USER MOD reduce.3.24.130724 H: found=0, std=0, add=993, rem=0, adj=32 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 508 THR OG1 : rot 73:sc= -0.0639 USER MOD Set 1.2: A 579 MET CE :methyl -155:sc= -6.92! (180deg=-7.57!) USER MOD Set 2.1: A 554 CYS SG : rot -63:sc= -6.24! USER MOD Set 2.2: A 555 CYS SG : rot 12:sc= -1.92 USER MOD Set 3.1: A 535 HIS : no HD1:sc= -3.09! C(o=-3.5!,f=-2!) USER MOD Set 3.2: A 536 MET CE :methyl -162:sc= -0.44 (180deg=-1.09) USER MOD Set 4.1: A 519 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.2: A 520 THR OG1 : rot 80:sc= 0.0897 USER MOD Set 5.1: A 503 ASN : amide:sc= -0.0508 K(o=-1.5,f=-0.058) USER MOD Set 5.2: A 506 GLN : amide:sc= -1.43 K(o=-1.5,f=-0.058) USER MOD Set 6.1: A 499 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 6.2: A 501 HIS : no HE2:sc= 0 X(o=0,f=-0.063) USER MOD Single : A 477 SER OG : rot 180:sc= 0 USER MOD Single : A 478 SER OG : rot 180:sc= 0 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+ 178:sc= 0 (180deg=-0.00255) USER MOD Single : A 487 THR OG1 : rot 180:sc= 0 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 11:sc= -0.938 USER MOD Single : A 497 LYS NZ :NH3+ -151:sc= -0.263 (180deg=-1.17) USER MOD Single : A 498 GLN : amide:sc= -0.0297 K(o=-0.03,f=-1.8!) USER MOD Single : A 500 LYS NZ :NH3+ 151:sc= -0.0257 (180deg=-1.02) USER MOD Single : A 504 THR OG1 : rot 90:sc= -0.172 USER MOD Single : A 505 GLN : amide:sc= -1.21 K(o=-1.2,f=-3.7!) USER MOD Single : A 511 GLN : amide:sc= -3.6! C(o=-3.6!,f=-5.8!) USER MOD Single : A 527 SER OG : rot 180:sc= 0 USER MOD Single : A 528 TYR OH : rot -13:sc= 0.0265 USER MOD Single : A 530 TYR OH : rot 180:sc= 0 USER MOD Single : A 534 ASN : amide:sc= 0.584 K(o=0.58,f=-4.4!) USER MOD Single : A 537 MET CE :methyl -139:sc= -0.315 (180deg=-2.65!) USER MOD Single : A 539 LYS NZ :NH3+ -153:sc= -0.199 (180deg=-1.16!) USER MOD Single : A 546 LYS NZ :NH3+ -115:sc= -0.0313 (180deg=-1.86!) USER MOD Single : A 549 GLN : amide:sc= -0.0118 K(o=-0.012,f=-1.3) USER MOD Single : A 556 ASN : amide:sc= -0.0123 K(o=-0.012,f=-2.7) USER MOD Single : A 564 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 565 GLN : amide:sc= -2.45 K(o=-2.4,f=-0.76) USER MOD Single : A 567 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 569 MET CE :methyl 168:sc= -0.153 (180deg=-0.183) USER MOD Single : A 570 HIS : no HE2:sc= -4.71! C(o=-4.7!,f=-5.1!) USER MOD Single : A 574 GLN : amide:sc= -2.1! K(o=-2.1!,f=-0.99) USER MOD Single : A 575 GLN : amide:sc= -0.0213 K(o=-0.021,f=-1.8!) USER MOD Single : A 583 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 584 SER OG : rot 180:sc= 0 USER MOD Single : A 591 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 592 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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= -0.0417 USER MOD Single : A 598 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 476 22.291 -9.343 1.568 1.00 0.00 N ATOM 2 CA GLY A 476 21.733 -8.468 2.582 1.00 0.00 C ATOM 3 C GLY A 476 20.218 -8.447 2.561 1.00 0.00 C ATOM 4 O GLY A 476 19.570 -9.075 3.399 1.00 0.00 O ATOM 0 HA2 GLY A 476 22.075 -8.792 3.565 1.00 0.00 H new ATOM 0 HA3 GLY A 476 22.109 -7.456 2.431 1.00 0.00 H new ATOM 8 N SER A 477 19.651 -7.722 1.602 1.00 0.00 N ATOM 9 CA SER A 477 18.201 -7.618 1.479 1.00 0.00 C ATOM 10 C SER A 477 17.808 -7.131 0.087 1.00 0.00 C ATOM 11 O SER A 477 18.418 -6.209 -0.455 1.00 0.00 O ATOM 12 CB SER A 477 17.646 -6.667 2.540 1.00 0.00 C ATOM 13 OG SER A 477 18.079 -5.337 2.311 1.00 0.00 O ATOM 0 H SER A 477 20.173 -7.198 0.899 1.00 0.00 H new ATOM 0 HA SER A 477 17.775 -8.610 1.632 1.00 0.00 H new ATOM 0 HB2 SER A 477 16.557 -6.704 2.532 1.00 0.00 H new ATOM 0 HB3 SER A 477 17.969 -6.992 3.529 1.00 0.00 H new ATOM 0 HG SER A 477 17.709 -4.749 3.002 1.00 0.00 H new ATOM 19 N SER A 478 16.786 -7.757 -0.485 1.00 0.00 N ATOM 20 CA SER A 478 16.312 -7.392 -1.815 1.00 0.00 C ATOM 21 C SER A 478 17.443 -7.475 -2.836 1.00 0.00 C ATOM 22 O SER A 478 17.585 -6.606 -3.694 1.00 0.00 O ATOM 23 CB SER A 478 15.726 -5.979 -1.800 1.00 0.00 C ATOM 24 OG SER A 478 14.773 -5.811 -2.835 1.00 0.00 O ATOM 0 H SER A 478 16.269 -8.520 -0.048 1.00 0.00 H new ATOM 0 HA SER A 478 15.533 -8.098 -2.103 1.00 0.00 H new ATOM 0 HB2 SER A 478 15.257 -5.787 -0.835 1.00 0.00 H new ATOM 0 HB3 SER A 478 16.527 -5.249 -1.917 1.00 0.00 H new ATOM 0 HG SER A 478 14.412 -4.900 -2.803 1.00 0.00 H new ATOM 30 N GLY A 479 18.247 -8.530 -2.735 1.00 0.00 N ATOM 31 CA GLY A 479 19.355 -8.709 -3.654 1.00 0.00 C ATOM 32 C GLY A 479 18.896 -9.094 -5.047 1.00 0.00 C ATOM 33 O GLY A 479 17.755 -8.831 -5.427 1.00 0.00 O ATOM 0 H GLY A 479 18.150 -9.263 -2.033 1.00 0.00 H new ATOM 0 HA2 GLY A 479 19.932 -7.786 -3.707 1.00 0.00 H new ATOM 0 HA3 GLY A 479 20.022 -9.480 -3.268 1.00 0.00 H new ATOM 37 N SER A 480 19.788 -9.718 -5.810 1.00 0.00 N ATOM 38 CA SER A 480 19.470 -10.136 -7.171 1.00 0.00 C ATOM 39 C SER A 480 19.835 -11.601 -7.389 1.00 0.00 C ATOM 40 O SER A 480 21.012 -11.961 -7.421 1.00 0.00 O ATOM 41 CB SER A 480 20.210 -9.258 -8.182 1.00 0.00 C ATOM 42 OG SER A 480 19.524 -8.037 -8.397 1.00 0.00 O ATOM 0 H SER A 480 20.736 -9.945 -5.509 1.00 0.00 H new ATOM 0 HA SER A 480 18.396 -10.022 -7.318 1.00 0.00 H new ATOM 0 HB2 SER A 480 21.218 -9.053 -7.821 1.00 0.00 H new ATOM 0 HB3 SER A 480 20.312 -9.793 -9.126 1.00 0.00 H new ATOM 0 HG SER A 480 20.019 -7.494 -9.046 1.00 0.00 H new ATOM 48 N SER A 481 18.817 -12.442 -7.538 1.00 0.00 N ATOM 49 CA SER A 481 19.029 -13.869 -7.749 1.00 0.00 C ATOM 50 C SER A 481 17.869 -14.481 -8.529 1.00 0.00 C ATOM 51 O SER A 481 16.737 -14.524 -8.049 1.00 0.00 O ATOM 52 CB SER A 481 19.190 -14.586 -6.407 1.00 0.00 C ATOM 53 OG SER A 481 19.619 -15.924 -6.592 1.00 0.00 O ATOM 0 H SER A 481 17.837 -12.160 -7.517 1.00 0.00 H new ATOM 0 HA SER A 481 19.942 -13.993 -8.331 1.00 0.00 H new ATOM 0 HB2 SER A 481 19.912 -14.051 -5.790 1.00 0.00 H new ATOM 0 HB3 SER A 481 18.242 -14.576 -5.870 1.00 0.00 H new ATOM 0 HG SER A 481 19.716 -16.360 -5.720 1.00 0.00 H new ATOM 59 N GLY A 482 18.161 -14.955 -9.737 1.00 0.00 N ATOM 60 CA GLY A 482 17.134 -15.558 -10.565 1.00 0.00 C ATOM 61 C GLY A 482 16.219 -14.527 -11.196 1.00 0.00 C ATOM 62 O GLY A 482 16.668 -13.461 -11.617 1.00 0.00 O ATOM 0 H GLY A 482 19.091 -14.932 -10.156 1.00 0.00 H new ATOM 0 HA2 GLY A 482 17.605 -16.150 -11.350 1.00 0.00 H new ATOM 0 HA3 GLY A 482 16.541 -16.244 -9.961 1.00 0.00 H new ATOM 66 N LYS A 483 14.930 -14.845 -11.265 1.00 0.00 N ATOM 67 CA LYS A 483 13.948 -13.940 -11.850 1.00 0.00 C ATOM 68 C LYS A 483 12.607 -14.055 -11.133 1.00 0.00 C ATOM 69 O LYS A 483 12.167 -15.143 -10.760 1.00 0.00 O ATOM 70 CB LYS A 483 13.771 -14.241 -13.340 1.00 0.00 C ATOM 71 CG LYS A 483 13.121 -15.586 -13.615 1.00 0.00 C ATOM 72 CD LYS A 483 14.133 -16.717 -13.551 1.00 0.00 C ATOM 73 CE LYS A 483 13.476 -18.031 -13.155 1.00 0.00 C ATOM 74 NZ LYS A 483 12.526 -18.512 -14.195 1.00 0.00 N ATOM 0 H LYS A 483 14.541 -15.724 -10.923 1.00 0.00 H new ATOM 0 HA LYS A 483 14.315 -12.920 -11.733 1.00 0.00 H new ATOM 0 HB2 LYS A 483 13.166 -13.455 -13.792 1.00 0.00 H new ATOM 0 HB3 LYS A 483 14.746 -14.212 -13.827 1.00 0.00 H new ATOM 0 HG2 LYS A 483 12.329 -15.764 -12.888 1.00 0.00 H new ATOM 0 HG3 LYS A 483 12.653 -15.571 -14.599 1.00 0.00 H new ATOM 0 HD2 LYS A 483 14.617 -16.829 -14.521 1.00 0.00 H new ATOM 0 HD3 LYS A 483 14.914 -16.468 -12.832 1.00 0.00 H new ATOM 0 HE2 LYS A 483 14.245 -18.786 -12.989 1.00 0.00 H new ATOM 0 HE3 LYS A 483 12.946 -17.902 -12.211 1.00 0.00 H new ATOM 0 HZ1 LYS A 483 12.125 -19.426 -13.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 483 11.759 -17.819 -14.312 1.00 0.00 H new ATOM 0 HZ3 LYS A 483 13.029 -18.627 -15.098 1.00 0.00 H new ATOM 88 N PRO A 484 11.939 -12.909 -10.938 1.00 0.00 N ATOM 89 CA PRO A 484 10.636 -12.856 -10.267 1.00 0.00 C ATOM 90 C PRO A 484 9.525 -13.474 -11.108 1.00 0.00 C ATOM 91 O PRO A 484 9.554 -13.406 -12.337 1.00 0.00 O ATOM 92 CB PRO A 484 10.394 -11.357 -10.079 1.00 0.00 C ATOM 93 CG PRO A 484 11.192 -10.707 -11.156 1.00 0.00 C ATOM 94 CD PRO A 484 12.403 -11.576 -11.357 1.00 0.00 C ATOM 0 HA PRO A 484 10.634 -13.422 -9.335 1.00 0.00 H new ATOM 0 HB2 PRO A 484 9.336 -11.113 -10.168 1.00 0.00 H new ATOM 0 HB3 PRO A 484 10.716 -11.025 -9.092 1.00 0.00 H new ATOM 0 HG2 PRO A 484 10.613 -10.626 -12.076 1.00 0.00 H new ATOM 0 HG3 PRO A 484 11.481 -9.695 -10.871 1.00 0.00 H new ATOM 0 HD2 PRO A 484 12.732 -11.573 -12.396 1.00 0.00 H new ATOM 0 HD3 PRO A 484 13.246 -11.236 -10.755 1.00 0.00 H new ATOM 102 N ILE A 485 8.548 -14.077 -10.439 1.00 0.00 N ATOM 103 CA ILE A 485 7.427 -14.706 -11.127 1.00 0.00 C ATOM 104 C ILE A 485 6.127 -13.955 -10.858 1.00 0.00 C ATOM 105 O ILE A 485 5.386 -14.287 -9.933 1.00 0.00 O ATOM 106 CB ILE A 485 7.256 -16.175 -10.698 1.00 0.00 C ATOM 107 CG1 ILE A 485 8.541 -16.961 -10.969 1.00 0.00 C ATOM 108 CG2 ILE A 485 6.080 -16.806 -11.428 1.00 0.00 C ATOM 109 CD1 ILE A 485 8.592 -18.298 -10.265 1.00 0.00 C ATOM 0 H ILE A 485 8.510 -14.143 -9.422 1.00 0.00 H new ATOM 0 HA ILE A 485 7.651 -14.671 -12.193 1.00 0.00 H new ATOM 0 HB ILE A 485 7.053 -16.204 -9.628 1.00 0.00 H new ATOM 0 HG12 ILE A 485 8.640 -17.121 -12.043 1.00 0.00 H new ATOM 0 HG13 ILE A 485 9.396 -16.362 -10.656 1.00 0.00 H new ATOM 0 HG21 ILE A 485 5.972 -17.844 -11.114 1.00 0.00 H new ATOM 0 HG22 ILE A 485 5.168 -16.258 -11.191 1.00 0.00 H new ATOM 0 HG23 ILE A 485 6.256 -16.768 -12.503 1.00 0.00 H new ATOM 0 HD11 ILE A 485 9.530 -18.799 -10.503 1.00 0.00 H new ATOM 0 HD12 ILE A 485 8.525 -18.145 -9.188 1.00 0.00 H new ATOM 0 HD13 ILE A 485 7.757 -18.916 -10.596 1.00 0.00 H new ATOM 121 N PHE A 486 5.855 -12.943 -11.675 1.00 0.00 N ATOM 122 CA PHE A 486 4.643 -12.145 -11.527 1.00 0.00 C ATOM 123 C PHE A 486 3.428 -13.040 -11.297 1.00 0.00 C ATOM 124 O PHE A 486 2.691 -12.868 -10.325 1.00 0.00 O ATOM 125 CB PHE A 486 4.424 -11.277 -12.767 1.00 0.00 C ATOM 126 CG PHE A 486 3.476 -10.135 -12.539 1.00 0.00 C ATOM 127 CD1 PHE A 486 2.190 -10.366 -12.078 1.00 0.00 C ATOM 128 CD2 PHE A 486 3.870 -8.830 -12.786 1.00 0.00 C ATOM 129 CE1 PHE A 486 1.314 -9.317 -11.867 1.00 0.00 C ATOM 130 CE2 PHE A 486 2.999 -7.777 -12.577 1.00 0.00 C ATOM 131 CZ PHE A 486 1.720 -8.021 -12.118 1.00 0.00 C ATOM 0 H PHE A 486 6.457 -12.656 -12.446 1.00 0.00 H new ATOM 0 HA PHE A 486 4.767 -11.499 -10.658 1.00 0.00 H new ATOM 0 HB2 PHE A 486 5.384 -10.881 -13.098 1.00 0.00 H new ATOM 0 HB3 PHE A 486 4.041 -11.901 -13.575 1.00 0.00 H new ATOM 0 HD1 PHE A 486 1.868 -11.378 -11.881 1.00 0.00 H new ATOM 0 HD2 PHE A 486 4.869 -8.633 -13.146 1.00 0.00 H new ATOM 0 HE1 PHE A 486 0.314 -9.511 -11.507 1.00 0.00 H new ATOM 0 HE2 PHE A 486 3.319 -6.764 -12.773 1.00 0.00 H new ATOM 0 HZ PHE A 486 1.038 -7.200 -11.955 1.00 0.00 H new ATOM 141 N THR A 487 3.225 -13.995 -12.199 1.00 0.00 N ATOM 142 CA THR A 487 2.099 -14.915 -12.097 1.00 0.00 C ATOM 143 C THR A 487 1.846 -15.315 -10.648 1.00 0.00 C ATOM 144 O THR A 487 0.750 -15.120 -10.122 1.00 0.00 O ATOM 145 CB THR A 487 2.335 -16.186 -12.935 1.00 0.00 C ATOM 146 OG1 THR A 487 2.539 -15.836 -14.308 1.00 0.00 O ATOM 147 CG2 THR A 487 1.153 -17.137 -12.819 1.00 0.00 C ATOM 0 H THR A 487 3.826 -14.152 -13.008 1.00 0.00 H new ATOM 0 HA THR A 487 1.225 -14.390 -12.484 1.00 0.00 H new ATOM 0 HB THR A 487 3.224 -16.688 -12.552 1.00 0.00 H new ATOM 0 HG1 THR A 487 2.690 -16.649 -14.834 1.00 0.00 H new ATOM 0 HG21 THR A 487 1.342 -18.027 -13.419 1.00 0.00 H new ATOM 0 HG22 THR A 487 1.018 -17.424 -11.776 1.00 0.00 H new ATOM 0 HG23 THR A 487 0.251 -16.642 -13.179 1.00 0.00 H new ATOM 155 N ASP A 488 2.866 -15.876 -10.007 1.00 0.00 N ATOM 156 CA ASP A 488 2.754 -16.302 -8.617 1.00 0.00 C ATOM 157 C ASP A 488 1.979 -15.277 -7.795 1.00 0.00 C ATOM 158 O ASP A 488 2.434 -14.150 -7.603 1.00 0.00 O ATOM 159 CB ASP A 488 4.143 -16.514 -8.013 1.00 0.00 C ATOM 160 CG ASP A 488 4.134 -17.519 -6.878 1.00 0.00 C ATOM 161 OD1 ASP A 488 3.610 -17.185 -5.794 1.00 0.00 O ATOM 162 OD2 ASP A 488 4.651 -18.639 -7.073 1.00 0.00 O ATOM 0 H ASP A 488 3.779 -16.046 -10.428 1.00 0.00 H new ATOM 0 HA ASP A 488 2.209 -17.246 -8.595 1.00 0.00 H new ATOM 0 HB2 ASP A 488 4.826 -16.855 -8.791 1.00 0.00 H new ATOM 0 HB3 ASP A 488 4.526 -15.561 -7.648 1.00 0.00 H new ATOM 167 N GLU A 489 0.807 -15.677 -7.313 1.00 0.00 N ATOM 168 CA GLU A 489 -0.032 -14.792 -6.513 1.00 0.00 C ATOM 169 C GLU A 489 0.272 -14.951 -5.026 1.00 0.00 C ATOM 170 O GLU A 489 -0.635 -14.964 -4.194 1.00 0.00 O ATOM 171 CB GLU A 489 -1.511 -15.079 -6.776 1.00 0.00 C ATOM 172 CG GLU A 489 -1.932 -16.492 -6.409 1.00 0.00 C ATOM 173 CD GLU A 489 -3.294 -16.858 -6.964 1.00 0.00 C ATOM 174 OE1 GLU A 489 -4.309 -16.477 -6.344 1.00 0.00 O ATOM 175 OE2 GLU A 489 -3.346 -17.525 -8.019 1.00 0.00 O ATOM 0 H GLU A 489 0.417 -16.608 -7.462 1.00 0.00 H new ATOM 0 HA GLU A 489 0.188 -13.765 -6.803 1.00 0.00 H new ATOM 0 HB2 GLU A 489 -2.116 -14.370 -6.210 1.00 0.00 H new ATOM 0 HB3 GLU A 489 -1.723 -14.908 -7.831 1.00 0.00 H new ATOM 0 HG2 GLU A 489 -1.190 -17.197 -6.784 1.00 0.00 H new ATOM 0 HG3 GLU A 489 -1.947 -16.592 -5.324 1.00 0.00 H new ATOM 182 N SER A 490 1.555 -15.073 -4.700 1.00 0.00 N ATOM 183 CA SER A 490 1.979 -15.236 -3.314 1.00 0.00 C ATOM 184 C SER A 490 2.346 -13.890 -2.696 1.00 0.00 C ATOM 185 O SER A 490 3.267 -13.214 -3.154 1.00 0.00 O ATOM 186 CB SER A 490 3.173 -16.189 -3.233 1.00 0.00 C ATOM 187 OG SER A 490 3.626 -16.327 -1.898 1.00 0.00 O ATOM 0 H SER A 490 2.318 -15.062 -5.376 1.00 0.00 H new ATOM 0 HA SER A 490 1.146 -15.659 -2.752 1.00 0.00 H new ATOM 0 HB2 SER A 490 2.890 -17.165 -3.627 1.00 0.00 H new ATOM 0 HB3 SER A 490 3.984 -15.815 -3.859 1.00 0.00 H new ATOM 0 HG SER A 490 4.388 -16.942 -1.873 1.00 0.00 H new ATOM 193 N TYR A 491 1.617 -13.508 -1.653 1.00 0.00 N ATOM 194 CA TYR A 491 1.862 -12.242 -0.973 1.00 0.00 C ATOM 195 C TYR A 491 1.890 -12.433 0.541 1.00 0.00 C ATOM 196 O TYR A 491 1.355 -11.616 1.291 1.00 0.00 O ATOM 197 CB TYR A 491 0.789 -11.219 -1.350 1.00 0.00 C ATOM 198 CG TYR A 491 -0.604 -11.803 -1.423 1.00 0.00 C ATOM 199 CD1 TYR A 491 -1.329 -12.068 -0.267 1.00 0.00 C ATOM 200 CD2 TYR A 491 -1.195 -12.091 -2.647 1.00 0.00 C ATOM 201 CE1 TYR A 491 -2.602 -12.602 -0.329 1.00 0.00 C ATOM 202 CE2 TYR A 491 -2.468 -12.624 -2.718 1.00 0.00 C ATOM 203 CZ TYR A 491 -3.167 -12.878 -1.556 1.00 0.00 C ATOM 204 OH TYR A 491 -4.434 -13.410 -1.623 1.00 0.00 O ATOM 0 H TYR A 491 0.852 -14.057 -1.260 1.00 0.00 H new ATOM 0 HA TYR A 491 2.836 -11.870 -1.292 1.00 0.00 H new ATOM 0 HB2 TYR A 491 0.797 -10.410 -0.619 1.00 0.00 H new ATOM 0 HB3 TYR A 491 1.041 -10.779 -2.315 1.00 0.00 H new ATOM 0 HD1 TYR A 491 -0.890 -11.853 0.696 1.00 0.00 H new ATOM 0 HD2 TYR A 491 -0.650 -11.895 -3.559 1.00 0.00 H new ATOM 0 HE1 TYR A 491 -3.151 -12.802 0.579 1.00 0.00 H new ATOM 0 HE2 TYR A 491 -2.913 -12.841 -3.678 1.00 0.00 H new ATOM 0 HH TYR A 491 -4.684 -13.544 -2.561 1.00 0.00 H new ATOM 214 N LEU A 492 2.517 -13.518 0.982 1.00 0.00 N ATOM 215 CA LEU A 492 2.615 -13.818 2.406 1.00 0.00 C ATOM 216 C LEU A 492 3.912 -13.266 2.990 1.00 0.00 C ATOM 217 O LEU A 492 3.898 -12.567 4.003 1.00 0.00 O ATOM 218 CB LEU A 492 2.543 -15.329 2.635 1.00 0.00 C ATOM 219 CG LEU A 492 1.935 -15.778 3.964 1.00 0.00 C ATOM 220 CD1 LEU A 492 0.472 -15.373 4.046 1.00 0.00 C ATOM 221 CD2 LEU A 492 2.085 -17.282 4.138 1.00 0.00 C ATOM 0 H LEU A 492 2.965 -14.204 0.374 1.00 0.00 H new ATOM 0 HA LEU A 492 1.777 -13.339 2.912 1.00 0.00 H new ATOM 0 HB2 LEU A 492 1.963 -15.772 1.825 1.00 0.00 H new ATOM 0 HB3 LEU A 492 3.552 -15.736 2.564 1.00 0.00 H new ATOM 0 HG LEU A 492 2.473 -15.284 4.773 1.00 0.00 H new ATOM 0 HD11 LEU A 492 0.056 -15.701 4.999 1.00 0.00 H new ATOM 0 HD12 LEU A 492 0.390 -14.289 3.968 1.00 0.00 H new ATOM 0 HD13 LEU A 492 -0.081 -15.838 3.230 1.00 0.00 H new ATOM 0 HD21 LEU A 492 1.647 -17.584 5.089 1.00 0.00 H new ATOM 0 HD22 LEU A 492 1.574 -17.795 3.324 1.00 0.00 H new ATOM 0 HD23 LEU A 492 3.142 -17.546 4.126 1.00 0.00 H new ATOM 233 N GLU A 493 5.029 -13.582 2.343 1.00 0.00 N ATOM 234 CA GLU A 493 6.333 -13.116 2.799 1.00 0.00 C ATOM 235 C GLU A 493 6.231 -11.717 3.400 1.00 0.00 C ATOM 236 O GLU A 493 6.645 -11.486 4.537 1.00 0.00 O ATOM 237 CB GLU A 493 7.332 -13.113 1.640 1.00 0.00 C ATOM 238 CG GLU A 493 8.780 -12.995 2.085 1.00 0.00 C ATOM 239 CD GLU A 493 9.741 -12.878 0.917 1.00 0.00 C ATOM 240 OE1 GLU A 493 9.785 -11.798 0.291 1.00 0.00 O ATOM 241 OE2 GLU A 493 10.449 -13.866 0.630 1.00 0.00 O ATOM 0 H GLU A 493 5.057 -14.158 1.502 1.00 0.00 H new ATOM 0 HA GLU A 493 6.685 -13.800 3.571 1.00 0.00 H new ATOM 0 HB2 GLU A 493 7.211 -14.031 1.065 1.00 0.00 H new ATOM 0 HB3 GLU A 493 7.098 -12.285 0.971 1.00 0.00 H new ATOM 0 HG2 GLU A 493 8.888 -12.122 2.729 1.00 0.00 H new ATOM 0 HG3 GLU A 493 9.045 -13.867 2.683 1.00 0.00 H new ATOM 248 N LEU A 494 5.678 -10.787 2.629 1.00 0.00 N ATOM 249 CA LEU A 494 5.521 -9.410 3.085 1.00 0.00 C ATOM 250 C LEU A 494 4.840 -9.362 4.449 1.00 0.00 C ATOM 251 O LEU A 494 5.377 -8.796 5.402 1.00 0.00 O ATOM 252 CB LEU A 494 4.709 -8.606 2.068 1.00 0.00 C ATOM 253 CG LEU A 494 5.484 -8.070 0.863 1.00 0.00 C ATOM 254 CD1 LEU A 494 6.552 -7.084 1.311 1.00 0.00 C ATOM 255 CD2 LEU A 494 6.107 -9.215 0.078 1.00 0.00 C ATOM 0 H LEU A 494 5.331 -10.961 1.686 1.00 0.00 H new ATOM 0 HA LEU A 494 6.513 -8.969 3.180 1.00 0.00 H new ATOM 0 HB2 LEU A 494 3.897 -9.235 1.702 1.00 0.00 H new ATOM 0 HB3 LEU A 494 4.251 -7.763 2.584 1.00 0.00 H new ATOM 0 HG LEU A 494 4.786 -7.546 0.210 1.00 0.00 H new ATOM 0 HD11 LEU A 494 7.093 -6.713 0.440 1.00 0.00 H new ATOM 0 HD12 LEU A 494 6.081 -6.248 1.829 1.00 0.00 H new ATOM 0 HD13 LEU A 494 7.248 -7.583 1.985 1.00 0.00 H new ATOM 0 HD21 LEU A 494 6.654 -8.815 -0.776 1.00 0.00 H new ATOM 0 HD22 LEU A 494 6.792 -9.767 0.722 1.00 0.00 H new ATOM 0 HD23 LEU A 494 5.322 -9.884 -0.275 1.00 0.00 H new ATOM 267 N TYR A 495 3.657 -9.960 4.535 1.00 0.00 N ATOM 268 CA TYR A 495 2.903 -9.985 5.782 1.00 0.00 C ATOM 269 C TYR A 495 3.816 -10.289 6.966 1.00 0.00 C ATOM 270 O TYR A 495 3.938 -9.487 7.892 1.00 0.00 O ATOM 271 CB TYR A 495 1.785 -11.026 5.706 1.00 0.00 C ATOM 272 CG TYR A 495 0.855 -11.005 6.898 1.00 0.00 C ATOM 273 CD1 TYR A 495 0.338 -9.809 7.380 1.00 0.00 C ATOM 274 CD2 TYR A 495 0.494 -12.182 7.543 1.00 0.00 C ATOM 275 CE1 TYR A 495 -0.511 -9.785 8.470 1.00 0.00 C ATOM 276 CE2 TYR A 495 -0.355 -12.168 8.632 1.00 0.00 C ATOM 277 CZ TYR A 495 -0.855 -10.967 9.092 1.00 0.00 C ATOM 278 OH TYR A 495 -1.701 -10.948 10.177 1.00 0.00 O ATOM 0 H TYR A 495 3.200 -10.434 3.756 1.00 0.00 H new ATOM 0 HA TYR A 495 2.463 -8.999 5.930 1.00 0.00 H new ATOM 0 HB2 TYR A 495 1.204 -10.857 4.800 1.00 0.00 H new ATOM 0 HB3 TYR A 495 2.229 -12.018 5.620 1.00 0.00 H new ATOM 0 HD1 TYR A 495 0.604 -8.882 6.894 1.00 0.00 H new ATOM 0 HD2 TYR A 495 0.884 -13.124 7.186 1.00 0.00 H new ATOM 0 HE1 TYR A 495 -0.903 -8.846 8.833 1.00 0.00 H new ATOM 0 HE2 TYR A 495 -0.626 -13.092 9.121 1.00 0.00 H new ATOM 0 HH TYR A 495 -2.099 -10.057 10.266 1.00 0.00 H new ATOM 288 N ARG A 496 4.457 -11.453 6.926 1.00 0.00 N ATOM 289 CA ARG A 496 5.359 -11.864 7.995 1.00 0.00 C ATOM 290 C ARG A 496 6.780 -11.378 7.724 1.00 0.00 C ATOM 291 O ARG A 496 7.750 -12.102 7.948 1.00 0.00 O ATOM 292 CB ARG A 496 5.350 -13.387 8.141 1.00 0.00 C ATOM 293 CG ARG A 496 3.955 -13.978 8.268 1.00 0.00 C ATOM 294 CD ARG A 496 3.916 -15.421 7.789 1.00 0.00 C ATOM 295 NE ARG A 496 4.272 -15.539 6.377 1.00 0.00 N ATOM 296 CZ ARG A 496 4.773 -16.644 5.835 1.00 0.00 C ATOM 297 NH1 ARG A 496 4.974 -17.720 6.583 1.00 0.00 N ATOM 298 NH2 ARG A 496 5.072 -16.674 4.543 1.00 0.00 N ATOM 0 H ARG A 496 4.368 -12.127 6.166 1.00 0.00 H new ATOM 0 HA ARG A 496 5.010 -11.414 8.924 1.00 0.00 H new ATOM 0 HB2 ARG A 496 5.846 -13.829 7.277 1.00 0.00 H new ATOM 0 HB3 ARG A 496 5.934 -13.663 9.019 1.00 0.00 H new ATOM 0 HG2 ARG A 496 3.631 -13.930 9.308 1.00 0.00 H new ATOM 0 HG3 ARG A 496 3.252 -13.381 7.687 1.00 0.00 H new ATOM 0 HD2 ARG A 496 4.602 -16.020 8.387 1.00 0.00 H new ATOM 0 HD3 ARG A 496 2.917 -15.828 7.946 1.00 0.00 H new ATOM 0 HE ARG A 496 4.128 -14.729 5.774 1.00 0.00 H new ATOM 0 HH11 ARG A 496 4.744 -17.701 7.577 1.00 0.00 H new ATOM 0 HH12 ARG A 496 5.359 -18.567 6.165 1.00 0.00 H new ATOM 0 HH21 ARG A 496 4.917 -15.848 3.964 1.00 0.00 H new ATOM 0 HH22 ARG A 496 5.457 -17.523 4.128 1.00 0.00 H new ATOM 312 N LYS A 497 6.896 -10.146 7.240 1.00 0.00 N ATOM 313 CA LYS A 497 8.197 -9.560 6.939 1.00 0.00 C ATOM 314 C LYS A 497 8.673 -8.675 8.086 1.00 0.00 C ATOM 315 O LYS A 497 9.804 -8.806 8.554 1.00 0.00 O ATOM 316 CB LYS A 497 8.125 -8.744 5.646 1.00 0.00 C ATOM 317 CG LYS A 497 9.475 -8.537 4.982 1.00 0.00 C ATOM 318 CD LYS A 497 9.760 -9.615 3.950 1.00 0.00 C ATOM 319 CE LYS A 497 10.506 -10.790 4.562 1.00 0.00 C ATOM 320 NZ LYS A 497 11.792 -10.368 5.183 1.00 0.00 N ATOM 0 H LYS A 497 6.104 -9.533 7.048 1.00 0.00 H new ATOM 0 HA LYS A 497 8.912 -10.372 6.809 1.00 0.00 H new ATOM 0 HB2 LYS A 497 7.458 -9.247 4.946 1.00 0.00 H new ATOM 0 HB3 LYS A 497 7.684 -7.771 5.864 1.00 0.00 H new ATOM 0 HG2 LYS A 497 9.500 -7.558 4.503 1.00 0.00 H new ATOM 0 HG3 LYS A 497 10.259 -8.541 5.740 1.00 0.00 H new ATOM 0 HD2 LYS A 497 8.822 -9.964 3.518 1.00 0.00 H new ATOM 0 HD3 LYS A 497 10.349 -9.193 3.135 1.00 0.00 H new ATOM 0 HE2 LYS A 497 9.878 -11.266 5.315 1.00 0.00 H new ATOM 0 HE3 LYS A 497 10.702 -11.536 3.792 1.00 0.00 H new ATOM 0 HZ1 LYS A 497 12.471 -11.154 5.143 1.00 0.00 H new ATOM 0 HZ2 LYS A 497 12.176 -9.552 4.665 1.00 0.00 H new ATOM 0 HZ3 LYS A 497 11.628 -10.103 6.175 1.00 0.00 H new ATOM 334 N GLN A 498 7.804 -7.775 8.534 1.00 0.00 N ATOM 335 CA GLN A 498 8.137 -6.869 9.626 1.00 0.00 C ATOM 336 C GLN A 498 7.432 -7.286 10.913 1.00 0.00 C ATOM 337 O GLN A 498 8.062 -7.785 11.845 1.00 0.00 O ATOM 338 CB GLN A 498 7.753 -5.434 9.262 1.00 0.00 C ATOM 339 CG GLN A 498 8.413 -4.385 10.143 1.00 0.00 C ATOM 340 CD GLN A 498 8.392 -3.003 9.520 1.00 0.00 C ATOM 341 OE1 GLN A 498 8.028 -2.840 8.355 1.00 0.00 O ATOM 342 NE2 GLN A 498 8.783 -1.998 10.296 1.00 0.00 N ATOM 0 H GLN A 498 6.864 -7.654 8.157 1.00 0.00 H new ATOM 0 HA GLN A 498 9.213 -6.918 9.790 1.00 0.00 H new ATOM 0 HB2 GLN A 498 8.024 -5.247 8.223 1.00 0.00 H new ATOM 0 HB3 GLN A 498 6.671 -5.327 9.333 1.00 0.00 H new ATOM 0 HG2 GLN A 498 7.904 -4.353 11.106 1.00 0.00 H new ATOM 0 HG3 GLN A 498 9.445 -4.676 10.337 1.00 0.00 H new ATOM 0 HE21 GLN A 498 9.077 -2.179 11.256 1.00 0.00 H new ATOM 0 HE22 GLN A 498 8.790 -1.045 9.932 1.00 0.00 H new ATOM 351 N LYS A 499 6.121 -7.076 10.958 1.00 0.00 N ATOM 352 CA LYS A 499 5.328 -7.430 12.130 1.00 0.00 C ATOM 353 C LYS A 499 3.868 -7.654 11.751 1.00 0.00 C ATOM 354 O LYS A 499 3.401 -7.170 10.719 1.00 0.00 O ATOM 355 CB LYS A 499 5.429 -6.331 13.190 1.00 0.00 C ATOM 356 CG LYS A 499 6.536 -6.563 14.203 1.00 0.00 C ATOM 357 CD LYS A 499 6.731 -5.354 15.103 1.00 0.00 C ATOM 358 CE LYS A 499 7.475 -4.239 14.385 1.00 0.00 C ATOM 359 NZ LYS A 499 7.118 -2.898 14.925 1.00 0.00 N ATOM 0 H LYS A 499 5.584 -6.662 10.196 1.00 0.00 H new ATOM 0 HA LYS A 499 5.725 -8.359 12.540 1.00 0.00 H new ATOM 0 HB2 LYS A 499 5.596 -5.374 12.695 1.00 0.00 H new ATOM 0 HB3 LYS A 499 4.477 -6.256 13.715 1.00 0.00 H new ATOM 0 HG2 LYS A 499 6.297 -7.436 14.811 1.00 0.00 H new ATOM 0 HG3 LYS A 499 7.467 -6.783 13.681 1.00 0.00 H new ATOM 0 HD2 LYS A 499 5.760 -4.988 15.438 1.00 0.00 H new ATOM 0 HD3 LYS A 499 7.286 -5.648 15.994 1.00 0.00 H new ATOM 0 HE2 LYS A 499 8.549 -4.396 14.484 1.00 0.00 H new ATOM 0 HE3 LYS A 499 7.244 -4.275 13.320 1.00 0.00 H new ATOM 0 HZ1 LYS A 499 7.646 -2.165 14.410 1.00 0.00 H new ATOM 0 HZ2 LYS A 499 6.097 -2.737 14.808 1.00 0.00 H new ATOM 0 HZ3 LYS A 499 7.361 -2.854 15.935 1.00 0.00 H new ATOM 373 N LYS A 500 3.149 -8.389 12.593 1.00 0.00 N ATOM 374 CA LYS A 500 1.740 -8.675 12.349 1.00 0.00 C ATOM 375 C LYS A 500 0.864 -7.507 12.790 1.00 0.00 C ATOM 376 O LYS A 500 0.327 -7.504 13.898 1.00 0.00 O ATOM 377 CB LYS A 500 1.322 -9.948 13.089 1.00 0.00 C ATOM 378 CG LYS A 500 -0.051 -10.460 12.689 1.00 0.00 C ATOM 379 CD LYS A 500 -0.485 -11.628 13.558 1.00 0.00 C ATOM 380 CE LYS A 500 -0.044 -12.958 12.965 1.00 0.00 C ATOM 381 NZ LYS A 500 1.370 -13.276 13.307 1.00 0.00 N ATOM 0 H LYS A 500 3.519 -8.798 13.451 1.00 0.00 H new ATOM 0 HA LYS A 500 1.605 -8.823 11.278 1.00 0.00 H new ATOM 0 HB2 LYS A 500 2.060 -10.727 12.900 1.00 0.00 H new ATOM 0 HB3 LYS A 500 1.330 -9.754 14.162 1.00 0.00 H new ATOM 0 HG2 LYS A 500 -0.779 -9.653 12.772 1.00 0.00 H new ATOM 0 HG3 LYS A 500 -0.035 -10.769 11.644 1.00 0.00 H new ATOM 0 HD2 LYS A 500 -0.063 -11.516 14.557 1.00 0.00 H new ATOM 0 HD3 LYS A 500 -1.570 -11.619 13.667 1.00 0.00 H new ATOM 0 HE2 LYS A 500 -0.694 -13.752 13.332 1.00 0.00 H new ATOM 0 HE3 LYS A 500 -0.158 -12.928 11.881 1.00 0.00 H new ATOM 0 HZ1 LYS A 500 1.495 -14.308 13.341 1.00 0.00 H new ATOM 0 HZ2 LYS A 500 2.001 -12.874 12.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 500 1.603 -12.868 14.235 1.00 0.00 H new ATOM 395 N HIS A 501 0.721 -6.517 11.914 1.00 0.00 N ATOM 396 CA HIS A 501 -0.093 -5.344 12.213 1.00 0.00 C ATOM 397 C HIS A 501 -1.388 -5.361 11.406 1.00 0.00 C ATOM 398 O HIS A 501 -2.427 -4.891 11.871 1.00 0.00 O ATOM 399 CB HIS A 501 0.690 -4.065 11.915 1.00 0.00 C ATOM 400 CG HIS A 501 1.679 -3.706 12.981 1.00 0.00 C ATOM 401 ND1 HIS A 501 1.315 -3.421 14.280 1.00 0.00 N ATOM 402 CD2 HIS A 501 3.027 -3.587 12.935 1.00 0.00 C ATOM 403 CE1 HIS A 501 2.396 -3.141 14.987 1.00 0.00 C ATOM 404 NE2 HIS A 501 3.448 -3.236 14.194 1.00 0.00 N ATOM 0 H HIS A 501 1.158 -6.504 10.992 1.00 0.00 H new ATOM 0 HA HIS A 501 -0.346 -5.368 13.273 1.00 0.00 H new ATOM 0 HB2 HIS A 501 1.216 -4.183 10.968 1.00 0.00 H new ATOM 0 HB3 HIS A 501 -0.012 -3.240 11.789 1.00 0.00 H new ATOM 0 HD1 HIS A 501 0.360 -3.426 14.639 1.00 0.00 H new ATOM 0 HD2 HIS A 501 3.654 -3.740 12.069 1.00 0.00 H new ATOM 0 HE1 HIS A 501 2.416 -2.879 16.035 1.00 0.00 H new ATOM 412 N LEU A 502 -1.318 -5.905 10.196 1.00 0.00 N ATOM 413 CA LEU A 502 -2.485 -5.984 9.324 1.00 0.00 C ATOM 414 C LEU A 502 -3.464 -7.043 9.819 1.00 0.00 C ATOM 415 O LEU A 502 -3.073 -8.003 10.481 1.00 0.00 O ATOM 416 CB LEU A 502 -2.054 -6.300 7.891 1.00 0.00 C ATOM 417 CG LEU A 502 -0.907 -5.457 7.333 1.00 0.00 C ATOM 418 CD1 LEU A 502 -0.589 -5.868 5.903 1.00 0.00 C ATOM 419 CD2 LEU A 502 -1.252 -3.977 7.399 1.00 0.00 C ATOM 0 H LEU A 502 -0.466 -6.298 9.796 1.00 0.00 H new ATOM 0 HA LEU A 502 -2.987 -5.017 9.341 1.00 0.00 H new ATOM 0 HB2 LEU A 502 -1.763 -7.349 7.844 1.00 0.00 H new ATOM 0 HB3 LEU A 502 -2.918 -6.179 7.238 1.00 0.00 H new ATOM 0 HG LEU A 502 -0.022 -5.631 7.945 1.00 0.00 H new ATOM 0 HD11 LEU A 502 0.230 -5.257 5.522 1.00 0.00 H new ATOM 0 HD12 LEU A 502 -0.298 -6.918 5.882 1.00 0.00 H new ATOM 0 HD13 LEU A 502 -1.470 -5.723 5.278 1.00 0.00 H new ATOM 0 HD21 LEU A 502 -0.424 -3.392 6.998 1.00 0.00 H new ATOM 0 HD22 LEU A 502 -2.150 -3.786 6.811 1.00 0.00 H new ATOM 0 HD23 LEU A 502 -1.430 -3.691 8.436 1.00 0.00 H new ATOM 431 N ASN A 503 -4.739 -6.861 9.491 1.00 0.00 N ATOM 432 CA ASN A 503 -5.775 -7.803 9.901 1.00 0.00 C ATOM 433 C ASN A 503 -6.460 -8.421 8.686 1.00 0.00 C ATOM 434 O ASN A 503 -6.259 -9.596 8.376 1.00 0.00 O ATOM 435 CB ASN A 503 -6.811 -7.101 10.782 1.00 0.00 C ATOM 436 CG ASN A 503 -6.187 -6.060 11.691 1.00 0.00 C ATOM 437 OD1 ASN A 503 -5.523 -6.394 12.672 1.00 0.00 O ATOM 438 ND2 ASN A 503 -6.398 -4.790 11.367 1.00 0.00 N ATOM 0 H ASN A 503 -5.080 -6.071 8.943 1.00 0.00 H new ATOM 0 HA ASN A 503 -5.301 -8.600 10.473 1.00 0.00 H new ATOM 0 HB2 ASN A 503 -7.559 -6.625 10.149 1.00 0.00 H new ATOM 0 HB3 ASN A 503 -7.331 -7.843 11.388 1.00 0.00 H new ATOM 0 HD21 ASN A 503 -6.003 -4.045 11.941 1.00 0.00 H new ATOM 0 HD22 ASN A 503 -6.955 -4.559 10.544 1.00 0.00 H new ATOM 445 N THR A 504 -7.270 -7.621 7.999 1.00 0.00 N ATOM 446 CA THR A 504 -7.985 -8.089 6.818 1.00 0.00 C ATOM 447 C THR A 504 -7.899 -7.073 5.685 1.00 0.00 C ATOM 448 O THR A 504 -7.215 -7.299 4.688 1.00 0.00 O ATOM 449 CB THR A 504 -9.467 -8.367 7.132 1.00 0.00 C ATOM 450 OG1 THR A 504 -9.572 -9.294 8.219 1.00 0.00 O ATOM 451 CG2 THR A 504 -10.184 -8.925 5.912 1.00 0.00 C ATOM 0 H THR A 504 -7.447 -6.646 8.240 1.00 0.00 H new ATOM 0 HA THR A 504 -7.507 -9.018 6.506 1.00 0.00 H new ATOM 0 HB THR A 504 -9.939 -7.425 7.411 1.00 0.00 H new ATOM 0 HG1 THR A 504 -9.599 -8.803 9.066 1.00 0.00 H new ATOM 0 HG21 THR A 504 -11.229 -9.113 6.159 1.00 0.00 H new ATOM 0 HG22 THR A 504 -10.128 -8.205 5.096 1.00 0.00 H new ATOM 0 HG23 THR A 504 -9.710 -9.858 5.606 1.00 0.00 H new ATOM 459 N GLN A 505 -8.598 -5.954 5.846 1.00 0.00 N ATOM 460 CA GLN A 505 -8.600 -4.903 4.835 1.00 0.00 C ATOM 461 C GLN A 505 -7.176 -4.501 4.465 1.00 0.00 C ATOM 462 O GLN A 505 -6.748 -4.679 3.325 1.00 0.00 O ATOM 463 CB GLN A 505 -9.372 -3.682 5.339 1.00 0.00 C ATOM 464 CG GLN A 505 -10.878 -3.808 5.181 1.00 0.00 C ATOM 465 CD GLN A 505 -11.631 -2.669 5.840 1.00 0.00 C ATOM 466 OE1 GLN A 505 -11.155 -2.071 6.806 1.00 0.00 O ATOM 467 NE2 GLN A 505 -12.814 -2.361 5.321 1.00 0.00 N ATOM 0 H GLN A 505 -9.170 -5.752 6.666 1.00 0.00 H new ATOM 0 HA GLN A 505 -9.092 -5.293 3.944 1.00 0.00 H new ATOM 0 HB2 GLN A 505 -9.137 -3.523 6.392 1.00 0.00 H new ATOM 0 HB3 GLN A 505 -9.031 -2.798 4.799 1.00 0.00 H new ATOM 0 HG2 GLN A 505 -11.127 -3.838 4.120 1.00 0.00 H new ATOM 0 HG3 GLN A 505 -11.207 -4.754 5.612 1.00 0.00 H new ATOM 0 HE21 GLN A 505 -13.171 -2.882 4.520 1.00 0.00 H new ATOM 0 HE22 GLN A 505 -13.366 -1.603 5.723 1.00 0.00 H new ATOM 476 N GLN A 506 -6.448 -3.959 5.436 1.00 0.00 N ATOM 477 CA GLN A 506 -5.072 -3.531 5.211 1.00 0.00 C ATOM 478 C GLN A 506 -4.354 -4.485 4.262 1.00 0.00 C ATOM 479 O GLN A 506 -3.636 -4.055 3.358 1.00 0.00 O ATOM 480 CB GLN A 506 -4.317 -3.449 6.539 1.00 0.00 C ATOM 481 CG GLN A 506 -4.882 -2.412 7.496 1.00 0.00 C ATOM 482 CD GLN A 506 -4.214 -2.450 8.857 1.00 0.00 C ATOM 483 OE1 GLN A 506 -4.759 -3.001 9.814 1.00 0.00 O ATOM 484 NE2 GLN A 506 -3.028 -1.861 8.950 1.00 0.00 N ATOM 0 H GLN A 506 -6.788 -3.806 6.386 1.00 0.00 H new ATOM 0 HA GLN A 506 -5.096 -2.542 4.754 1.00 0.00 H new ATOM 0 HB2 GLN A 506 -4.339 -4.426 7.021 1.00 0.00 H new ATOM 0 HB3 GLN A 506 -3.271 -3.216 6.339 1.00 0.00 H new ATOM 0 HG2 GLN A 506 -4.760 -1.419 7.063 1.00 0.00 H new ATOM 0 HG3 GLN A 506 -5.953 -2.579 7.616 1.00 0.00 H new ATOM 0 HE21 GLN A 506 -2.614 -1.416 8.131 1.00 0.00 H new ATOM 0 HE22 GLN A 506 -2.531 -1.853 9.841 1.00 0.00 H new ATOM 493 N LEU A 507 -4.551 -5.782 4.474 1.00 0.00 N ATOM 494 CA LEU A 507 -3.922 -6.798 3.637 1.00 0.00 C ATOM 495 C LEU A 507 -4.468 -6.747 2.214 1.00 0.00 C ATOM 496 O LEU A 507 -3.708 -6.722 1.246 1.00 0.00 O ATOM 497 CB LEU A 507 -4.148 -8.188 4.233 1.00 0.00 C ATOM 498 CG LEU A 507 -3.215 -8.589 5.377 1.00 0.00 C ATOM 499 CD1 LEU A 507 -3.830 -9.711 6.198 1.00 0.00 C ATOM 500 CD2 LEU A 507 -1.855 -9.004 4.836 1.00 0.00 C ATOM 0 H LEU A 507 -5.141 -6.155 5.218 1.00 0.00 H new ATOM 0 HA LEU A 507 -2.852 -6.593 3.602 1.00 0.00 H new ATOM 0 HB2 LEU A 507 -5.176 -8.244 4.592 1.00 0.00 H new ATOM 0 HB3 LEU A 507 -4.049 -8.924 3.435 1.00 0.00 H new ATOM 0 HG LEU A 507 -3.076 -7.725 6.027 1.00 0.00 H new ATOM 0 HD11 LEU A 507 -3.152 -9.983 7.007 1.00 0.00 H new ATOM 0 HD12 LEU A 507 -4.780 -9.377 6.617 1.00 0.00 H new ATOM 0 HD13 LEU A 507 -4.000 -10.578 5.560 1.00 0.00 H new ATOM 0 HD21 LEU A 507 -1.205 -9.286 5.664 1.00 0.00 H new ATOM 0 HD22 LEU A 507 -1.975 -9.853 4.163 1.00 0.00 H new ATOM 0 HD23 LEU A 507 -1.410 -8.171 4.292 1.00 0.00 H new ATOM 512 N THR A 508 -5.792 -6.728 2.094 1.00 0.00 N ATOM 513 CA THR A 508 -6.440 -6.678 0.790 1.00 0.00 C ATOM 514 C THR A 508 -5.860 -5.562 -0.071 1.00 0.00 C ATOM 515 O THR A 508 -5.514 -5.777 -1.232 1.00 0.00 O ATOM 516 CB THR A 508 -7.960 -6.468 0.926 1.00 0.00 C ATOM 517 OG1 THR A 508 -8.531 -7.519 1.714 1.00 0.00 O ATOM 518 CG2 THR A 508 -8.626 -6.433 -0.441 1.00 0.00 C ATOM 0 H THR A 508 -6.436 -6.747 2.885 1.00 0.00 H new ATOM 0 HA THR A 508 -6.254 -7.638 0.308 1.00 0.00 H new ATOM 0 HB THR A 508 -8.130 -5.511 1.420 1.00 0.00 H new ATOM 0 HG1 THR A 508 -8.284 -7.394 2.654 1.00 0.00 H new ATOM 0 HG21 THR A 508 -9.699 -6.284 -0.319 1.00 0.00 H new ATOM 0 HG22 THR A 508 -8.210 -5.614 -1.028 1.00 0.00 H new ATOM 0 HG23 THR A 508 -8.447 -7.376 -0.957 1.00 0.00 H new ATOM 526 N ALA A 509 -5.754 -4.370 0.507 1.00 0.00 N ATOM 527 CA ALA A 509 -5.213 -3.220 -0.207 1.00 0.00 C ATOM 528 C ALA A 509 -3.747 -3.438 -0.566 1.00 0.00 C ATOM 529 O ALA A 509 -3.340 -3.231 -1.710 1.00 0.00 O ATOM 530 CB ALA A 509 -5.372 -1.958 0.627 1.00 0.00 C ATOM 0 H ALA A 509 -6.036 -4.176 1.468 1.00 0.00 H new ATOM 0 HA ALA A 509 -5.774 -3.102 -1.134 1.00 0.00 H new ATOM 0 HB1 ALA A 509 -4.964 -1.107 0.081 1.00 0.00 H new ATOM 0 HB2 ALA A 509 -6.429 -1.786 0.829 1.00 0.00 H new ATOM 0 HB3 ALA A 509 -4.837 -2.075 1.570 1.00 0.00 H new ATOM 536 N PHE A 510 -2.957 -3.856 0.418 1.00 0.00 N ATOM 537 CA PHE A 510 -1.535 -4.100 0.205 1.00 0.00 C ATOM 538 C PHE A 510 -1.313 -5.006 -1.003 1.00 0.00 C ATOM 539 O PHE A 510 -0.408 -4.776 -1.804 1.00 0.00 O ATOM 540 CB PHE A 510 -0.913 -4.733 1.452 1.00 0.00 C ATOM 541 CG PHE A 510 0.555 -5.017 1.311 1.00 0.00 C ATOM 542 CD1 PHE A 510 1.466 -3.981 1.185 1.00 0.00 C ATOM 543 CD2 PHE A 510 1.024 -6.321 1.304 1.00 0.00 C ATOM 544 CE1 PHE A 510 2.817 -4.240 1.055 1.00 0.00 C ATOM 545 CE2 PHE A 510 2.374 -6.586 1.174 1.00 0.00 C ATOM 546 CZ PHE A 510 3.272 -5.544 1.050 1.00 0.00 C ATOM 0 H PHE A 510 -3.277 -4.033 1.370 1.00 0.00 H new ATOM 0 HA PHE A 510 -1.052 -3.142 0.012 1.00 0.00 H new ATOM 0 HB2 PHE A 510 -1.066 -4.068 2.302 1.00 0.00 H new ATOM 0 HB3 PHE A 510 -1.435 -5.663 1.676 1.00 0.00 H new ATOM 0 HD1 PHE A 510 1.116 -2.959 1.188 1.00 0.00 H new ATOM 0 HD2 PHE A 510 0.326 -7.140 1.401 1.00 0.00 H new ATOM 0 HE1 PHE A 510 3.517 -3.423 0.957 1.00 0.00 H new ATOM 0 HE2 PHE A 510 2.727 -7.607 1.169 1.00 0.00 H new ATOM 0 HZ PHE A 510 4.328 -5.748 0.949 1.00 0.00 H new ATOM 556 N GLN A 511 -2.145 -6.035 -1.124 1.00 0.00 N ATOM 557 CA GLN A 511 -2.039 -6.975 -2.233 1.00 0.00 C ATOM 558 C GLN A 511 -2.297 -6.278 -3.565 1.00 0.00 C ATOM 559 O GLN A 511 -1.486 -6.359 -4.488 1.00 0.00 O ATOM 560 CB GLN A 511 -3.027 -8.128 -2.048 1.00 0.00 C ATOM 561 CG GLN A 511 -2.983 -9.153 -3.170 1.00 0.00 C ATOM 562 CD GLN A 511 -3.630 -8.651 -4.445 1.00 0.00 C ATOM 563 OE1 GLN A 511 -4.590 -7.880 -4.406 1.00 0.00 O ATOM 564 NE2 GLN A 511 -3.107 -9.085 -5.586 1.00 0.00 N ATOM 0 H GLN A 511 -2.899 -6.239 -0.468 1.00 0.00 H new ATOM 0 HA GLN A 511 -1.024 -7.373 -2.243 1.00 0.00 H new ATOM 0 HB2 GLN A 511 -2.817 -8.628 -1.102 1.00 0.00 H new ATOM 0 HB3 GLN A 511 -4.036 -7.723 -1.977 1.00 0.00 H new ATOM 0 HG2 GLN A 511 -1.946 -9.419 -3.374 1.00 0.00 H new ATOM 0 HG3 GLN A 511 -3.487 -10.063 -2.845 1.00 0.00 H new ATOM 0 HE21 GLN A 511 -2.312 -9.723 -5.572 1.00 0.00 H new ATOM 0 HE22 GLN A 511 -3.501 -8.780 -6.476 1.00 0.00 H new ATOM 573 N LEU A 512 -3.432 -5.594 -3.659 1.00 0.00 N ATOM 574 CA LEU A 512 -3.798 -4.882 -4.878 1.00 0.00 C ATOM 575 C LEU A 512 -2.676 -3.949 -5.322 1.00 0.00 C ATOM 576 O LEU A 512 -2.324 -3.900 -6.501 1.00 0.00 O ATOM 577 CB LEU A 512 -5.084 -4.083 -4.660 1.00 0.00 C ATOM 578 CG LEU A 512 -6.371 -4.901 -4.546 1.00 0.00 C ATOM 579 CD1 LEU A 512 -7.482 -4.066 -3.930 1.00 0.00 C ATOM 580 CD2 LEU A 512 -6.791 -5.427 -5.911 1.00 0.00 C ATOM 0 H LEU A 512 -4.115 -5.518 -2.905 1.00 0.00 H new ATOM 0 HA LEU A 512 -3.965 -5.620 -5.663 1.00 0.00 H new ATOM 0 HB2 LEU A 512 -4.971 -3.492 -3.751 1.00 0.00 H new ATOM 0 HB3 LEU A 512 -5.196 -3.380 -5.486 1.00 0.00 H new ATOM 0 HG LEU A 512 -6.181 -5.753 -3.893 1.00 0.00 H new ATOM 0 HD11 LEU A 512 -8.390 -4.665 -3.857 1.00 0.00 H new ATOM 0 HD12 LEU A 512 -7.182 -3.739 -2.934 1.00 0.00 H new ATOM 0 HD13 LEU A 512 -7.672 -3.194 -4.556 1.00 0.00 H new ATOM 0 HD21 LEU A 512 -7.709 -6.007 -5.811 1.00 0.00 H new ATOM 0 HD22 LEU A 512 -6.963 -4.589 -6.587 1.00 0.00 H new ATOM 0 HD23 LEU A 512 -6.003 -6.062 -6.314 1.00 0.00 H new ATOM 592 N LEU A 513 -2.115 -3.211 -4.369 1.00 0.00 N ATOM 593 CA LEU A 513 -1.030 -2.281 -4.661 1.00 0.00 C ATOM 594 C LEU A 513 0.181 -3.016 -5.224 1.00 0.00 C ATOM 595 O LEU A 513 0.693 -2.667 -6.288 1.00 0.00 O ATOM 596 CB LEU A 513 -0.634 -1.516 -3.396 1.00 0.00 C ATOM 597 CG LEU A 513 -1.625 -0.455 -2.916 1.00 0.00 C ATOM 598 CD1 LEU A 513 -1.373 -0.112 -1.455 1.00 0.00 C ATOM 599 CD2 LEU A 513 -1.531 0.792 -3.782 1.00 0.00 C ATOM 0 H LEU A 513 -2.394 -3.239 -3.388 1.00 0.00 H new ATOM 0 HA LEU A 513 -1.383 -1.573 -5.411 1.00 0.00 H new ATOM 0 HB2 LEU A 513 -0.485 -2.236 -2.591 1.00 0.00 H new ATOM 0 HB3 LEU A 513 0.327 -1.033 -3.573 1.00 0.00 H new ATOM 0 HG LEU A 513 -2.633 -0.860 -3.005 1.00 0.00 H new ATOM 0 HD11 LEU A 513 -2.087 0.645 -1.130 1.00 0.00 H new ATOM 0 HD12 LEU A 513 -1.491 -1.008 -0.845 1.00 0.00 H new ATOM 0 HD13 LEU A 513 -0.360 0.273 -1.341 1.00 0.00 H new ATOM 0 HD21 LEU A 513 -2.243 1.537 -3.426 1.00 0.00 H new ATOM 0 HD22 LEU A 513 -0.521 1.199 -3.725 1.00 0.00 H new ATOM 0 HD23 LEU A 513 -1.761 0.535 -4.816 1.00 0.00 H new ATOM 611 N PHE A 514 0.634 -4.038 -4.505 1.00 0.00 N ATOM 612 CA PHE A 514 1.785 -4.824 -4.934 1.00 0.00 C ATOM 613 C PHE A 514 1.679 -5.181 -6.414 1.00 0.00 C ATOM 614 O PHE A 514 2.607 -4.950 -7.187 1.00 0.00 O ATOM 615 CB PHE A 514 1.898 -6.100 -4.097 1.00 0.00 C ATOM 616 CG PHE A 514 2.763 -7.155 -4.726 1.00 0.00 C ATOM 617 CD1 PHE A 514 2.236 -8.042 -5.651 1.00 0.00 C ATOM 618 CD2 PHE A 514 4.104 -7.260 -4.392 1.00 0.00 C ATOM 619 CE1 PHE A 514 3.029 -9.013 -6.232 1.00 0.00 C ATOM 620 CE2 PHE A 514 4.902 -8.229 -4.970 1.00 0.00 C ATOM 621 CZ PHE A 514 4.364 -9.107 -5.890 1.00 0.00 C ATOM 0 H PHE A 514 0.222 -4.341 -3.623 1.00 0.00 H new ATOM 0 HA PHE A 514 2.681 -4.220 -4.787 1.00 0.00 H new ATOM 0 HB2 PHE A 514 2.302 -5.847 -3.117 1.00 0.00 H new ATOM 0 HB3 PHE A 514 0.900 -6.508 -3.935 1.00 0.00 H new ATOM 0 HD1 PHE A 514 1.193 -7.974 -5.921 1.00 0.00 H new ATOM 0 HD2 PHE A 514 4.530 -6.577 -3.672 1.00 0.00 H new ATOM 0 HE1 PHE A 514 2.606 -9.697 -6.952 1.00 0.00 H new ATOM 0 HE2 PHE A 514 5.946 -8.300 -4.702 1.00 0.00 H new ATOM 0 HZ PHE A 514 4.986 -9.866 -6.341 1.00 0.00 H new ATOM 631 N ALA A 515 0.539 -5.747 -6.800 1.00 0.00 N ATOM 632 CA ALA A 515 0.310 -6.134 -8.186 1.00 0.00 C ATOM 633 C ALA A 515 0.436 -4.935 -9.120 1.00 0.00 C ATOM 634 O ALA A 515 1.159 -4.985 -10.115 1.00 0.00 O ATOM 635 CB ALA A 515 -1.060 -6.779 -8.334 1.00 0.00 C ATOM 0 H ALA A 515 -0.239 -5.947 -6.172 1.00 0.00 H new ATOM 0 HA ALA A 515 1.074 -6.860 -8.465 1.00 0.00 H new ATOM 0 HB1 ALA A 515 -1.218 -7.063 -9.374 1.00 0.00 H new ATOM 0 HB2 ALA A 515 -1.114 -7.666 -7.703 1.00 0.00 H new ATOM 0 HB3 ALA A 515 -1.831 -6.070 -8.031 1.00 0.00 H new ATOM 641 N TRP A 516 -0.271 -3.860 -8.792 1.00 0.00 N ATOM 642 CA TRP A 516 -0.239 -2.648 -9.603 1.00 0.00 C ATOM 643 C TRP A 516 1.196 -2.188 -9.837 1.00 0.00 C ATOM 644 O TRP A 516 1.567 -1.826 -10.953 1.00 0.00 O ATOM 645 CB TRP A 516 -1.040 -1.535 -8.926 1.00 0.00 C ATOM 646 CG TRP A 516 -0.770 -0.176 -9.497 1.00 0.00 C ATOM 647 CD1 TRP A 516 -1.454 0.441 -10.505 1.00 0.00 C ATOM 648 CD2 TRP A 516 0.260 0.733 -9.094 1.00 0.00 C ATOM 649 NE1 TRP A 516 -0.911 1.678 -10.753 1.00 0.00 N ATOM 650 CE2 TRP A 516 0.141 1.882 -9.900 1.00 0.00 C ATOM 651 CE3 TRP A 516 1.271 0.689 -8.129 1.00 0.00 C ATOM 652 CZ2 TRP A 516 0.995 2.974 -9.770 1.00 0.00 C ATOM 653 CZ3 TRP A 516 2.117 1.774 -8.002 1.00 0.00 C ATOM 654 CH2 TRP A 516 1.975 2.904 -8.818 1.00 0.00 C ATOM 0 H TRP A 516 -0.873 -3.802 -7.971 1.00 0.00 H new ATOM 0 HA TRP A 516 -0.691 -2.875 -10.569 1.00 0.00 H new ATOM 0 HB2 TRP A 516 -2.104 -1.755 -9.018 1.00 0.00 H new ATOM 0 HB3 TRP A 516 -0.808 -1.526 -7.861 1.00 0.00 H new ATOM 0 HD1 TRP A 516 -2.298 0.018 -11.030 1.00 0.00 H new ATOM 0 HE1 TRP A 516 -1.238 2.338 -11.458 1.00 0.00 H new ATOM 0 HE3 TRP A 516 1.388 -0.177 -7.495 1.00 0.00 H new ATOM 0 HZ2 TRP A 516 0.888 3.846 -10.399 1.00 0.00 H new ATOM 0 HZ3 TRP A 516 2.902 1.751 -7.260 1.00 0.00 H new ATOM 0 HH2 TRP A 516 2.652 3.736 -8.693 1.00 0.00 H new ATOM 665 N ARG A 517 1.998 -2.204 -8.777 1.00 0.00 N ATOM 666 CA ARG A 517 3.392 -1.787 -8.868 1.00 0.00 C ATOM 667 C ARG A 517 4.157 -2.659 -9.859 1.00 0.00 C ATOM 668 O ARG A 517 4.835 -2.152 -10.753 1.00 0.00 O ATOM 669 CB ARG A 517 4.058 -1.856 -7.492 1.00 0.00 C ATOM 670 CG ARG A 517 5.563 -1.649 -7.533 1.00 0.00 C ATOM 671 CD ARG A 517 6.218 -2.064 -6.225 1.00 0.00 C ATOM 672 NE ARG A 517 6.075 -3.495 -5.971 1.00 0.00 N ATOM 673 CZ ARG A 517 6.848 -4.174 -5.131 1.00 0.00 C ATOM 674 NH1 ARG A 517 7.814 -3.555 -4.466 1.00 0.00 N ATOM 675 NH2 ARG A 517 6.655 -5.475 -4.954 1.00 0.00 N ATOM 0 H ARG A 517 1.706 -2.501 -7.846 1.00 0.00 H new ATOM 0 HA ARG A 517 3.414 -0.757 -9.224 1.00 0.00 H new ATOM 0 HB2 ARG A 517 3.613 -1.101 -6.844 1.00 0.00 H new ATOM 0 HB3 ARG A 517 3.845 -2.826 -7.043 1.00 0.00 H new ATOM 0 HG2 ARG A 517 5.989 -2.227 -8.354 1.00 0.00 H new ATOM 0 HG3 ARG A 517 5.782 -0.600 -7.734 1.00 0.00 H new ATOM 0 HD2 ARG A 517 7.276 -1.805 -6.251 1.00 0.00 H new ATOM 0 HD3 ARG A 517 5.773 -1.504 -5.403 1.00 0.00 H new ATOM 0 HE ARG A 517 5.341 -4.001 -6.466 1.00 0.00 H new ATOM 0 HH11 ARG A 517 7.965 -2.555 -4.599 1.00 0.00 H new ATOM 0 HH12 ARG A 517 8.406 -4.079 -3.822 1.00 0.00 H new ATOM 0 HH21 ARG A 517 5.913 -5.954 -5.463 1.00 0.00 H new ATOM 0 HH22 ARG A 517 7.249 -5.996 -4.309 1.00 0.00 H new ATOM 689 N ASP A 518 4.043 -3.972 -9.694 1.00 0.00 N ATOM 690 CA ASP A 518 4.723 -4.915 -10.574 1.00 0.00 C ATOM 691 C ASP A 518 4.262 -4.740 -12.018 1.00 0.00 C ATOM 692 O ASP A 518 5.071 -4.763 -12.947 1.00 0.00 O ATOM 693 CB ASP A 518 4.466 -6.351 -10.115 1.00 0.00 C ATOM 694 CG ASP A 518 5.445 -7.337 -10.722 1.00 0.00 C ATOM 695 OD1 ASP A 518 5.920 -7.084 -11.849 1.00 0.00 O ATOM 696 OD2 ASP A 518 5.736 -8.361 -10.069 1.00 0.00 O ATOM 0 H ASP A 518 3.486 -4.408 -8.959 1.00 0.00 H new ATOM 0 HA ASP A 518 5.793 -4.712 -10.525 1.00 0.00 H new ATOM 0 HB2 ASP A 518 4.533 -6.399 -9.028 1.00 0.00 H new ATOM 0 HB3 ASP A 518 3.450 -6.639 -10.385 1.00 0.00 H new ATOM 701 N LYS A 519 2.958 -4.567 -12.200 1.00 0.00 N ATOM 702 CA LYS A 519 2.388 -4.388 -13.530 1.00 0.00 C ATOM 703 C LYS A 519 3.013 -3.187 -14.234 1.00 0.00 C ATOM 704 O LYS A 519 3.667 -3.331 -15.268 1.00 0.00 O ATOM 705 CB LYS A 519 0.871 -4.204 -13.437 1.00 0.00 C ATOM 706 CG LYS A 519 0.187 -4.102 -14.789 1.00 0.00 C ATOM 707 CD LYS A 519 0.141 -2.666 -15.284 1.00 0.00 C ATOM 708 CE LYS A 519 -0.679 -1.782 -14.358 1.00 0.00 C ATOM 709 NZ LYS A 519 -1.091 -0.514 -15.021 1.00 0.00 N ATOM 0 H LYS A 519 2.275 -4.547 -11.443 1.00 0.00 H new ATOM 0 HA LYS A 519 2.605 -5.283 -14.113 1.00 0.00 H new ATOM 0 HB2 LYS A 519 0.445 -5.042 -12.886 1.00 0.00 H new ATOM 0 HB3 LYS A 519 0.657 -3.303 -12.862 1.00 0.00 H new ATOM 0 HG2 LYS A 519 0.717 -4.721 -15.513 1.00 0.00 H new ATOM 0 HG3 LYS A 519 -0.827 -4.495 -14.715 1.00 0.00 H new ATOM 0 HD2 LYS A 519 1.155 -2.274 -15.359 1.00 0.00 H new ATOM 0 HD3 LYS A 519 -0.286 -2.639 -16.286 1.00 0.00 H new ATOM 0 HE2 LYS A 519 -1.566 -2.324 -14.029 1.00 0.00 H new ATOM 0 HE3 LYS A 519 -0.097 -1.552 -13.466 1.00 0.00 H new ATOM 0 HZ1 LYS A 519 -1.648 0.060 -14.356 1.00 0.00 H new ATOM 0 HZ2 LYS A 519 -0.245 0.016 -15.312 1.00 0.00 H new ATOM 0 HZ3 LYS A 519 -1.668 -0.732 -15.858 1.00 0.00 H new ATOM 723 N THR A 520 2.811 -2.003 -13.665 1.00 0.00 N ATOM 724 CA THR A 520 3.356 -0.778 -14.237 1.00 0.00 C ATOM 725 C THR A 520 4.876 -0.843 -14.330 1.00 0.00 C ATOM 726 O THR A 520 5.464 -0.434 -15.331 1.00 0.00 O ATOM 727 CB THR A 520 2.956 0.456 -13.407 1.00 0.00 C ATOM 728 OG1 THR A 520 1.544 0.450 -13.168 1.00 0.00 O ATOM 729 CG2 THR A 520 3.348 1.740 -14.122 1.00 0.00 C ATOM 0 H THR A 520 2.274 -1.866 -12.809 1.00 0.00 H new ATOM 0 HA THR A 520 2.937 -0.684 -15.239 1.00 0.00 H new ATOM 0 HB THR A 520 3.485 0.412 -12.455 1.00 0.00 H new ATOM 0 HG1 THR A 520 1.340 -0.160 -12.429 1.00 0.00 H new ATOM 0 HG21 THR A 520 3.055 2.598 -13.516 1.00 0.00 H new ATOM 0 HG22 THR A 520 4.427 1.756 -14.276 1.00 0.00 H new ATOM 0 HG23 THR A 520 2.843 1.788 -15.087 1.00 0.00 H new ATOM 737 N ALA A 521 5.507 -1.359 -13.281 1.00 0.00 N ATOM 738 CA ALA A 521 6.959 -1.480 -13.245 1.00 0.00 C ATOM 739 C ALA A 521 7.520 -1.762 -14.635 1.00 0.00 C ATOM 740 O ALA A 521 8.408 -1.055 -15.111 1.00 0.00 O ATOM 741 CB ALA A 521 7.374 -2.576 -12.275 1.00 0.00 C ATOM 0 H ALA A 521 5.035 -1.700 -12.444 1.00 0.00 H new ATOM 0 HA ALA A 521 7.370 -0.531 -12.901 1.00 0.00 H new ATOM 0 HB1 ALA A 521 8.461 -2.655 -12.259 1.00 0.00 H new ATOM 0 HB2 ALA A 521 7.013 -2.333 -11.276 1.00 0.00 H new ATOM 0 HB3 ALA A 521 6.946 -3.526 -12.595 1.00 0.00 H new ATOM 747 N ARG A 522 6.997 -2.799 -15.280 1.00 0.00 N ATOM 748 CA ARG A 522 7.448 -3.175 -16.615 1.00 0.00 C ATOM 749 C ARG A 522 7.317 -2.002 -17.583 1.00 0.00 C ATOM 750 O ARG A 522 8.270 -1.650 -18.279 1.00 0.00 O ATOM 751 CB ARG A 522 6.642 -4.368 -17.131 1.00 0.00 C ATOM 752 CG ARG A 522 7.384 -5.204 -18.161 1.00 0.00 C ATOM 753 CD ARG A 522 6.957 -6.663 -18.108 1.00 0.00 C ATOM 754 NE ARG A 522 7.719 -7.491 -19.039 1.00 0.00 N ATOM 755 CZ ARG A 522 7.900 -8.797 -18.882 1.00 0.00 C ATOM 756 NH1 ARG A 522 7.377 -9.421 -17.835 1.00 0.00 N ATOM 757 NH2 ARG A 522 8.605 -9.483 -19.772 1.00 0.00 N ATOM 0 H ARG A 522 6.261 -3.394 -14.900 1.00 0.00 H new ATOM 0 HA ARG A 522 8.499 -3.456 -16.551 1.00 0.00 H new ATOM 0 HB2 ARG A 522 6.369 -5.003 -16.288 1.00 0.00 H new ATOM 0 HB3 ARG A 522 5.713 -4.005 -17.571 1.00 0.00 H new ATOM 0 HG2 ARG A 522 7.197 -4.805 -19.158 1.00 0.00 H new ATOM 0 HG3 ARG A 522 8.457 -5.131 -17.985 1.00 0.00 H new ATOM 0 HD2 ARG A 522 7.088 -7.042 -17.095 1.00 0.00 H new ATOM 0 HD3 ARG A 522 5.895 -6.739 -18.342 1.00 0.00 H new ATOM 0 HE ARG A 522 8.135 -7.041 -19.855 1.00 0.00 H new ATOM 0 HH11 ARG A 522 6.834 -8.898 -17.148 1.00 0.00 H new ATOM 0 HH12 ARG A 522 7.518 -10.424 -17.717 1.00 0.00 H new ATOM 0 HH21 ARG A 522 9.009 -9.007 -20.579 1.00 0.00 H new ATOM 0 HH22 ARG A 522 8.743 -10.486 -19.650 1.00 0.00 H new ATOM 771 N ARG A 523 6.131 -1.403 -17.622 1.00 0.00 N ATOM 772 CA ARG A 523 5.876 -0.272 -18.506 1.00 0.00 C ATOM 773 C ARG A 523 6.854 0.866 -18.229 1.00 0.00 C ATOM 774 O ARG A 523 7.376 1.487 -19.154 1.00 0.00 O ATOM 775 CB ARG A 523 4.439 0.222 -18.334 1.00 0.00 C ATOM 776 CG ARG A 523 4.061 1.342 -19.289 1.00 0.00 C ATOM 777 CD ARG A 523 2.573 1.331 -19.601 1.00 0.00 C ATOM 778 NE ARG A 523 1.767 1.691 -18.437 1.00 0.00 N ATOM 779 CZ ARG A 523 0.545 2.204 -18.520 1.00 0.00 C ATOM 780 NH1 ARG A 523 -0.010 2.415 -19.705 1.00 0.00 N ATOM 781 NH2 ARG A 523 -0.125 2.506 -17.415 1.00 0.00 N ATOM 0 H ARG A 523 5.332 -1.682 -17.052 1.00 0.00 H new ATOM 0 HA ARG A 523 6.017 -0.607 -19.534 1.00 0.00 H new ATOM 0 HB2 ARG A 523 3.756 -0.615 -18.481 1.00 0.00 H new ATOM 0 HB3 ARG A 523 4.303 0.568 -17.309 1.00 0.00 H new ATOM 0 HG2 ARG A 523 4.335 2.302 -18.852 1.00 0.00 H new ATOM 0 HG3 ARG A 523 4.628 1.240 -20.214 1.00 0.00 H new ATOM 0 HD2 ARG A 523 2.368 2.028 -20.414 1.00 0.00 H new ATOM 0 HD3 ARG A 523 2.283 0.340 -19.950 1.00 0.00 H new ATOM 0 HE ARG A 523 2.165 1.540 -17.510 1.00 0.00 H new ATOM 0 HH11 ARG A 523 0.502 2.183 -20.556 1.00 0.00 H new ATOM 0 HH12 ARG A 523 -0.949 2.809 -19.766 1.00 0.00 H new ATOM 0 HH21 ARG A 523 0.299 2.344 -16.501 1.00 0.00 H new ATOM 0 HH22 ARG A 523 -1.064 2.900 -17.479 1.00 0.00 H new ATOM 795 N GLU A 524 7.095 1.133 -16.950 1.00 0.00 N ATOM 796 CA GLU A 524 8.009 2.198 -16.552 1.00 0.00 C ATOM 797 C GLU A 524 9.454 1.818 -16.862 1.00 0.00 C ATOM 798 O GLU A 524 10.286 2.680 -17.149 1.00 0.00 O ATOM 799 CB GLU A 524 7.858 2.498 -15.059 1.00 0.00 C ATOM 800 CG GLU A 524 6.486 3.029 -14.681 1.00 0.00 C ATOM 801 CD GLU A 524 5.984 4.088 -15.643 1.00 0.00 C ATOM 802 OE1 GLU A 524 6.733 5.051 -15.910 1.00 0.00 O ATOM 803 OE2 GLU A 524 4.842 3.953 -16.130 1.00 0.00 O ATOM 0 H GLU A 524 6.671 0.628 -16.172 1.00 0.00 H new ATOM 0 HA GLU A 524 7.756 3.092 -17.122 1.00 0.00 H new ATOM 0 HB2 GLU A 524 8.055 1.588 -14.492 1.00 0.00 H new ATOM 0 HB3 GLU A 524 8.614 3.226 -14.765 1.00 0.00 H new ATOM 0 HG2 GLU A 524 5.776 2.203 -14.654 1.00 0.00 H new ATOM 0 HG3 GLU A 524 6.527 3.447 -13.675 1.00 0.00 H new ATOM 810 N ASP A 525 9.746 0.524 -16.802 1.00 0.00 N ATOM 811 CA ASP A 525 11.089 0.029 -17.076 1.00 0.00 C ATOM 812 C ASP A 525 12.074 0.514 -16.017 1.00 0.00 C ATOM 813 O ASP A 525 13.198 0.905 -16.334 1.00 0.00 O ATOM 814 CB ASP A 525 11.549 0.481 -18.463 1.00 0.00 C ATOM 815 CG ASP A 525 12.826 -0.207 -18.903 1.00 0.00 C ATOM 816 OD1 ASP A 525 13.119 -1.304 -18.382 1.00 0.00 O ATOM 817 OD2 ASP A 525 13.533 0.350 -19.769 1.00 0.00 O ATOM 0 H ASP A 525 9.070 -0.202 -16.566 1.00 0.00 H new ATOM 0 HA ASP A 525 11.061 -1.060 -17.048 1.00 0.00 H new ATOM 0 HB2 ASP A 525 10.761 0.276 -19.188 1.00 0.00 H new ATOM 0 HB3 ASP A 525 11.705 1.560 -18.457 1.00 0.00 H new ATOM 822 N GLU A 526 11.644 0.487 -14.760 1.00 0.00 N ATOM 823 CA GLU A 526 12.488 0.926 -13.655 1.00 0.00 C ATOM 824 C GLU A 526 12.442 -0.074 -12.503 1.00 0.00 C ATOM 825 O GLU A 526 11.590 -0.962 -12.473 1.00 0.00 O ATOM 826 CB GLU A 526 12.046 2.306 -13.164 1.00 0.00 C ATOM 827 CG GLU A 526 13.128 3.058 -12.407 1.00 0.00 C ATOM 828 CD GLU A 526 14.439 3.118 -13.168 1.00 0.00 C ATOM 829 OE1 GLU A 526 14.563 3.976 -14.067 1.00 0.00 O ATOM 830 OE2 GLU A 526 15.338 2.307 -12.866 1.00 0.00 O ATOM 0 H GLU A 526 10.717 0.166 -14.481 1.00 0.00 H new ATOM 0 HA GLU A 526 13.514 0.988 -14.018 1.00 0.00 H new ATOM 0 HB2 GLU A 526 11.731 2.903 -14.020 1.00 0.00 H new ATOM 0 HB3 GLU A 526 11.176 2.191 -12.518 1.00 0.00 H new ATOM 0 HG2 GLU A 526 12.785 4.072 -12.202 1.00 0.00 H new ATOM 0 HG3 GLU A 526 13.293 2.576 -11.443 1.00 0.00 H new ATOM 837 N SER A 527 13.364 0.076 -11.559 1.00 0.00 N ATOM 838 CA SER A 527 13.432 -0.816 -10.407 1.00 0.00 C ATOM 839 C SER A 527 12.130 -0.777 -9.612 1.00 0.00 C ATOM 840 O SER A 527 11.420 0.229 -9.611 1.00 0.00 O ATOM 841 CB SER A 527 14.606 -0.430 -9.505 1.00 0.00 C ATOM 842 OG SER A 527 14.505 0.919 -9.085 1.00 0.00 O ATOM 0 H SER A 527 14.075 0.807 -11.568 1.00 0.00 H new ATOM 0 HA SER A 527 13.583 -1.831 -10.773 1.00 0.00 H new ATOM 0 HB2 SER A 527 14.630 -1.084 -8.634 1.00 0.00 H new ATOM 0 HB3 SER A 527 15.544 -0.578 -10.040 1.00 0.00 H new ATOM 0 HG SER A 527 15.266 1.140 -8.509 1.00 0.00 H new ATOM 848 N TYR A 528 11.824 -1.878 -8.936 1.00 0.00 N ATOM 849 CA TYR A 528 10.607 -1.972 -8.139 1.00 0.00 C ATOM 850 C TYR A 528 10.562 -0.872 -7.083 1.00 0.00 C ATOM 851 O TYR A 528 9.643 -0.054 -7.061 1.00 0.00 O ATOM 852 CB TYR A 528 10.517 -3.344 -7.467 1.00 0.00 C ATOM 853 CG TYR A 528 10.132 -4.458 -8.414 1.00 0.00 C ATOM 854 CD1 TYR A 528 8.955 -4.395 -9.150 1.00 0.00 C ATOM 855 CD2 TYR A 528 10.945 -5.573 -8.573 1.00 0.00 C ATOM 856 CE1 TYR A 528 8.599 -5.410 -10.016 1.00 0.00 C ATOM 857 CE2 TYR A 528 10.597 -6.593 -9.438 1.00 0.00 C ATOM 858 CZ TYR A 528 9.423 -6.507 -10.157 1.00 0.00 C ATOM 859 OH TYR A 528 9.073 -7.521 -11.018 1.00 0.00 O ATOM 0 H TYR A 528 12.402 -2.718 -8.924 1.00 0.00 H new ATOM 0 HA TYR A 528 9.755 -1.845 -8.806 1.00 0.00 H new ATOM 0 HB2 TYR A 528 11.479 -3.581 -7.013 1.00 0.00 H new ATOM 0 HB3 TYR A 528 9.787 -3.296 -6.659 1.00 0.00 H new ATOM 0 HD1 TYR A 528 8.307 -3.537 -9.043 1.00 0.00 H new ATOM 0 HD2 TYR A 528 11.865 -5.644 -8.011 1.00 0.00 H new ATOM 0 HE1 TYR A 528 7.680 -5.345 -10.580 1.00 0.00 H new ATOM 0 HE2 TYR A 528 11.241 -7.453 -9.550 1.00 0.00 H new ATOM 0 HH TYR A 528 8.135 -7.417 -11.282 1.00 0.00 H new ATOM 869 N GLY A 529 11.563 -0.860 -6.207 1.00 0.00 N ATOM 870 CA GLY A 529 11.620 0.144 -5.160 1.00 0.00 C ATOM 871 C GLY A 529 11.358 1.542 -5.682 1.00 0.00 C ATOM 872 O GLY A 529 10.682 2.339 -5.031 1.00 0.00 O ATOM 0 H GLY A 529 12.335 -1.527 -6.204 1.00 0.00 H new ATOM 0 HA2 GLY A 529 10.887 -0.096 -4.390 1.00 0.00 H new ATOM 0 HA3 GLY A 529 12.601 0.115 -4.686 1.00 0.00 H new ATOM 876 N TYR A 530 11.895 1.843 -6.859 1.00 0.00 N ATOM 877 CA TYR A 530 11.719 3.156 -7.467 1.00 0.00 C ATOM 878 C TYR A 530 10.239 3.485 -7.636 1.00 0.00 C ATOM 879 O TYR A 530 9.780 4.557 -7.244 1.00 0.00 O ATOM 880 CB TYR A 530 12.424 3.213 -8.823 1.00 0.00 C ATOM 881 CG TYR A 530 11.950 4.345 -9.706 1.00 0.00 C ATOM 882 CD1 TYR A 530 10.824 4.204 -10.507 1.00 0.00 C ATOM 883 CD2 TYR A 530 12.627 5.558 -9.737 1.00 0.00 C ATOM 884 CE1 TYR A 530 10.387 5.236 -11.315 1.00 0.00 C ATOM 885 CE2 TYR A 530 12.197 6.596 -10.541 1.00 0.00 C ATOM 886 CZ TYR A 530 11.077 6.430 -11.328 1.00 0.00 C ATOM 887 OH TYR A 530 10.645 7.461 -12.131 1.00 0.00 O ATOM 0 H TYR A 530 12.456 1.195 -7.411 1.00 0.00 H new ATOM 0 HA TYR A 530 12.163 3.897 -6.803 1.00 0.00 H new ATOM 0 HB2 TYR A 530 13.497 3.315 -8.661 1.00 0.00 H new ATOM 0 HB3 TYR A 530 12.269 2.268 -9.344 1.00 0.00 H new ATOM 0 HD1 TYR A 530 10.280 3.271 -10.498 1.00 0.00 H new ATOM 0 HD2 TYR A 530 13.505 5.692 -9.122 1.00 0.00 H new ATOM 0 HE1 TYR A 530 9.510 5.108 -11.933 1.00 0.00 H new ATOM 0 HE2 TYR A 530 12.735 7.532 -10.553 1.00 0.00 H new ATOM 0 HH TYR A 530 11.240 8.232 -12.022 1.00 0.00 H new ATOM 897 N VAL A 531 9.496 2.552 -8.224 1.00 0.00 N ATOM 898 CA VAL A 531 8.067 2.739 -8.445 1.00 0.00 C ATOM 899 C VAL A 531 7.324 2.903 -7.124 1.00 0.00 C ATOM 900 O VAL A 531 6.707 3.939 -6.870 1.00 0.00 O ATOM 901 CB VAL A 531 7.459 1.555 -9.220 1.00 0.00 C ATOM 902 CG1 VAL A 531 5.972 1.776 -9.451 1.00 0.00 C ATOM 903 CG2 VAL A 531 8.187 1.352 -10.539 1.00 0.00 C ATOM 0 H VAL A 531 9.861 1.659 -8.556 1.00 0.00 H new ATOM 0 HA VAL A 531 7.954 3.647 -9.037 1.00 0.00 H new ATOM 0 HB VAL A 531 7.579 0.651 -8.622 1.00 0.00 H new ATOM 0 HG11 VAL A 531 5.559 0.930 -10.000 1.00 0.00 H new ATOM 0 HG12 VAL A 531 5.464 1.868 -8.491 1.00 0.00 H new ATOM 0 HG13 VAL A 531 5.825 2.689 -10.028 1.00 0.00 H new ATOM 0 HG21 VAL A 531 7.744 0.511 -11.073 1.00 0.00 H new ATOM 0 HG22 VAL A 531 8.100 2.254 -11.145 1.00 0.00 H new ATOM 0 HG23 VAL A 531 9.240 1.145 -10.346 1.00 0.00 H new ATOM 913 N LEU A 532 7.387 1.876 -6.284 1.00 0.00 N ATOM 914 CA LEU A 532 6.720 1.905 -4.987 1.00 0.00 C ATOM 915 C LEU A 532 7.405 0.965 -4.001 1.00 0.00 C ATOM 916 O LEU A 532 7.265 -0.256 -4.070 1.00 0.00 O ATOM 917 CB LEU A 532 5.248 1.518 -5.139 1.00 0.00 C ATOM 918 CG LEU A 532 4.359 1.766 -3.920 1.00 0.00 C ATOM 919 CD1 LEU A 532 3.964 3.232 -3.836 1.00 0.00 C ATOM 920 CD2 LEU A 532 3.122 0.881 -3.973 1.00 0.00 C ATOM 0 H LEU A 532 7.894 1.012 -6.478 1.00 0.00 H new ATOM 0 HA LEU A 532 6.784 2.921 -4.597 1.00 0.00 H new ATOM 0 HB2 LEU A 532 4.834 2.069 -5.984 1.00 0.00 H new ATOM 0 HB3 LEU A 532 5.196 0.459 -5.392 1.00 0.00 H new ATOM 0 HG LEU A 532 4.925 1.512 -3.024 1.00 0.00 H new ATOM 0 HD11 LEU A 532 3.332 3.389 -2.962 1.00 0.00 H new ATOM 0 HD12 LEU A 532 4.860 3.846 -3.750 1.00 0.00 H new ATOM 0 HD13 LEU A 532 3.416 3.513 -4.735 1.00 0.00 H new ATOM 0 HD21 LEU A 532 2.501 1.071 -3.098 1.00 0.00 H new ATOM 0 HD22 LEU A 532 2.554 1.104 -4.876 1.00 0.00 H new ATOM 0 HD23 LEU A 532 3.424 -0.166 -3.983 1.00 0.00 H new ATOM 932 N PRO A 533 8.163 1.546 -3.059 1.00 0.00 N ATOM 933 CA PRO A 533 8.883 0.778 -2.038 1.00 0.00 C ATOM 934 C PRO A 533 7.942 0.136 -1.025 1.00 0.00 C ATOM 935 O PRO A 533 6.726 0.307 -1.098 1.00 0.00 O ATOM 936 CB PRO A 533 9.763 1.830 -1.359 1.00 0.00 C ATOM 937 CG PRO A 533 9.051 3.120 -1.579 1.00 0.00 C ATOM 938 CD PRO A 533 8.375 2.996 -2.917 1.00 0.00 C ATOM 0 HA PRO A 533 9.443 -0.051 -2.470 1.00 0.00 H new ATOM 0 HB2 PRO A 533 9.882 1.620 -0.296 1.00 0.00 H new ATOM 0 HB3 PRO A 533 10.762 1.850 -1.794 1.00 0.00 H new ATOM 0 HG2 PRO A 533 8.323 3.304 -0.789 1.00 0.00 H new ATOM 0 HG3 PRO A 533 9.749 3.957 -1.570 1.00 0.00 H new ATOM 0 HD2 PRO A 533 7.433 3.544 -2.944 1.00 0.00 H new ATOM 0 HD3 PRO A 533 8.997 3.392 -3.720 1.00 0.00 H new ATOM 946 N ASN A 534 8.513 -0.603 -0.079 1.00 0.00 N ATOM 947 CA ASN A 534 7.724 -1.271 0.950 1.00 0.00 C ATOM 948 C ASN A 534 7.106 -0.256 1.906 1.00 0.00 C ATOM 949 O ASN A 534 5.893 -0.244 2.117 1.00 0.00 O ATOM 950 CB ASN A 534 8.596 -2.258 1.729 1.00 0.00 C ATOM 951 CG ASN A 534 9.609 -2.959 0.844 1.00 0.00 C ATOM 952 OD1 ASN A 534 10.489 -2.322 0.265 1.00 0.00 O ATOM 953 ND2 ASN A 534 9.489 -4.277 0.736 1.00 0.00 N ATOM 0 H ASN A 534 9.519 -0.754 -0.004 1.00 0.00 H new ATOM 0 HA ASN A 534 6.919 -1.817 0.459 1.00 0.00 H new ATOM 0 HB2 ASN A 534 9.119 -1.727 2.525 1.00 0.00 H new ATOM 0 HB3 ASN A 534 7.959 -3.002 2.207 1.00 0.00 H new ATOM 0 HD21 ASN A 534 10.142 -4.803 0.155 1.00 0.00 H new ATOM 0 HD22 ASN A 534 8.744 -4.764 1.234 1.00 0.00 H new ATOM 960 N HIS A 535 7.949 0.595 2.483 1.00 0.00 N ATOM 961 CA HIS A 535 7.486 1.616 3.416 1.00 0.00 C ATOM 962 C HIS A 535 6.282 2.363 2.850 1.00 0.00 C ATOM 963 O HIS A 535 5.271 2.535 3.530 1.00 0.00 O ATOM 964 CB HIS A 535 8.613 2.601 3.728 1.00 0.00 C ATOM 965 CG HIS A 535 8.688 3.748 2.768 1.00 0.00 C ATOM 966 ND1 HIS A 535 9.513 3.751 1.663 1.00 0.00 N ATOM 967 CD2 HIS A 535 8.035 4.933 2.751 1.00 0.00 C ATOM 968 CE1 HIS A 535 9.364 4.889 1.009 1.00 0.00 C ATOM 969 NE2 HIS A 535 8.473 5.624 1.648 1.00 0.00 N ATOM 0 H HIS A 535 8.956 0.598 2.321 1.00 0.00 H new ATOM 0 HA HIS A 535 7.183 1.120 4.338 1.00 0.00 H new ATOM 0 HB2 HIS A 535 8.475 2.990 4.737 1.00 0.00 H new ATOM 0 HB3 HIS A 535 9.564 2.068 3.719 1.00 0.00 H new ATOM 0 HD2 HIS A 535 7.305 5.272 3.471 1.00 0.00 H new ATOM 0 HE1 HIS A 535 9.883 5.170 0.105 1.00 0.00 H new ATOM 0 HE2 HIS A 535 8.161 6.554 1.368 1.00 0.00 H new ATOM 977 N MET A 536 6.400 2.806 1.603 1.00 0.00 N ATOM 978 CA MET A 536 5.321 3.535 0.946 1.00 0.00 C ATOM 979 C MET A 536 4.097 2.644 0.761 1.00 0.00 C ATOM 980 O MET A 536 3.016 2.946 1.266 1.00 0.00 O ATOM 981 CB MET A 536 5.788 4.068 -0.410 1.00 0.00 C ATOM 982 CG MET A 536 4.896 5.163 -0.973 1.00 0.00 C ATOM 983 SD MET A 536 5.708 6.126 -2.263 1.00 0.00 S ATOM 984 CE MET A 536 6.849 7.104 -1.288 1.00 0.00 C ATOM 0 H MET A 536 7.231 2.673 1.027 1.00 0.00 H new ATOM 0 HA MET A 536 5.044 4.375 1.582 1.00 0.00 H new ATOM 0 HB2 MET A 536 6.803 4.453 -0.310 1.00 0.00 H new ATOM 0 HB3 MET A 536 5.829 3.243 -1.121 1.00 0.00 H new ATOM 0 HG2 MET A 536 3.988 4.715 -1.377 1.00 0.00 H new ATOM 0 HG3 MET A 536 4.591 5.829 -0.166 1.00 0.00 H new ATOM 0 HE1 MET A 536 7.189 7.958 -1.874 1.00 0.00 H new ATOM 0 HE2 MET A 536 6.347 7.458 -0.387 1.00 0.00 H new ATOM 0 HE3 MET A 536 7.706 6.492 -1.009 1.00 0.00 H new ATOM 994 N MET A 537 4.274 1.546 0.034 1.00 0.00 N ATOM 995 CA MET A 537 3.183 0.611 -0.217 1.00 0.00 C ATOM 996 C MET A 537 2.411 0.321 1.066 1.00 0.00 C ATOM 997 O MET A 537 1.179 0.344 1.080 1.00 0.00 O ATOM 998 CB MET A 537 3.726 -0.692 -0.805 1.00 0.00 C ATOM 999 CG MET A 537 2.651 -1.574 -1.421 1.00 0.00 C ATOM 1000 SD MET A 537 3.276 -2.584 -2.778 1.00 0.00 S ATOM 1001 CE MET A 537 4.407 -3.663 -1.905 1.00 0.00 C ATOM 0 H MET A 537 5.162 1.282 -0.392 1.00 0.00 H new ATOM 0 HA MET A 537 2.502 1.069 -0.934 1.00 0.00 H new ATOM 0 HB2 MET A 537 4.471 -0.456 -1.565 1.00 0.00 H new ATOM 0 HB3 MET A 537 4.237 -1.250 -0.021 1.00 0.00 H new ATOM 0 HG2 MET A 537 2.234 -2.224 -0.651 1.00 0.00 H new ATOM 0 HG3 MET A 537 1.836 -0.947 -1.785 1.00 0.00 H new ATOM 0 HE1 MET A 537 5.315 -3.792 -2.494 1.00 0.00 H new ATOM 0 HE2 MET A 537 4.660 -3.222 -0.941 1.00 0.00 H new ATOM 0 HE3 MET A 537 3.936 -4.633 -1.748 1.00 0.00 H new ATOM 1011 N LEU A 538 3.141 0.049 2.142 1.00 0.00 N ATOM 1012 CA LEU A 538 2.524 -0.246 3.431 1.00 0.00 C ATOM 1013 C LEU A 538 1.744 0.958 3.949 1.00 0.00 C ATOM 1014 O LEU A 538 0.516 0.923 4.043 1.00 0.00 O ATOM 1015 CB LEU A 538 3.591 -0.654 4.448 1.00 0.00 C ATOM 1016 CG LEU A 538 4.124 -2.082 4.326 1.00 0.00 C ATOM 1017 CD1 LEU A 538 5.457 -2.217 5.046 1.00 0.00 C ATOM 1018 CD2 LEU A 538 3.114 -3.077 4.879 1.00 0.00 C ATOM 0 H LEU A 538 4.161 0.027 2.148 1.00 0.00 H new ATOM 0 HA LEU A 538 1.828 -1.074 3.293 1.00 0.00 H new ATOM 0 HB2 LEU A 538 4.431 0.035 4.359 1.00 0.00 H new ATOM 0 HB3 LEU A 538 3.178 -0.526 5.449 1.00 0.00 H new ATOM 0 HG LEU A 538 4.281 -2.302 3.270 1.00 0.00 H new ATOM 0 HD11 LEU A 538 5.821 -3.240 4.949 1.00 0.00 H new ATOM 0 HD12 LEU A 538 6.180 -1.531 4.605 1.00 0.00 H new ATOM 0 HD13 LEU A 538 5.326 -1.977 6.101 1.00 0.00 H new ATOM 0 HD21 LEU A 538 3.510 -4.088 4.784 1.00 0.00 H new ATOM 0 HD22 LEU A 538 2.926 -2.858 5.930 1.00 0.00 H new ATOM 0 HD23 LEU A 538 2.182 -2.998 4.319 1.00 0.00 H new ATOM 1030 N LYS A 539 2.463 2.023 4.283 1.00 0.00 N ATOM 1031 CA LYS A 539 1.840 3.240 4.789 1.00 0.00 C ATOM 1032 C LYS A 539 0.484 3.472 4.129 1.00 0.00 C ATOM 1033 O LYS A 539 -0.463 3.919 4.777 1.00 0.00 O ATOM 1034 CB LYS A 539 2.751 4.445 4.543 1.00 0.00 C ATOM 1035 CG LYS A 539 2.322 5.695 5.290 1.00 0.00 C ATOM 1036 CD LYS A 539 2.708 6.956 4.536 1.00 0.00 C ATOM 1037 CE LYS A 539 4.125 7.394 4.871 1.00 0.00 C ATOM 1038 NZ LYS A 539 4.316 7.582 6.336 1.00 0.00 N ATOM 0 H LYS A 539 3.480 2.068 4.212 1.00 0.00 H new ATOM 0 HA LYS A 539 1.687 3.121 5.862 1.00 0.00 H new ATOM 0 HB2 LYS A 539 3.768 4.187 4.838 1.00 0.00 H new ATOM 0 HB3 LYS A 539 2.774 4.660 3.475 1.00 0.00 H new ATOM 0 HG2 LYS A 539 1.243 5.677 5.442 1.00 0.00 H new ATOM 0 HG3 LYS A 539 2.783 5.705 6.278 1.00 0.00 H new ATOM 0 HD2 LYS A 539 2.624 6.780 3.464 1.00 0.00 H new ATOM 0 HD3 LYS A 539 2.011 7.757 4.783 1.00 0.00 H new ATOM 0 HE2 LYS A 539 4.831 6.649 4.505 1.00 0.00 H new ATOM 0 HE3 LYS A 539 4.349 8.327 4.353 1.00 0.00 H new ATOM 0 HZ1 LYS A 539 5.070 8.279 6.501 1.00 0.00 H new ATOM 0 HZ2 LYS A 539 3.430 7.923 6.761 1.00 0.00 H new ATOM 0 HZ3 LYS A 539 4.581 6.675 6.771 1.00 0.00 H new ATOM 1052 N ILE A 540 0.399 3.164 2.840 1.00 0.00 N ATOM 1053 CA ILE A 540 -0.842 3.336 2.094 1.00 0.00 C ATOM 1054 C ILE A 540 -1.821 2.205 2.388 1.00 0.00 C ATOM 1055 O ILE A 540 -2.961 2.445 2.785 1.00 0.00 O ATOM 1056 CB ILE A 540 -0.583 3.396 0.577 1.00 0.00 C ATOM 1057 CG1 ILE A 540 0.318 4.585 0.238 1.00 0.00 C ATOM 1058 CG2 ILE A 540 -1.899 3.488 -0.181 1.00 0.00 C ATOM 1059 CD1 ILE A 540 0.966 4.482 -1.125 1.00 0.00 C ATOM 0 H ILE A 540 1.174 2.794 2.290 1.00 0.00 H new ATOM 0 HA ILE A 540 -1.277 4.282 2.417 1.00 0.00 H new ATOM 0 HB ILE A 540 -0.074 2.481 0.273 1.00 0.00 H new ATOM 0 HG12 ILE A 540 -0.271 5.501 0.283 1.00 0.00 H new ATOM 0 HG13 ILE A 540 1.097 4.669 0.996 1.00 0.00 H new ATOM 0 HG21 ILE A 540 -1.700 3.530 -1.252 1.00 0.00 H new ATOM 0 HG22 ILE A 540 -2.509 2.612 0.041 1.00 0.00 H new ATOM 0 HG23 ILE A 540 -2.432 4.388 0.124 1.00 0.00 H new ATOM 0 HD11 ILE A 540 1.590 5.359 -1.298 1.00 0.00 H new ATOM 0 HD12 ILE A 540 1.582 3.584 -1.168 1.00 0.00 H new ATOM 0 HD13 ILE A 540 0.193 4.429 -1.892 1.00 0.00 H new ATOM 1071 N ALA A 541 -1.368 0.971 2.191 1.00 0.00 N ATOM 1072 CA ALA A 541 -2.203 -0.198 2.438 1.00 0.00 C ATOM 1073 C ALA A 541 -2.844 -0.132 3.820 1.00 0.00 C ATOM 1074 O ALA A 541 -3.996 -0.526 3.999 1.00 0.00 O ATOM 1075 CB ALA A 541 -1.384 -1.472 2.294 1.00 0.00 C ATOM 0 H ALA A 541 -0.427 0.755 1.861 1.00 0.00 H new ATOM 0 HA ALA A 541 -3.001 -0.207 1.696 1.00 0.00 H new ATOM 0 HB1 ALA A 541 -2.020 -2.337 2.481 1.00 0.00 H new ATOM 0 HB2 ALA A 541 -0.979 -1.532 1.284 1.00 0.00 H new ATOM 0 HB3 ALA A 541 -0.565 -1.462 3.014 1.00 0.00 H new ATOM 1081 N GLU A 542 -2.089 0.366 4.794 1.00 0.00 N ATOM 1082 CA GLU A 542 -2.584 0.481 6.161 1.00 0.00 C ATOM 1083 C GLU A 542 -3.508 1.687 6.306 1.00 0.00 C ATOM 1084 O GLU A 542 -4.532 1.619 6.985 1.00 0.00 O ATOM 1085 CB GLU A 542 -1.416 0.599 7.142 1.00 0.00 C ATOM 1086 CG GLU A 542 -0.463 -0.583 7.098 1.00 0.00 C ATOM 1087 CD GLU A 542 0.427 -0.662 8.324 1.00 0.00 C ATOM 1088 OE1 GLU A 542 -0.077 -0.410 9.438 1.00 0.00 O ATOM 1089 OE2 GLU A 542 1.626 -0.974 8.169 1.00 0.00 O ATOM 0 H GLU A 542 -1.133 0.696 4.662 1.00 0.00 H new ATOM 0 HA GLU A 542 -3.153 -0.420 6.391 1.00 0.00 H new ATOM 0 HB2 GLU A 542 -0.860 1.511 6.924 1.00 0.00 H new ATOM 0 HB3 GLU A 542 -1.810 0.700 8.153 1.00 0.00 H new ATOM 0 HG2 GLU A 542 -1.038 -1.505 7.011 1.00 0.00 H new ATOM 0 HG3 GLU A 542 0.159 -0.510 6.206 1.00 0.00 H new ATOM 1096 N GLU A 543 -3.137 2.790 5.662 1.00 0.00 N ATOM 1097 CA GLU A 543 -3.932 4.011 5.720 1.00 0.00 C ATOM 1098 C GLU A 543 -5.319 3.786 5.127 1.00 0.00 C ATOM 1099 O GLU A 543 -6.334 4.074 5.764 1.00 0.00 O ATOM 1100 CB GLU A 543 -3.223 5.143 4.973 1.00 0.00 C ATOM 1101 CG GLU A 543 -2.284 5.956 5.849 1.00 0.00 C ATOM 1102 CD GLU A 543 -2.965 6.495 7.091 1.00 0.00 C ATOM 1103 OE1 GLU A 543 -3.891 7.321 6.950 1.00 0.00 O ATOM 1104 OE2 GLU A 543 -2.572 6.090 8.206 1.00 0.00 O ATOM 0 H GLU A 543 -2.292 2.863 5.095 1.00 0.00 H new ATOM 0 HA GLU A 543 -4.045 4.291 6.767 1.00 0.00 H new ATOM 0 HB2 GLU A 543 -2.657 4.721 4.143 1.00 0.00 H new ATOM 0 HB3 GLU A 543 -3.972 5.808 4.543 1.00 0.00 H new ATOM 0 HG2 GLU A 543 -1.439 5.334 6.144 1.00 0.00 H new ATOM 0 HG3 GLU A 543 -1.882 6.787 5.270 1.00 0.00 H new ATOM 1111 N LEU A 544 -5.356 3.271 3.903 1.00 0.00 N ATOM 1112 CA LEU A 544 -6.619 3.008 3.222 1.00 0.00 C ATOM 1113 C LEU A 544 -7.395 4.301 2.993 1.00 0.00 C ATOM 1114 O LEU A 544 -8.567 4.422 3.348 1.00 0.00 O ATOM 1115 CB LEU A 544 -7.467 2.029 4.037 1.00 0.00 C ATOM 1116 CG LEU A 544 -6.861 0.643 4.261 1.00 0.00 C ATOM 1117 CD1 LEU A 544 -7.844 -0.256 4.995 1.00 0.00 C ATOM 1118 CD2 LEU A 544 -6.452 0.018 2.936 1.00 0.00 C ATOM 0 H LEU A 544 -4.526 3.027 3.362 1.00 0.00 H new ATOM 0 HA LEU A 544 -6.394 2.565 2.252 1.00 0.00 H new ATOM 0 HB2 LEU A 544 -7.669 2.477 5.010 1.00 0.00 H new ATOM 0 HB3 LEU A 544 -8.428 1.907 3.536 1.00 0.00 H new ATOM 0 HG LEU A 544 -5.969 0.753 4.878 1.00 0.00 H new ATOM 0 HD11 LEU A 544 -7.396 -1.238 5.146 1.00 0.00 H new ATOM 0 HD12 LEU A 544 -8.087 0.184 5.962 1.00 0.00 H new ATOM 0 HD13 LEU A 544 -8.754 -0.359 4.404 1.00 0.00 H new ATOM 0 HD21 LEU A 544 -6.023 -0.968 3.116 1.00 0.00 H new ATOM 0 HD22 LEU A 544 -7.327 -0.079 2.294 1.00 0.00 H new ATOM 0 HD23 LEU A 544 -5.712 0.652 2.448 1.00 0.00 H new ATOM 1130 N PRO A 545 -6.727 5.292 2.383 1.00 0.00 N ATOM 1131 CA PRO A 545 -7.335 6.593 2.090 1.00 0.00 C ATOM 1132 C PRO A 545 -8.397 6.505 0.999 1.00 0.00 C ATOM 1133 O PRO A 545 -8.083 6.286 -0.171 1.00 0.00 O ATOM 1134 CB PRO A 545 -6.151 7.440 1.617 1.00 0.00 C ATOM 1135 CG PRO A 545 -5.167 6.453 1.090 1.00 0.00 C ATOM 1136 CD PRO A 545 -5.327 5.218 1.932 1.00 0.00 C ATOM 0 HA PRO A 545 -7.852 7.005 2.957 1.00 0.00 H new ATOM 0 HB2 PRO A 545 -6.454 8.148 0.846 1.00 0.00 H new ATOM 0 HB3 PRO A 545 -5.728 8.022 2.436 1.00 0.00 H new ATOM 0 HG2 PRO A 545 -5.357 6.236 0.039 1.00 0.00 H new ATOM 0 HG3 PRO A 545 -4.151 6.842 1.157 1.00 0.00 H new ATOM 0 HD2 PRO A 545 -5.138 4.312 1.357 1.00 0.00 H new ATOM 0 HD3 PRO A 545 -4.634 5.212 2.773 1.00 0.00 H new ATOM 1144 N LYS A 546 -9.655 6.677 1.389 1.00 0.00 N ATOM 1145 CA LYS A 546 -10.764 6.619 0.444 1.00 0.00 C ATOM 1146 C LYS A 546 -10.519 7.548 -0.740 1.00 0.00 C ATOM 1147 O LYS A 546 -10.771 7.183 -1.888 1.00 0.00 O ATOM 1148 CB LYS A 546 -12.074 6.997 1.140 1.00 0.00 C ATOM 1149 CG LYS A 546 -12.059 8.388 1.750 1.00 0.00 C ATOM 1150 CD LYS A 546 -13.337 8.672 2.522 1.00 0.00 C ATOM 1151 CE LYS A 546 -14.454 9.133 1.599 1.00 0.00 C ATOM 1152 NZ LYS A 546 -14.182 10.481 1.028 1.00 0.00 N ATOM 0 H LYS A 546 -9.932 6.858 2.354 1.00 0.00 H new ATOM 0 HA LYS A 546 -10.839 5.597 0.072 1.00 0.00 H new ATOM 0 HB2 LYS A 546 -12.890 6.934 0.420 1.00 0.00 H new ATOM 0 HB3 LYS A 546 -12.283 6.268 1.923 1.00 0.00 H new ATOM 0 HG2 LYS A 546 -11.201 8.485 2.416 1.00 0.00 H new ATOM 0 HG3 LYS A 546 -11.936 9.131 0.962 1.00 0.00 H new ATOM 0 HD2 LYS A 546 -13.650 7.773 3.053 1.00 0.00 H new ATOM 0 HD3 LYS A 546 -13.146 9.437 3.275 1.00 0.00 H new ATOM 0 HE2 LYS A 546 -14.576 8.414 0.789 1.00 0.00 H new ATOM 0 HE3 LYS A 546 -15.394 9.155 2.150 1.00 0.00 H new ATOM 0 HZ1 LYS A 546 -14.892 11.156 1.378 1.00 0.00 H new ATOM 0 HZ2 LYS A 546 -13.234 10.795 1.317 1.00 0.00 H new ATOM 0 HZ3 LYS A 546 -14.230 10.435 -0.010 1.00 0.00 H new ATOM 1166 N GLU A 547 -10.025 8.748 -0.453 1.00 0.00 N ATOM 1167 CA GLU A 547 -9.745 9.727 -1.497 1.00 0.00 C ATOM 1168 C GLU A 547 -8.349 9.521 -2.077 1.00 0.00 C ATOM 1169 O GLU A 547 -7.471 8.927 -1.451 1.00 0.00 O ATOM 1170 CB GLU A 547 -9.874 11.147 -0.942 1.00 0.00 C ATOM 1171 CG GLU A 547 -11.308 11.643 -0.863 1.00 0.00 C ATOM 1172 CD GLU A 547 -11.461 12.845 0.048 1.00 0.00 C ATOM 1173 OE1 GLU A 547 -10.584 13.050 0.913 1.00 0.00 O ATOM 1174 OE2 GLU A 547 -12.458 13.582 -0.105 1.00 0.00 O ATOM 0 H GLU A 547 -9.811 9.066 0.492 1.00 0.00 H new ATOM 0 HA GLU A 547 -10.475 9.588 -2.295 1.00 0.00 H new ATOM 0 HB2 GLU A 547 -9.432 11.180 0.054 1.00 0.00 H new ATOM 0 HB3 GLU A 547 -9.298 11.827 -1.569 1.00 0.00 H new ATOM 0 HG2 GLU A 547 -11.654 11.904 -1.863 1.00 0.00 H new ATOM 0 HG3 GLU A 547 -11.948 10.837 -0.505 1.00 0.00 H new ATOM 1181 N PRO A 548 -8.138 10.022 -3.303 1.00 0.00 N ATOM 1182 CA PRO A 548 -6.852 9.906 -3.996 1.00 0.00 C ATOM 1183 C PRO A 548 -5.767 10.763 -3.352 1.00 0.00 C ATOM 1184 O PRO A 548 -4.577 10.544 -3.576 1.00 0.00 O ATOM 1185 CB PRO A 548 -7.162 10.408 -5.408 1.00 0.00 C ATOM 1186 CG PRO A 548 -8.332 11.315 -5.239 1.00 0.00 C ATOM 1187 CD PRO A 548 -9.140 10.742 -4.108 1.00 0.00 C ATOM 0 HA PRO A 548 -6.464 8.888 -3.967 1.00 0.00 H new ATOM 0 HB2 PRO A 548 -6.310 10.936 -5.836 1.00 0.00 H new ATOM 0 HB3 PRO A 548 -7.395 9.582 -6.080 1.00 0.00 H new ATOM 0 HG2 PRO A 548 -8.009 12.331 -5.012 1.00 0.00 H new ATOM 0 HG3 PRO A 548 -8.922 11.365 -6.154 1.00 0.00 H new ATOM 0 HD2 PRO A 548 -9.633 11.524 -3.530 1.00 0.00 H new ATOM 0 HD3 PRO A 548 -9.920 10.073 -4.470 1.00 0.00 H new ATOM 1195 N GLN A 549 -6.187 11.738 -2.552 1.00 0.00 N ATOM 1196 CA GLN A 549 -5.250 12.627 -1.876 1.00 0.00 C ATOM 1197 C GLN A 549 -4.376 11.853 -0.894 1.00 0.00 C ATOM 1198 O GLN A 549 -3.154 11.996 -0.889 1.00 0.00 O ATOM 1199 CB GLN A 549 -6.005 13.735 -1.141 1.00 0.00 C ATOM 1200 CG GLN A 549 -5.095 14.772 -0.502 1.00 0.00 C ATOM 1201 CD GLN A 549 -5.850 15.998 -0.027 1.00 0.00 C ATOM 1202 OE1 GLN A 549 -7.046 16.143 -0.284 1.00 0.00 O ATOM 1203 NE2 GLN A 549 -5.155 16.888 0.671 1.00 0.00 N ATOM 0 H GLN A 549 -7.169 11.932 -2.356 1.00 0.00 H new ATOM 0 HA GLN A 549 -4.605 13.076 -2.632 1.00 0.00 H new ATOM 0 HB2 GLN A 549 -6.674 14.234 -1.842 1.00 0.00 H new ATOM 0 HB3 GLN A 549 -6.630 13.287 -0.368 1.00 0.00 H new ATOM 0 HG2 GLN A 549 -4.574 14.321 0.343 1.00 0.00 H new ATOM 0 HG3 GLN A 549 -4.334 15.075 -1.221 1.00 0.00 H new ATOM 0 HE21 GLN A 549 -4.166 16.727 0.861 1.00 0.00 H new ATOM 0 HE22 GLN A 549 -5.610 17.732 1.018 1.00 0.00 H new ATOM 1212 N GLY A 550 -5.012 11.034 -0.063 1.00 0.00 N ATOM 1213 CA GLY A 550 -4.278 10.250 0.913 1.00 0.00 C ATOM 1214 C GLY A 550 -3.135 9.473 0.291 1.00 0.00 C ATOM 1215 O GLY A 550 -2.127 9.207 0.946 1.00 0.00 O ATOM 0 H GLY A 550 -6.023 10.899 -0.048 1.00 0.00 H new ATOM 0 HA2 GLY A 550 -3.886 10.912 1.685 1.00 0.00 H new ATOM 0 HA3 GLY A 550 -4.960 9.556 1.404 1.00 0.00 H new ATOM 1219 N ILE A 551 -3.291 9.107 -0.977 1.00 0.00 N ATOM 1220 CA ILE A 551 -2.264 8.355 -1.687 1.00 0.00 C ATOM 1221 C ILE A 551 -1.150 9.274 -2.177 1.00 0.00 C ATOM 1222 O ILE A 551 -0.013 8.841 -2.365 1.00 0.00 O ATOM 1223 CB ILE A 551 -2.853 7.595 -2.890 1.00 0.00 C ATOM 1224 CG1 ILE A 551 -3.864 6.549 -2.415 1.00 0.00 C ATOM 1225 CG2 ILE A 551 -1.743 6.938 -3.697 1.00 0.00 C ATOM 1226 CD1 ILE A 551 -5.292 7.048 -2.411 1.00 0.00 C ATOM 0 H ILE A 551 -4.119 9.319 -1.534 1.00 0.00 H new ATOM 0 HA ILE A 551 -1.853 7.635 -0.979 1.00 0.00 H new ATOM 0 HB ILE A 551 -3.370 8.307 -3.533 1.00 0.00 H new ATOM 0 HG12 ILE A 551 -3.796 5.671 -3.058 1.00 0.00 H new ATOM 0 HG13 ILE A 551 -3.597 6.228 -1.408 1.00 0.00 H new ATOM 0 HG21 ILE A 551 -2.175 6.405 -4.544 1.00 0.00 H new ATOM 0 HG22 ILE A 551 -1.057 7.702 -4.062 1.00 0.00 H new ATOM 0 HG23 ILE A 551 -1.200 6.235 -3.065 1.00 0.00 H new ATOM 0 HD11 ILE A 551 -5.954 6.255 -2.063 1.00 0.00 H new ATOM 0 HD12 ILE A 551 -5.375 7.907 -1.746 1.00 0.00 H new ATOM 0 HD13 ILE A 551 -5.577 7.342 -3.421 1.00 0.00 H new ATOM 1238 N ILE A 552 -1.484 10.544 -2.379 1.00 0.00 N ATOM 1239 CA ILE A 552 -0.511 11.525 -2.844 1.00 0.00 C ATOM 1240 C ILE A 552 0.360 12.021 -1.695 1.00 0.00 C ATOM 1241 O ILE A 552 1.562 12.232 -1.860 1.00 0.00 O ATOM 1242 CB ILE A 552 -1.201 12.731 -3.508 1.00 0.00 C ATOM 1243 CG1 ILE A 552 -2.014 12.277 -4.722 1.00 0.00 C ATOM 1244 CG2 ILE A 552 -0.170 13.773 -3.914 1.00 0.00 C ATOM 1245 CD1 ILE A 552 -2.655 13.417 -5.481 1.00 0.00 C ATOM 0 H ILE A 552 -2.421 10.918 -2.228 1.00 0.00 H new ATOM 0 HA ILE A 552 0.115 11.024 -3.582 1.00 0.00 H new ATOM 0 HB ILE A 552 -1.882 13.183 -2.787 1.00 0.00 H new ATOM 0 HG12 ILE A 552 -1.363 11.722 -5.398 1.00 0.00 H new ATOM 0 HG13 ILE A 552 -2.792 11.589 -4.391 1.00 0.00 H new ATOM 0 HG21 ILE A 552 -0.673 14.619 -4.382 1.00 0.00 H new ATOM 0 HG22 ILE A 552 0.369 14.115 -3.031 1.00 0.00 H new ATOM 0 HG23 ILE A 552 0.533 13.333 -4.621 1.00 0.00 H new ATOM 0 HD11 ILE A 552 -3.215 13.021 -6.328 1.00 0.00 H new ATOM 0 HD12 ILE A 552 -3.332 13.959 -4.820 1.00 0.00 H new ATOM 0 HD13 ILE A 552 -1.881 14.094 -5.842 1.00 0.00 H new ATOM 1257 N ALA A 553 -0.253 12.204 -0.530 1.00 0.00 N ATOM 1258 CA ALA A 553 0.468 12.672 0.647 1.00 0.00 C ATOM 1259 C ALA A 553 1.389 11.586 1.194 1.00 0.00 C ATOM 1260 O ALA A 553 2.534 11.857 1.558 1.00 0.00 O ATOM 1261 CB ALA A 553 -0.511 13.125 1.720 1.00 0.00 C ATOM 0 H ALA A 553 -1.247 12.035 -0.376 1.00 0.00 H new ATOM 0 HA ALA A 553 1.085 13.521 0.351 1.00 0.00 H new ATOM 0 HB1 ALA A 553 0.041 13.472 2.593 1.00 0.00 H new ATOM 0 HB2 ALA A 553 -1.125 13.938 1.332 1.00 0.00 H new ATOM 0 HB3 ALA A 553 -1.152 12.290 2.004 1.00 0.00 H new ATOM 1267 N CYS A 554 0.883 10.360 1.249 1.00 0.00 N ATOM 1268 CA CYS A 554 1.661 9.233 1.753 1.00 0.00 C ATOM 1269 C CYS A 554 3.095 9.289 1.237 1.00 0.00 C ATOM 1270 O CYS A 554 4.007 8.733 1.850 1.00 0.00 O ATOM 1271 CB CYS A 554 1.009 7.912 1.342 1.00 0.00 C ATOM 1272 SG CYS A 554 1.346 7.423 -0.366 1.00 0.00 S ATOM 0 H CYS A 554 -0.063 10.120 0.951 1.00 0.00 H new ATOM 0 HA CYS A 554 1.683 9.295 2.841 1.00 0.00 H new ATOM 0 HB2 CYS A 554 1.357 7.124 2.010 1.00 0.00 H new ATOM 0 HB3 CYS A 554 -0.069 7.993 1.480 1.00 0.00 H new ATOM 0 HG CYS A 554 0.837 8.302 -1.177 1.00 0.00 H new ATOM 1278 N CYS A 555 3.286 9.962 0.108 1.00 0.00 N ATOM 1279 CA CYS A 555 4.610 10.088 -0.492 1.00 0.00 C ATOM 1280 C CYS A 555 5.070 11.542 -0.492 1.00 0.00 C ATOM 1281 O CYS A 555 4.320 12.441 -0.869 1.00 0.00 O ATOM 1282 CB CYS A 555 4.599 9.544 -1.921 1.00 0.00 C ATOM 1283 SG CYS A 555 3.132 10.002 -2.874 1.00 0.00 S ATOM 0 H CYS A 555 2.542 10.429 -0.410 1.00 0.00 H new ATOM 0 HA CYS A 555 5.310 9.504 0.106 1.00 0.00 H new ATOM 0 HB2 CYS A 555 5.485 9.905 -2.443 1.00 0.00 H new ATOM 0 HB3 CYS A 555 4.671 8.457 -1.885 1.00 0.00 H new ATOM 0 HG CYS A 555 2.468 10.919 -2.235 1.00 0.00 H new ATOM 1289 N ASN A 556 6.309 11.765 -0.065 1.00 0.00 N ATOM 1290 CA ASN A 556 6.869 13.110 -0.013 1.00 0.00 C ATOM 1291 C ASN A 556 8.389 13.072 -0.136 1.00 0.00 C ATOM 1292 O ASN A 556 9.097 12.603 0.755 1.00 0.00 O ATOM 1293 CB ASN A 556 6.469 13.802 1.291 1.00 0.00 C ATOM 1294 CG ASN A 556 6.504 15.314 1.178 1.00 0.00 C ATOM 1295 OD1 ASN A 556 7.280 15.872 0.403 1.00 0.00 O ATOM 1296 ND2 ASN A 556 5.660 15.985 1.954 1.00 0.00 N ATOM 0 H ASN A 556 6.944 11.031 0.250 1.00 0.00 H new ATOM 0 HA ASN A 556 6.468 13.676 -0.854 1.00 0.00 H new ATOM 0 HB2 ASN A 556 5.465 13.485 1.574 1.00 0.00 H new ATOM 0 HB3 ASN A 556 7.141 13.484 2.088 1.00 0.00 H new ATOM 0 HD21 ASN A 556 5.638 17.004 1.922 1.00 0.00 H new ATOM 0 HD22 ASN A 556 5.034 15.481 2.582 1.00 0.00 H new ATOM 1303 N PRO A 557 8.905 13.577 -1.267 1.00 0.00 N ATOM 1304 CA PRO A 557 8.072 14.138 -2.335 1.00 0.00 C ATOM 1305 C PRO A 557 7.267 13.067 -3.064 1.00 0.00 C ATOM 1306 O PRO A 557 7.443 11.873 -2.824 1.00 0.00 O ATOM 1307 CB PRO A 557 9.091 14.777 -3.281 1.00 0.00 C ATOM 1308 CG PRO A 557 10.354 14.023 -3.043 1.00 0.00 C ATOM 1309 CD PRO A 557 10.340 13.640 -1.589 1.00 0.00 C ATOM 0 HA PRO A 557 7.331 14.838 -1.949 1.00 0.00 H new ATOM 0 HB2 PRO A 557 8.772 14.696 -4.320 1.00 0.00 H new ATOM 0 HB3 PRO A 557 9.218 15.838 -3.068 1.00 0.00 H new ATOM 0 HG2 PRO A 557 10.407 13.139 -3.679 1.00 0.00 H new ATOM 0 HG3 PRO A 557 11.224 14.636 -3.277 1.00 0.00 H new ATOM 0 HD2 PRO A 557 10.832 12.682 -1.421 1.00 0.00 H new ATOM 0 HD3 PRO A 557 10.858 14.376 -0.974 1.00 0.00 H new ATOM 1317 N VAL A 558 6.384 13.503 -3.957 1.00 0.00 N ATOM 1318 CA VAL A 558 5.553 12.582 -4.723 1.00 0.00 C ATOM 1319 C VAL A 558 6.193 12.252 -6.067 1.00 0.00 C ATOM 1320 O VAL A 558 6.568 13.136 -6.838 1.00 0.00 O ATOM 1321 CB VAL A 558 4.147 13.163 -4.965 1.00 0.00 C ATOM 1322 CG1 VAL A 558 3.281 12.167 -5.721 1.00 0.00 C ATOM 1323 CG2 VAL A 558 3.498 13.553 -3.646 1.00 0.00 C ATOM 0 H VAL A 558 6.226 14.488 -4.168 1.00 0.00 H new ATOM 0 HA VAL A 558 5.464 11.670 -4.132 1.00 0.00 H new ATOM 0 HB VAL A 558 4.243 14.061 -5.575 1.00 0.00 H new ATOM 0 HG11 VAL A 558 2.292 12.595 -5.883 1.00 0.00 H new ATOM 0 HG12 VAL A 558 3.741 11.942 -6.683 1.00 0.00 H new ATOM 0 HG13 VAL A 558 3.189 11.250 -5.139 1.00 0.00 H new ATOM 0 HG21 VAL A 558 2.505 13.962 -3.836 1.00 0.00 H new ATOM 0 HG22 VAL A 558 3.412 12.673 -3.008 1.00 0.00 H new ATOM 0 HG23 VAL A 558 4.110 14.304 -3.147 1.00 0.00 H new ATOM 1333 N PRO A 559 6.322 10.949 -6.357 1.00 0.00 N ATOM 1334 CA PRO A 559 6.916 10.472 -7.610 1.00 0.00 C ATOM 1335 C PRO A 559 6.027 10.753 -8.817 1.00 0.00 C ATOM 1336 O PRO A 559 4.828 11.002 -8.690 1.00 0.00 O ATOM 1337 CB PRO A 559 7.052 8.964 -7.386 1.00 0.00 C ATOM 1338 CG PRO A 559 6.007 8.635 -6.376 1.00 0.00 C ATOM 1339 CD PRO A 559 5.897 9.841 -5.485 1.00 0.00 C ATOM 0 HA PRO A 559 7.860 10.971 -7.830 1.00 0.00 H new ATOM 0 HB2 PRO A 559 6.896 8.411 -8.312 1.00 0.00 H new ATOM 0 HB3 PRO A 559 8.047 8.706 -7.024 1.00 0.00 H new ATOM 0 HG2 PRO A 559 5.054 8.418 -6.858 1.00 0.00 H new ATOM 0 HG3 PRO A 559 6.284 7.750 -5.803 1.00 0.00 H new ATOM 0 HD2 PRO A 559 4.878 9.982 -5.124 1.00 0.00 H new ATOM 0 HD3 PRO A 559 6.537 9.752 -4.607 1.00 0.00 H new ATOM 1347 N PRO A 560 6.627 10.713 -10.016 1.00 0.00 N ATOM 1348 CA PRO A 560 5.908 10.960 -11.269 1.00 0.00 C ATOM 1349 C PRO A 560 4.933 9.838 -11.609 1.00 0.00 C ATOM 1350 O PRO A 560 4.225 9.900 -12.615 1.00 0.00 O ATOM 1351 CB PRO A 560 7.026 11.032 -12.312 1.00 0.00 C ATOM 1352 CG PRO A 560 8.139 10.230 -11.730 1.00 0.00 C ATOM 1353 CD PRO A 560 8.053 10.423 -10.241 1.00 0.00 C ATOM 0 HA PRO A 560 5.297 11.861 -11.217 1.00 0.00 H new ATOM 0 HB2 PRO A 560 6.702 10.623 -13.269 1.00 0.00 H new ATOM 0 HB3 PRO A 560 7.333 12.062 -12.493 1.00 0.00 H new ATOM 0 HG2 PRO A 560 8.041 9.177 -11.993 1.00 0.00 H new ATOM 0 HG3 PRO A 560 9.103 10.565 -12.112 1.00 0.00 H new ATOM 0 HD2 PRO A 560 8.372 9.531 -9.701 1.00 0.00 H new ATOM 0 HD3 PRO A 560 8.688 11.243 -9.905 1.00 0.00 H new ATOM 1361 N LEU A 561 4.902 8.812 -10.766 1.00 0.00 N ATOM 1362 CA LEU A 561 4.014 7.674 -10.977 1.00 0.00 C ATOM 1363 C LEU A 561 2.758 7.797 -10.119 1.00 0.00 C ATOM 1364 O LEU A 561 1.649 7.924 -10.638 1.00 0.00 O ATOM 1365 CB LEU A 561 4.740 6.368 -10.654 1.00 0.00 C ATOM 1366 CG LEU A 561 5.878 5.981 -11.599 1.00 0.00 C ATOM 1367 CD1 LEU A 561 6.597 4.741 -11.090 1.00 0.00 C ATOM 1368 CD2 LEU A 561 5.347 5.751 -13.007 1.00 0.00 C ATOM 0 H LEU A 561 5.482 8.745 -9.930 1.00 0.00 H new ATOM 0 HA LEU A 561 3.716 7.667 -12.026 1.00 0.00 H new ATOM 0 HB2 LEU A 561 5.142 6.440 -9.643 1.00 0.00 H new ATOM 0 HB3 LEU A 561 4.008 5.560 -10.649 1.00 0.00 H new ATOM 0 HG LEU A 561 6.593 6.803 -11.631 1.00 0.00 H new ATOM 0 HD11 LEU A 561 7.404 4.481 -11.776 1.00 0.00 H new ATOM 0 HD12 LEU A 561 7.011 4.940 -10.102 1.00 0.00 H new ATOM 0 HD13 LEU A 561 5.892 3.912 -11.028 1.00 0.00 H new ATOM 0 HD21 LEU A 561 6.171 5.476 -13.666 1.00 0.00 H new ATOM 0 HD22 LEU A 561 4.611 4.947 -12.992 1.00 0.00 H new ATOM 0 HD23 LEU A 561 4.879 6.665 -13.373 1.00 0.00 H new ATOM 1380 N VAL A 562 2.941 7.761 -8.803 1.00 0.00 N ATOM 1381 CA VAL A 562 1.824 7.872 -7.873 1.00 0.00 C ATOM 1382 C VAL A 562 0.842 8.949 -8.319 1.00 0.00 C ATOM 1383 O VAL A 562 -0.373 8.762 -8.249 1.00 0.00 O ATOM 1384 CB VAL A 562 2.311 8.196 -6.448 1.00 0.00 C ATOM 1385 CG1 VAL A 562 1.128 8.396 -5.512 1.00 0.00 C ATOM 1386 CG2 VAL A 562 3.227 7.095 -5.935 1.00 0.00 C ATOM 0 H VAL A 562 3.852 7.656 -8.357 1.00 0.00 H new ATOM 0 HA VAL A 562 1.320 6.905 -7.867 1.00 0.00 H new ATOM 0 HB VAL A 562 2.880 9.125 -6.480 1.00 0.00 H new ATOM 0 HG11 VAL A 562 1.491 8.624 -4.510 1.00 0.00 H new ATOM 0 HG12 VAL A 562 0.515 9.222 -5.872 1.00 0.00 H new ATOM 0 HG13 VAL A 562 0.529 7.486 -5.482 1.00 0.00 H new ATOM 0 HG21 VAL A 562 3.562 7.340 -4.927 1.00 0.00 H new ATOM 0 HG22 VAL A 562 2.685 6.150 -5.917 1.00 0.00 H new ATOM 0 HG23 VAL A 562 4.092 7.005 -6.593 1.00 0.00 H new ATOM 1396 N ARG A 563 1.375 10.075 -8.780 1.00 0.00 N ATOM 1397 CA ARG A 563 0.545 11.183 -9.238 1.00 0.00 C ATOM 1398 C ARG A 563 -0.059 10.880 -10.606 1.00 0.00 C ATOM 1399 O ARG A 563 -1.229 11.169 -10.855 1.00 0.00 O ATOM 1400 CB ARG A 563 1.368 12.471 -9.305 1.00 0.00 C ATOM 1401 CG ARG A 563 0.523 13.727 -9.443 1.00 0.00 C ATOM 1402 CD ARG A 563 0.119 14.278 -8.084 1.00 0.00 C ATOM 1403 NE ARG A 563 -0.925 15.293 -8.194 1.00 0.00 N ATOM 1404 CZ ARG A 563 -1.130 16.238 -7.283 1.00 0.00 C ATOM 1405 NH1 ARG A 563 -0.366 16.296 -6.200 1.00 0.00 N ATOM 1406 NH2 ARG A 563 -2.100 17.127 -7.453 1.00 0.00 N ATOM 0 H ARG A 563 2.379 10.245 -8.846 1.00 0.00 H new ATOM 0 HA ARG A 563 -0.267 11.316 -8.523 1.00 0.00 H new ATOM 0 HB2 ARG A 563 1.977 12.550 -8.405 1.00 0.00 H new ATOM 0 HB3 ARG A 563 2.054 12.410 -10.150 1.00 0.00 H new ATOM 0 HG2 ARG A 563 1.082 14.484 -9.993 1.00 0.00 H new ATOM 0 HG3 ARG A 563 -0.370 13.504 -10.027 1.00 0.00 H new ATOM 0 HD2 ARG A 563 -0.233 13.463 -7.452 1.00 0.00 H new ATOM 0 HD3 ARG A 563 0.992 14.708 -7.593 1.00 0.00 H new ATOM 0 HE ARG A 563 -1.530 15.276 -9.015 1.00 0.00 H new ATOM 0 HH11 ARG A 563 0.381 15.614 -6.065 1.00 0.00 H new ATOM 0 HH12 ARG A 563 -0.525 17.022 -5.502 1.00 0.00 H new ATOM 0 HH21 ARG A 563 -2.690 17.086 -8.284 1.00 0.00 H new ATOM 0 HH22 ARG A 563 -2.256 17.852 -6.753 1.00 0.00 H new ATOM 1420 N GLN A 564 0.748 10.297 -11.487 1.00 0.00 N ATOM 1421 CA GLN A 564 0.292 9.957 -12.830 1.00 0.00 C ATOM 1422 C GLN A 564 -0.853 8.951 -12.778 1.00 0.00 C ATOM 1423 O GLN A 564 -1.947 9.217 -13.273 1.00 0.00 O ATOM 1424 CB GLN A 564 1.449 9.389 -13.655 1.00 0.00 C ATOM 1425 CG GLN A 564 1.033 8.911 -15.036 1.00 0.00 C ATOM 1426 CD GLN A 564 2.137 8.154 -15.749 1.00 0.00 C ATOM 1427 OE1 GLN A 564 1.976 6.985 -16.102 1.00 0.00 O ATOM 1428 NE2 GLN A 564 3.266 8.818 -15.964 1.00 0.00 N ATOM 0 H GLN A 564 1.719 10.051 -11.295 1.00 0.00 H new ATOM 0 HA GLN A 564 -0.071 10.868 -13.305 1.00 0.00 H new ATOM 0 HB2 GLN A 564 2.219 10.154 -13.761 1.00 0.00 H new ATOM 0 HB3 GLN A 564 1.898 8.558 -13.112 1.00 0.00 H new ATOM 0 HG2 GLN A 564 0.157 8.269 -14.945 1.00 0.00 H new ATOM 0 HG3 GLN A 564 0.738 9.769 -15.640 1.00 0.00 H new ATOM 0 HE21 GLN A 564 3.355 9.786 -15.654 1.00 0.00 H new ATOM 0 HE22 GLN A 564 4.044 8.361 -16.439 1.00 0.00 H new ATOM 1437 N GLN A 565 -0.592 7.796 -12.175 1.00 0.00 N ATOM 1438 CA GLN A 565 -1.601 6.750 -12.060 1.00 0.00 C ATOM 1439 C GLN A 565 -2.330 6.841 -10.723 1.00 0.00 C ATOM 1440 O GLN A 565 -2.766 5.830 -10.172 1.00 0.00 O ATOM 1441 CB GLN A 565 -0.956 5.371 -12.209 1.00 0.00 C ATOM 1442 CG GLN A 565 -0.241 5.174 -13.536 1.00 0.00 C ATOM 1443 CD GLN A 565 -1.164 4.670 -14.628 1.00 0.00 C ATOM 1444 OE1 GLN A 565 -2.025 5.402 -15.116 1.00 0.00 O ATOM 1445 NE2 GLN A 565 -0.990 3.412 -15.017 1.00 0.00 N ATOM 0 H GLN A 565 0.309 7.561 -11.759 1.00 0.00 H new ATOM 0 HA GLN A 565 -2.328 6.892 -12.860 1.00 0.00 H new ATOM 0 HB2 GLN A 565 -0.244 5.222 -11.397 1.00 0.00 H new ATOM 0 HB3 GLN A 565 -1.725 4.606 -12.103 1.00 0.00 H new ATOM 0 HG2 GLN A 565 0.203 6.119 -13.849 1.00 0.00 H new ATOM 0 HG3 GLN A 565 0.577 4.466 -13.402 1.00 0.00 H new ATOM 0 HE21 GLN A 565 -0.264 2.840 -14.585 1.00 0.00 H new ATOM 0 HE22 GLN A 565 -1.583 3.017 -15.747 1.00 0.00 H new ATOM 1454 N ILE A 566 -2.457 8.059 -10.206 1.00 0.00 N ATOM 1455 CA ILE A 566 -3.133 8.281 -8.935 1.00 0.00 C ATOM 1456 C ILE A 566 -4.547 7.709 -8.956 1.00 0.00 C ATOM 1457 O ILE A 566 -5.008 7.130 -7.974 1.00 0.00 O ATOM 1458 CB ILE A 566 -3.204 9.781 -8.589 1.00 0.00 C ATOM 1459 CG1 ILE A 566 -3.964 9.989 -7.278 1.00 0.00 C ATOM 1460 CG2 ILE A 566 -3.865 10.554 -9.720 1.00 0.00 C ATOM 1461 CD1 ILE A 566 -3.247 9.432 -6.069 1.00 0.00 C ATOM 0 H ILE A 566 -2.101 8.906 -10.648 1.00 0.00 H new ATOM 0 HA ILE A 566 -2.547 7.767 -8.173 1.00 0.00 H new ATOM 0 HB ILE A 566 -2.189 10.158 -8.462 1.00 0.00 H new ATOM 0 HG12 ILE A 566 -4.133 11.056 -7.131 1.00 0.00 H new ATOM 0 HG13 ILE A 566 -4.944 9.519 -7.357 1.00 0.00 H new ATOM 0 HG21 ILE A 566 -3.908 11.612 -9.461 1.00 0.00 H new ATOM 0 HG22 ILE A 566 -3.286 10.427 -10.634 1.00 0.00 H new ATOM 0 HG23 ILE A 566 -4.876 10.177 -9.876 1.00 0.00 H new ATOM 0 HD11 ILE A 566 -3.844 9.615 -5.176 1.00 0.00 H new ATOM 0 HD12 ILE A 566 -3.102 8.359 -6.194 1.00 0.00 H new ATOM 0 HD13 ILE A 566 -2.278 9.919 -5.964 1.00 0.00 H new ATOM 1473 N ASN A 567 -5.230 7.876 -10.084 1.00 0.00 N ATOM 1474 CA ASN A 567 -6.591 7.375 -10.234 1.00 0.00 C ATOM 1475 C ASN A 567 -6.654 5.877 -9.949 1.00 0.00 C ATOM 1476 O ASN A 567 -7.517 5.414 -9.204 1.00 0.00 O ATOM 1477 CB ASN A 567 -7.108 7.658 -11.646 1.00 0.00 C ATOM 1478 CG ASN A 567 -7.258 9.142 -11.920 1.00 0.00 C ATOM 1479 OD1 ASN A 567 -8.100 9.813 -11.322 1.00 0.00 O ATOM 1480 ND2 ASN A 567 -6.441 9.661 -12.828 1.00 0.00 N ATOM 0 H ASN A 567 -4.863 8.354 -10.907 1.00 0.00 H new ATOM 0 HA ASN A 567 -7.223 7.892 -9.512 1.00 0.00 H new ATOM 0 HB2 ASN A 567 -6.423 7.224 -12.375 1.00 0.00 H new ATOM 0 HB3 ASN A 567 -8.071 7.167 -11.782 1.00 0.00 H new ATOM 0 HD21 ASN A 567 -6.496 10.654 -13.055 1.00 0.00 H new ATOM 0 HD22 ASN A 567 -5.758 9.067 -13.299 1.00 0.00 H new ATOM 1487 N GLU A 568 -5.734 5.127 -10.546 1.00 0.00 N ATOM 1488 CA GLU A 568 -5.686 3.682 -10.355 1.00 0.00 C ATOM 1489 C GLU A 568 -5.484 3.334 -8.883 1.00 0.00 C ATOM 1490 O GLU A 568 -6.204 2.506 -8.326 1.00 0.00 O ATOM 1491 CB GLU A 568 -4.560 3.072 -11.194 1.00 0.00 C ATOM 1492 CG GLU A 568 -4.779 1.607 -11.532 1.00 0.00 C ATOM 1493 CD GLU A 568 -6.201 1.315 -11.969 1.00 0.00 C ATOM 1494 OE1 GLU A 568 -6.634 1.882 -12.994 1.00 0.00 O ATOM 1495 OE2 GLU A 568 -6.882 0.521 -11.286 1.00 0.00 O ATOM 0 H GLU A 568 -5.012 5.495 -11.166 1.00 0.00 H new ATOM 0 HA GLU A 568 -6.639 3.266 -10.681 1.00 0.00 H new ATOM 0 HB2 GLU A 568 -4.460 3.639 -12.120 1.00 0.00 H new ATOM 0 HB3 GLU A 568 -3.619 3.175 -10.654 1.00 0.00 H new ATOM 0 HG2 GLU A 568 -4.092 1.315 -12.326 1.00 0.00 H new ATOM 0 HG3 GLU A 568 -4.538 0.997 -10.661 1.00 0.00 H new ATOM 1502 N MET A 569 -4.499 3.972 -8.260 1.00 0.00 N ATOM 1503 CA MET A 569 -4.202 3.730 -6.853 1.00 0.00 C ATOM 1504 C MET A 569 -5.454 3.898 -5.997 1.00 0.00 C ATOM 1505 O MET A 569 -5.794 3.024 -5.200 1.00 0.00 O ATOM 1506 CB MET A 569 -3.108 4.684 -6.369 1.00 0.00 C ATOM 1507 CG MET A 569 -1.806 4.557 -7.143 1.00 0.00 C ATOM 1508 SD MET A 569 -1.024 2.946 -6.929 1.00 0.00 S ATOM 1509 CE MET A 569 0.243 3.342 -5.727 1.00 0.00 C ATOM 0 H MET A 569 -3.893 4.660 -8.707 1.00 0.00 H new ATOM 0 HA MET A 569 -3.849 2.704 -6.753 1.00 0.00 H new ATOM 0 HB2 MET A 569 -3.470 5.709 -6.448 1.00 0.00 H new ATOM 0 HB3 MET A 569 -2.914 4.495 -5.313 1.00 0.00 H new ATOM 0 HG2 MET A 569 -2.000 4.724 -8.202 1.00 0.00 H new ATOM 0 HG3 MET A 569 -1.117 5.337 -6.818 1.00 0.00 H new ATOM 0 HE1 MET A 569 0.671 2.420 -5.333 1.00 0.00 H new ATOM 0 HE2 MET A 569 1.026 3.931 -6.204 1.00 0.00 H new ATOM 0 HE3 MET A 569 -0.196 3.916 -4.911 1.00 0.00 H new ATOM 1519 N HIS A 570 -6.134 5.027 -6.167 1.00 0.00 N ATOM 1520 CA HIS A 570 -7.349 5.309 -5.410 1.00 0.00 C ATOM 1521 C HIS A 570 -8.347 4.162 -5.537 1.00 0.00 C ATOM 1522 O HIS A 570 -8.916 3.707 -4.544 1.00 0.00 O ATOM 1523 CB HIS A 570 -7.986 6.612 -5.894 1.00 0.00 C ATOM 1524 CG HIS A 570 -9.390 6.807 -5.411 1.00 0.00 C ATOM 1525 ND1 HIS A 570 -10.301 7.621 -6.052 1.00 0.00 N ATOM 1526 CD2 HIS A 570 -10.039 6.288 -4.342 1.00 0.00 C ATOM 1527 CE1 HIS A 570 -11.448 7.595 -5.398 1.00 0.00 C ATOM 1528 NE2 HIS A 570 -11.316 6.793 -4.357 1.00 0.00 N ATOM 0 H HIS A 570 -5.865 5.761 -6.822 1.00 0.00 H new ATOM 0 HA HIS A 570 -7.077 5.415 -4.360 1.00 0.00 H new ATOM 0 HB2 HIS A 570 -7.376 7.451 -5.560 1.00 0.00 H new ATOM 0 HB3 HIS A 570 -7.980 6.627 -6.984 1.00 0.00 H new ATOM 0 HD1 HIS A 570 -10.117 8.159 -6.899 1.00 0.00 H new ATOM 0 HD2 HIS A 570 -9.629 5.604 -3.613 1.00 0.00 H new ATOM 0 HE1 HIS A 570 -12.342 8.137 -5.668 1.00 0.00 H new ATOM 1536 N LEU A 571 -8.555 3.700 -6.765 1.00 0.00 N ATOM 1537 CA LEU A 571 -9.486 2.606 -7.023 1.00 0.00 C ATOM 1538 C LEU A 571 -9.155 1.394 -6.157 1.00 0.00 C ATOM 1539 O LEU A 571 -10.040 0.797 -5.543 1.00 0.00 O ATOM 1540 CB LEU A 571 -9.448 2.216 -8.501 1.00 0.00 C ATOM 1541 CG LEU A 571 -9.977 3.260 -9.485 1.00 0.00 C ATOM 1542 CD1 LEU A 571 -9.699 2.833 -10.918 1.00 0.00 C ATOM 1543 CD2 LEU A 571 -11.467 3.485 -9.273 1.00 0.00 C ATOM 0 H LEU A 571 -8.092 4.065 -7.597 1.00 0.00 H new ATOM 0 HA LEU A 571 -10.489 2.948 -6.769 1.00 0.00 H new ATOM 0 HB2 LEU A 571 -8.417 1.984 -8.768 1.00 0.00 H new ATOM 0 HB3 LEU A 571 -10.025 1.300 -8.629 1.00 0.00 H new ATOM 0 HG LEU A 571 -9.458 4.201 -9.301 1.00 0.00 H new ATOM 0 HD11 LEU A 571 -10.083 3.588 -11.604 1.00 0.00 H new ATOM 0 HD12 LEU A 571 -8.624 2.724 -11.063 1.00 0.00 H new ATOM 0 HD13 LEU A 571 -10.191 1.880 -11.116 1.00 0.00 H new ATOM 0 HD21 LEU A 571 -11.827 4.231 -9.982 1.00 0.00 H new ATOM 0 HD22 LEU A 571 -12.002 2.548 -9.429 1.00 0.00 H new ATOM 0 HD23 LEU A 571 -11.641 3.837 -8.256 1.00 0.00 H new ATOM 1555 N LEU A 572 -7.876 1.038 -6.110 1.00 0.00 N ATOM 1556 CA LEU A 572 -7.428 -0.101 -5.317 1.00 0.00 C ATOM 1557 C LEU A 572 -7.837 0.057 -3.857 1.00 0.00 C ATOM 1558 O LEU A 572 -8.386 -0.865 -3.252 1.00 0.00 O ATOM 1559 CB LEU A 572 -5.909 -0.253 -5.420 1.00 0.00 C ATOM 1560 CG LEU A 572 -5.331 -0.276 -6.835 1.00 0.00 C ATOM 1561 CD1 LEU A 572 -3.811 -0.253 -6.791 1.00 0.00 C ATOM 1562 CD2 LEU A 572 -5.826 -1.499 -7.593 1.00 0.00 C ATOM 0 H LEU A 572 -7.131 1.522 -6.612 1.00 0.00 H new ATOM 0 HA LEU A 572 -7.905 -0.998 -5.713 1.00 0.00 H new ATOM 0 HB2 LEU A 572 -5.444 0.567 -4.873 1.00 0.00 H new ATOM 0 HB3 LEU A 572 -5.621 -1.176 -4.917 1.00 0.00 H new ATOM 0 HG LEU A 572 -5.672 0.616 -7.361 1.00 0.00 H new ATOM 0 HD11 LEU A 572 -3.417 -0.270 -7.807 1.00 0.00 H new ATOM 0 HD12 LEU A 572 -3.475 0.653 -6.287 1.00 0.00 H new ATOM 0 HD13 LEU A 572 -3.449 -1.126 -6.247 1.00 0.00 H new ATOM 0 HD21 LEU A 572 -5.405 -1.499 -8.598 1.00 0.00 H new ATOM 0 HD22 LEU A 572 -5.515 -2.403 -7.069 1.00 0.00 H new ATOM 0 HD23 LEU A 572 -6.914 -1.473 -7.656 1.00 0.00 H new ATOM 1574 N ILE A 573 -7.569 1.232 -3.296 1.00 0.00 N ATOM 1575 CA ILE A 573 -7.913 1.512 -1.908 1.00 0.00 C ATOM 1576 C ILE A 573 -9.401 1.296 -1.656 1.00 0.00 C ATOM 1577 O ILE A 573 -9.796 0.799 -0.601 1.00 0.00 O ATOM 1578 CB ILE A 573 -7.541 2.954 -1.515 1.00 0.00 C ATOM 1579 CG1 ILE A 573 -6.059 3.215 -1.793 1.00 0.00 C ATOM 1580 CG2 ILE A 573 -7.862 3.203 -0.049 1.00 0.00 C ATOM 1581 CD1 ILE A 573 -5.130 2.297 -1.029 1.00 0.00 C ATOM 0 H ILE A 573 -7.115 2.005 -3.782 1.00 0.00 H new ATOM 0 HA ILE A 573 -7.339 0.818 -1.295 1.00 0.00 H new ATOM 0 HB ILE A 573 -8.132 3.643 -2.118 1.00 0.00 H new ATOM 0 HG12 ILE A 573 -5.872 3.101 -2.861 1.00 0.00 H new ATOM 0 HG13 ILE A 573 -5.826 4.249 -1.538 1.00 0.00 H new ATOM 0 HG21 ILE A 573 -7.593 4.226 0.214 1.00 0.00 H new ATOM 0 HG22 ILE A 573 -8.928 3.053 0.121 1.00 0.00 H new ATOM 0 HG23 ILE A 573 -7.295 2.509 0.571 1.00 0.00 H new ATOM 0 HD11 ILE A 573 -4.096 2.539 -1.275 1.00 0.00 H new ATOM 0 HD12 ILE A 573 -5.289 2.428 0.041 1.00 0.00 H new ATOM 0 HD13 ILE A 573 -5.335 1.262 -1.302 1.00 0.00 H new ATOM 1593 N GLN A 574 -10.222 1.672 -2.631 1.00 0.00 N ATOM 1594 CA GLN A 574 -11.667 1.518 -2.515 1.00 0.00 C ATOM 1595 C GLN A 574 -12.068 0.050 -2.609 1.00 0.00 C ATOM 1596 O GLN A 574 -13.063 -0.370 -2.020 1.00 0.00 O ATOM 1597 CB GLN A 574 -12.376 2.324 -3.606 1.00 0.00 C ATOM 1598 CG GLN A 574 -12.058 3.810 -3.569 1.00 0.00 C ATOM 1599 CD GLN A 574 -12.835 4.546 -2.495 1.00 0.00 C ATOM 1600 OE1 GLN A 574 -13.912 5.086 -2.752 1.00 0.00 O ATOM 1601 NE2 GLN A 574 -12.292 4.573 -1.284 1.00 0.00 N ATOM 0 H GLN A 574 -9.911 2.085 -3.510 1.00 0.00 H new ATOM 0 HA GLN A 574 -11.970 1.896 -1.539 1.00 0.00 H new ATOM 0 HB2 GLN A 574 -12.095 1.925 -4.581 1.00 0.00 H new ATOM 0 HB3 GLN A 574 -13.453 2.189 -3.504 1.00 0.00 H new ATOM 0 HG2 GLN A 574 -10.990 3.945 -3.397 1.00 0.00 H new ATOM 0 HG3 GLN A 574 -12.282 4.250 -4.541 1.00 0.00 H new ATOM 0 HE21 GLN A 574 -11.398 4.112 -1.116 1.00 0.00 H new ATOM 0 HE22 GLN A 574 -12.769 5.055 -0.522 1.00 0.00 H new ATOM 1610 N GLN A 575 -11.286 -0.725 -3.354 1.00 0.00 N ATOM 1611 CA GLN A 575 -11.561 -2.147 -3.525 1.00 0.00 C ATOM 1612 C GLN A 575 -11.274 -2.916 -2.240 1.00 0.00 C ATOM 1613 O GLN A 575 -11.946 -3.898 -1.929 1.00 0.00 O ATOM 1614 CB GLN A 575 -10.722 -2.715 -4.671 1.00 0.00 C ATOM 1615 CG GLN A 575 -11.134 -2.199 -6.040 1.00 0.00 C ATOM 1616 CD GLN A 575 -10.345 -2.837 -7.167 1.00 0.00 C ATOM 1617 OE1 GLN A 575 -9.259 -2.375 -7.518 1.00 0.00 O ATOM 1618 NE2 GLN A 575 -10.887 -3.905 -7.739 1.00 0.00 N ATOM 0 H GLN A 575 -10.458 -0.393 -3.848 1.00 0.00 H new ATOM 0 HA GLN A 575 -12.618 -2.261 -3.766 1.00 0.00 H new ATOM 0 HB2 GLN A 575 -9.674 -2.469 -4.500 1.00 0.00 H new ATOM 0 HB3 GLN A 575 -10.800 -3.802 -4.663 1.00 0.00 H new ATOM 0 HG2 GLN A 575 -12.196 -2.391 -6.192 1.00 0.00 H new ATOM 0 HG3 GLN A 575 -10.997 -1.118 -6.073 1.00 0.00 H new ATOM 0 HE21 GLN A 575 -11.789 -4.254 -7.416 1.00 0.00 H new ATOM 0 HE22 GLN A 575 -10.401 -4.377 -8.502 1.00 0.00 H new ATOM 1627 N ALA A 576 -10.270 -2.462 -1.496 1.00 0.00 N ATOM 1628 CA ALA A 576 -9.895 -3.106 -0.243 1.00 0.00 C ATOM 1629 C ALA A 576 -10.772 -2.622 0.907 1.00 0.00 C ATOM 1630 O ALA A 576 -10.966 -3.333 1.893 1.00 0.00 O ATOM 1631 CB ALA A 576 -8.428 -2.848 0.064 1.00 0.00 C ATOM 0 H ALA A 576 -9.702 -1.651 -1.740 1.00 0.00 H new ATOM 0 HA ALA A 576 -10.048 -4.179 -0.354 1.00 0.00 H new ATOM 0 HB1 ALA A 576 -8.162 -3.335 1.002 1.00 0.00 H new ATOM 0 HB2 ALA A 576 -7.812 -3.249 -0.741 1.00 0.00 H new ATOM 0 HB3 ALA A 576 -8.258 -1.775 0.151 1.00 0.00 H new ATOM 1637 N ARG A 577 -11.298 -1.409 0.773 1.00 0.00 N ATOM 1638 CA ARG A 577 -12.153 -0.830 1.803 1.00 0.00 C ATOM 1639 C ARG A 577 -13.598 -1.289 1.632 1.00 0.00 C ATOM 1640 O ARG A 577 -14.261 -1.656 2.601 1.00 0.00 O ATOM 1641 CB ARG A 577 -12.083 0.698 1.754 1.00 0.00 C ATOM 1642 CG ARG A 577 -12.472 1.367 3.062 1.00 0.00 C ATOM 1643 CD ARG A 577 -11.928 2.785 3.145 1.00 0.00 C ATOM 1644 NE ARG A 577 -12.662 3.597 4.112 1.00 0.00 N ATOM 1645 CZ ARG A 577 -12.553 3.451 5.428 1.00 0.00 C ATOM 1646 NH1 ARG A 577 -11.744 2.530 5.931 1.00 0.00 N ATOM 1647 NH2 ARG A 577 -13.254 4.229 6.243 1.00 0.00 N ATOM 0 H ARG A 577 -11.148 -0.808 -0.038 1.00 0.00 H new ATOM 0 HA ARG A 577 -11.793 -1.173 2.773 1.00 0.00 H new ATOM 0 HB2 ARG A 577 -11.069 0.999 1.489 1.00 0.00 H new ATOM 0 HB3 ARG A 577 -12.739 1.058 0.962 1.00 0.00 H new ATOM 0 HG2 ARG A 577 -13.558 1.387 3.153 1.00 0.00 H new ATOM 0 HG3 ARG A 577 -12.092 0.781 3.899 1.00 0.00 H new ATOM 0 HD2 ARG A 577 -10.875 2.753 3.424 1.00 0.00 H new ATOM 0 HD3 ARG A 577 -11.984 3.253 2.162 1.00 0.00 H new ATOM 0 HE ARG A 577 -13.293 4.316 3.757 1.00 0.00 H new ATOM 0 HH11 ARG A 577 -11.203 1.931 5.307 1.00 0.00 H new ATOM 0 HH12 ARG A 577 -11.662 2.420 6.942 1.00 0.00 H new ATOM 0 HH21 ARG A 577 -13.877 4.940 5.859 1.00 0.00 H new ATOM 0 HH22 ARG A 577 -13.170 4.116 7.253 1.00 0.00 H new ATOM 1661 N GLU A 578 -14.078 -1.265 0.392 1.00 0.00 N ATOM 1662 CA GLU A 578 -15.445 -1.677 0.095 1.00 0.00 C ATOM 1663 C GLU A 578 -15.754 -3.031 0.728 1.00 0.00 C ATOM 1664 O GLU A 578 -16.845 -3.247 1.255 1.00 0.00 O ATOM 1665 CB GLU A 578 -15.663 -1.748 -1.418 1.00 0.00 C ATOM 1666 CG GLU A 578 -14.790 -2.780 -2.111 1.00 0.00 C ATOM 1667 CD GLU A 578 -15.112 -2.920 -3.586 1.00 0.00 C ATOM 1668 OE1 GLU A 578 -15.701 -1.978 -4.156 1.00 0.00 O ATOM 1669 OE2 GLU A 578 -14.776 -3.971 -4.170 1.00 0.00 O ATOM 0 H GLU A 578 -13.541 -0.965 -0.422 1.00 0.00 H new ATOM 0 HA GLU A 578 -16.121 -0.934 0.518 1.00 0.00 H new ATOM 0 HB2 GLU A 578 -16.710 -1.979 -1.615 1.00 0.00 H new ATOM 0 HB3 GLU A 578 -15.466 -0.768 -1.851 1.00 0.00 H new ATOM 0 HG2 GLU A 578 -13.743 -2.500 -1.996 1.00 0.00 H new ATOM 0 HG3 GLU A 578 -14.917 -3.746 -1.622 1.00 0.00 H new ATOM 1676 N MET A 579 -14.786 -3.940 0.670 1.00 0.00 N ATOM 1677 CA MET A 579 -14.954 -5.272 1.238 1.00 0.00 C ATOM 1678 C MET A 579 -14.956 -5.218 2.762 1.00 0.00 C ATOM 1679 O MET A 579 -14.222 -4.447 3.381 1.00 0.00 O ATOM 1680 CB MET A 579 -13.841 -6.202 0.751 1.00 0.00 C ATOM 1681 CG MET A 579 -12.443 -5.686 1.052 1.00 0.00 C ATOM 1682 SD MET A 579 -11.963 -5.942 2.771 1.00 0.00 S ATOM 1683 CE MET A 579 -11.818 -7.726 2.819 1.00 0.00 C ATOM 0 H MET A 579 -13.877 -3.778 0.235 1.00 0.00 H new ATOM 0 HA MET A 579 -15.916 -5.662 0.905 1.00 0.00 H new ATOM 0 HB2 MET A 579 -13.966 -7.180 1.216 1.00 0.00 H new ATOM 0 HB3 MET A 579 -13.943 -6.345 -0.325 1.00 0.00 H new ATOM 0 HG2 MET A 579 -11.727 -6.187 0.401 1.00 0.00 H new ATOM 0 HG3 MET A 579 -12.395 -4.622 0.820 1.00 0.00 H new ATOM 0 HE1 MET A 579 -11.969 -8.076 3.840 1.00 0.00 H new ATOM 0 HE2 MET A 579 -12.571 -8.170 2.168 1.00 0.00 H new ATOM 0 HE3 MET A 579 -10.825 -8.020 2.478 1.00 0.00 H new ATOM 1693 N PRO A 580 -15.801 -6.054 3.385 1.00 0.00 N ATOM 1694 CA PRO A 580 -15.918 -6.119 4.844 1.00 0.00 C ATOM 1695 C PRO A 580 -14.681 -6.725 5.499 1.00 0.00 C ATOM 1696 O PRO A 580 -13.962 -7.513 4.882 1.00 0.00 O ATOM 1697 CB PRO A 580 -17.135 -7.022 5.062 1.00 0.00 C ATOM 1698 CG PRO A 580 -17.207 -7.864 3.835 1.00 0.00 C ATOM 1699 CD PRO A 580 -16.706 -7.000 2.711 1.00 0.00 C ATOM 0 HA PRO A 580 -16.019 -5.129 5.289 1.00 0.00 H new ATOM 0 HB2 PRO A 580 -17.018 -7.634 5.956 1.00 0.00 H new ATOM 0 HB3 PRO A 580 -18.044 -6.436 5.194 1.00 0.00 H new ATOM 0 HG2 PRO A 580 -16.596 -8.761 3.940 1.00 0.00 H new ATOM 0 HG3 PRO A 580 -18.229 -8.195 3.648 1.00 0.00 H new ATOM 0 HD2 PRO A 580 -16.184 -7.587 1.955 1.00 0.00 H new ATOM 0 HD3 PRO A 580 -17.523 -6.484 2.206 1.00 0.00 H new ATOM 1707 N LEU A 581 -14.438 -6.354 6.751 1.00 0.00 N ATOM 1708 CA LEU A 581 -13.287 -6.862 7.490 1.00 0.00 C ATOM 1709 C LEU A 581 -13.452 -8.346 7.802 1.00 0.00 C ATOM 1710 O LEU A 581 -14.556 -8.888 7.729 1.00 0.00 O ATOM 1711 CB LEU A 581 -13.102 -6.074 8.788 1.00 0.00 C ATOM 1712 CG LEU A 581 -12.662 -4.618 8.632 1.00 0.00 C ATOM 1713 CD1 LEU A 581 -13.196 -3.773 9.778 1.00 0.00 C ATOM 1714 CD2 LEU A 581 -11.145 -4.524 8.560 1.00 0.00 C ATOM 0 H LEU A 581 -15.022 -5.703 7.276 1.00 0.00 H new ATOM 0 HA LEU A 581 -12.402 -6.737 6.866 1.00 0.00 H new ATOM 0 HB2 LEU A 581 -14.043 -6.091 9.337 1.00 0.00 H new ATOM 0 HB3 LEU A 581 -12.365 -6.592 9.402 1.00 0.00 H new ATOM 0 HG LEU A 581 -13.075 -4.232 7.700 1.00 0.00 H new ATOM 0 HD11 LEU A 581 -12.873 -2.740 9.650 1.00 0.00 H new ATOM 0 HD12 LEU A 581 -14.285 -3.814 9.784 1.00 0.00 H new ATOM 0 HD13 LEU A 581 -12.813 -4.158 10.723 1.00 0.00 H new ATOM 0 HD21 LEU A 581 -10.850 -3.481 8.449 1.00 0.00 H new ATOM 0 HD22 LEU A 581 -10.712 -4.928 9.475 1.00 0.00 H new ATOM 0 HD23 LEU A 581 -10.785 -5.096 7.705 1.00 0.00 H new ATOM 1726 N LEU A 582 -12.349 -8.998 8.151 1.00 0.00 N ATOM 1727 CA LEU A 582 -12.370 -10.420 8.476 1.00 0.00 C ATOM 1728 C LEU A 582 -13.393 -11.159 7.619 1.00 0.00 C ATOM 1729 O LEU A 582 -14.223 -11.910 8.133 1.00 0.00 O ATOM 1730 CB LEU A 582 -12.691 -10.619 9.959 1.00 0.00 C ATOM 1731 CG LEU A 582 -13.864 -9.805 10.507 1.00 0.00 C ATOM 1732 CD1 LEU A 582 -15.185 -10.479 10.168 1.00 0.00 C ATOM 1733 CD2 LEU A 582 -13.728 -9.620 12.011 1.00 0.00 C ATOM 0 H LEU A 582 -11.428 -8.565 8.216 1.00 0.00 H new ATOM 0 HA LEU A 582 -11.383 -10.831 8.266 1.00 0.00 H new ATOM 0 HB2 LEU A 582 -12.898 -11.676 10.127 1.00 0.00 H new ATOM 0 HB3 LEU A 582 -11.802 -10.373 10.539 1.00 0.00 H new ATOM 0 HG LEU A 582 -13.850 -8.821 10.038 1.00 0.00 H new ATOM 0 HD11 LEU A 582 -16.009 -9.886 10.566 1.00 0.00 H new ATOM 0 HD12 LEU A 582 -15.285 -10.559 9.086 1.00 0.00 H new ATOM 0 HD13 LEU A 582 -15.209 -11.475 10.610 1.00 0.00 H new ATOM 0 HD21 LEU A 582 -14.571 -9.039 12.384 1.00 0.00 H new ATOM 0 HD22 LEU A 582 -13.716 -10.595 12.498 1.00 0.00 H new ATOM 0 HD23 LEU A 582 -12.799 -9.094 12.230 1.00 0.00 H new ATOM 1745 N LYS A 583 -13.327 -10.943 6.310 1.00 0.00 N ATOM 1746 CA LYS A 583 -14.244 -11.591 5.380 1.00 0.00 C ATOM 1747 C LYS A 583 -14.616 -12.988 5.866 1.00 0.00 C ATOM 1748 O LYS A 583 -15.793 -13.306 6.030 1.00 0.00 O ATOM 1749 CB LYS A 583 -13.616 -11.674 3.987 1.00 0.00 C ATOM 1750 CG LYS A 583 -13.590 -10.346 3.251 1.00 0.00 C ATOM 1751 CD LYS A 583 -13.300 -10.534 1.771 1.00 0.00 C ATOM 1752 CE LYS A 583 -11.851 -10.931 1.534 1.00 0.00 C ATOM 1753 NZ LYS A 583 -11.475 -10.825 0.097 1.00 0.00 N ATOM 0 H LYS A 583 -12.647 -10.324 5.869 1.00 0.00 H new ATOM 0 HA LYS A 583 -15.152 -10.991 5.327 1.00 0.00 H new ATOM 0 HB2 LYS A 583 -12.597 -12.049 4.079 1.00 0.00 H new ATOM 0 HB3 LYS A 583 -14.170 -12.399 3.391 1.00 0.00 H new ATOM 0 HG2 LYS A 583 -14.549 -9.842 3.374 1.00 0.00 H new ATOM 0 HG3 LYS A 583 -12.831 -9.699 3.692 1.00 0.00 H new ATOM 0 HD2 LYS A 583 -13.960 -11.300 1.364 1.00 0.00 H new ATOM 0 HD3 LYS A 583 -13.517 -9.610 1.236 1.00 0.00 H new ATOM 0 HE2 LYS A 583 -11.198 -10.292 2.128 1.00 0.00 H new ATOM 0 HE3 LYS A 583 -11.694 -11.954 1.876 1.00 0.00 H new ATOM 0 HZ1 LYS A 583 -10.480 -11.104 -0.023 1.00 0.00 H new ATOM 0 HZ2 LYS A 583 -12.081 -11.453 -0.468 1.00 0.00 H new ATOM 0 HZ3 LYS A 583 -11.600 -9.843 -0.223 1.00 0.00 H new ATOM 1767 N SER A 584 -13.603 -13.818 6.097 1.00 0.00 N ATOM 1768 CA SER A 584 -13.824 -15.182 6.562 1.00 0.00 C ATOM 1769 C SER A 584 -14.245 -15.194 8.029 1.00 0.00 C ATOM 1770 O SER A 584 -13.516 -14.717 8.898 1.00 0.00 O ATOM 1771 CB SER A 584 -12.557 -16.018 6.377 1.00 0.00 C ATOM 1772 OG SER A 584 -12.672 -17.271 7.029 1.00 0.00 O ATOM 0 H SER A 584 -12.622 -13.569 5.970 1.00 0.00 H new ATOM 0 HA SER A 584 -14.627 -15.617 5.967 1.00 0.00 H new ATOM 0 HB2 SER A 584 -12.372 -16.173 5.314 1.00 0.00 H new ATOM 0 HB3 SER A 584 -11.699 -15.476 6.774 1.00 0.00 H new ATOM 0 HG SER A 584 -11.850 -17.787 6.894 1.00 0.00 H new ATOM 1778 N GLU A 585 -15.426 -15.743 8.295 1.00 0.00 N ATOM 1779 CA GLU A 585 -15.944 -15.817 9.655 1.00 0.00 C ATOM 1780 C GLU A 585 -15.530 -17.124 10.326 1.00 0.00 C ATOM 1781 O GLU A 585 -16.152 -18.166 10.116 1.00 0.00 O ATOM 1782 CB GLU A 585 -17.470 -15.694 9.651 1.00 0.00 C ATOM 1783 CG GLU A 585 -17.971 -14.362 9.120 1.00 0.00 C ATOM 1784 CD GLU A 585 -19.467 -14.360 8.869 1.00 0.00 C ATOM 1785 OE1 GLU A 585 -19.893 -14.896 7.824 1.00 0.00 O ATOM 1786 OE2 GLU A 585 -20.210 -13.823 9.716 1.00 0.00 O ATOM 0 H GLU A 585 -16.041 -16.143 7.587 1.00 0.00 H new ATOM 0 HA GLU A 585 -15.521 -14.988 10.222 1.00 0.00 H new ATOM 0 HB2 GLU A 585 -17.889 -16.498 9.046 1.00 0.00 H new ATOM 0 HB3 GLU A 585 -17.840 -15.833 10.667 1.00 0.00 H new ATOM 0 HG2 GLU A 585 -17.725 -13.575 9.833 1.00 0.00 H new ATOM 0 HG3 GLU A 585 -17.450 -14.126 8.192 1.00 0.00 H new ATOM 1793 N VAL A 586 -14.476 -17.060 11.132 1.00 0.00 N ATOM 1794 CA VAL A 586 -13.978 -18.238 11.834 1.00 0.00 C ATOM 1795 C VAL A 586 -14.180 -18.107 13.339 1.00 0.00 C ATOM 1796 O VAL A 586 -14.141 -19.096 14.070 1.00 0.00 O ATOM 1797 CB VAL A 586 -12.483 -18.472 11.547 1.00 0.00 C ATOM 1798 CG1 VAL A 586 -11.637 -17.392 12.203 1.00 0.00 C ATOM 1799 CG2 VAL A 586 -12.060 -19.854 12.021 1.00 0.00 C ATOM 0 H VAL A 586 -13.950 -16.206 11.316 1.00 0.00 H new ATOM 0 HA VAL A 586 -14.549 -19.090 11.466 1.00 0.00 H new ATOM 0 HB VAL A 586 -12.325 -18.418 10.470 1.00 0.00 H new ATOM 0 HG11 VAL A 586 -10.584 -17.575 11.989 1.00 0.00 H new ATOM 0 HG12 VAL A 586 -11.923 -16.417 11.810 1.00 0.00 H new ATOM 0 HG13 VAL A 586 -11.796 -17.410 13.281 1.00 0.00 H new ATOM 0 HG21 VAL A 586 -11.001 -20.003 11.810 1.00 0.00 H new ATOM 0 HG22 VAL A 586 -12.232 -19.939 13.094 1.00 0.00 H new ATOM 0 HG23 VAL A 586 -12.644 -20.612 11.499 1.00 0.00 H new ATOM 1809 N ALA A 587 -14.397 -16.878 13.797 1.00 0.00 N ATOM 1810 CA ALA A 587 -14.608 -16.617 15.215 1.00 0.00 C ATOM 1811 C ALA A 587 -15.079 -15.185 15.446 1.00 0.00 C ATOM 1812 O ALA A 587 -14.324 -14.234 15.245 1.00 0.00 O ATOM 1813 CB ALA A 587 -13.332 -16.888 15.998 1.00 0.00 C ATOM 0 H ALA A 587 -14.431 -16.048 13.206 1.00 0.00 H new ATOM 0 HA ALA A 587 -15.388 -17.290 15.570 1.00 0.00 H new ATOM 0 HB1 ALA A 587 -13.505 -16.689 17.056 1.00 0.00 H new ATOM 0 HB2 ALA A 587 -13.040 -17.930 15.868 1.00 0.00 H new ATOM 0 HB3 ALA A 587 -12.536 -16.240 15.632 1.00 0.00 H new ATOM 1819 N ALA A 588 -16.330 -15.039 15.869 1.00 0.00 N ATOM 1820 CA ALA A 588 -16.900 -13.723 16.128 1.00 0.00 C ATOM 1821 C ALA A 588 -16.103 -12.980 17.195 1.00 0.00 C ATOM 1822 O ALA A 588 -16.296 -13.196 18.391 1.00 0.00 O ATOM 1823 CB ALA A 588 -18.356 -13.852 16.549 1.00 0.00 C ATOM 0 H ALA A 588 -16.968 -15.816 16.040 1.00 0.00 H new ATOM 0 HA ALA A 588 -16.850 -13.145 15.205 1.00 0.00 H new ATOM 0 HB1 ALA A 588 -18.769 -12.861 16.739 1.00 0.00 H new ATOM 0 HB2 ALA A 588 -18.923 -14.335 15.753 1.00 0.00 H new ATOM 0 HB3 ALA A 588 -18.421 -14.452 17.457 1.00 0.00 H new ATOM 1829 N GLY A 589 -15.206 -12.103 16.754 1.00 0.00 N ATOM 1830 CA GLY A 589 -14.392 -11.342 17.684 1.00 0.00 C ATOM 1831 C GLY A 589 -15.187 -10.276 18.411 1.00 0.00 C ATOM 1832 O GLY A 589 -16.109 -9.686 17.848 1.00 0.00 O ATOM 0 H GLY A 589 -15.029 -11.906 15.769 1.00 0.00 H new ATOM 0 HA2 GLY A 589 -13.948 -12.020 18.413 1.00 0.00 H new ATOM 0 HA3 GLY A 589 -13.570 -10.873 17.143 1.00 0.00 H new ATOM 1836 N VAL A 590 -14.831 -10.029 19.668 1.00 0.00 N ATOM 1837 CA VAL A 590 -15.518 -9.027 20.474 1.00 0.00 C ATOM 1838 C VAL A 590 -14.613 -7.833 20.755 1.00 0.00 C ATOM 1839 O VAL A 590 -13.433 -7.993 21.065 1.00 0.00 O ATOM 1840 CB VAL A 590 -16.000 -9.618 21.813 1.00 0.00 C ATOM 1841 CG1 VAL A 590 -14.827 -10.176 22.604 1.00 0.00 C ATOM 1842 CG2 VAL A 590 -16.746 -8.567 22.620 1.00 0.00 C ATOM 0 H VAL A 590 -14.071 -10.509 20.150 1.00 0.00 H new ATOM 0 HA VAL A 590 -16.383 -8.696 19.899 1.00 0.00 H new ATOM 0 HB VAL A 590 -16.687 -10.437 21.602 1.00 0.00 H new ATOM 0 HG11 VAL A 590 -15.187 -10.589 23.546 1.00 0.00 H new ATOM 0 HG12 VAL A 590 -14.339 -10.961 22.026 1.00 0.00 H new ATOM 0 HG13 VAL A 590 -14.113 -9.378 22.807 1.00 0.00 H new ATOM 0 HG21 VAL A 590 -17.080 -9.001 23.563 1.00 0.00 H new ATOM 0 HG22 VAL A 590 -16.083 -7.726 22.822 1.00 0.00 H new ATOM 0 HG23 VAL A 590 -17.611 -8.220 22.054 1.00 0.00 H new ATOM 1852 N LYS A 591 -15.175 -6.634 20.645 1.00 0.00 N ATOM 1853 CA LYS A 591 -14.420 -5.410 20.888 1.00 0.00 C ATOM 1854 C LYS A 591 -14.768 -4.818 22.250 1.00 0.00 C ATOM 1855 O LYS A 591 -15.766 -5.194 22.866 1.00 0.00 O ATOM 1856 CB LYS A 591 -14.704 -4.385 19.788 1.00 0.00 C ATOM 1857 CG LYS A 591 -13.829 -4.555 18.558 1.00 0.00 C ATOM 1858 CD LYS A 591 -14.026 -3.416 17.571 1.00 0.00 C ATOM 1859 CE LYS A 591 -13.360 -3.713 16.237 1.00 0.00 C ATOM 1860 NZ LYS A 591 -13.850 -2.810 15.159 1.00 0.00 N ATOM 0 H LYS A 591 -16.151 -6.484 20.389 1.00 0.00 H new ATOM 0 HA LYS A 591 -13.359 -5.659 20.880 1.00 0.00 H new ATOM 0 HB2 LYS A 591 -15.750 -4.462 19.493 1.00 0.00 H new ATOM 0 HB3 LYS A 591 -14.559 -3.383 20.191 1.00 0.00 H new ATOM 0 HG2 LYS A 591 -12.782 -4.600 18.859 1.00 0.00 H new ATOM 0 HG3 LYS A 591 -14.062 -5.503 18.073 1.00 0.00 H new ATOM 0 HD2 LYS A 591 -15.092 -3.247 17.417 1.00 0.00 H new ATOM 0 HD3 LYS A 591 -13.614 -2.497 17.988 1.00 0.00 H new ATOM 0 HE2 LYS A 591 -12.280 -3.605 16.338 1.00 0.00 H new ATOM 0 HE3 LYS A 591 -13.552 -4.749 15.958 1.00 0.00 H new ATOM 0 HZ1 LYS A 591 -13.372 -3.045 14.266 1.00 0.00 H new ATOM 0 HZ2 LYS A 591 -14.877 -2.931 15.045 1.00 0.00 H new ATOM 0 HZ3 LYS A 591 -13.644 -1.823 15.413 1.00 0.00 H new ATOM 1874 N LYS A 592 -13.939 -3.890 22.716 1.00 0.00 N ATOM 1875 CA LYS A 592 -14.159 -3.243 24.004 1.00 0.00 C ATOM 1876 C LYS A 592 -15.126 -2.071 23.867 1.00 0.00 C ATOM 1877 O LYS A 592 -15.164 -1.404 22.833 1.00 0.00 O ATOM 1878 CB LYS A 592 -12.831 -2.757 24.588 1.00 0.00 C ATOM 1879 CG LYS A 592 -12.118 -3.801 25.429 1.00 0.00 C ATOM 1880 CD LYS A 592 -11.057 -3.172 26.317 1.00 0.00 C ATOM 1881 CE LYS A 592 -10.427 -4.199 27.246 1.00 0.00 C ATOM 1882 NZ LYS A 592 -9.474 -5.088 26.525 1.00 0.00 N ATOM 0 H LYS A 592 -13.108 -3.569 22.220 1.00 0.00 H new ATOM 0 HA LYS A 592 -14.599 -3.977 24.680 1.00 0.00 H new ATOM 0 HB2 LYS A 592 -12.176 -2.450 23.773 1.00 0.00 H new ATOM 0 HB3 LYS A 592 -13.014 -1.873 25.199 1.00 0.00 H new ATOM 0 HG2 LYS A 592 -12.844 -4.330 26.047 1.00 0.00 H new ATOM 0 HG3 LYS A 592 -11.655 -4.541 24.776 1.00 0.00 H new ATOM 0 HD2 LYS A 592 -10.284 -2.718 25.697 1.00 0.00 H new ATOM 0 HD3 LYS A 592 -11.503 -2.371 26.907 1.00 0.00 H new ATOM 0 HE2 LYS A 592 -9.905 -3.686 28.054 1.00 0.00 H new ATOM 0 HE3 LYS A 592 -11.210 -4.802 27.705 1.00 0.00 H new ATOM 0 HZ1 LYS A 592 -9.066 -5.774 27.192 1.00 0.00 H new ATOM 0 HZ2 LYS A 592 -9.977 -5.597 25.770 1.00 0.00 H new ATOM 0 HZ3 LYS A 592 -8.712 -4.515 26.108 1.00 0.00 H new ATOM 1896 N SER A 593 -15.904 -1.826 24.916 1.00 0.00 N ATOM 1897 CA SER A 593 -16.872 -0.735 24.911 1.00 0.00 C ATOM 1898 C SER A 593 -16.858 0.010 26.242 1.00 0.00 C ATOM 1899 O SER A 593 -16.557 -0.568 27.286 1.00 0.00 O ATOM 1900 CB SER A 593 -18.276 -1.273 24.629 1.00 0.00 C ATOM 1901 OG SER A 593 -18.476 -1.473 23.240 1.00 0.00 O ATOM 0 H SER A 593 -15.883 -2.368 25.780 1.00 0.00 H new ATOM 0 HA SER A 593 -16.592 -0.037 24.122 1.00 0.00 H new ATOM 0 HB2 SER A 593 -18.422 -2.214 25.160 1.00 0.00 H new ATOM 0 HB3 SER A 593 -19.020 -0.574 25.010 1.00 0.00 H new ATOM 0 HG SER A 593 -19.380 -1.819 23.086 1.00 0.00 H new ATOM 1907 N SER A 594 -17.186 1.297 26.196 1.00 0.00 N ATOM 1908 CA SER A 594 -17.208 2.123 27.398 1.00 0.00 C ATOM 1909 C SER A 594 -17.784 3.504 27.097 1.00 0.00 C ATOM 1910 O SER A 594 -18.023 3.851 25.941 1.00 0.00 O ATOM 1911 CB SER A 594 -15.798 2.260 27.974 1.00 0.00 C ATOM 1912 OG SER A 594 -14.890 2.730 26.993 1.00 0.00 O ATOM 0 H SER A 594 -17.440 1.790 25.340 1.00 0.00 H new ATOM 0 HA SER A 594 -17.847 1.634 28.134 1.00 0.00 H new ATOM 0 HB2 SER A 594 -15.812 2.947 28.820 1.00 0.00 H new ATOM 0 HB3 SER A 594 -15.461 1.295 28.353 1.00 0.00 H new ATOM 0 HG SER A 594 -13.996 2.811 27.387 1.00 0.00 H new ATOM 1918 N GLY A 595 -18.003 4.289 28.147 1.00 0.00 N ATOM 1919 CA GLY A 595 -18.548 5.623 27.976 1.00 0.00 C ATOM 1920 C GLY A 595 -19.877 5.801 28.684 1.00 0.00 C ATOM 1921 O GLY A 595 -20.943 5.558 28.118 1.00 0.00 O ATOM 0 H GLY A 595 -17.813 4.025 29.114 1.00 0.00 H new ATOM 0 HA2 GLY A 595 -17.836 6.355 28.357 1.00 0.00 H new ATOM 0 HA3 GLY A 595 -18.676 5.826 26.913 1.00 0.00 H new ATOM 1925 N PRO A 596 -19.823 6.235 29.952 1.00 0.00 N ATOM 1926 CA PRO A 596 -21.022 6.454 30.765 1.00 0.00 C ATOM 1927 C PRO A 596 -21.835 7.652 30.288 1.00 0.00 C ATOM 1928 O PRO A 596 -21.471 8.801 30.537 1.00 0.00 O ATOM 1929 CB PRO A 596 -20.459 6.714 32.165 1.00 0.00 C ATOM 1930 CG PRO A 596 -19.083 7.235 31.929 1.00 0.00 C ATOM 1931 CD PRO A 596 -18.586 6.545 30.689 1.00 0.00 C ATOM 0 HA PRO A 596 -21.707 5.608 30.716 1.00 0.00 H new ATOM 0 HB2 PRO A 596 -21.068 7.436 32.709 1.00 0.00 H new ATOM 0 HB3 PRO A 596 -20.440 5.801 32.760 1.00 0.00 H new ATOM 0 HG2 PRO A 596 -19.093 8.317 31.796 1.00 0.00 H new ATOM 0 HG3 PRO A 596 -18.435 7.024 32.779 1.00 0.00 H new ATOM 0 HD2 PRO A 596 -17.923 7.188 30.110 1.00 0.00 H new ATOM 0 HD3 PRO A 596 -18.024 5.642 30.929 1.00 0.00 H new ATOM 1939 N SER A 597 -22.939 7.376 29.600 1.00 0.00 N ATOM 1940 CA SER A 597 -23.803 8.432 29.084 1.00 0.00 C ATOM 1941 C SER A 597 -25.117 7.854 28.567 1.00 0.00 C ATOM 1942 O SER A 597 -25.197 6.674 28.226 1.00 0.00 O ATOM 1943 CB SER A 597 -23.094 9.199 27.966 1.00 0.00 C ATOM 1944 OG SER A 597 -23.952 10.169 27.390 1.00 0.00 O ATOM 0 H SER A 597 -23.256 6.430 29.387 1.00 0.00 H new ATOM 0 HA SER A 597 -24.025 9.118 29.901 1.00 0.00 H new ATOM 0 HB2 SER A 597 -22.204 9.686 28.363 1.00 0.00 H new ATOM 0 HB3 SER A 597 -22.760 8.502 27.197 1.00 0.00 H new ATOM 0 HG SER A 597 -23.475 10.647 26.679 1.00 0.00 H new ATOM 1950 N SER A 598 -26.144 8.696 28.511 1.00 0.00 N ATOM 1951 CA SER A 598 -27.456 8.270 28.039 1.00 0.00 C ATOM 1952 C SER A 598 -27.368 7.704 26.625 1.00 0.00 C ATOM 1953 O SER A 598 -26.785 8.319 25.733 1.00 0.00 O ATOM 1954 CB SER A 598 -28.439 9.442 28.071 1.00 0.00 C ATOM 1955 OG SER A 598 -28.813 9.758 29.400 1.00 0.00 O ATOM 0 H SER A 598 -26.093 9.677 28.787 1.00 0.00 H new ATOM 0 HA SER A 598 -27.816 7.485 28.704 1.00 0.00 H new ATOM 0 HB2 SER A 598 -27.985 10.314 27.601 1.00 0.00 H new ATOM 0 HB3 SER A 598 -29.327 9.192 27.490 1.00 0.00 H new ATOM 0 HG SER A 598 -29.440 10.511 29.393 1.00 0.00 H new ATOM 1961 N GLY A 599 -27.951 6.525 26.428 1.00 0.00 N ATOM 1962 CA GLY A 599 -27.927 5.895 25.121 1.00 0.00 C ATOM 1963 C GLY A 599 -29.315 5.720 24.536 1.00 0.00 C ATOM 1964 O GLY A 599 -29.467 5.222 23.421 1.00 0.00 O ATOM 0 H GLY A 599 -28.439 5.995 27.150 1.00 0.00 H new ATOM 0 HA2 GLY A 599 -27.323 6.497 24.442 1.00 0.00 H new ATOM 0 HA3 GLY A 599 -27.444 4.921 25.199 1.00 0.00 H new TER 1968 GLY A 599