -2.129 -4.387 1.00 0.00 H new ATOM 0 HH12 ARG A 517 8.673 -3.637 -3.907 1.00 0.00 H new ATOM 0 HH21 ARG A 517 6.922 -5.613 -6.243 1.00 0.00 H new ATOM 0 HH22 ARG A 517 8.129 -5.600 -4.953 1.00 0.00 H new ATOM 689 N ASP A 518 4.116 -3.966 -9.282 1.00 0.00 N ATOM 690 CA ASP A 518 4.836 -4.979 -10.044 1.00 0.00 C ATOM 691 C ASP A 518 4.523 -4.863 -11.533 1.00 0.00 C ATOM 692 O ASP A 518 5.413 -4.973 -12.376 1.00 0.00 O ATOM 693 CB ASP A 518 4.476 -6.378 -9.542 1.00 0.00 C ATOM 694 CG ASP A 518 5.449 -7.435 -10.026 1.00 0.00 C ATOM 695 OD1 ASP A 518 6.619 -7.087 -10.294 1.00 0.00 O ATOM 696 OD2 ASP A 518 5.041 -8.610 -10.136 1.00 0.00 O ATOM 0 H ASP A 518 3.563 -4.334 -8.508 1.00 0.00 H new ATOM 0 HA ASP A 518 5.904 -4.815 -9.901 1.00 0.00 H new ATOM 0 HB2 ASP A 518 4.458 -6.376 -8.452 1.00 0.00 H new ATOM 0 HB3 ASP A 518 3.471 -6.633 -9.877 1.00 0.00 H new ATOM 701 N LYS A 519 3.252 -4.642 -11.849 1.00 0.00 N ATOM 702 CA LYS A 519 2.819 -4.511 -13.235 1.00 0.00 C ATOM 703 C LYS A 519 3.444 -3.281 -13.886 1.00 0.00 C ATOM 704 O LYS A 519 4.162 -3.389 -14.881 1.00 0.00 O ATOM 705 CB LYS A 519 1.293 -4.421 -13.309 1.00 0.00 C ATOM 706 CG LYS A 519 0.766 -4.155 -14.708 1.00 0.00 C ATOM 707 CD LYS A 519 -0.559 -3.412 -14.674 1.00 0.00 C ATOM 708 CE LYS A 519 -0.364 -1.940 -14.340 1.00 0.00 C ATOM 709 NZ LYS A 519 -1.544 -1.371 -13.633 1.00 0.00 N ATOM 0 H LYS A 519 2.503 -4.550 -11.163 1.00 0.00 H new ATOM 0 HA LYS A 519 3.151 -5.396 -13.778 1.00 0.00 H new ATOM 0 HB2 LYS A 519 0.864 -5.353 -12.940 1.00 0.00 H new ATOM 0 HB3 LYS A 519 0.952 -3.627 -12.644 1.00 0.00 H new ATOM 0 HG2 LYS A 519 1.497 -3.572 -15.268 1.00 0.00 H new ATOM 0 HG3 LYS A 519 0.640 -5.100 -15.236 1.00 0.00 H new ATOM 0 HD2 LYS A 519 -1.054 -3.504 -15.641 1.00 0.00 H new ATOM 0 HD3 LYS A 519 -1.216 -3.870 -13.934 1.00 0.00 H new ATOM 0 HE2 LYS A 519 0.523 -1.823 -13.718 1.00 0.00 H new ATOM 0 HE3 LYS A 519 -0.186 -1.380 -15.258 1.00 0.00 H new ATOM 0 HZ1 LYS A 519 -1.898 -0.546 -14.157 1.00 0.00 H new ATOM 0 HZ2 LYS A 519 -2.293 -2.090 -13.573 1.00 0.00 H new ATOM 0 HZ3 LYS A 519 -1.267 -1.079 -12.674 1.00 0.00 H new ATOM 723 N THR A 520 3.166 -2.111 -13.319 1.00 0.00 N ATOM 724 CA THR A 520 3.701 -0.861 -13.843 1.00 0.00 C ATOM 725 C THR A 520 5.222 -0.906 -13.929 1.00 0.00 C ATOM 726 O THR A 520 5.819 -0.338 -14.842 1.00 0.00 O ATOM 727 CB THR A 520 3.283 0.339 -12.972 1.00 0.00 C ATOM 728 OG1 THR A 520 1.872 0.298 -12.727 1.00 0.00 O ATOM 729 CG2 THR A 520 3.647 1.652 -13.648 1.00 0.00 C ATOM 0 H THR A 520 2.573 -2.003 -12.496 1.00 0.00 H new ATOM 0 HA THR A 520 3.287 -0.736 -14.844 1.00 0.00 H new ATOM 0 HB THR A 520 3.819 0.276 -12.025 1.00 0.00 H new ATOM 0 HG1 THR A 520 1.614 1.063 -12.171 1.00 0.00 H new ATOM 0 HG21 THR A 520 3.342 2.484 -13.014 1.00 0.00 H new ATOM 0 HG22 THR A 520 4.725 1.693 -13.807 1.00 0.00 H new ATOM 0 HG23 THR A 520 3.136 1.721 -14.608 1.00 0.00 H new ATOM 737 N ALA A 521 5.844 -1.587 -12.971 1.00 0.00 N ATOM 738 CA ALA A 521 7.296 -1.709 -12.940 1.00 0.00 C ATOM 739 C ALA A 521 7.856 -1.963 -14.336 1.00 0.00 C ATOM 740 O ALA A 521 8.739 -1.243 -14.801 1.00 0.00 O ATOM 741 CB ALA A 521 7.712 -2.823 -11.992 1.00 0.00 C ATOM 0 H ALA A 521 5.364 -2.062 -12.206 1.00 0.00 H new ATOM 0 HA ALA A 521 7.707 -0.767 -12.578 1.00 0.00 H new ATOM 0 HB1 ALA A 521 8.799 -2.903 -11.979 1.00 0.00 H new ATOM 0 HB2 ALA A 521 7.352 -2.599 -10.988 1.00 0.00 H new ATOM 0 HB3 ALA A 521 7.283 -3.767 -12.329 1.00 0.00 H new ATOM 747 N ARG A 522 7.336 -2.992 -14.998 1.00 0.00 N ATOM 748 CA ARG A 522 7.786 -3.342 -16.340 1.00 0.00 C ATOM 749 C ARG A 522 7.294 -2.321 -17.362 1.00 0.00 C ATOM 750 O ARG A 522 8.027 -1.937 -18.273 1.00 0.00 O ATOM 751 CB ARG A 522 7.289 -4.738 -16.719 1.00 0.00 C ATOM 752 CG ARG A 522 7.790 -5.216 -18.072 1.00 0.00 C ATOM 753 CD ARG A 522 9.279 -5.520 -18.040 1.00 0.00 C ATOM 754 NE ARG A 522 9.841 -5.650 -19.382 1.00 0.00 N ATOM 755 CZ ARG A 522 11.021 -6.206 -19.634 1.00 0.00 C ATOM 756 NH1 ARG A 522 11.760 -6.681 -18.640 1.00 0.00 N ATOM 757 NH2 ARG A 522 11.464 -6.289 -20.882 1.00 0.00 N ATOM 0 H ARG A 522 6.603 -3.597 -14.627 1.00 0.00 H new ATOM 0 HA ARG A 522 8.876 -3.338 -16.343 1.00 0.00 H new ATOM 0 HB2 ARG A 522 7.604 -5.447 -15.953 1.00 0.00 H new ATOM 0 HB3 ARG A 522 6.199 -4.737 -16.724 1.00 0.00 H new ATOM 0 HG2 ARG A 522 7.242 -6.110 -18.369 1.00 0.00 H new ATOM 0 HG3 ARG A 522 7.589 -4.454 -18.825 1.00 0.00 H new ATOM 0 HD2 ARG A 522 9.799 -4.726 -17.505 1.00 0.00 H new ATOM 0 HD3 ARG A 522 9.449 -6.443 -17.485 1.00 0.00 H new ATOM 0 HE ARG A 522 9.298 -5.294 -20.169 1.00 0.00 H new ATOM 0 HH11 ARG A 522 11.423 -6.620 -17.679 1.00 0.00 H new ATOM 0 HH12 ARG A 522 12.666 -7.107 -18.836 1.00 0.00 H new ATOM 0 HH21 ARG A 522 10.898 -5.926 -21.649 1.00 0.00 H new ATOM 0 HH22 ARG A 522 12.370 -6.716 -21.074 1.00 0.00 H new ATOM 771 N ARG A 523 6.048 -1.886 -17.204 1.00 0.00 N ATOM 772 CA ARG A 523 5.457 -0.911 -18.113 1.00 0.00 C ATOM 773 C ARG A 523 6.355 0.314 -18.254 1.00 0.00 C ATOM 774 O ARG A 523 6.581 0.806 -19.359 1.00 0.00 O ATOM 775 CB ARG A 523 4.074 -0.489 -17.614 1.00 0.00 C ATOM 776 CG ARG A 523 3.385 0.523 -18.515 1.00 0.00 C ATOM 777 CD ARG A 523 2.965 -0.102 -19.836 1.00 0.00 C ATOM 778 NE ARG A 523 4.004 0.022 -20.855 1.00 0.00 N ATOM 779 CZ ARG A 523 4.230 1.136 -21.542 1.00 0.00 C ATOM 780 NH1 ARG A 523 3.495 2.217 -21.320 1.00 0.00 N ATOM 781 NH2 ARG A 523 5.195 1.171 -22.453 1.00 0.00 N ATOM 0 H ARG A 523 5.428 -2.194 -16.455 1.00 0.00 H new ATOM 0 HA ARG A 523 5.354 -1.380 -19.092 1.00 0.00 H new ATOM 0 HB2 ARG A 523 3.443 -1.374 -17.526 1.00 0.00 H new ATOM 0 HB3 ARG A 523 4.171 -0.066 -16.614 1.00 0.00 H new ATOM 0 HG2 ARG A 523 2.509 0.927 -18.007 1.00 0.00 H new ATOM 0 HG3 ARG A 523 4.057 1.360 -18.705 1.00 0.00 H new ATOM 0 HD2 ARG A 523 2.733 -1.156 -19.681 1.00 0.00 H new ATOM 0 HD3 ARG A 523 2.052 0.377 -20.189 1.00 0.00 H new ATOM 0 HE ARG A 523 4.588 -0.791 -21.050 1.00 0.00 H new ATOM 0 HH11 ARG A 523 2.754 2.195 -20.620 1.00 0.00 H new ATOM 0 HH12 ARG A 523 3.671 3.071 -21.849 1.00 0.00 H new ATOM 0 HH21 ARG A 523 5.764 0.342 -22.626 1.00 0.00 H new ATOM 0 HH22 ARG A 523 5.368 2.027 -22.980 1.00 0.00 H new ATOM 795 N GLU A 524 6.864 0.802 -17.127 1.00 0.00 N ATOM 796 CA GLU A 524 7.736 1.970 -17.125 1.00 0.00 C ATOM 797 C GLU A 524 9.200 1.557 -17.001 1.00 0.00 C ATOM 798 O GLU A 524 10.048 2.352 -16.595 1.00 0.00 O ATOM 799 CB GLU A 524 7.361 2.913 -15.980 1.00 0.00 C ATOM 800 CG GLU A 524 5.999 3.564 -16.148 1.00 0.00 C ATOM 801 CD GLU A 524 5.896 4.380 -17.422 1.00 0.00 C ATOM 802 OE1 GLU A 524 6.908 4.995 -17.817 1.00 0.00 O ATOM 803 OE2 GLU A 524 4.802 4.401 -18.025 1.00 0.00 O ATOM 0 H GLU A 524 6.687 0.406 -16.204 1.00 0.00 H new ATOM 0 HA GLU A 524 7.603 2.491 -18.073 1.00 0.00 H new ATOM 0 HB2 GLU A 524 7.375 2.356 -15.043 1.00 0.00 H new ATOM 0 HB3 GLU A 524 8.119 3.692 -15.899 1.00 0.00 H new ATOM 0 HG2 GLU A 524 5.229 2.792 -16.152 1.00 0.00 H new ATOM 0 HG3 GLU A 524 5.800 4.208 -15.291 1.00 0.00 H new ATOM 810 N ASP A 525 9.488 0.309 -17.352 1.00 0.00 N ATOM 811 CA ASP A 525 10.848 -0.211 -17.281 1.00 0.00 C ATOM 812 C ASP A 525 11.596 0.384 -16.092 1.00 0.00 C ATOM 813 O ASP A 525 12.761 0.764 -16.206 1.00 0.00 O ATOM 814 CB ASP A 525 11.602 0.093 -18.577 1.00 0.00 C ATOM 815 CG ASP A 525 11.004 -0.618 -19.775 1.00 0.00 C ATOM 816 OD1 ASP A 525 11.083 -1.864 -19.825 1.00 0.00 O ATOM 817 OD2 ASP A 525 10.458 0.070 -20.662 1.00 0.00 O ATOM 0 H ASP A 525 8.797 -0.362 -17.689 1.00 0.00 H new ATOM 0 HA ASP A 525 10.791 -1.291 -17.148 1.00 0.00 H new ATOM 0 HB2 ASP A 525 11.594 1.168 -18.755 1.00 0.00 H new ATOM 0 HB3 ASP A 525 12.645 -0.204 -18.465 1.00 0.00 H new ATOM 822 N GLU A 526 10.917 0.463 -14.952 1.00 0.00 N ATOM 823 CA GLU A 526 11.517 1.014 -13.742 1.00 0.00 C ATOM 824 C GLU A 526 11.711 -0.072 -12.688 1.00 0.00 C ATOM 825 O GLU A 526 11.243 -1.199 -12.848 1.00 0.00 O ATOM 826 CB GLU A 526 10.643 2.137 -13.179 1.00 0.00 C ATOM 827 CG GLU A 526 10.960 3.504 -13.761 1.00 0.00 C ATOM 828 CD GLU A 526 12.430 3.859 -13.653 1.00 0.00 C ATOM 829 OE1 GLU A 526 13.101 3.335 -12.739 1.00 0.00 O ATOM 830 OE2 GLU A 526 12.909 4.660 -14.482 1.00 0.00 O ATOM 0 H GLU A 526 9.952 0.153 -14.841 1.00 0.00 H new ATOM 0 HA GLU A 526 12.494 1.420 -14.004 1.00 0.00 H new ATOM 0 HB2 GLU A 526 9.596 1.903 -13.372 1.00 0.00 H new ATOM 0 HB3 GLU A 526 10.767 2.175 -12.097 1.00 0.00 H new ATOM 0 HG2 GLU A 526 10.661 3.526 -14.809 1.00 0.00 H new ATOM 0 HG3 GLU A 526 10.369 4.260 -13.245 1.00 0.00 H new ATOM 837 N SER A 527 12.406 0.277 -11.609 1.00 0.00 N ATOM 838 CA SER A 527 12.667 -0.668 -10.530 1.00 0.00 C ATOM 839 C SER A 527 11.593 -0.570 -9.451 1.00 0.00 C ATOM 840 O SER A 527 10.842 0.404 -9.393 1.00 0.00 O ATOM 841 CB SER A 527 14.045 -0.409 -9.919 1.00 0.00 C ATOM 842 OG SER A 527 14.017 0.714 -9.055 1.00 0.00 O ATOM 0 H SER A 527 12.798 1.207 -11.460 1.00 0.00 H new ATOM 0 HA SER A 527 12.647 -1.674 -10.948 1.00 0.00 H new ATOM 0 HB2 SER A 527 14.372 -1.289 -9.366 1.00 0.00 H new ATOM 0 HB3 SER A 527 14.773 -0.243 -10.713 1.00 0.00 H new ATOM 0 HG SER A 527 14.909 0.857 -8.676 1.00 0.00 H new ATOM 848 N TYR A 528 11.526 -1.586 -8.598 1.00 0.00 N ATOM 849 CA TYR A 528 10.543 -1.617 -7.521 1.00 0.00 C ATOM 850 C TYR A 528 10.672 -0.385 -6.630 1.00 0.00 C ATOM 851 O TYR A 528 9.729 0.391 -6.485 1.00 0.00 O ATOM 852 CB TYR A 528 10.713 -2.886 -6.683 1.00 0.00 C ATOM 853 CG TYR A 528 10.526 -4.162 -7.473 1.00 0.00 C ATOM 854 CD1 TYR A 528 9.370 -4.382 -8.212 1.00 0.00 C ATOM 855 CD2 TYR A 528 11.504 -5.149 -7.478 1.00 0.00 C ATOM 856 CE1 TYR A 528 9.195 -5.546 -8.934 1.00 0.00 C ATOM 857 CE2 TYR A 528 11.338 -6.315 -8.198 1.00 0.00 C ATOM 858 CZ TYR A 528 10.182 -6.510 -8.925 1.00 0.00 C ATOM 859 OH TYR A 528 10.012 -7.672 -9.642 1.00 0.00 O ATOM 0 H TYR A 528 12.141 -2.399 -8.631 1.00 0.00 H new ATOM 0 HA TYR A 528 9.550 -1.616 -7.970 1.00 0.00 H new ATOM 0 HB2 TYR A 528 11.708 -2.887 -6.237 1.00 0.00 H new ATOM 0 HB3 TYR A 528 9.996 -2.868 -5.862 1.00 0.00 H new ATOM 0 HD1 TYR A 528 8.595 -3.630 -8.222 1.00 0.00 H new ATOM 0 HD2 TYR A 528 12.410 -5.001 -6.909 1.00 0.00 H new ATOM 0 HE1 TYR A 528 8.290 -5.701 -9.503 1.00 0.00 H new ATOM 0 HE2 TYR A 528 12.109 -7.071 -8.192 1.00 0.00 H new ATOM 0 HH TYR A 528 10.800 -8.244 -9.530 1.00 0.00 H new ATOM 869 N GLY A 529 11.849 -0.213 -6.036 1.00 0.00 N ATOM 870 CA GLY A 529 12.081 0.926 -5.167 1.00 0.00 C ATOM 871 C GLY A 529 11.653 2.235 -5.800 1.00 0.00 C ATOM 872 O GLY A 529 10.830 2.962 -5.243 1.00 0.00 O ATOM 0 H GLY A 529 12.645 -0.842 -6.141 1.00 0.00 H new ATOM 0 HA2 GLY A 529 11.538 0.783 -4.233 1.00 0.00 H new ATOM 0 HA3 GLY A 529 13.140 0.977 -4.915 1.00 0.00 H new ATOM 876 N TYR A 530 12.213 2.538 -6.966 1.00 0.00 N ATOM 877 CA TYR A 530 11.888 3.770 -7.673 1.00 0.00 C ATOM 878 C TYR A 530 10.377 3.955 -7.779 1.00 0.00 C ATOM 879 O TYR A 530 9.818 4.911 -7.241 1.00 0.00 O ATOM 880 CB TYR A 530 12.511 3.761 -9.070 1.00 0.00 C ATOM 881 CG TYR A 530 12.086 4.930 -9.930 1.00 0.00 C ATOM 882 CD1 TYR A 530 10.951 4.855 -10.727 1.00 0.00 C ATOM 883 CD2 TYR A 530 12.820 6.110 -9.945 1.00 0.00 C ATOM 884 CE1 TYR A 530 10.559 5.920 -11.515 1.00 0.00 C ATOM 885 CE2 TYR A 530 12.436 7.180 -10.729 1.00 0.00 C ATOM 886 CZ TYR A 530 11.305 7.080 -11.512 1.00 0.00 C ATOM 887 OH TYR A 530 10.918 8.144 -12.295 1.00 0.00 O ATOM 0 H TYR A 530 12.895 1.946 -7.441 1.00 0.00 H new ATOM 0 HA TYR A 530 12.299 4.604 -7.105 1.00 0.00 H new ATOM 0 HB2 TYR A 530 13.597 3.767 -8.975 1.00 0.00 H new ATOM 0 HB3 TYR A 530 12.240 2.833 -9.573 1.00 0.00 H new ATOM 0 HD1 TYR A 530 10.364 3.948 -10.731 1.00 0.00 H new ATOM 0 HD2 TYR A 530 13.706 6.192 -9.333 1.00 0.00 H new ATOM 0 HE1 TYR A 530 9.674 5.845 -12.129 1.00 0.00 H new ATOM 0 HE2 TYR A 530 13.018 8.090 -10.729 1.00 0.00 H new ATOM 0 HH TYR A 530 11.550 8.884 -12.177 1.00 0.00 H new ATOM 897 N VAL A 531 9.722 3.032 -8.476 1.00 0.00 N ATOM 898 CA VAL A 531 8.276 3.091 -8.652 1.00 0.00 C ATOM 899 C VAL A 531 7.568 3.293 -7.318 1.00 0.00 C ATOM 900 O VAL A 531 6.951 4.333 -7.081 1.00 0.00 O ATOM 901 CB VAL A 531 7.739 1.809 -9.316 1.00 0.00 C ATOM 902 CG1 VAL A 531 6.222 1.854 -9.415 1.00 0.00 C ATOM 903 CG2 VAL A 531 8.366 1.618 -10.689 1.00 0.00 C ATOM 0 H VAL A 531 10.170 2.235 -8.928 1.00 0.00 H new ATOM 0 HA VAL A 531 8.071 3.942 -9.302 1.00 0.00 H new ATOM 0 HB VAL A 531 8.013 0.956 -8.695 1.00 0.00 H new ATOM 0 HG11 VAL A 531 5.861 0.940 -9.887 1.00 0.00 H new ATOM 0 HG12 VAL A 531 5.795 1.940 -8.416 1.00 0.00 H new ATOM 0 HG13 VAL A 531 5.922 2.714 -10.013 1.00 0.00 H new ATOM 0 HG21 VAL A 531 7.975 0.708 -11.144 1.00 0.00 H new ATOM 0 HG22 VAL A 531 8.124 2.472 -11.321 1.00 0.00 H new ATOM 0 HG23 VAL A 531 9.448 1.537 -10.587 1.00 0.00 H new ATOM 913 N LEU A 532 7.660 2.294 -6.448 1.00 0.00 N ATOM 914 CA LEU A 532 7.028 2.361 -5.135 1.00 0.00 C ATOM 915 C LEU A 532 7.694 1.397 -4.159 1.00 0.00 C ATOM 916 O LEU A 532 7.572 0.177 -4.273 1.00 0.00 O ATOM 917 CB LEU A 532 5.536 2.042 -5.247 1.00 0.00 C ATOM 918 CG LEU A 532 4.712 2.225 -3.972 1.00 0.00 C ATOM 919 CD1 LEU A 532 4.423 3.698 -3.731 1.00 0.00 C ATOM 920 CD2 LEU A 532 3.416 1.432 -4.056 1.00 0.00 C ATOM 0 H LEU A 532 8.166 1.427 -6.628 1.00 0.00 H new ATOM 0 HA LEU A 532 7.148 3.375 -4.754 1.00 0.00 H new ATOM 0 HB2 LEU A 532 5.108 2.673 -6.026 1.00 0.00 H new ATOM 0 HB3 LEU A 532 5.430 1.009 -5.579 1.00 0.00 H new ATOM 0 HG LEU A 532 5.292 1.847 -3.130 1.00 0.00 H new ATOM 0 HD11 LEU A 532 3.836 3.809 -2.820 1.00 0.00 H new ATOM 0 HD12 LEU A 532 5.362 4.241 -3.626 1.00 0.00 H new ATOM 0 HD13 LEU A 532 3.863 4.102 -4.575 1.00 0.00 H new ATOM 0 HD21 LEU A 532 2.842 1.574 -3.140 1.00 0.00 H new ATOM 0 HD22 LEU A 532 2.831 1.780 -4.908 1.00 0.00 H new ATOM 0 HD23 LEU A 532 3.645 0.374 -4.180 1.00 0.00 H new ATOM 932 N PRO A 533 8.415 1.954 -3.175 1.00 0.00 N ATOM 933 CA PRO A 533 9.113 1.161 -2.158 1.00 0.00 C ATOM 934 C PRO A 533 8.149 0.474 -1.197 1.00 0.00 C ATOM 935 O PRO A 533 7.000 0.890 -1.052 1.00 0.00 O ATOM 936 CB PRO A 533 9.959 2.199 -1.417 1.00 0.00 C ATOM 937 CG PRO A 533 9.238 3.488 -1.617 1.00 0.00 C ATOM 938 CD PRO A 533 8.604 3.401 -2.978 1.00 0.00 C ATOM 0 HA PRO A 533 9.697 0.354 -2.600 1.00 0.00 H new ATOM 0 HB2 PRO A 533 10.047 1.955 -0.358 1.00 0.00 H new ATOM 0 HB3 PRO A 533 10.971 2.245 -1.819 1.00 0.00 H new ATOM 0 HG2 PRO A 533 8.484 3.637 -0.844 1.00 0.00 H new ATOM 0 HG3 PRO A 533 9.925 4.332 -1.560 1.00 0.00 H new ATOM 0 HD2 PRO A 533 7.657 3.939 -3.015 1.00 0.00 H new ATOM 0 HD3 PRO A 533 9.245 3.831 -3.748 1.00 0.00 H new ATOM 946 N ASN A 534 8.626 -0.579 -0.540 1.00 0.00 N ATOM 947 CA ASN A 534 7.805 -1.323 0.408 1.00 0.00 C ATOM 948 C ASN A 534 7.224 -0.395 1.470 1.00 0.00 C ATOM 949 O ASN A 534 6.017 -0.395 1.717 1.00 0.00 O ATOM 950 CB ASN A 534 8.632 -2.425 1.075 1.00 0.00 C ATOM 951 CG ASN A 534 9.502 -3.175 0.084 1.00 0.00 C ATOM 952 OD1 ASN A 534 10.487 -2.638 -0.424 1.00 0.00 O ATOM 953 ND2 ASN A 534 9.140 -4.421 -0.195 1.00 0.00 N ATOM 0 H ASN A 534 9.576 -0.936 -0.647 1.00 0.00 H new ATOM 0 HA ASN A 534 6.981 -1.778 -0.142 1.00 0.00 H new ATOM 0 HB2 ASN A 534 9.263 -1.985 1.848 1.00 0.00 H new ATOM 0 HB3 ASN A 534 7.963 -3.128 1.571 1.00 0.00 H new ATOM 0 HD21 ASN A 534 9.686 -4.975 -0.855 1.00 0.00 H new ATOM 0 HD22 ASN A 534 8.316 -4.825 0.250 1.00 0.00 H new ATOM 960 N HIS A 535 8.090 0.395 2.096 1.00 0.00 N ATOM 961 CA HIS A 535 7.663 1.330 3.131 1.00 0.00 C ATOM 962 C HIS A 535 6.426 2.104 2.687 1.00 0.00 C ATOM 963 O HIS A 535 5.440 2.188 3.419 1.00 0.00 O ATOM 964 CB HIS A 535 8.794 2.302 3.468 1.00 0.00 C ATOM 965 CG HIS A 535 8.779 3.549 2.638 1.00 0.00 C ATOM 966 ND1 HIS A 535 9.757 3.849 1.713 1.00 0.00 N ATOM 967 CD2 HIS A 535 7.895 4.573 2.595 1.00 0.00 C ATOM 968 CE1 HIS A 535 9.477 5.005 1.139 1.00 0.00 C ATOM 969 NE2 HIS A 535 8.352 5.466 1.656 1.00 0.00 N ATOM 0 H HIS A 535 9.092 0.407 1.905 1.00 0.00 H new ATOM 0 HA HIS A 535 7.410 0.756 4.022 1.00 0.00 H new ATOM 0 HB2 HIS A 535 8.725 2.575 4.521 1.00 0.00 H new ATOM 0 HB3 HIS A 535 9.750 1.796 3.332 1.00 0.00 H new ATOM 0 HD1 HIS A 535 10.570 3.269 1.505 1.00 0.00 H new ATOM 0 HD2 HIS A 535 6.998 4.670 3.188 1.00 0.00 H new ATOM 0 HE1 HIS A 535 10.067 5.491 0.376 1.00 0.00 H new ATOM 977 N MET A 536 6.486 2.667 1.485 1.00 0.00 N ATOM 978 CA MET A 536 5.369 3.434 0.944 1.00 0.00 C ATOM 979 C MET A 536 4.153 2.540 0.723 1.00 0.00 C ATOM 980 O MET A 536 3.044 2.871 1.142 1.00 0.00 O ATOM 981 CB MET A 536 5.772 4.102 -0.371 1.00 0.00 C ATOM 982 CG MET A 536 4.846 5.234 -0.786 1.00 0.00 C ATOM 983 SD MET A 536 4.913 6.636 0.347 1.00 0.00 S ATOM 984 CE MET A 536 6.466 7.387 -0.136 1.00 0.00 C ATOM 0 H MET A 536 7.295 2.607 0.867 1.00 0.00 H new ATOM 0 HA MET A 536 5.104 4.205 1.668 1.00 0.00 H new ATOM 0 HB2 MET A 536 6.786 4.489 -0.276 1.00 0.00 H new ATOM 0 HB3 MET A 536 5.790 3.350 -1.160 1.00 0.00 H new ATOM 0 HG2 MET A 536 5.114 5.569 -1.788 1.00 0.00 H new ATOM 0 HG3 MET A 536 3.823 4.861 -0.837 1.00 0.00 H new ATOM 0 HE1 MET A 536 6.888 7.927 0.712 1.00 0.00 H new ATOM 0 HE2 MET A 536 7.162 6.611 -0.455 1.00 0.00 H new ATOM 0 HE3 MET A 536 6.294 8.081 -0.959 1.00 0.00 H new ATOM 994 N MET A 537 4.368 1.408 0.063 1.00 0.00 N ATOM 995 CA MET A 537 3.289 0.467 -0.213 1.00 0.00 C ATOM 996 C MET A 537 2.525 0.127 1.063 1.00 0.00 C ATOM 997 O MET A 537 1.294 0.164 1.091 1.00 0.00 O ATOM 998 CB MET A 537 3.846 -0.811 -0.844 1.00 0.00 C ATOM 999 CG MET A 537 2.830 -1.566 -1.685 1.00 0.00 C ATOM 1000 SD MET A 537 3.116 -3.346 -1.688 1.00 0.00 S ATOM 1001 CE MET A 537 4.697 -3.433 -2.526 1.00 0.00 C ATOM 0 H MET A 537 5.280 1.119 -0.291 1.00 0.00 H new ATOM 0 HA MET A 537 2.600 0.938 -0.914 1.00 0.00 H new ATOM 0 HB2 MET A 537 4.703 -0.555 -1.467 1.00 0.00 H new ATOM 0 HB3 MET A 537 4.211 -1.467 -0.054 1.00 0.00 H new ATOM 0 HG2 MET A 537 1.828 -1.364 -1.306 1.00 0.00 H new ATOM 0 HG3 MET A 537 2.864 -1.195 -2.709 1.00 0.00 H new ATOM 0 HE1 MET A 537 5.143 -4.413 -2.360 1.00 0.00 H new ATOM 0 HE2 MET A 537 4.551 -3.277 -3.595 1.00 0.00 H new ATOM 0 HE3 MET A 537 5.360 -2.662 -2.134 1.00 0.00 H new ATOM 1011 N LEU A 538 3.262 -0.206 2.117 1.00 0.00 N ATOM 1012 CA LEU A 538 2.654 -0.553 3.397 1.00 0.00 C ATOM 1013 C LEU A 538 1.906 0.639 3.986 1.00 0.00 C ATOM 1014 O LEU A 538 0.696 0.580 4.206 1.00 0.00 O ATOM 1015 CB LEU A 538 3.724 -1.033 4.379 1.00 0.00 C ATOM 1016 CG LEU A 538 4.194 -2.478 4.205 1.00 0.00 C ATOM 1017 CD1 LEU A 538 5.505 -2.705 4.941 1.00 0.00 C ATOM 1018 CD2 LEU A 538 3.130 -3.448 4.697 1.00 0.00 C ATOM 0 H LEU A 538 4.281 -0.243 2.111 1.00 0.00 H new ATOM 0 HA LEU A 538 1.940 -1.358 3.225 1.00 0.00 H new ATOM 0 HB2 LEU A 538 4.590 -0.377 4.291 1.00 0.00 H new ATOM 0 HB3 LEU A 538 3.338 -0.917 5.392 1.00 0.00 H new ATOM 0 HG LEU A 538 4.360 -2.660 3.143 1.00 0.00 H new ATOM 0 HD11 LEU A 538 5.824 -3.739 4.806 1.00 0.00 H new ATOM 0 HD12 LEU A 538 6.267 -2.035 4.542 1.00 0.00 H new ATOM 0 HD13 LEU A 538 5.365 -2.504 6.003 1.00 0.00 H new ATOM 0 HD21 LEU A 538 3.482 -4.471 4.565 1.00 0.00 H new ATOM 0 HD22 LEU A 538 2.932 -3.265 5.753 1.00 0.00 H new ATOM 0 HD23 LEU A 538 2.213 -3.303 4.125 1.00 0.00 H new ATOM 1030 N LYS A 539 2.634 1.722 4.237 1.00 0.00 N ATOM 1031 CA LYS A 539 2.040 2.930 4.797 1.00 0.00 C ATOM 1032 C LYS A 539 0.673 3.203 4.177 1.00 0.00 C ATOM 1033 O LYS A 539 -0.287 3.514 4.882 1.00 0.00 O ATOM 1034 CB LYS A 539 2.963 4.130 4.569 1.00 0.00 C ATOM 1035 CG LYS A 539 2.334 5.461 4.941 1.00 0.00 C ATOM 1036 CD LYS A 539 3.378 6.459 5.413 1.00 0.00 C ATOM 1037 CE LYS A 539 4.139 7.064 4.244 1.00 0.00 C ATOM 1038 NZ LYS A 539 5.229 7.970 4.700 1.00 0.00 N ATOM 0 H LYS A 539 3.637 1.788 4.061 1.00 0.00 H new ATOM 0 HA LYS A 539 1.910 2.777 5.868 1.00 0.00 H new ATOM 0 HB2 LYS A 539 3.874 3.993 5.152 1.00 0.00 H new ATOM 0 HB3 LYS A 539 3.257 4.157 3.520 1.00 0.00 H new ATOM 0 HG2 LYS A 539 1.804 5.867 4.079 1.00 0.00 H new ATOM 0 HG3 LYS A 539 1.594 5.308 5.727 1.00 0.00 H new ATOM 0 HD2 LYS A 539 2.893 7.252 5.983 1.00 0.00 H new ATOM 0 HD3 LYS A 539 4.077 5.964 6.087 1.00 0.00 H new ATOM 0 HE2 LYS A 539 4.562 6.266 3.634 1.00 0.00 H new ATOM 0 HE3 LYS A 539 3.448 7.618 3.609 1.00 0.00 H new ATOM 0 HZ1 LYS A 539 5.357 8.735 4.008 1.00 0.00 H new ATOM 0 HZ2 LYS A 539 4.979 8.377 5.624 1.00 0.00 H new ATOM 0 HZ3 LYS A 539 6.114 7.431 4.788 1.00 0.00 H new ATOM 1052 N ILE A 540 0.593 3.082 2.856 1.00 0.00 N ATOM 1053 CA ILE A 540 -0.657 3.313 2.143 1.00 0.00 C ATOM 1054 C ILE A 540 -1.652 2.187 2.400 1.00 0.00 C ATOM 1055 O ILE A 540 -2.771 2.425 2.853 1.00 0.00 O ATOM 1056 CB ILE A 540 -0.424 3.440 0.626 1.00 0.00 C ATOM 1057 CG1 ILE A 540 0.463 4.650 0.324 1.00 0.00 C ATOM 1058 CG2 ILE A 540 -1.753 3.555 -0.106 1.00 0.00 C ATOM 1059 CD1 ILE A 540 1.040 4.642 -1.075 1.00 0.00 C ATOM 0 H ILE A 540 1.379 2.825 2.258 1.00 0.00 H new ATOM 0 HA ILE A 540 -1.067 4.250 2.519 1.00 0.00 H new ATOM 0 HB ILE A 540 0.086 2.543 0.275 1.00 0.00 H new ATOM 0 HG12 ILE A 540 -0.119 5.561 0.463 1.00 0.00 H new ATOM 0 HG13 ILE A 540 1.280 4.681 1.045 1.00 0.00 H new ATOM 0 HG21 ILE A 540 -1.572 3.644 -1.177 1.00 0.00 H new ATOM 0 HG22 ILE A 540 -2.353 2.666 0.088 1.00 0.00 H new ATOM 0 HG23 ILE A 540 -2.287 4.437 0.246 1.00 0.00 H new ATOM 0 HD11 ILE A 540 1.658 5.529 -1.219 1.00 0.00 H new ATOM 0 HD12 ILE A 540 1.650 3.749 -1.212 1.00 0.00 H new ATOM 0 HD13 ILE A 540 0.229 4.643 -1.803 1.00 0.00 H new ATOM 1071 N ALA A 541 -1.236 0.958 2.110 1.00 0.00 N ATOM 1072 CA ALA A 541 -2.090 -0.206 2.313 1.00 0.00 C ATOM 1073 C ALA A 541 -2.731 -0.181 3.696 1.00 0.00 C ATOM 1074 O ALA A 541 -3.876 -0.599 3.866 1.00 0.00 O ATOM 1075 CB ALA A 541 -1.290 -1.486 2.122 1.00 0.00 C ATOM 0 H ALA A 541 -0.313 0.743 1.734 1.00 0.00 H new ATOM 0 HA ALA A 541 -2.888 -0.175 1.571 1.00 0.00 H new ATOM 0 HB1 ALA A 541 -1.940 -2.348 2.276 1.00 0.00 H new ATOM 0 HB2 ALA A 541 -0.884 -1.514 1.111 1.00 0.00 H new ATOM 0 HB3 ALA A 541 -0.472 -1.515 2.842 1.00 0.00 H new ATOM 1081 N GLU A 542 -1.985 0.310 4.681 1.00 0.00 N ATOM 1082 CA GLU A 542 -2.482 0.387 6.049 1.00 0.00 C ATOM 1083 C GLU A 542 -3.375 1.610 6.236 1.00 0.00 C ATOM 1084 O GLU A 542 -4.392 1.549 6.926 1.00 0.00 O ATOM 1085 CB GLU A 542 -1.315 0.439 7.037 1.00 0.00 C ATOM 1086 CG GLU A 542 -0.390 -0.763 6.950 1.00 0.00 C ATOM 1087 CD GLU A 542 0.500 -0.904 8.170 1.00 0.00 C ATOM 1088 OE1 GLU A 542 1.310 0.012 8.423 1.00 0.00 O ATOM 1089 OE2 GLU A 542 0.386 -1.931 8.871 1.00 0.00 O ATOM 0 H GLU A 542 -1.035 0.660 4.557 1.00 0.00 H new ATOM 0 HA GLU A 542 -3.074 -0.507 6.243 1.00 0.00 H new ATOM 0 HB2 GLU A 542 -0.737 1.345 6.856 1.00 0.00 H new ATOM 0 HB3 GLU A 542 -1.711 0.510 8.050 1.00 0.00 H new ATOM 0 HG2 GLU A 542 -0.986 -1.668 6.833 1.00 0.00 H new ATOM 0 HG3 GLU A 542 0.232 -0.674 6.059 1.00 0.00 H new ATOM 1096 N GLU A 543 -2.986 2.720 5.616 1.00 0.00 N ATOM 1097 CA GLU A 543 -3.751 3.958 5.715 1.00 0.00 C ATOM 1098 C GLU A 543 -5.156 3.776 5.147 1.00 0.00 C ATOM 1099 O GLU A 543 -6.139 4.226 5.737 1.00 0.00 O ATOM 1100 CB GLU A 543 -3.032 5.088 4.976 1.00 0.00 C ATOM 1101 CG GLU A 543 -2.028 5.836 5.837 1.00 0.00 C ATOM 1102 CD GLU A 543 -2.646 6.393 7.105 1.00 0.00 C ATOM 1103 OE1 GLU A 543 -3.682 7.082 7.007 1.00 0.00 O ATOM 1104 OE2 GLU A 543 -2.092 6.138 8.195 1.00 0.00 O ATOM 0 H GLU A 543 -2.147 2.787 5.040 1.00 0.00 H new ATOM 0 HA GLU A 543 -3.836 4.220 6.770 1.00 0.00 H new ATOM 0 HB2 GLU A 543 -2.517 4.674 4.109 1.00 0.00 H new ATOM 0 HB3 GLU A 543 -3.773 5.794 4.600 1.00 0.00 H new ATOM 0 HG2 GLU A 543 -1.210 5.165 6.100 1.00 0.00 H new ATOM 0 HG3 GLU A 543 -1.597 6.653 5.259 1.00 0.00 H new ATOM 1111 N LEU A 544 -5.242 3.116 3.998 1.00 0.00 N ATOM 1112 CA LEU A 544 -6.525 2.875 3.348 1.00 0.00 C ATOM 1113 C LEU A 544 -7.239 4.189 3.047 1.00 0.00 C ATOM 1114 O LEU A 544 -8.385 4.405 3.440 1.00 0.00 O ATOM 1115 CB LEU A 544 -7.408 1.992 4.231 1.00 0.00 C ATOM 1116 CG LEU A 544 -6.884 0.583 4.509 1.00 0.00 C ATOM 1117 CD1 LEU A 544 -7.932 -0.242 5.239 1.00 0.00 C ATOM 1118 CD2 LEU A 544 -6.474 -0.099 3.212 1.00 0.00 C ATOM 0 H LEU A 544 -4.438 2.738 3.497 1.00 0.00 H new ATOM 0 HA LEU A 544 -6.336 2.362 2.405 1.00 0.00 H new ATOM 0 HB2 LEU A 544 -7.555 2.498 5.185 1.00 0.00 H new ATOM 0 HB3 LEU A 544 -8.388 1.907 3.761 1.00 0.00 H new ATOM 0 HG LEU A 544 -6.005 0.663 5.148 1.00 0.00 H new ATOM 0 HD11 LEU A 544 -7.541 -1.242 5.428 1.00 0.00 H new ATOM 0 HD12 LEU A 544 -8.177 0.237 6.187 1.00 0.00 H new ATOM 0 HD13 LEU A 544 -8.830 -0.314 4.626 1.00 0.00 H new ATOM 0 HD21 LEU A 544 -6.104 -1.101 3.429 1.00 0.00 H new ATOM 0 HD22 LEU A 544 -7.336 -0.167 2.548 1.00 0.00 H new ATOM 0 HD23 LEU A 544 -5.688 0.481 2.728 1.00 0.00 H new ATOM 1130 N PRO A 545 -6.547 5.088 2.332 1.00 0.00 N ATOM 1131 CA PRO A 545 -7.096 6.395 1.960 1.00 0.00 C ATOM 1132 C PRO A 545 -8.210 6.283 0.925 1.00 0.00 C ATOM 1133 O PRO A 545 -7.955 6.033 -0.253 1.00 0.00 O ATOM 1134 CB PRO A 545 -5.891 7.132 1.370 1.00 0.00 C ATOM 1135 CG PRO A 545 -4.988 6.051 0.884 1.00 0.00 C ATOM 1136 CD PRO A 545 -5.176 4.897 1.830 1.00 0.00 C ATOM 0 HA PRO A 545 -7.549 6.903 2.811 1.00 0.00 H new ATOM 0 HB2 PRO A 545 -6.190 7.793 0.557 1.00 0.00 H new ATOM 0 HB3 PRO A 545 -5.399 7.751 2.120 1.00 0.00 H new ATOM 0 HG2 PRO A 545 -5.238 5.763 -0.137 1.00 0.00 H new ATOM 0 HG3 PRO A 545 -3.950 6.384 0.876 1.00 0.00 H new ATOM 0 HD2 PRO A 545 -5.064 3.939 1.323 1.00 0.00 H new ATOM 0 HD3 PRO A 545 -4.445 4.917 2.639 1.00 0.00 H new ATOM 1144 N LYS A 546 -9.448 6.470 1.372 1.00 0.00 N ATOM 1145 CA LYS A 546 -10.602 6.392 0.484 1.00 0.00 C ATOM 1146 C LYS A 546 -10.463 7.371 -0.677 1.00 0.00 C ATOM 1147 O LYS A 546 -10.968 7.124 -1.772 1.00 0.00 O ATOM 1148 CB LYS A 546 -11.888 6.684 1.261 1.00 0.00 C ATOM 1149 CG LYS A 546 -11.854 7.997 2.023 1.00 0.00 C ATOM 1150 CD LYS A 546 -13.254 8.518 2.301 1.00 0.00 C ATOM 1151 CE LYS A 546 -13.238 9.642 3.324 1.00 0.00 C ATOM 1152 NZ LYS A 546 -13.013 9.133 4.705 1.00 0.00 N ATOM 0 H LYS A 546 -9.677 6.677 2.344 1.00 0.00 H new ATOM 0 HA LYS A 546 -10.650 5.381 0.079 1.00 0.00 H new ATOM 0 HB2 LYS A 546 -12.727 6.699 0.565 1.00 0.00 H new ATOM 0 HB3 LYS A 546 -12.071 5.871 1.963 1.00 0.00 H new ATOM 0 HG2 LYS A 546 -11.323 7.858 2.965 1.00 0.00 H new ATOM 0 HG3 LYS A 546 -11.297 8.737 1.449 1.00 0.00 H new ATOM 0 HD2 LYS A 546 -13.701 8.875 1.373 1.00 0.00 H new ATOM 0 HD3 LYS A 546 -13.881 7.703 2.664 1.00 0.00 H new ATOM 0 HE2 LYS A 546 -12.454 10.355 3.068 1.00 0.00 H new ATOM 0 HE3 LYS A 546 -14.184 10.181 3.286 1.00 0.00 H new ATOM 0 HZ1 LYS A 546 -13.160 9.904 5.387 1.00 0.00 H new ATOM 0 HZ2 LYS A 546 -13.682 8.362 4.904 1.00 0.00 H new ATOM 0 HZ3 LYS A 546 -12.040 8.777 4.789 1.00 0.00 H new ATOM 1166 N GLU A 547 -9.775 8.481 -0.430 1.00 0.00 N ATOM 1167 CA GLU A 547 -9.570 9.496 -1.457 1.00 0.00 C ATOM 1168 C GLU A 547 -8.192 9.353 -2.096 1.00 0.00 C ATOM 1169 O GLU A 547 -7.277 8.754 -1.531 1.00 0.00 O ATOM 1170 CB GLU A 547 -9.723 10.896 -0.859 1.00 0.00 C ATOM 1171 CG GLU A 547 -11.144 11.431 -0.918 1.00 0.00 C ATOM 1172 CD GLU A 547 -11.461 12.103 -2.240 1.00 0.00 C ATOM 1173 OE1 GLU A 547 -11.055 13.269 -2.426 1.00 0.00 O ATOM 1174 OE2 GLU A 547 -12.114 11.461 -3.089 1.00 0.00 O ATOM 0 H GLU A 547 -9.351 8.700 0.471 1.00 0.00 H new ATOM 0 HA GLU A 547 -10.326 9.353 -2.229 1.00 0.00 H new ATOM 0 HB2 GLU A 547 -9.394 10.876 0.180 1.00 0.00 H new ATOM 0 HB3 GLU A 547 -9.063 11.583 -1.389 1.00 0.00 H new ATOM 0 HG2 GLU A 547 -11.844 10.611 -0.755 1.00 0.00 H new ATOM 0 HG3 GLU A 547 -11.294 12.144 -0.107 1.00 0.00 H new ATOM 1181 N PRO A 548 -8.039 9.915 -3.304 1.00 0.00 N ATOM 1182 CA PRO A 548 -6.777 9.864 -4.048 1.00 0.00 C ATOM 1183 C PRO A 548 -5.690 10.718 -3.405 1.00 0.00 C ATOM 1184 O PRO A 548 -4.500 10.488 -3.618 1.00 0.00 O ATOM 1185 CB PRO A 548 -7.152 10.422 -5.423 1.00 0.00 C ATOM 1186 CG PRO A 548 -8.336 11.290 -5.169 1.00 0.00 C ATOM 1187 CD PRO A 548 -9.087 10.645 -4.037 1.00 0.00 C ATOM 0 HA PRO A 548 -6.364 8.856 -4.081 1.00 0.00 H new ATOM 0 HB2 PRO A 548 -6.330 10.991 -5.857 1.00 0.00 H new ATOM 0 HB3 PRO A 548 -7.391 9.622 -6.123 1.00 0.00 H new ATOM 0 HG2 PRO A 548 -8.029 12.302 -4.907 1.00 0.00 H new ATOM 0 HG3 PRO A 548 -8.961 11.367 -6.058 1.00 0.00 H new ATOM 0 HD2 PRO A 548 -9.577 11.386 -3.406 1.00 0.00 H new ATOM 0 HD3 PRO A 548 -9.864 9.973 -4.402 1.00 0.00 H new ATOM 1195 N GLN A 549 -6.107 11.704 -2.617 1.00 0.00 N ATOM 1196 CA GLN A 549 -5.168 12.592 -1.943 1.00 0.00 C ATOM 1197 C GLN A 549 -4.314 11.823 -0.941 1.00 0.00 C ATOM 1198 O GLN A 549 -3.098 11.999 -0.882 1.00 0.00 O ATOM 1199 CB GLN A 549 -5.919 13.719 -1.232 1.00 0.00 C ATOM 1200 CG GLN A 549 -5.121 15.007 -1.120 1.00 0.00 C ATOM 1201 CD GLN A 549 -5.204 15.856 -2.373 1.00 0.00 C ATOM 1202 OE1 GLN A 549 -4.699 15.476 -3.430 1.00 0.00 O ATOM 1203 NE2 GLN A 549 -5.846 17.014 -2.263 1.00 0.00 N ATOM 0 H GLN A 549 -7.089 11.908 -2.430 1.00 0.00 H new ATOM 0 HA GLN A 549 -4.510 13.023 -2.698 1.00 0.00 H new ATOM 0 HB2 GLN A 549 -6.846 13.921 -1.769 1.00 0.00 H new ATOM 0 HB3 GLN A 549 -6.196 13.385 -0.232 1.00 0.00 H new ATOM 0 HG2 GLN A 549 -5.486 15.584 -0.270 1.00 0.00 H new ATOM 0 HG3 GLN A 549 -4.077 14.767 -0.917 1.00 0.00 H new ATOM 0 HE21 GLN A 549 -6.250 17.290 -1.368 1.00 0.00 H new ATOM 0 HE22 GLN A 549 -5.935 17.627 -3.074 1.00 0.00 H new ATOM 1212 N GLY A 550 -4.960 10.968 -0.154 1.00 0.00 N ATOM 1213 CA GLY A 550 -4.244 10.184 0.836 1.00 0.00 C ATOM 1214 C GLY A 550 -3.074 9.426 0.240 1.00 0.00 C ATOM 1215 O GLY A 550 -2.069 9.195 0.912 1.00 0.00 O ATOM 0 H GLY A 550 -5.966 10.804 -0.184 1.00 0.00 H new ATOM 0 HA2 GLY A 550 -3.882 10.844 1.625 1.00 0.00 H new ATOM 0 HA3 GLY A 550 -4.931 9.478 1.302 1.00 0.00 H new ATOM 1219 N ILE A 551 -3.205 9.038 -1.024 1.00 0.00 N ATOM 1220 CA ILE A 551 -2.151 8.301 -1.710 1.00 0.00 C ATOM 1221 C ILE A 551 -1.012 9.228 -2.122 1.00 0.00 C ATOM 1222 O ILE A 551 0.110 8.780 -2.362 1.00 0.00 O ATOM 1223 CB ILE A 551 -2.689 7.580 -2.959 1.00 0.00 C ATOM 1224 CG1 ILE A 551 -3.787 6.588 -2.569 1.00 0.00 C ATOM 1225 CG2 ILE A 551 -1.559 6.868 -3.688 1.00 0.00 C ATOM 1226 CD1 ILE A 551 -5.177 7.184 -2.596 1.00 0.00 C ATOM 0 H ILE A 551 -4.031 9.222 -1.594 1.00 0.00 H new ATOM 0 HA ILE A 551 -1.776 7.558 -1.006 1.00 0.00 H new ATOM 0 HB ILE A 551 -3.118 8.322 -3.632 1.00 0.00 H new ATOM 0 HG12 ILE A 551 -3.753 5.735 -3.247 1.00 0.00 H new ATOM 0 HG13 ILE A 551 -3.583 6.208 -1.568 1.00 0.00 H new ATOM 0 HG21 ILE A 551 -1.956 6.363 -4.569 1.00 0.00 H new ATOM 0 HG22 ILE A 551 -0.808 7.596 -3.995 1.00 0.00 H new ATOM 0 HG23 ILE A 551 -1.103 6.134 -3.024 1.00 0.00 H new ATOM 0 HD11 ILE A 551 -5.904 6.424 -2.309 1.00 0.00 H new ATOM 0 HD12 ILE A 551 -5.229 8.019 -1.897 1.00 0.00 H new ATOM 0 HD13 ILE A 551 -5.401 7.539 -3.602 1.00 0.00 H new ATOM 1238 N ILE A 552 -1.308 10.521 -2.201 1.00 0.00 N ATOM 1239 CA ILE A 552 -0.308 11.510 -2.582 1.00 0.00 C ATOM 1240 C ILE A 552 0.412 12.064 -1.357 1.00 0.00 C ATOM 1241 O ILE A 552 1.619 12.301 -1.387 1.00 0.00 O ATOM 1242 CB ILE A 552 -0.940 12.677 -3.363 1.00 0.00 C ATOM 1243 CG1 ILE A 552 -1.637 12.158 -4.622 1.00 0.00 C ATOM 1244 CG2 ILE A 552 0.119 13.708 -3.724 1.00 0.00 C ATOM 1245 CD1 ILE A 552 -2.285 13.248 -5.447 1.00 0.00 C ATOM 0 H ILE A 552 -2.232 10.908 -2.006 1.00 0.00 H new ATOM 0 HA ILE A 552 0.411 11.001 -3.224 1.00 0.00 H new ATOM 0 HB ILE A 552 -1.686 13.157 -2.729 1.00 0.00 H new ATOM 0 HG12 ILE A 552 -0.910 11.631 -5.239 1.00 0.00 H new ATOM 0 HG13 ILE A 552 -2.397 11.432 -4.334 1.00 0.00 H new ATOM 0 HG21 ILE A 552 -0.343 14.527 -4.276 1.00 0.00 H new ATOM 0 HG22 ILE A 552 0.574 14.096 -2.813 1.00 0.00 H new ATOM 0 HG23 ILE A 552 0.886 13.241 -4.342 1.00 0.00 H new ATOM 0 HD11 ILE A 552 -2.760 12.807 -6.324 1.00 0.00 H new ATOM 0 HD12 ILE A 552 -3.037 13.761 -4.847 1.00 0.00 H new ATOM 0 HD13 ILE A 552 -1.526 13.963 -5.766 1.00 0.00 H new ATOM 1257 N ALA A 553 -0.338 12.267 -0.278 1.00 0.00 N ATOM 1258 CA ALA A 553 0.228 12.789 0.959 1.00 0.00 C ATOM 1259 C ALA A 553 1.281 11.841 1.524 1.00 0.00 C ATOM 1260 O ALA A 553 2.356 12.271 1.943 1.00 0.00 O ATOM 1261 CB ALA A 553 -0.871 13.030 1.983 1.00 0.00 C ATOM 0 H ALA A 553 -1.339 12.078 -0.236 1.00 0.00 H new ATOM 0 HA ALA A 553 0.714 13.738 0.734 1.00 0.00 H new ATOM 0 HB1 ALA A 553 -0.433 13.420 2.902 1.00 0.00 H new ATOM 0 HB2 ALA A 553 -1.585 13.752 1.587 1.00 0.00 H new ATOM 0 HB3 ALA A 553 -1.383 12.091 2.195 1.00 0.00 H new ATOM 1267 N CYS A 554 0.965 10.551 1.532 1.00 0.00 N ATOM 1268 CA CYS A 554 1.884 9.542 2.047 1.00 0.00 C ATOM 1269 C CYS A 554 3.270 9.704 1.433 1.00 0.00 C ATOM 1270 O CYS A 554 4.278 9.361 2.051 1.00 0.00 O ATOM 1271 CB CYS A 554 1.346 8.139 1.760 1.00 0.00 C ATOM 1272 SG CYS A 554 1.203 7.749 0.000 1.00 0.00 S ATOM 0 H CYS A 554 0.080 10.179 1.188 1.00 0.00 H new ATOM 0 HA CYS A 554 1.967 9.678 3.125 1.00 0.00 H new ATOM 0 HB2 CYS A 554 2.001 7.407 2.231 1.00 0.00 H new ATOM 0 HB3 CYS A 554 0.366 8.035 2.225 1.00 0.00 H new ATOM 0 HG CYS A 554 2.315 8.049 -0.603 1.00 0.00 H new ATOM 1278 N CYS A 555 3.313 10.228 0.213 1.00 0.00 N ATOM 1279 CA CYS A 555 4.576 10.434 -0.487 1.00 0.00 C ATOM 1280 C CYS A 555 5.076 11.862 -0.297 1.00 0.00 C ATOM 1281 O CYS A 555 4.305 12.816 -0.380 1.00 0.00 O ATOM 1282 CB CYS A 555 4.412 10.132 -1.978 1.00 0.00 C ATOM 1283 SG CYS A 555 3.838 8.455 -2.333 1.00 0.00 S ATOM 0 H CYS A 555 2.488 10.518 -0.312 1.00 0.00 H new ATOM 0 HA CYS A 555 5.313 9.751 -0.064 1.00 0.00 H new ATOM 0 HB2 CYS A 555 3.707 10.844 -2.406 1.00 0.00 H new ATOM 0 HB3 CYS A 555 5.368 10.291 -2.477 1.00 0.00 H new ATOM 0 HG CYS A 555 4.140 7.673 -1.339 1.00 0.00 H new ATOM 1289 N ASN A 556 6.373 11.999 -0.039 1.00 0.00 N ATOM 1290 CA ASN A 556 6.977 13.311 0.165 1.00 0.00 C ATOM 1291 C ASN A 556 8.493 13.242 0.012 1.00 0.00 C ATOM 1292 O ASN A 556 9.209 12.751 0.885 1.00 0.00 O ATOM 1293 CB ASN A 556 6.617 13.850 1.552 1.00 0.00 C ATOM 1294 CG ASN A 556 6.740 15.359 1.635 1.00 0.00 C ATOM 1295 OD1 ASN A 556 7.269 16.001 0.727 1.00 0.00 O ATOM 1296 ND2 ASN A 556 6.249 15.933 2.727 1.00 0.00 N ATOM 0 H ASN A 556 7.025 11.218 0.034 1.00 0.00 H new ATOM 0 HA ASN A 556 6.584 13.987 -0.594 1.00 0.00 H new ATOM 0 HB2 ASN A 556 5.597 13.557 1.799 1.00 0.00 H new ATOM 0 HB3 ASN A 556 7.269 13.393 2.297 1.00 0.00 H new ATOM 0 HD21 ASN A 556 6.302 16.946 2.839 1.00 0.00 H new ATOM 0 HD22 ASN A 556 5.819 15.361 3.454 1.00 0.00 H new ATOM 1303 N PRO A 557 8.996 13.746 -1.125 1.00 0.00 N ATOM 1304 CA PRO A 557 8.154 14.333 -2.172 1.00 0.00 C ATOM 1305 C PRO A 557 7.312 13.286 -2.893 1.00 0.00 C ATOM 1306 O PRO A 557 7.430 12.089 -2.628 1.00 0.00 O ATOM 1307 CB PRO A 557 9.167 14.959 -3.133 1.00 0.00 C ATOM 1308 CG PRO A 557 10.418 14.177 -2.927 1.00 0.00 C ATOM 1309 CD PRO A 557 10.426 13.782 -1.476 1.00 0.00 C ATOM 0 HA PRO A 557 7.436 15.045 -1.766 1.00 0.00 H new ATOM 0 HB2 PRO A 557 8.825 14.894 -4.166 1.00 0.00 H new ATOM 0 HB3 PRO A 557 9.320 16.016 -2.914 1.00 0.00 H new ATOM 0 HG2 PRO A 557 10.439 13.298 -3.571 1.00 0.00 H new ATOM 0 HG3 PRO A 557 11.296 14.774 -3.174 1.00 0.00 H new ATOM 0 HD2 PRO A 557 10.901 12.813 -1.326 1.00 0.00 H new ATOM 0 HD3 PRO A 557 10.972 14.502 -0.866 1.00 0.00 H new ATOM 1317 N VAL A 558 6.463 13.743 -3.807 1.00 0.00 N ATOM 1318 CA VAL A 558 5.603 12.845 -4.569 1.00 0.00 C ATOM 1319 C VAL A 558 6.152 12.616 -5.972 1.00 0.00 C ATOM 1320 O VAL A 558 6.379 13.554 -6.738 1.00 0.00 O ATOM 1321 CB VAL A 558 4.169 13.398 -4.675 1.00 0.00 C ATOM 1322 CG1 VAL A 558 3.304 12.479 -5.524 1.00 0.00 C ATOM 1323 CG2 VAL A 558 3.565 13.582 -3.290 1.00 0.00 C ATOM 0 H VAL A 558 6.352 14.730 -4.038 1.00 0.00 H new ATOM 0 HA VAL A 558 5.581 11.897 -4.032 1.00 0.00 H new ATOM 0 HB VAL A 558 4.209 14.373 -5.162 1.00 0.00 H new ATOM 0 HG11 VAL A 558 2.295 12.886 -5.588 1.00 0.00 H new ATOM 0 HG12 VAL A 558 3.728 12.402 -6.525 1.00 0.00 H new ATOM 0 HG13 VAL A 558 3.268 11.489 -5.068 1.00 0.00 H new ATOM 0 HG21 VAL A 558 2.552 13.973 -3.384 1.00 0.00 H new ATOM 0 HG22 VAL A 558 3.537 12.622 -2.775 1.00 0.00 H new ATOM 0 HG23 VAL A 558 4.173 14.283 -2.718 1.00 0.00 H new ATOM 1333 N PRO A 559 6.371 11.340 -6.321 1.00 0.00 N ATOM 1334 CA PRO A 559 6.896 10.957 -7.635 1.00 0.00 C ATOM 1335 C PRO A 559 5.886 11.192 -8.754 1.00 0.00 C ATOM 1336 O PRO A 559 4.709 11.460 -8.513 1.00 0.00 O ATOM 1337 CB PRO A 559 7.185 9.462 -7.480 1.00 0.00 C ATOM 1338 CG PRO A 559 6.263 9.008 -6.402 1.00 0.00 C ATOM 1339 CD PRO A 559 6.123 10.172 -5.460 1.00 0.00 C ATOM 0 HA PRO A 559 7.770 11.547 -7.913 1.00 0.00 H new ATOM 0 HB2 PRO A 559 7.001 8.925 -8.410 1.00 0.00 H new ATOM 0 HB3 PRO A 559 8.226 9.286 -7.211 1.00 0.00 H new ATOM 0 HG2 PRO A 559 5.295 8.719 -6.812 1.00 0.00 H new ATOM 0 HG3 PRO A 559 6.664 8.135 -5.887 1.00 0.00 H new ATOM 0 HD2 PRO A 559 5.131 10.208 -5.010 1.00 0.00 H new ATOM 0 HD3 PRO A 559 6.842 10.116 -4.642 1.00 0.00 H new ATOM 1347 N PRO A 560 6.355 11.089 -10.006 1.00 0.00 N ATOM 1348 CA PRO A 560 5.508 11.285 -11.187 1.00 0.00 C ATOM 1349 C PRO A 560 4.496 10.159 -11.368 1.00 0.00 C ATOM 1350 O PRO A 560 3.351 10.396 -11.756 1.00 0.00 O ATOM 1351 CB PRO A 560 6.510 11.295 -12.344 1.00 0.00 C ATOM 1352 CG PRO A 560 7.673 10.508 -11.845 1.00 0.00 C ATOM 1353 CD PRO A 560 7.747 10.771 -10.367 1.00 0.00 C ATOM 0 HA PRO A 560 4.911 12.194 -11.114 1.00 0.00 H new ATOM 0 HB2 PRO A 560 6.084 10.846 -13.241 1.00 0.00 H new ATOM 0 HB3 PRO A 560 6.803 12.312 -12.605 1.00 0.00 H new ATOM 0 HG2 PRO A 560 7.540 9.445 -12.046 1.00 0.00 H new ATOM 0 HG3 PRO A 560 8.593 10.814 -12.342 1.00 0.00 H new ATOM 0 HD2 PRO A 560 8.115 9.901 -9.822 1.00 0.00 H new ATOM 0 HD3 PRO A 560 8.420 11.598 -10.139 1.00 0.00 H new ATOM 1361 N LEU A 561 4.924 8.934 -11.084 1.00 0.00 N ATOM 1362 CA LEU A 561 4.054 7.770 -11.215 1.00 0.00 C ATOM 1363 C LEU A 561 2.840 7.891 -10.298 1.00 0.00 C ATOM 1364 O LEU A 561 1.710 8.040 -10.763 1.00 0.00 O ATOM 1365 CB LEU A 561 4.827 6.491 -10.890 1.00 0.00 C ATOM 1366 CG LEU A 561 6.049 6.206 -11.763 1.00 0.00 C ATOM 1367 CD1 LEU A 561 6.861 5.057 -11.186 1.00 0.00 C ATOM 1368 CD2 LEU A 561 5.624 5.896 -13.191 1.00 0.00 C ATOM 0 H LEU A 561 5.868 8.721 -10.762 1.00 0.00 H new ATOM 0 HA LEU A 561 3.704 7.723 -12.246 1.00 0.00 H new ATOM 0 HB2 LEU A 561 5.151 6.540 -9.851 1.00 0.00 H new ATOM 0 HB3 LEU A 561 4.143 5.646 -10.970 1.00 0.00 H new ATOM 0 HG LEU A 561 6.677 7.097 -11.777 1.00 0.00 H new ATOM 0 HD11 LEU A 561 7.727 4.869 -11.821 1.00 0.00 H new ATOM 0 HD12 LEU A 561 7.197 5.317 -10.182 1.00 0.00 H new ATOM 0 HD13 LEU A 561 6.242 4.161 -11.141 1.00 0.00 H new ATOM 0 HD21 LEU A 561 6.507 5.696 -13.798 1.00 0.00 H new ATOM 0 HD22 LEU A 561 4.974 5.021 -13.195 1.00 0.00 H new ATOM 0 HD23 LEU A 561 5.086 6.749 -13.604 1.00 0.00 H new ATOM 1380 N VAL A 562 3.083 7.829 -8.993 1.00 0.00 N ATOM 1381 CA VAL A 562 2.011 7.935 -8.010 1.00 0.00 C ATOM 1382 C VAL A 562 0.986 8.984 -8.426 1.00 0.00 C ATOM 1383 O VAL A 562 -0.215 8.808 -8.224 1.00 0.00 O ATOM 1384 CB VAL A 562 2.560 8.294 -6.617 1.00 0.00 C ATOM 1385 CG1 VAL A 562 1.421 8.495 -5.629 1.00 0.00 C ATOM 1386 CG2 VAL A 562 3.517 7.218 -6.128 1.00 0.00 C ATOM 0 H VAL A 562 4.013 7.706 -8.592 1.00 0.00 H new ATOM 0 HA VAL A 562 1.529 6.959 -7.961 1.00 0.00 H new ATOM 0 HB VAL A 562 3.112 9.231 -6.694 1.00 0.00 H new ATOM 0 HG11 VAL A 562 1.829 8.748 -4.650 1.00 0.00 H new ATOM 0 HG12 VAL A 562 0.778 9.305 -5.975 1.00 0.00 H new ATOM 0 HG13 VAL A 562 0.839 7.577 -5.553 1.00 0.00 H new ATOM 0 HG21 VAL A 562 3.895 7.488 -5.142 1.00 0.00 H new ATOM 0 HG22 VAL A 562 2.992 6.265 -6.066 1.00 0.00 H new ATOM 0 HG23 VAL A 562 4.351 7.129 -6.825 1.00 0.00 H new ATOM 1396 N ARG A 563 1.469 10.077 -9.009 1.00 0.00 N ATOM 1397 CA ARG A 563 0.594 11.155 -9.454 1.00 0.00 C ATOM 1398 C ARG A 563 -0.047 10.817 -10.796 1.00 0.00 C ATOM 1399 O ARG A 563 -1.195 11.178 -11.054 1.00 0.00 O ATOM 1400 CB ARG A 563 1.380 12.463 -9.567 1.00 0.00 C ATOM 1401 CG ARG A 563 0.532 13.647 -10.005 1.00 0.00 C ATOM 1402 CD ARG A 563 -0.194 14.278 -8.827 1.00 0.00 C ATOM 1403 NE ARG A 563 -1.110 15.333 -9.252 1.00 0.00 N ATOM 1404 CZ ARG A 563 -0.728 16.579 -9.509 1.00 0.00 C ATOM 1405 NH1 ARG A 563 0.547 16.924 -9.386 1.00 0.00 N ATOM 1406 NH2 ARG A 563 -1.621 17.483 -9.890 1.00 0.00 N ATOM 0 H ARG A 563 2.461 10.239 -9.184 1.00 0.00 H new ATOM 0 HA ARG A 563 -0.197 11.276 -8.714 1.00 0.00 H new ATOM 0 HB2 ARG A 563 1.834 12.689 -8.602 1.00 0.00 H new ATOM 0 HB3 ARG A 563 2.195 12.327 -10.278 1.00 0.00 H new ATOM 0 HG2 ARG A 563 1.166 14.393 -10.485 1.00 0.00 H new ATOM 0 HG3 ARG A 563 -0.195 13.320 -10.749 1.00 0.00 H new ATOM 0 HD2 ARG A 563 -0.750 13.510 -8.290 1.00 0.00 H new ATOM 0 HD3 ARG A 563 0.535 14.690 -8.130 1.00 0.00 H new ATOM 0 HE ARG A 563 -2.097 15.100 -9.357 1.00 0.00 H new ATOM 0 HH11 ARG A 563 1.237 16.232 -9.093 1.00 0.00 H new ATOM 0 HH12 ARG A 563 0.838 17.881 -9.584 1.00 0.00 H new ATOM 0 HH21 ARG A 563 -2.602 17.222 -9.986 1.00 0.00 H new ATOM 0 HH22 ARG A 563 -1.326 18.439 -10.087 1.00 0.00 H new ATOM 1420 N GLN A 564 0.702 10.123 -11.646 1.00 0.00 N ATOM 1421 CA GLN A 564 0.207 9.738 -12.962 1.00 0.00 C ATOM 1422 C GLN A 564 -0.886 8.680 -12.844 1.00 0.00 C ATOM 1423 O GLN A 564 -1.989 8.854 -13.363 1.00 0.00 O ATOM 1424 CB GLN A 564 1.352 9.209 -13.828 1.00 0.00 C ATOM 1425 CG GLN A 564 1.073 9.287 -15.320 1.00 0.00 C ATOM 1426 CD GLN A 564 2.300 8.990 -16.159 1.00 0.00 C ATOM 1427 OE1 GLN A 564 2.283 8.102 -17.012 1.00 0.00 O ATOM 1428 NE2 GLN A 564 3.375 9.733 -15.921 1.00 0.00 N ATOM 0 H GLN A 564 1.654 9.816 -11.447 1.00 0.00 H new ATOM 0 HA GLN A 564 -0.218 10.624 -13.435 1.00 0.00 H new ATOM 0 HB2 GLN A 564 2.256 9.776 -13.606 1.00 0.00 H new ATOM 0 HB3 GLN A 564 1.551 8.172 -13.558 1.00 0.00 H new ATOM 0 HG2 GLN A 564 0.283 8.581 -15.576 1.00 0.00 H new ATOM 0 HG3 GLN A 564 0.702 10.282 -15.565 1.00 0.00 H new ATOM 0 HE21 GLN A 564 3.345 10.458 -15.205 1.00 0.00 H new ATOM 0 HE22 GLN A 564 4.230 9.578 -16.455 1.00 0.00 H new ATOM 1437 N GLN A 565 -0.572 7.585 -12.159 1.00 0.00 N ATOM 1438 CA GLN A 565 -1.528 6.500 -11.975 1.00 0.00 C ATOM 1439 C GLN A 565 -2.298 6.669 -10.669 1.00 0.00 C ATOM 1440 O GLN A 565 -2.808 5.698 -10.108 1.00 0.00 O ATOM 1441 CB GLN A 565 -0.808 5.151 -11.985 1.00 0.00 C ATOM 1442 CG GLN A 565 0.049 4.928 -13.220 1.00 0.00 C ATOM 1443 CD GLN A 565 -0.739 4.359 -14.383 1.00 0.00 C ATOM 1444 OE1 GLN A 565 -1.418 5.090 -15.105 1.00 0.00 O ATOM 1445 NE2 GLN A 565 -0.655 3.047 -14.571 1.00 0.00 N ATOM 0 H GLN A 565 0.336 7.426 -11.723 1.00 0.00 H new ATOM 0 HA GLN A 565 -2.238 6.531 -12.801 1.00 0.00 H new ATOM 0 HB2 GLN A 565 -0.178 5.078 -11.098 1.00 0.00 H new ATOM 0 HB3 GLN A 565 -1.548 4.353 -11.917 1.00 0.00 H new ATOM 0 HG2 GLN A 565 0.500 5.874 -13.520 1.00 0.00 H new ATOM 0 HG3 GLN A 565 0.866 4.250 -12.973 1.00 0.00 H new ATOM 0 HE21 GLN A 565 -0.081 2.478 -13.949 1.00 0.00 H new ATOM 0 HE22 GLN A 565 -1.165 2.608 -15.338 1.00 0.00 H new ATOM 1454 N ILE A 566 -2.377 7.906 -10.190 1.00 0.00 N ATOM 1455 CA ILE A 566 -3.086 8.201 -8.951 1.00 0.00 C ATOM 1456 C ILE A 566 -4.523 7.693 -9.005 1.00 0.00 C ATOM 1457 O ILE A 566 -5.111 7.356 -7.978 1.00 0.00 O ATOM 1458 CB ILE A 566 -3.099 9.712 -8.656 1.00 0.00 C ATOM 1459 CG1 ILE A 566 -3.639 9.975 -7.249 1.00 0.00 C ATOM 1460 CG2 ILE A 566 -3.932 10.448 -9.695 1.00 0.00 C ATOM 1461 CD1 ILE A 566 -2.933 9.180 -6.173 1.00 0.00 C ATOM 0 H ILE A 566 -1.959 8.720 -10.641 1.00 0.00 H new ATOM 0 HA ILE A 566 -2.551 7.687 -8.152 1.00 0.00 H new ATOM 0 HB ILE A 566 -2.076 10.086 -8.708 1.00 0.00 H new ATOM 0 HG12 ILE A 566 -3.545 11.038 -7.025 1.00 0.00 H new ATOM 0 HG13 ILE A 566 -4.703 9.737 -7.226 1.00 0.00 H new ATOM 0 HG21 ILE A 566 -3.931 11.515 -9.473 1.00 0.00 H new ATOM 0 HG22 ILE A 566 -3.507 10.283 -10.685 1.00 0.00 H new ATOM 0 HG23 ILE A 566 -4.955 10.073 -9.673 1.00 0.00 H new ATOM 0 HD11 ILE A 566 -3.367 9.416 -5.202 1.00 0.00 H new ATOM 0 HD12 ILE A 566 -3.049 8.115 -6.373 1.00 0.00 H new ATOM 0 HD13 ILE A 566 -1.873 9.435 -6.168 1.00 0.00 H new ATOM 1473 N ASN A 567 -5.080 7.638 -10.210 1.00 0.00 N ATOM 1474 CA ASN A 567 -6.448 7.169 -10.398 1.00 0.00 C ATOM 1475 C ASN A 567 -6.566 5.685 -10.064 1.00 0.00 C ATOM 1476 O ASN A 567 -7.475 5.271 -9.346 1.00 0.00 O ATOM 1477 CB ASN A 567 -6.901 7.416 -11.839 1.00 0.00 C ATOM 1478 CG ASN A 567 -6.460 8.771 -12.359 1.00 0.00 C ATOM 1479 OD1 ASN A 567 -6.550 9.777 -11.655 1.00 0.00 O ATOM 1480 ND2 ASN A 567 -5.982 8.802 -13.597 1.00 0.00 N ATOM 0 H ASN A 567 -4.606 7.912 -11.070 1.00 0.00 H new ATOM 0 HA ASN A 567 -7.093 7.728 -9.720 1.00 0.00 H new ATOM 0 HB2 ASN A 567 -6.498 6.634 -12.483 1.00 0.00 H new ATOM 0 HB3 ASN A 567 -7.987 7.345 -11.893 1.00 0.00 H new ATOM 0 HD21 ASN A 567 -5.671 9.685 -14.002 1.00 0.00 H new ATOM 0 HD22 ASN A 567 -5.926 7.943 -14.144 1.00 0.00 H new ATOM 1487 N GLU A 568 -5.639 4.890 -10.590 1.00 0.00 N ATOM 1488 CA GLU A 568 -5.639 3.452 -10.348 1.00 0.00 C ATOM 1489 C GLU A 568 -5.454 3.151 -8.863 1.00 0.00 C ATOM 1490 O GLU A 568 -6.201 2.365 -8.281 1.00 0.00 O ATOM 1491 CB GLU A 568 -4.532 2.776 -11.159 1.00 0.00 C ATOM 1492 CG GLU A 568 -4.867 1.355 -11.580 1.00 0.00 C ATOM 1493 CD GLU A 568 -6.227 1.249 -12.244 1.00 0.00 C ATOM 1494 OE1 GLU A 568 -6.515 2.071 -13.139 1.00 0.00 O ATOM 1495 OE2 GLU A 568 -7.002 0.344 -11.868 1.00 0.00 O ATOM 0 H GLU A 568 -4.879 5.217 -11.186 1.00 0.00 H new ATOM 0 HA GLU A 568 -6.604 3.056 -10.664 1.00 0.00 H new ATOM 0 HB2 GLU A 568 -4.330 3.372 -12.049 1.00 0.00 H new ATOM 0 HB3 GLU A 568 -3.616 2.765 -10.568 1.00 0.00 H new ATOM 0 HG2 GLU A 568 -4.102 0.994 -12.267 1.00 0.00 H new ATOM 0 HG3 GLU A 568 -4.842 0.705 -10.705 1.00 0.00 H new ATOM 1502 N MET A 569 -4.452 3.781 -8.258 1.00 0.00 N ATOM 1503 CA MET A 569 -4.169 3.581 -6.842 1.00 0.00 C ATOM 1504 C MET A 569 -5.419 3.814 -5.999 1.00 0.00 C ATOM 1505 O MET A 569 -5.797 2.970 -5.186 1.00 0.00 O ATOM 1506 CB MET A 569 -3.050 4.521 -6.386 1.00 0.00 C ATOM 1507 CG MET A 569 -1.783 4.404 -7.217 1.00 0.00 C ATOM 1508 SD MET A 569 -0.379 5.249 -6.464 1.00 0.00 S ATOM 1509 CE MET A 569 0.331 3.924 -5.489 1.00 0.00 C ATOM 0 H MET A 569 -3.823 4.434 -8.726 1.00 0.00 H new ATOM 0 HA MET A 569 -3.846 2.549 -6.704 1.00 0.00 H new ATOM 0 HB2 MET A 569 -3.410 5.549 -6.429 1.00 0.00 H new ATOM 0 HB3 MET A 569 -2.812 4.310 -5.343 1.00 0.00 H new ATOM 0 HG2 MET A 569 -1.538 3.351 -7.353 1.00 0.00 H new ATOM 0 HG3 MET A 569 -1.963 4.820 -8.208 1.00 0.00 H new ATOM 0 HE1 MET A 569 1.383 4.135 -5.299 1.00 0.00 H new ATOM 0 HE2 MET A 569 -0.200 3.845 -4.540 1.00 0.00 H new ATOM 0 HE3 MET A 569 0.242 2.984 -6.033 1.00 0.00 H new ATOM 1519 N HIS A 570 -6.056 4.963 -6.198 1.00 0.00 N ATOM 1520 CA HIS A 570 -7.264 5.306 -5.456 1.00 0.00 C ATOM 1521 C HIS A 570 -8.304 4.196 -5.569 1.00 0.00 C ATOM 1522 O HIS A 570 -8.894 3.780 -4.571 1.00 0.00 O ATOM 1523 CB HIS A 570 -7.848 6.622 -5.971 1.00 0.00 C ATOM 1524 CG HIS A 570 -9.231 6.901 -5.468 1.00 0.00 C ATOM 1525 ND1 HIS A 570 -10.134 7.691 -6.148 1.00 0.00 N ATOM 1526 CD2 HIS A 570 -9.864 6.489 -4.345 1.00 0.00 C ATOM 1527 CE1 HIS A 570 -11.262 7.754 -5.464 1.00 0.00 C ATOM 1528 NE2 HIS A 570 -11.125 7.033 -4.366 1.00 0.00 N ATOM 0 H HIS A 570 -5.756 5.672 -6.867 1.00 0.00 H new ATOM 0 HA HIS A 570 -6.995 5.423 -4.406 1.00 0.00 H new ATOM 0 HB2 HIS A 570 -7.191 7.441 -5.677 1.00 0.00 H new ATOM 0 HB3 HIS A 570 -7.864 6.601 -7.061 1.00 0.00 H new ATOM 0 HD1 HIS A 570 -9.958 8.154 -7.040 1.00 0.00 H new ATOM 0 HD2 HIS A 570 -9.454 5.851 -3.576 1.00 0.00 H new ATOM 0 HE1 HIS A 570 -12.146 8.302 -5.753 1.00 0.00 H new ATOM 1536 N LEU A 571 -8.525 3.720 -6.789 1.00 0.00 N ATOM 1537 CA LEU A 571 -9.495 2.658 -7.033 1.00 0.00 C ATOM 1538 C LEU A 571 -9.222 1.456 -6.134 1.00 0.00 C ATOM 1539 O LEU A 571 -10.141 0.892 -5.538 1.00 0.00 O ATOM 1540 CB LEU A 571 -9.455 2.231 -8.501 1.00 0.00 C ATOM 1541 CG LEU A 571 -10.008 3.241 -9.508 1.00 0.00 C ATOM 1542 CD1 LEU A 571 -9.676 2.813 -10.929 1.00 0.00 C ATOM 1543 CD2 LEU A 571 -11.512 3.399 -9.334 1.00 0.00 C ATOM 0 H LEU A 571 -8.045 4.053 -7.625 1.00 0.00 H new ATOM 0 HA LEU A 571 -10.487 3.045 -6.801 1.00 0.00 H new ATOM 0 HB2 LEU A 571 -8.421 2.012 -8.767 1.00 0.00 H new ATOM 0 HB3 LEU A 571 -10.015 1.301 -8.604 1.00 0.00 H new ATOM 0 HG LEU A 571 -9.538 4.206 -9.322 1.00 0.00 H new ATOM 0 HD11 LEU A 571 -10.077 3.543 -11.632 1.00 0.00 H new ATOM 0 HD12 LEU A 571 -8.594 2.752 -11.047 1.00 0.00 H new ATOM 0 HD13 LEU A 571 -10.118 1.837 -11.128 1.00 0.00 H new ATOM 0 HD21 LEU A 571 -11.888 4.121 -10.059 1.00 0.00 H new ATOM 0 HD22 LEU A 571 -12.000 2.437 -9.493 1.00 0.00 H new ATOM 0 HD23 LEU A 571 -11.726 3.752 -8.325 1.00 0.00 H new ATOM 1555 N LEU A 572 -7.955 1.068 -6.041 1.00 0.00 N ATOM 1556 CA LEU A 572 -7.561 -0.066 -5.214 1.00 0.00 C ATOM 1557 C LEU A 572 -7.991 0.141 -3.765 1.00 0.00 C ATOM 1558 O LEU A 572 -8.698 -0.690 -3.193 1.00 0.00 O ATOM 1559 CB LEU A 572 -6.046 -0.272 -5.283 1.00 0.00 C ATOM 1560 CG LEU A 572 -5.449 -0.394 -6.686 1.00 0.00 C ATOM 1561 CD1 LEU A 572 -3.935 -0.514 -6.613 1.00 0.00 C ATOM 1562 CD2 LEU A 572 -6.046 -1.587 -7.417 1.00 0.00 C ATOM 0 H LEU A 572 -7.183 1.523 -6.529 1.00 0.00 H new ATOM 0 HA LEU A 572 -8.061 -0.955 -5.599 1.00 0.00 H new ATOM 0 HB2 LEU A 572 -5.562 0.562 -4.775 1.00 0.00 H new ATOM 0 HB3 LEU A 572 -5.796 -1.174 -4.724 1.00 0.00 H new ATOM 0 HG LEU A 572 -5.695 0.509 -7.245 1.00 0.00 H new ATOM 0 HD11 LEU A 572 -3.528 -0.600 -7.620 1.00 0.00 H new ATOM 0 HD12 LEU A 572 -3.523 0.371 -6.129 1.00 0.00 H new ATOM 0 HD13 LEU A 572 -3.668 -1.400 -6.037 1.00 0.00 H new ATOM 0 HD21 LEU A 572 -5.610 -1.659 -8.413 1.00 0.00 H new ATOM 0 HD22 LEU A 572 -5.831 -2.499 -6.861 1.00 0.00 H new ATOM 0 HD23 LEU A 572 -7.125 -1.459 -7.502 1.00 0.00 H new ATOM 1574 N ILE A 573 -7.562 1.254 -3.179 1.00 0.00 N ATOM 1575 CA ILE A 573 -7.907 1.571 -1.799 1.00 0.00 C ATOM 1576 C ILE A 573 -9.405 1.420 -1.557 1.00 0.00 C ATOM 1577 O ILE A 573 -9.828 0.952 -0.501 1.00 0.00 O ATOM 1578 CB ILE A 573 -7.480 3.003 -1.427 1.00 0.00 C ATOM 1579 CG1 ILE A 573 -5.983 3.194 -1.679 1.00 0.00 C ATOM 1580 CG2 ILE A 573 -7.819 3.296 0.027 1.00 0.00 C ATOM 1581 CD1 ILE A 573 -5.118 2.153 -1.003 1.00 0.00 C ATOM 0 H ILE A 573 -6.975 1.951 -3.638 1.00 0.00 H new ATOM 0 HA ILE A 573 -7.367 0.864 -1.169 1.00 0.00 H new ATOM 0 HB ILE A 573 -8.028 3.705 -2.056 1.00 0.00 H new ATOM 0 HG12 ILE A 573 -5.797 3.167 -2.753 1.00 0.00 H new ATOM 0 HG13 ILE A 573 -5.687 4.183 -1.329 1.00 0.00 H new ATOM 0 HG21 ILE A 573 -7.511 4.312 0.275 1.00 0.00 H new ATOM 0 HG22 ILE A 573 -8.894 3.196 0.177 1.00 0.00 H new ATOM 0 HG23 ILE A 573 -7.295 2.591 0.672 1.00 0.00 H new ATOM 0 HD11 ILE A 573 -4.069 2.351 -1.225 1.00 0.00 H new ATOM 0 HD12 ILE A 573 -5.274 2.194 0.075 1.00 0.00 H new ATOM 0 HD13 ILE A 573 -5.386 1.163 -1.371 1.00 0.00 H new ATOM 1593 N GLN A 574 -10.201 1.819 -2.544 1.00 0.00 N ATOM 1594 CA GLN A 574 -11.652 1.727 -2.438 1.00 0.00 C ATOM 1595 C GLN A 574 -12.113 0.275 -2.525 1.00 0.00 C ATOM 1596 O GLN A 574 -13.118 -0.103 -1.923 1.00 0.00 O ATOM 1597 CB GLN A 574 -12.318 2.552 -3.541 1.00 0.00 C ATOM 1598 CG GLN A 574 -11.917 4.019 -3.529 1.00 0.00 C ATOM 1599 CD GLN A 574 -12.770 4.849 -2.589 1.00 0.00 C ATOM 1600 OE1 GLN A 574 -12.480 4.764 -1.296 1.00 0.00 O flip ATOM 1601 NE2 GLN A 574 -13.679 5.558 -3.021 1.00 0.00 N flip ATOM 0 H GLN A 574 -9.866 2.209 -3.425 1.00 0.00 H new ATOM 0 HA GLN A 574 -11.946 2.126 -1.467 1.00 0.00 H new ATOM 0 HB2 GLN A 574 -12.063 2.122 -4.509 1.00 0.00 H new ATOM 0 HB3 GLN A 574 -13.400 2.479 -3.435 1.00 0.00 H new ATOM 0 HG2 GLN A 574 -10.871 4.104 -3.235 1.00 0.00 H new ATOM 0 HG3 GLN A 574 -11.998 4.422 -4.538 1.00 0.00 H new ATOM 0 HE21 GLN A 574 -13.866 5.593 -4.023 1.00 0.00 H new ATOM 0 HE22 GLN A 574 -14.245 6.111 -2.377 1.00 0.00 H new ATOM 1610 N GLN A 575 -11.373 -0.532 -3.277 1.00 0.00 N ATOM 1611 CA GLN A 575 -11.707 -1.942 -3.443 1.00 0.00 C ATOM 1612 C GLN A 575 -11.403 -2.726 -2.171 1.00 0.00 C ATOM 1613 O GLN A 575 -11.979 -3.787 -1.932 1.00 0.00 O ATOM 1614 CB GLN A 575 -10.932 -2.536 -4.620 1.00 0.00 C ATOM 1615 CG GLN A 575 -11.391 -2.019 -5.974 1.00 0.00 C ATOM 1616 CD GLN A 575 -11.173 -3.025 -7.087 1.00 0.00 C ATOM 1617 OE1 GLN A 575 -11.740 -4.118 -7.072 1.00 0.00 O ATOM 1618 NE2 GLN A 575 -10.348 -2.660 -8.062 1.00 0.00 N ATOM 0 H GLN A 575 -10.538 -0.234 -3.781 1.00 0.00 H new ATOM 0 HA GLN A 575 -12.775 -2.015 -3.647 1.00 0.00 H new ATOM 0 HB2 GLN A 575 -9.872 -2.313 -4.496 1.00 0.00 H new ATOM 0 HB3 GLN A 575 -11.034 -3.621 -4.601 1.00 0.00 H new ATOM 0 HG2 GLN A 575 -12.450 -1.764 -5.922 1.00 0.00 H new ATOM 0 HG3 GLN A 575 -10.853 -1.100 -6.209 1.00 0.00 H new ATOM 0 HE21 GLN A 575 -9.899 -1.744 -8.034 1.00 0.00 H new ATOM 0 HE22 GLN A 575 -10.163 -3.295 -8.838 1.00 0.00 H new ATOM 1627 N ALA A 576 -10.496 -2.196 -1.357 1.00 0.00 N ATOM 1628 CA ALA A 576 -10.117 -2.846 -0.108 1.00 0.00 C ATOM 1629 C ALA A 576 -11.041 -2.428 1.030 1.00 0.00 C ATOM 1630 O ALA A 576 -11.212 -3.161 2.005 1.00 0.00 O ATOM 1631 CB ALA A 576 -8.671 -2.523 0.237 1.00 0.00 C ATOM 0 H ALA A 576 -10.010 -1.318 -1.540 1.00 0.00 H new ATOM 0 HA ALA A 576 -10.215 -3.923 -0.243 1.00 0.00 H new ATOM 0 HB1 ALA A 576 -8.401 -3.015 1.172 1.00 0.00 H new ATOM 0 HB2 ALA A 576 -8.019 -2.878 -0.561 1.00 0.00 H new ATOM 0 HB3 ALA A 576 -8.555 -1.445 0.348 1.00 0.00 H new ATOM 1637 N ARG A 577 -11.635 -1.246 0.901 1.00 0.00 N ATOM 1638 CA ARG A 577 -12.541 -0.730 1.920 1.00 0.00 C ATOM 1639 C ARG A 577 -13.984 -1.115 1.610 1.00 0.00 C ATOM 1640 O ARG A 577 -14.748 -1.471 2.508 1.00 0.00 O ATOM 1641 CB ARG A 577 -12.418 0.791 2.020 1.00 0.00 C ATOM 1642 CG ARG A 577 -11.411 1.254 3.060 1.00 0.00 C ATOM 1643 CD ARG A 577 -10.890 2.649 2.749 1.00 0.00 C ATOM 1644 NE ARG A 577 -10.568 3.395 3.962 1.00 0.00 N ATOM 1645 CZ ARG A 577 -11.468 4.062 4.676 1.00 0.00 C ATOM 1646 NH1 ARG A 577 -12.740 4.074 4.301 1.00 0.00 N ATOM 1647 NH2 ARG A 577 -11.097 4.717 5.769 1.00 0.00 N ATOM 0 H ARG A 577 -11.505 -0.628 0.100 1.00 0.00 H new ATOM 0 HA ARG A 577 -12.262 -1.174 2.876 1.00 0.00 H new ATOM 0 HB2 ARG A 577 -12.131 1.188 1.047 1.00 0.00 H new ATOM 0 HB3 ARG A 577 -13.395 1.211 2.260 1.00 0.00 H new ATOM 0 HG2 ARG A 577 -11.876 1.250 4.046 1.00 0.00 H new ATOM 0 HG3 ARG A 577 -10.577 0.553 3.098 1.00 0.00 H new ATOM 0 HD2 ARG A 577 -10.001 2.573 2.123 1.00 0.00 H new ATOM 0 HD3 ARG A 577 -11.638 3.196 2.175 1.00 0.00 H new ATOM 0 HE ARG A 577 -9.598 3.405 4.279 1.00 0.00 H new ATOM 0 HH11 ARG A 577 -13.029 3.570 3.463 1.00 0.00 H new ATOM 0 HH12 ARG A 577 -13.429 4.587 4.851 1.00 0.00 H new ATOM 0 HH21 ARG A 577 -10.120 4.709 6.062 1.00 0.00 H new ATOM 0 HH22 ARG A 577 -11.789 5.229 6.316 1.00 0.00 H new ATOM 1661 N GLU A 578 -14.351 -1.041 0.335 1.00 0.00 N ATOM 1662 CA GLU A 578 -15.703 -1.380 -0.092 1.00 0.00 C ATOM 1663 C GLU A 578 -16.115 -2.748 0.443 1.00 0.00 C ATOM 1664 O GLU A 578 -17.258 -2.947 0.854 1.00 0.00 O ATOM 1665 CB GLU A 578 -15.797 -1.368 -1.619 1.00 0.00 C ATOM 1666 CG GLU A 578 -15.146 -2.572 -2.279 1.00 0.00 C ATOM 1667 CD GLU A 578 -15.257 -2.540 -3.791 1.00 0.00 C ATOM 1668 OE1 GLU A 578 -15.015 -1.466 -4.380 1.00 0.00 O ATOM 1669 OE2 GLU A 578 -15.585 -3.588 -4.385 1.00 0.00 O ATOM 0 H GLU A 578 -13.731 -0.749 -0.420 1.00 0.00 H new ATOM 0 HA GLU A 578 -16.383 -0.631 0.313 1.00 0.00 H new ATOM 0 HB2 GLU A 578 -16.847 -1.329 -1.910 1.00 0.00 H new ATOM 0 HB3 GLU A 578 -15.328 -0.460 -1.996 1.00 0.00 H new ATOM 0 HG2 GLU A 578 -14.094 -2.612 -1.997 1.00 0.00 H new ATOM 0 HG3 GLU A 578 -15.612 -3.483 -1.904 1.00 0.00 H new ATOM 1676 N MET A 579 -15.176 -3.688 0.434 1.00 0.00 N ATOM 1677 CA MET A 579 -15.441 -5.038 0.919 1.00 0.00 C ATOM 1678 C MET A 579 -15.556 -5.056 2.440 1.00 0.00 C ATOM 1679 O MET A 579 -14.818 -4.374 3.150 1.00 0.00 O ATOM 1680 CB MET A 579 -14.333 -5.992 0.468 1.00 0.00 C ATOM 1681 CG MET A 579 -12.947 -5.577 0.935 1.00 0.00 C ATOM 1682 SD MET A 579 -12.614 -6.061 2.640 1.00 0.00 S ATOM 1683 CE MET A 579 -12.857 -7.833 2.542 1.00 0.00 C ATOM 0 H MET A 579 -14.225 -3.540 0.096 1.00 0.00 H new ATOM 0 HA MET A 579 -16.390 -5.369 0.497 1.00 0.00 H new ATOM 0 HB2 MET A 579 -14.550 -6.992 0.844 1.00 0.00 H new ATOM 0 HB3 MET A 579 -14.338 -6.053 -0.620 1.00 0.00 H new ATOM 0 HG2 MET A 579 -12.198 -6.025 0.282 1.00 0.00 H new ATOM 0 HG3 MET A 579 -12.845 -4.496 0.842 1.00 0.00 H new ATOM 0 HE1 MET A 579 -12.584 -8.291 3.493 1.00 0.00 H new ATOM 0 HE2 MET A 579 -13.904 -8.045 2.325 1.00 0.00 H new ATOM 0 HE3 MET A 579 -12.232 -8.243 1.749 1.00 0.00 H new ATOM 1693 N PRO A 580 -16.504 -5.855 2.953 1.00 0.00 N ATOM 1694 CA PRO A 580 -16.737 -5.981 4.395 1.00 0.00 C ATOM 1695 C PRO A 580 -15.601 -6.709 5.105 1.00 0.00 C ATOM 1696 O PRO A 580 -14.653 -7.171 4.468 1.00 0.00 O ATOM 1697 CB PRO A 580 -18.029 -6.798 4.475 1.00 0.00 C ATOM 1698 CG PRO A 580 -18.066 -7.573 3.202 1.00 0.00 C ATOM 1699 CD PRO A 580 -17.420 -6.697 2.165 1.00 0.00 C ATOM 0 HA PRO A 580 -16.800 -5.009 4.884 1.00 0.00 H new ATOM 0 HB2 PRO A 580 -18.026 -7.459 5.341 1.00 0.00 H new ATOM 0 HB3 PRO A 580 -18.901 -6.151 4.570 1.00 0.00 H new ATOM 0 HG2 PRO A 580 -17.530 -8.517 3.304 1.00 0.00 H new ATOM 0 HG3 PRO A 580 -19.091 -7.817 2.923 1.00 0.00 H new ATOM 0 HD2 PRO A 580 -16.885 -7.285 1.419 1.00 0.00 H new ATOM 0 HD3 PRO A 580 -18.157 -6.098 1.630 1.00 0.00 H new ATOM 1707 N LEU A 581 -15.702 -6.808 6.425 1.00 0.00 N ATOM 1708 CA LEU A 581 -14.683 -7.481 7.223 1.00 0.00 C ATOM 1709 C LEU A 581 -15.171 -8.849 7.689 1.00 0.00 C ATOM 1710 O LEU A 581 -15.953 -8.951 8.636 1.00 0.00 O ATOM 1711 CB LEU A 581 -14.303 -6.623 8.430 1.00 0.00 C ATOM 1712 CG LEU A 581 -13.523 -5.343 8.126 1.00 0.00 C ATOM 1713 CD1 LEU A 581 -13.817 -4.278 9.171 1.00 0.00 C ATOM 1714 CD2 LEU A 581 -12.031 -5.630 8.060 1.00 0.00 C ATOM 0 H LEU A 581 -16.480 -6.431 6.966 1.00 0.00 H new ATOM 0 HA LEU A 581 -13.803 -7.625 6.596 1.00 0.00 H new ATOM 0 HB2 LEU A 581 -15.216 -6.351 8.959 1.00 0.00 H new ATOM 0 HB3 LEU A 581 -13.710 -7.233 9.111 1.00 0.00 H new ATOM 0 HG LEU A 581 -13.843 -4.968 7.154 1.00 0.00 H new ATOM 0 HD11 LEU A 581 -13.253 -3.375 8.938 1.00 0.00 H new ATOM 0 HD12 LEU A 581 -14.883 -4.051 9.169 1.00 0.00 H new ATOM 0 HD13 LEU A 581 -13.526 -4.644 10.155 1.00 0.00 H new ATOM 0 HD21 LEU A 581 -11.492 -4.708 7.843 1.00 0.00 H new ATOM 0 HD22 LEU A 581 -11.695 -6.030 9.017 1.00 0.00 H new ATOM 0 HD23 LEU A 581 -11.835 -6.358 7.273 1.00 0.00 H new ATOM 1726 N LEU A 582 -14.705 -9.897 7.021 1.00 0.00 N ATOM 1727 CA LEU A 582 -15.092 -11.260 7.369 1.00 0.00 C ATOM 1728 C LEU A 582 -15.227 -11.419 8.880 1.00 0.00 C ATOM 1729 O LEU A 582 -16.210 -11.973 9.372 1.00 0.00 O ATOM 1730 CB LEU A 582 -14.065 -12.257 6.829 1.00 0.00 C ATOM 1731 CG LEU A 582 -14.123 -12.533 5.326 1.00 0.00 C ATOM 1732 CD1 LEU A 582 -15.415 -13.248 4.964 1.00 0.00 C ATOM 1733 CD2 LEU A 582 -13.991 -11.236 4.541 1.00 0.00 C ATOM 0 H LEU A 582 -14.058 -9.830 6.235 1.00 0.00 H new ATOM 0 HA LEU A 582 -16.061 -11.464 6.913 1.00 0.00 H new ATOM 0 HB2 LEU A 582 -13.068 -11.889 7.072 1.00 0.00 H new ATOM 0 HB3 LEU A 582 -14.193 -13.202 7.357 1.00 0.00 H new ATOM 0 HG LEU A 582 -13.287 -13.181 5.062 1.00 0.00 H new ATOM 0 HD11 LEU A 582 -15.438 -13.436 3.891 1.00 0.00 H new ATOM 0 HD12 LEU A 582 -15.469 -14.196 5.500 1.00 0.00 H new ATOM 0 HD13 LEU A 582 -16.266 -12.626 5.242 1.00 0.00 H new ATOM 0 HD21 LEU A 582 -14.034 -11.451 3.473 1.00 0.00 H new ATOM 0 HD22 LEU A 582 -14.806 -10.564 4.809 1.00 0.00 H new ATOM 0 HD23 LEU A 582 -13.038 -10.763 4.777 1.00 0.00 H new ATOM 1745 N LYS A 583 -14.232 -10.928 9.612 1.00 0.00 N ATOM 1746 CA LYS A 583 -14.240 -11.012 11.068 1.00 0.00 C ATOM 1747 C LYS A 583 -13.570 -9.789 11.687 1.00 0.00 C ATOM 1748 O LYS A 583 -12.478 -9.395 11.279 1.00 0.00 O ATOM 1749 CB LYS A 583 -13.527 -12.285 11.530 1.00 0.00 C ATOM 1750 CG LYS A 583 -12.072 -12.357 11.101 1.00 0.00 C ATOM 1751 CD LYS A 583 -11.334 -13.475 11.819 1.00 0.00 C ATOM 1752 CE LYS A 583 -10.051 -13.851 11.093 1.00 0.00 C ATOM 1753 NZ LYS A 583 -9.080 -14.528 11.998 1.00 0.00 N ATOM 0 H LYS A 583 -13.410 -10.468 9.221 1.00 0.00 H new ATOM 0 HA LYS A 583 -15.278 -11.043 11.399 1.00 0.00 H new ATOM 0 HB2 LYS A 583 -13.580 -12.347 12.617 1.00 0.00 H new ATOM 0 HB3 LYS A 583 -14.057 -13.152 11.135 1.00 0.00 H new ATOM 0 HG2 LYS A 583 -12.017 -12.516 10.024 1.00 0.00 H new ATOM 0 HG3 LYS A 583 -11.583 -11.405 11.308 1.00 0.00 H new ATOM 0 HD2 LYS A 583 -11.100 -13.163 12.837 1.00 0.00 H new ATOM 0 HD3 LYS A 583 -11.980 -14.349 11.895 1.00 0.00 H new ATOM 0 HE2 LYS A 583 -10.287 -14.508 10.256 1.00 0.00 H new ATOM 0 HE3 LYS A 583 -9.594 -12.954 10.675 1.00 0.00 H new ATOM 0 HZ1 LYS A 583 -8.219 -14.768 11.466 1.00 0.00 H new ATOM 0 HZ2 LYS A 583 -8.836 -13.892 12.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 583 -9.507 -15.397 12.377 1.00 0.00 H new ATOM 1767 N SER A 584 -14.232 -9.194 12.674 1.00 0.00 N ATOM 1768 CA SER A 584 -13.702 -8.014 13.347 1.00 0.00 C ATOM 1769 C SER A 584 -14.591 -7.612 14.520 1.00 0.00 C ATOM 1770 O SER A 584 -15.788 -7.377 14.352 1.00 0.00 O ATOM 1771 CB SER A 584 -13.579 -6.850 12.362 1.00 0.00 C ATOM 1772 OG SER A 584 -14.856 -6.398 11.946 1.00 0.00 O ATOM 0 H SER A 584 -15.136 -9.510 13.025 1.00 0.00 H new ATOM 0 HA SER A 584 -12.712 -8.260 13.732 1.00 0.00 H new ATOM 0 HB2 SER A 584 -13.034 -6.030 12.829 1.00 0.00 H new ATOM 0 HB3 SER A 584 -13.000 -7.164 11.494 1.00 0.00 H new ATOM 0 HG SER A 584 -15.502 -6.532 12.670 1.00 0.00 H new ATOM 1778 N GLU A 585 -13.997 -7.535 15.706 1.00 0.00 N ATOM 1779 CA GLU A 585 -14.736 -7.163 16.907 1.00 0.00 C ATOM 1780 C GLU A 585 -15.273 -5.739 16.795 1.00 0.00 C ATOM 1781 O GLU A 585 -14.553 -4.770 17.039 1.00 0.00 O ATOM 1782 CB GLU A 585 -13.841 -7.286 18.142 1.00 0.00 C ATOM 1783 CG GLU A 585 -13.632 -8.719 18.601 1.00 0.00 C ATOM 1784 CD GLU A 585 -12.682 -9.487 17.702 1.00 0.00 C ATOM 1785 OE1 GLU A 585 -13.153 -10.074 16.705 1.00 0.00 O ATOM 1786 OE2 GLU A 585 -11.468 -9.501 17.995 1.00 0.00 O ATOM 0 H GLU A 585 -13.007 -7.725 15.861 1.00 0.00 H new ATOM 0 HA GLU A 585 -15.580 -7.845 17.009 1.00 0.00 H new ATOM 0 HB2 GLU A 585 -12.872 -6.838 17.924 1.00 0.00 H new ATOM 0 HB3 GLU A 585 -14.281 -6.712 18.958 1.00 0.00 H new ATOM 0 HG2 GLU A 585 -13.242 -8.717 19.619 1.00 0.00 H new ATOM 0 HG3 GLU A 585 -14.594 -9.231 18.629 1.00 0.00 H new ATOM 1793 N VAL A 586 -16.544 -5.619 16.423 1.00 0.00 N ATOM 1794 CA VAL A 586 -17.179 -4.315 16.279 1.00 0.00 C ATOM 1795 C VAL A 586 -16.888 -3.426 17.482 1.00 0.00 C ATOM 1796 O VAL A 586 -16.870 -3.891 18.621 1.00 0.00 O ATOM 1797 CB VAL A 586 -18.704 -4.449 16.111 1.00 0.00 C ATOM 1798 CG1 VAL A 586 -19.317 -5.138 17.321 1.00 0.00 C ATOM 1799 CG2 VAL A 586 -19.337 -3.084 15.887 1.00 0.00 C ATOM 0 H VAL A 586 -17.154 -6.410 16.216 1.00 0.00 H new ATOM 0 HA VAL A 586 -16.761 -3.857 15.383 1.00 0.00 H new ATOM 0 HB VAL A 586 -18.902 -5.065 15.234 1.00 0.00 H new ATOM 0 HG11 VAL A 586 -20.395 -5.223 17.184 1.00 0.00 H new ATOM 0 HG12 VAL A 586 -18.885 -6.133 17.431 1.00 0.00 H new ATOM 0 HG13 VAL A 586 -19.111 -4.552 18.217 1.00 0.00 H new ATOM 0 HG21 VAL A 586 -20.415 -3.197 15.770 1.00 0.00 H new ATOM 0 HG22 VAL A 586 -19.130 -2.442 16.743 1.00 0.00 H new ATOM 0 HG23 VAL A 586 -18.920 -2.633 14.987 1.00 0.00 H new ATOM 1809 N ALA A 587 -16.659 -2.143 17.222 1.00 0.00 N ATOM 1810 CA ALA A 587 -16.371 -1.187 18.284 1.00 0.00 C ATOM 1811 C ALA A 587 -17.428 -0.089 18.336 1.00 0.00 C ATOM 1812 O ALA A 587 -18.243 0.045 17.424 1.00 0.00 O ATOM 1813 CB ALA A 587 -14.988 -0.582 18.088 1.00 0.00 C ATOM 0 H ALA A 587 -16.667 -1.742 16.284 1.00 0.00 H new ATOM 0 HA ALA A 587 -16.392 -1.720 19.235 1.00 0.00 H new ATOM 0 HB1 ALA A 587 -14.786 0.130 18.888 1.00 0.00 H new ATOM 0 HB2 ALA A 587 -14.239 -1.373 18.108 1.00 0.00 H new ATOM 0 HB3 ALA A 587 -14.948 -0.069 17.127 1.00 0.00 H new ATOM 1819 N ALA A 588 -17.409 0.694 19.410 1.00 0.00 N ATOM 1820 CA ALA A 588 -18.365 1.781 19.580 1.00 0.00 C ATOM 1821 C ALA A 588 -17.922 3.026 18.820 1.00 0.00 C ATOM 1822 O ALA A 588 -16.775 3.125 18.386 1.00 0.00 O ATOM 1823 CB ALA A 588 -18.545 2.098 21.057 1.00 0.00 C ATOM 0 H ALA A 588 -16.742 0.596 20.175 1.00 0.00 H new ATOM 0 HA ALA A 588 -19.322 1.458 19.169 1.00 0.00 H new ATOM 0 HB1 ALA A 588 -19.262 2.912 21.170 1.00 0.00 H new ATOM 0 HB2 ALA A 588 -18.915 1.214 21.576 1.00 0.00 H new ATOM 0 HB3 ALA A 588 -17.588 2.396 21.485 1.00 0.00 H new ATOM 1829 N GLY A 589 -18.840 3.974 18.660 1.00 0.00 N ATOM 1830 CA GLY A 589 -18.525 5.200 17.950 1.00 0.00 C ATOM 1831 C GLY A 589 -18.751 6.436 18.799 1.00 0.00 C ATOM 1832 O GLY A 589 -18.326 6.492 19.953 1.00 0.00 O ATOM 0 H GLY A 589 -19.796 3.915 19.009 1.00 0.00 H new ATOM 0 HA2 GLY A 589 -17.485 5.171 17.625 1.00 0.00 H new ATOM 0 HA3 GLY A 589 -19.138 5.263 17.051 1.00 0.00 H new ATOM 1836 N VAL A 590 -19.422 7.430 18.226 1.00 0.00 N ATOM 1837 CA VAL A 590 -19.704 8.672 18.937 1.00 0.00 C ATOM 1838 C VAL A 590 -21.155 8.722 19.401 1.00 0.00 C ATOM 1839 O VAL A 590 -22.069 8.364 18.658 1.00 0.00 O ATOM 1840 CB VAL A 590 -19.415 9.901 18.055 1.00 0.00 C ATOM 1841 CG1 VAL A 590 -19.741 11.184 18.804 1.00 0.00 C ATOM 1842 CG2 VAL A 590 -17.966 9.897 17.594 1.00 0.00 C ATOM 0 H VAL A 590 -19.781 7.400 17.272 1.00 0.00 H new ATOM 0 HA VAL A 590 -19.047 8.696 19.806 1.00 0.00 H new ATOM 0 HB VAL A 590 -20.053 9.851 17.173 1.00 0.00 H new ATOM 0 HG11 VAL A 590 -19.531 12.042 18.165 1.00 0.00 H new ATOM 0 HG12 VAL A 590 -20.796 11.187 19.079 1.00 0.00 H new ATOM 0 HG13 VAL A 590 -19.131 11.244 19.705 1.00 0.00 H new ATOM 0 HG21 VAL A 590 -17.780 10.772 16.972 1.00 0.00 H new ATOM 0 HG22 VAL A 590 -17.308 9.922 18.462 1.00 0.00 H new ATOM 0 HG23 VAL A 590 -17.770 8.993 17.017 1.00 0.00 H new ATOM 1852 N LYS A 591 -21.360 9.170 20.635 1.00 0.00 N ATOM 1853 CA LYS A 591 -22.701 9.270 21.200 1.00 0.00 C ATOM 1854 C LYS A 591 -23.445 10.472 20.626 1.00 0.00 C ATOM 1855 O LYS A 591 -23.111 11.620 20.921 1.00 0.00 O ATOM 1856 CB LYS A 591 -22.627 9.383 22.724 1.00 0.00 C ATOM 1857 CG LYS A 591 -23.987 9.446 23.396 1.00 0.00 C ATOM 1858 CD LYS A 591 -24.512 8.059 23.726 1.00 0.00 C ATOM 1859 CE LYS A 591 -25.673 8.120 24.707 1.00 0.00 C ATOM 1860 NZ LYS A 591 -26.190 6.764 25.039 1.00 0.00 N ATOM 0 H LYS A 591 -20.614 9.470 21.263 1.00 0.00 H new ATOM 0 HA LYS A 591 -23.248 8.366 20.935 1.00 0.00 H new ATOM 0 HB2 LYS A 591 -22.076 8.528 23.117 1.00 0.00 H new ATOM 0 HB3 LYS A 591 -22.060 10.276 22.987 1.00 0.00 H new ATOM 0 HG2 LYS A 591 -23.915 10.035 24.310 1.00 0.00 H new ATOM 0 HG3 LYS A 591 -24.693 9.957 22.742 1.00 0.00 H new ATOM 0 HD2 LYS A 591 -24.834 7.564 22.810 1.00 0.00 H new ATOM 0 HD3 LYS A 591 -23.708 7.456 24.149 1.00 0.00 H new ATOM 0 HE2 LYS A 591 -25.351 8.620 25.621 1.00 0.00 H new ATOM 0 HE3 LYS A 591 -26.477 8.721 24.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 591 -26.980 6.848 25.710 1.00 0.00 H new ATOM 0 HZ2 LYS A 591 -26.521 6.297 24.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 591 -25.430 6.198 25.468 1.00 0.00 H new ATOM 1874 N LYS A 592 -24.455 10.200 19.807 1.00 0.00 N ATOM 1875 CA LYS A 592 -25.249 11.259 19.194 1.00 0.00 C ATOM 1876 C LYS A 592 -26.033 12.031 20.250 1.00 0.00 C ATOM 1877 O LYS A 592 -25.974 13.260 20.305 1.00 0.00 O ATOM 1878 CB LYS A 592 -26.210 10.669 18.160 1.00 0.00 C ATOM 1879 CG LYS A 592 -26.997 11.718 17.393 1.00 0.00 C ATOM 1880 CD LYS A 592 -28.278 11.142 16.815 1.00 0.00 C ATOM 1881 CE LYS A 592 -29.155 12.228 16.210 1.00 0.00 C ATOM 1882 NZ LYS A 592 -28.523 12.847 15.012 1.00 0.00 N ATOM 0 H LYS A 592 -24.743 9.255 19.552 1.00 0.00 H new ATOM 0 HA LYS A 592 -24.568 11.949 18.696 1.00 0.00 H new ATOM 0 HB2 LYS A 592 -25.643 10.064 17.453 1.00 0.00 H new ATOM 0 HB3 LYS A 592 -26.908 10.000 18.664 1.00 0.00 H new ATOM 0 HG2 LYS A 592 -27.237 12.550 18.055 1.00 0.00 H new ATOM 0 HG3 LYS A 592 -26.382 12.119 16.588 1.00 0.00 H new ATOM 0 HD2 LYS A 592 -28.034 10.403 16.052 1.00 0.00 H new ATOM 0 HD3 LYS A 592 -28.830 10.622 17.598 1.00 0.00 H new ATOM 0 HE2 LYS A 592 -30.120 11.803 15.933 1.00 0.00 H new ATOM 0 HE3 LYS A 592 -29.348 12.998 16.957 1.00 0.00 H new ATOM 0 HZ1 LYS A 592 -29.173 13.546 14.599 1.00 0.00 H new ATOM 0 HZ2 LYS A 592 -27.639 13.318 15.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 592 -28.316 12.109 14.309 1.00 0.00 H new ATOM 1896 N SER A 593 -26.766 11.304 21.087 1.00 0.00 N ATOM 1897 CA SER A 593 -27.564 11.922 22.139 1.00 0.00 C ATOM 1898 C SER A 593 -26.857 13.149 22.707 1.00 0.00 C ATOM 1899 O SER A 593 -25.856 13.031 23.414 1.00 0.00 O ATOM 1900 CB SER A 593 -27.839 10.915 23.258 1.00 0.00 C ATOM 1901 OG SER A 593 -28.747 11.444 24.208 1.00 0.00 O ATOM 0 H SER A 593 -26.824 10.286 21.057 1.00 0.00 H new ATOM 0 HA SER A 593 -28.512 12.239 21.703 1.00 0.00 H new ATOM 0 HB2 SER A 593 -28.246 9.997 22.834 1.00 0.00 H new ATOM 0 HB3 SER A 593 -26.904 10.651 23.752 1.00 0.00 H new ATOM 0 HG SER A 593 -28.907 10.781 24.912 1.00 0.00 H new ATOM 1907 N SER A 594 -27.386 14.327 22.392 1.00 0.00 N ATOM 1908 CA SER A 594 -26.804 15.577 22.867 1.00 0.00 C ATOM 1909 C SER A 594 -27.805 16.353 23.718 1.00 0.00 C ATOM 1910 O SER A 594 -29.015 16.160 23.604 1.00 0.00 O ATOM 1911 CB SER A 594 -26.350 16.435 21.685 1.00 0.00 C ATOM 1912 OG SER A 594 -27.411 16.641 20.768 1.00 0.00 O ATOM 0 H SER A 594 -28.216 14.442 21.810 1.00 0.00 H new ATOM 0 HA SER A 594 -25.939 15.335 23.484 1.00 0.00 H new ATOM 0 HB2 SER A 594 -25.987 17.397 22.048 1.00 0.00 H new ATOM 0 HB3 SER A 594 -25.516 15.950 21.178 1.00 0.00 H new ATOM 0 HG SER A 594 -27.096 17.194 20.022 1.00 0.00 H new ATOM 1918 N GLY A 595 -27.290 17.232 24.573 1.00 0.00 N ATOM 1919 CA GLY A 595 -28.151 18.024 25.431 1.00 0.00 C ATOM 1920 C GLY A 595 -28.168 19.489 25.042 1.00 0.00 C ATOM 1921 O GLY A 595 -27.664 20.351 25.764 1.00 0.00 O ATOM 0 H GLY A 595 -26.292 17.409 24.686 1.00 0.00 H new ATOM 0 HA2 GLY A 595 -29.166 17.628 25.388 1.00 0.00 H new ATOM 0 HA3 GLY A 595 -27.816 17.929 26.464 1.00 0.00 H new ATOM 1925 N PRO A 596 -28.758 19.789 23.875 1.00 0.00 N ATOM 1926 CA PRO A 596 -28.851 21.160 23.365 1.00 0.00 C ATOM 1927 C PRO A 596 -29.810 22.019 24.182 1.00 0.00 C ATOM 1928 O PRO A 596 -30.053 23.180 23.853 1.00 0.00 O ATOM 1929 CB PRO A 596 -29.381 20.974 21.941 1.00 0.00 C ATOM 1930 CG PRO A 596 -30.114 19.677 21.977 1.00 0.00 C ATOM 1931 CD PRO A 596 -29.379 18.813 22.965 1.00 0.00 C ATOM 0 HA PRO A 596 -27.893 21.678 23.414 1.00 0.00 H new ATOM 0 HB2 PRO A 596 -30.040 21.793 21.653 1.00 0.00 H new ATOM 0 HB3 PRO A 596 -28.568 20.949 21.216 1.00 0.00 H new ATOM 0 HG2 PRO A 596 -31.150 19.823 22.281 1.00 0.00 H new ATOM 0 HG3 PRO A 596 -30.134 19.212 20.991 1.00 0.00 H new ATOM 0 HD2 PRO A 596 -30.056 18.143 23.495 1.00 0.00 H new ATOM 0 HD3 PRO A 596 -28.632 18.188 22.475 1.00 0.00 H new ATOM 1939 N SER A 597 -30.352 21.441 25.250 1.00 0.00 N ATOM 1940 CA SER A 597 -31.287 22.153 26.113 1.00 0.00 C ATOM 1941 C SER A 597 -30.971 23.645 26.142 1.00 0.00 C ATOM 1942 O SER A 597 -29.814 24.044 26.272 1.00 0.00 O ATOM 1943 CB SER A 597 -31.240 21.583 27.531 1.00 0.00 C ATOM 1944 OG SER A 597 -31.289 20.166 27.514 1.00 0.00 O ATOM 0 H SER A 597 -30.159 20.482 25.538 1.00 0.00 H new ATOM 0 HA SER A 597 -32.290 22.019 25.708 1.00 0.00 H new ATOM 0 HB2 SER A 597 -30.328 21.912 28.028 1.00 0.00 H new ATOM 0 HB3 SER A 597 -32.077 21.972 28.110 1.00 0.00 H new ATOM 0 HG SER A 597 -31.256 19.826 28.433 1.00 0.00 H new ATOM 1950 N SER A 598 -32.009 24.466 26.019 1.00 0.00 N ATOM 1951 CA SER A 598 -31.844 25.915 26.027 1.00 0.00 C ATOM 1952 C SER A 598 -30.966 26.355 27.194 1.00 0.00 C ATOM 1953 O SER A 598 -30.553 25.539 28.017 1.00 0.00 O ATOM 1954 CB SER A 598 -33.207 26.605 26.110 1.00 0.00 C ATOM 1955 OG SER A 598 -33.688 26.624 27.443 1.00 0.00 O ATOM 0 H SER A 598 -32.974 24.152 25.913 1.00 0.00 H new ATOM 0 HA SER A 598 -31.355 26.205 25.097 1.00 0.00 H new ATOM 0 HB2 SER A 598 -33.125 27.625 25.735 1.00 0.00 H new ATOM 0 HB3 SER A 598 -33.921 26.086 25.470 1.00 0.00 H new ATOM 0 HG SER A 598 -34.559 27.072 27.470 1.00 0.00 H new ATOM 1961 N GLY A 599 -30.685 27.653 27.260 1.00 0.00 N ATOM 1962 CA GLY A 599 -29.859 28.180 28.329 1.00 0.00 C ATOM 1963 C GLY A 599 -30.029 29.676 28.510 1.00 0.00 C ATOM 1964 O GLY A 599 -29.915 30.440 27.553 1.00 0.00 O ATOM 0 H GLY A 599 -31.015 28.349 26.591 1.00 0.00 H new ATOM 0 HA2 GLY A 599 -30.110 27.674 29.261 1.00 0.00 H new ATOM 0 HA3 GLY A 599 -28.813 27.959 28.118 1.00 0.00 H new TER 1968 GLY A 599