USER MOD reduce.3.24.130724 H: found=0, std=0, add=993, rem=0, adj=31 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 592 LYS NZ :NH3+ -147:sc= -1.04 (180deg=-2.28!) USER MOD Set 1.2: A 593 SER OG : rot 38:sc= 0.391 USER MOD Set 2.1: A 570 HIS : no HE2:sc= -2.59 K(o=-5.8,f=-6.4) USER MOD Set 2.2: A 574 GLN : amide:sc= -3.16! K(o=-5.8!,f=-3.7) USER MOD Set 3.1: A 535 HIS : no HE2:sc= -3.71! C(o=-7.7!,f=-8!) USER MOD Set 3.2: A 536 MET CE :methyl -134:sc= -2.89 (180deg=-2.1!) USER MOD Set 3.3: A 555 CYS SG : rot -92:sc= -1.12 USER MOD Single : A 477 SER OG : rot 180:sc= 0 USER MOD Single : A 478 SER OG : rot 31:sc= 0.83 USER MOD Single : A 480 SER OG : rot 40:sc= 0.0189 USER MOD Single : A 481 SER OG : rot 53:sc= 1.21 USER MOD Single : A 483 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0155) USER MOD Single : A 487 THR OG1 : rot 180:sc= 0 USER MOD Single : A 490 SER OG : rot 180:sc= -2.36! USER MOD Single : A 491 TYR OH : rot 180:sc= 0 USER MOD Single : A 495 TYR OH : rot 180:sc= 0 USER MOD Single : A 497 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 498 GLN : amide:sc= 0 K(o=0,f=-0.92) USER MOD Single : A 499 LYS NZ :NH3+ 158:sc= -0.179 (180deg=-0.838) USER MOD Single : A 500 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 501 HIS : no HD1:sc=-0.00462 X(o=-0.0046,f=-0.027) USER MOD Single : A 503 ASN : amide:sc= -0.166 K(o=-0.17,f=-2!) USER MOD Single : A 504 THR OG1 : rot 180:sc= 0 USER MOD Single : A 505 GLN : amide:sc= 1.15 K(o=1.2,f=-0.75) USER MOD Single : A 506 GLN : amide:sc= -0.0937 K(o=-0.094,f=-9.2!) USER MOD Single : A 508 THR OG1 : rot 180:sc= 0 USER MOD Single : A 511 GLN : amide:sc= 0.00379 X(o=0.0038,f=0) USER MOD Single : A 519 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 520 THR OG1 : rot 139:sc= 0.0274 USER MOD Single : A 527 SER OG : rot 180:sc= 0 USER MOD Single : A 528 TYR OH : rot 1:sc= 0.478 USER MOD Single : A 530 TYR OH : rot 180:sc= 0 USER MOD Single : A 534 ASN : amide:sc= -0.567 K(o=-0.57,f=-1.8!) USER MOD Single : A 537 MET CE :methyl 168:sc= -0.574 (180deg=-1.16) USER MOD Single : A 539 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 546 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 549 GLN : amide:sc= -0.146 K(o=-0.15,f=-1.9!) USER MOD Single : A 554 CYS SG : rot -109:sc= -1.85! USER MOD Single : A 556 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 564 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 565 GLN : amide:sc= -0.0954 K(o=-0.095,f=-1.1) USER MOD Single : A 567 ASN : amide:sc= -0.314 X(o=-0.31,f=-0.31) USER MOD Single : A 569 MET CE :methyl -108:sc= -0.308 (180deg=-4.19!) USER MOD Single : A 575 GLN : amide:sc= -0.234 X(o=-0.23,f=0) USER MOD Single : A 579 MET CE :methyl 143:sc= -1.45 (180deg=-2.17!) USER MOD Single : A 583 LYS NZ :NH3+ -137:sc= -1.85 (180deg=-4.58!) 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 594 SER OG : rot -76:sc= 0.0489 USER MOD Single : A 597 SER OG : rot 180:sc=-0.00266 USER MOD Single : A 598 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 476 22.539 -17.182 -19.304 1.00 0.00 N ATOM 2 CA GLY A 476 21.421 -17.009 -18.396 1.00 0.00 C ATOM 3 C GLY A 476 20.081 -17.128 -19.096 1.00 0.00 C ATOM 4 O GLY A 476 19.466 -16.122 -19.448 1.00 0.00 O ATOM 0 HA2 GLY A 476 21.481 -17.756 -17.604 1.00 0.00 H new ATOM 0 HA3 GLY A 476 21.493 -16.032 -17.919 1.00 0.00 H new ATOM 8 N SER A 477 19.630 -18.361 -19.299 1.00 0.00 N ATOM 9 CA SER A 477 18.357 -18.609 -19.967 1.00 0.00 C ATOM 10 C SER A 477 17.285 -19.014 -18.960 1.00 0.00 C ATOM 11 O SER A 477 17.560 -19.735 -18.001 1.00 0.00 O ATOM 12 CB SER A 477 18.517 -19.701 -21.027 1.00 0.00 C ATOM 13 OG SER A 477 19.272 -19.233 -22.131 1.00 0.00 O ATOM 0 H SER A 477 20.126 -19.204 -19.011 1.00 0.00 H new ATOM 0 HA SER A 477 18.044 -17.685 -20.453 1.00 0.00 H new ATOM 0 HB2 SER A 477 19.009 -20.569 -20.588 1.00 0.00 H new ATOM 0 HB3 SER A 477 17.535 -20.029 -21.367 1.00 0.00 H new ATOM 0 HG SER A 477 19.362 -19.950 -22.793 1.00 0.00 H new ATOM 19 N SER A 478 16.062 -18.545 -19.186 1.00 0.00 N ATOM 20 CA SER A 478 14.948 -18.855 -18.298 1.00 0.00 C ATOM 21 C SER A 478 13.616 -18.504 -18.953 1.00 0.00 C ATOM 22 O SER A 478 13.308 -17.333 -19.168 1.00 0.00 O ATOM 23 CB SER A 478 15.096 -18.097 -16.977 1.00 0.00 C ATOM 24 OG SER A 478 14.972 -16.699 -17.175 1.00 0.00 O ATOM 0 H SER A 478 15.818 -17.949 -19.977 1.00 0.00 H new ATOM 0 HA SER A 478 14.962 -19.926 -18.098 1.00 0.00 H new ATOM 0 HB2 SER A 478 14.337 -18.436 -16.272 1.00 0.00 H new ATOM 0 HB3 SER A 478 16.066 -18.320 -16.533 1.00 0.00 H new ATOM 0 HG SER A 478 14.362 -16.527 -17.922 1.00 0.00 H new ATOM 30 N GLY A 479 12.830 -19.529 -19.268 1.00 0.00 N ATOM 31 CA GLY A 479 11.540 -19.309 -19.896 1.00 0.00 C ATOM 32 C GLY A 479 10.385 -19.523 -18.939 1.00 0.00 C ATOM 33 O GLY A 479 10.291 -20.566 -18.292 1.00 0.00 O ATOM 0 H GLY A 479 13.063 -20.508 -19.100 1.00 0.00 H new ATOM 0 HA2 GLY A 479 11.499 -18.293 -20.288 1.00 0.00 H new ATOM 0 HA3 GLY A 479 11.433 -19.983 -20.746 1.00 0.00 H new ATOM 37 N SER A 480 9.504 -18.532 -18.845 1.00 0.00 N ATOM 38 CA SER A 480 8.352 -18.614 -17.955 1.00 0.00 C ATOM 39 C SER A 480 7.285 -17.599 -18.352 1.00 0.00 C ATOM 40 O SER A 480 7.579 -16.421 -18.556 1.00 0.00 O ATOM 41 CB SER A 480 8.783 -18.379 -16.506 1.00 0.00 C ATOM 42 OG SER A 480 9.536 -17.185 -16.385 1.00 0.00 O ATOM 0 H SER A 480 9.566 -17.663 -19.375 1.00 0.00 H new ATOM 0 HA SER A 480 7.927 -19.614 -18.042 1.00 0.00 H new ATOM 0 HB2 SER A 480 7.902 -18.324 -15.866 1.00 0.00 H new ATOM 0 HB3 SER A 480 9.377 -19.224 -16.158 1.00 0.00 H new ATOM 0 HG SER A 480 9.138 -16.489 -16.949 1.00 0.00 H new ATOM 48 N SER A 481 6.045 -18.064 -18.459 1.00 0.00 N ATOM 49 CA SER A 481 4.933 -17.198 -18.835 1.00 0.00 C ATOM 50 C SER A 481 3.598 -17.904 -18.619 1.00 0.00 C ATOM 51 O SER A 481 3.555 -19.091 -18.301 1.00 0.00 O ATOM 52 CB SER A 481 5.066 -16.769 -20.297 1.00 0.00 C ATOM 53 OG SER A 481 5.879 -15.615 -20.418 1.00 0.00 O ATOM 0 H SER A 481 5.784 -19.036 -18.291 1.00 0.00 H new ATOM 0 HA SER A 481 4.962 -16.313 -18.200 1.00 0.00 H new ATOM 0 HB2 SER A 481 5.496 -17.583 -20.880 1.00 0.00 H new ATOM 0 HB3 SER A 481 4.078 -16.567 -20.711 1.00 0.00 H new ATOM 0 HG SER A 481 6.734 -15.768 -19.964 1.00 0.00 H new ATOM 59 N GLY A 482 2.509 -17.162 -18.795 1.00 0.00 N ATOM 60 CA GLY A 482 1.186 -17.732 -18.616 1.00 0.00 C ATOM 61 C GLY A 482 0.672 -17.568 -17.199 1.00 0.00 C ATOM 62 O GLY A 482 -0.492 -17.224 -16.989 1.00 0.00 O ATOM 0 H GLY A 482 2.519 -16.177 -19.058 1.00 0.00 H new ATOM 0 HA2 GLY A 482 0.492 -17.256 -19.309 1.00 0.00 H new ATOM 0 HA3 GLY A 482 1.213 -18.792 -18.869 1.00 0.00 H new ATOM 66 N LYS A 483 1.539 -17.816 -16.224 1.00 0.00 N ATOM 67 CA LYS A 483 1.167 -17.695 -14.819 1.00 0.00 C ATOM 68 C LYS A 483 1.560 -16.328 -14.268 1.00 0.00 C ATOM 69 O LYS A 483 2.526 -15.708 -14.712 1.00 0.00 O ATOM 70 CB LYS A 483 1.835 -18.800 -13.997 1.00 0.00 C ATOM 71 CG LYS A 483 1.211 -20.170 -14.198 1.00 0.00 C ATOM 72 CD LYS A 483 1.674 -20.807 -15.498 1.00 0.00 C ATOM 73 CE LYS A 483 1.004 -22.152 -15.729 1.00 0.00 C ATOM 74 NZ LYS A 483 1.500 -23.189 -14.782 1.00 0.00 N ATOM 0 H LYS A 483 2.505 -18.102 -16.381 1.00 0.00 H new ATOM 0 HA LYS A 483 0.085 -17.799 -14.745 1.00 0.00 H new ATOM 0 HB2 LYS A 483 2.891 -18.849 -14.261 1.00 0.00 H new ATOM 0 HB3 LYS A 483 1.782 -18.538 -12.940 1.00 0.00 H new ATOM 0 HG2 LYS A 483 1.473 -20.817 -13.361 1.00 0.00 H new ATOM 0 HG3 LYS A 483 0.125 -20.079 -14.203 1.00 0.00 H new ATOM 0 HD2 LYS A 483 1.451 -20.140 -16.331 1.00 0.00 H new ATOM 0 HD3 LYS A 483 2.756 -20.937 -15.475 1.00 0.00 H new ATOM 0 HE2 LYS A 483 -0.075 -22.044 -15.617 1.00 0.00 H new ATOM 0 HE3 LYS A 483 1.187 -22.478 -16.753 1.00 0.00 H new ATOM 0 HZ1 LYS A 483 1.057 -24.103 -15.005 1.00 0.00 H new ATOM 0 HZ2 LYS A 483 2.533 -23.274 -14.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 483 1.257 -22.915 -13.809 1.00 0.00 H new ATOM 88 N PRO A 484 0.795 -15.847 -13.277 1.00 0.00 N ATOM 89 CA PRO A 484 1.045 -14.549 -12.643 1.00 0.00 C ATOM 90 C PRO A 484 2.313 -14.553 -11.795 1.00 0.00 C ATOM 91 O PRO A 484 2.283 -14.918 -10.620 1.00 0.00 O ATOM 92 CB PRO A 484 -0.188 -14.342 -11.760 1.00 0.00 C ATOM 93 CG PRO A 484 -0.685 -15.717 -11.475 1.00 0.00 C ATOM 94 CD PRO A 484 -0.373 -16.532 -12.699 1.00 0.00 C ATOM 0 HA PRO A 484 1.197 -13.759 -13.378 1.00 0.00 H new ATOM 0 HB2 PRO A 484 0.067 -13.815 -10.841 1.00 0.00 H new ATOM 0 HB3 PRO A 484 -0.944 -13.745 -12.270 1.00 0.00 H new ATOM 0 HG2 PRO A 484 -0.197 -16.134 -10.594 1.00 0.00 H new ATOM 0 HG3 PRO A 484 -1.756 -15.711 -11.273 1.00 0.00 H new ATOM 0 HD2 PRO A 484 -0.146 -17.568 -12.445 1.00 0.00 H new ATOM 0 HD3 PRO A 484 -1.212 -16.551 -13.394 1.00 0.00 H new ATOM 102 N ILE A 485 3.424 -14.144 -12.399 1.00 0.00 N ATOM 103 CA ILE A 485 4.701 -14.100 -11.698 1.00 0.00 C ATOM 104 C ILE A 485 5.095 -12.665 -11.364 1.00 0.00 C ATOM 105 O ILE A 485 5.710 -11.974 -12.176 1.00 0.00 O ATOM 106 CB ILE A 485 5.823 -14.748 -12.530 1.00 0.00 C ATOM 107 CG1 ILE A 485 5.459 -16.193 -12.878 1.00 0.00 C ATOM 108 CG2 ILE A 485 7.142 -14.696 -11.773 1.00 0.00 C ATOM 109 CD1 ILE A 485 6.232 -16.743 -14.056 1.00 0.00 C ATOM 0 H ILE A 485 3.465 -13.839 -13.371 1.00 0.00 H new ATOM 0 HA ILE A 485 4.573 -14.664 -10.774 1.00 0.00 H new ATOM 0 HB ILE A 485 5.937 -14.188 -13.458 1.00 0.00 H new ATOM 0 HG12 ILE A 485 5.640 -16.824 -12.008 1.00 0.00 H new ATOM 0 HG13 ILE A 485 4.392 -16.248 -13.096 1.00 0.00 H new ATOM 0 HG21 ILE A 485 7.925 -15.158 -12.374 1.00 0.00 H new ATOM 0 HG22 ILE A 485 7.405 -13.658 -11.571 1.00 0.00 H new ATOM 0 HG23 ILE A 485 7.042 -15.235 -10.831 1.00 0.00 H new ATOM 0 HD11 ILE A 485 5.923 -17.771 -14.246 1.00 0.00 H new ATOM 0 HD12 ILE A 485 6.032 -16.135 -14.938 1.00 0.00 H new ATOM 0 HD13 ILE A 485 7.299 -16.720 -13.834 1.00 0.00 H new ATOM 121 N PHE A 486 4.738 -12.223 -10.163 1.00 0.00 N ATOM 122 CA PHE A 486 5.055 -10.870 -9.720 1.00 0.00 C ATOM 123 C PHE A 486 6.056 -10.895 -8.569 1.00 0.00 C ATOM 124 O PHE A 486 6.963 -10.065 -8.501 1.00 0.00 O ATOM 125 CB PHE A 486 3.782 -10.141 -9.288 1.00 0.00 C ATOM 126 CG PHE A 486 3.110 -9.395 -10.405 1.00 0.00 C ATOM 127 CD1 PHE A 486 3.841 -8.570 -11.243 1.00 0.00 C ATOM 128 CD2 PHE A 486 1.746 -9.518 -10.616 1.00 0.00 C ATOM 129 CE1 PHE A 486 3.226 -7.882 -12.273 1.00 0.00 C ATOM 130 CE2 PHE A 486 1.125 -8.833 -11.643 1.00 0.00 C ATOM 131 CZ PHE A 486 1.866 -8.013 -12.472 1.00 0.00 C ATOM 0 H PHE A 486 4.229 -12.782 -9.479 1.00 0.00 H new ATOM 0 HA PHE A 486 5.505 -10.336 -10.557 1.00 0.00 H new ATOM 0 HB2 PHE A 486 3.081 -10.865 -8.872 1.00 0.00 H new ATOM 0 HB3 PHE A 486 4.027 -9.440 -8.490 1.00 0.00 H new ATOM 0 HD1 PHE A 486 4.905 -8.462 -11.090 1.00 0.00 H new ATOM 0 HD2 PHE A 486 1.161 -10.157 -9.970 1.00 0.00 H new ATOM 0 HE1 PHE A 486 3.808 -7.243 -12.921 1.00 0.00 H new ATOM 0 HE2 PHE A 486 0.061 -8.939 -11.797 1.00 0.00 H new ATOM 0 HZ PHE A 486 1.382 -7.475 -13.274 1.00 0.00 H new ATOM 141 N THR A 487 5.885 -11.854 -7.664 1.00 0.00 N ATOM 142 CA THR A 487 6.771 -11.987 -6.515 1.00 0.00 C ATOM 143 C THR A 487 8.232 -12.022 -6.948 1.00 0.00 C ATOM 144 O THR A 487 8.743 -13.065 -7.359 1.00 0.00 O ATOM 145 CB THR A 487 6.456 -13.260 -5.707 1.00 0.00 C ATOM 146 OG1 THR A 487 5.121 -13.197 -5.193 1.00 0.00 O ATOM 147 CG2 THR A 487 7.440 -13.430 -4.559 1.00 0.00 C ATOM 0 H THR A 487 5.141 -12.550 -7.705 1.00 0.00 H new ATOM 0 HA THR A 487 6.603 -11.114 -5.884 1.00 0.00 H new ATOM 0 HB THR A 487 6.548 -14.118 -6.373 1.00 0.00 H new ATOM 0 HG1 THR A 487 4.928 -14.011 -4.682 1.00 0.00 H new ATOM 0 HG21 THR A 487 7.197 -14.336 -4.003 1.00 0.00 H new ATOM 0 HG22 THR A 487 8.452 -13.508 -4.956 1.00 0.00 H new ATOM 0 HG23 THR A 487 7.376 -12.568 -3.895 1.00 0.00 H new ATOM 155 N ASP A 488 8.900 -10.878 -6.853 1.00 0.00 N ATOM 156 CA ASP A 488 10.305 -10.779 -7.234 1.00 0.00 C ATOM 157 C ASP A 488 11.149 -10.270 -6.069 1.00 0.00 C ATOM 158 O ASP A 488 12.029 -10.973 -5.575 1.00 0.00 O ATOM 159 CB ASP A 488 10.464 -9.851 -8.439 1.00 0.00 C ATOM 160 CG ASP A 488 10.109 -10.533 -9.745 1.00 0.00 C ATOM 161 OD1 ASP A 488 9.003 -11.105 -9.834 1.00 0.00 O ATOM 162 OD2 ASP A 488 10.938 -10.495 -10.679 1.00 0.00 O ATOM 0 H ASP A 488 8.492 -10.006 -6.516 1.00 0.00 H new ATOM 0 HA ASP A 488 10.654 -11.776 -7.504 1.00 0.00 H new ATOM 0 HB2 ASP A 488 9.829 -8.975 -8.306 1.00 0.00 H new ATOM 0 HB3 ASP A 488 11.493 -9.495 -8.486 1.00 0.00 H new ATOM 167 N GLU A 489 10.874 -9.043 -5.637 1.00 0.00 N ATOM 168 CA GLU A 489 11.610 -8.440 -4.532 1.00 0.00 C ATOM 169 C GLU A 489 10.754 -8.394 -3.269 1.00 0.00 C ATOM 170 O GLU A 489 10.730 -7.389 -2.559 1.00 0.00 O ATOM 171 CB GLU A 489 12.066 -7.028 -4.904 1.00 0.00 C ATOM 172 CG GLU A 489 13.315 -7.000 -5.769 1.00 0.00 C ATOM 173 CD GLU A 489 13.923 -5.615 -5.871 1.00 0.00 C ATOM 174 OE1 GLU A 489 13.157 -4.629 -5.862 1.00 0.00 O ATOM 175 OE2 GLU A 489 15.165 -5.517 -5.959 1.00 0.00 O ATOM 0 H GLU A 489 10.148 -8.448 -6.035 1.00 0.00 H new ATOM 0 HA GLU A 489 12.487 -9.057 -4.334 1.00 0.00 H new ATOM 0 HB2 GLU A 489 11.258 -6.521 -5.431 1.00 0.00 H new ATOM 0 HB3 GLU A 489 12.254 -6.464 -3.991 1.00 0.00 H new ATOM 0 HG2 GLU A 489 14.054 -7.687 -5.357 1.00 0.00 H new ATOM 0 HG3 GLU A 489 13.069 -7.359 -6.768 1.00 0.00 H new ATOM 182 N SER A 490 10.052 -9.489 -2.997 1.00 0.00 N ATOM 183 CA SER A 490 9.191 -9.573 -1.823 1.00 0.00 C ATOM 184 C SER A 490 9.551 -10.786 -0.970 1.00 0.00 C ATOM 185 O SER A 490 10.364 -11.620 -1.369 1.00 0.00 O ATOM 186 CB SER A 490 7.722 -9.651 -2.246 1.00 0.00 C ATOM 187 OG SER A 490 7.374 -10.967 -2.639 1.00 0.00 O ATOM 0 H SER A 490 10.062 -10.330 -3.573 1.00 0.00 H new ATOM 0 HA SER A 490 9.343 -8.673 -1.227 1.00 0.00 H new ATOM 0 HB2 SER A 490 7.085 -9.334 -1.420 1.00 0.00 H new ATOM 0 HB3 SER A 490 7.541 -8.962 -3.071 1.00 0.00 H new ATOM 0 HG SER A 490 6.431 -10.991 -2.903 1.00 0.00 H new ATOM 193 N TYR A 491 8.940 -10.877 0.206 1.00 0.00 N ATOM 194 CA TYR A 491 9.197 -11.986 1.117 1.00 0.00 C ATOM 195 C TYR A 491 8.268 -11.924 2.326 1.00 0.00 C ATOM 196 O TYR A 491 8.199 -10.909 3.019 1.00 0.00 O ATOM 197 CB TYR A 491 10.655 -11.966 1.578 1.00 0.00 C ATOM 198 CG TYR A 491 11.217 -13.340 1.868 1.00 0.00 C ATOM 199 CD1 TYR A 491 10.506 -14.256 2.634 1.00 0.00 C ATOM 200 CD2 TYR A 491 12.459 -13.722 1.375 1.00 0.00 C ATOM 201 CE1 TYR A 491 11.016 -15.511 2.902 1.00 0.00 C ATOM 202 CE2 TYR A 491 12.976 -14.976 1.636 1.00 0.00 C ATOM 203 CZ TYR A 491 12.251 -15.867 2.401 1.00 0.00 C ATOM 204 OH TYR A 491 12.762 -17.117 2.664 1.00 0.00 O ATOM 0 H TYR A 491 8.263 -10.196 0.551 1.00 0.00 H new ATOM 0 HA TYR A 491 9.005 -12.916 0.582 1.00 0.00 H new ATOM 0 HB2 TYR A 491 11.264 -11.488 0.810 1.00 0.00 H new ATOM 0 HB3 TYR A 491 10.735 -11.353 2.476 1.00 0.00 H new ATOM 0 HD1 TYR A 491 9.538 -13.982 3.026 1.00 0.00 H new ATOM 0 HD2 TYR A 491 13.030 -13.026 0.778 1.00 0.00 H new ATOM 0 HE1 TYR A 491 10.451 -16.210 3.501 1.00 0.00 H new ATOM 0 HE2 TYR A 491 13.942 -15.258 1.244 1.00 0.00 H new ATOM 0 HH TYR A 491 13.640 -17.208 2.237 1.00 0.00 H new ATOM 214 N LEU A 492 7.556 -13.018 2.572 1.00 0.00 N ATOM 215 CA LEU A 492 6.631 -13.091 3.698 1.00 0.00 C ATOM 216 C LEU A 492 7.158 -12.297 4.888 1.00 0.00 C ATOM 217 O LEU A 492 6.387 -11.701 5.639 1.00 0.00 O ATOM 218 CB LEU A 492 6.403 -14.549 4.102 1.00 0.00 C ATOM 219 CG LEU A 492 5.040 -14.870 4.716 1.00 0.00 C ATOM 220 CD1 LEU A 492 5.002 -14.454 6.179 1.00 0.00 C ATOM 221 CD2 LEU A 492 3.928 -14.183 3.936 1.00 0.00 C ATOM 0 H LEU A 492 7.601 -13.866 2.007 1.00 0.00 H new ATOM 0 HA LEU A 492 5.682 -12.655 3.386 1.00 0.00 H new ATOM 0 HB2 LEU A 492 6.538 -15.175 3.220 1.00 0.00 H new ATOM 0 HB3 LEU A 492 7.177 -14.833 4.816 1.00 0.00 H new ATOM 0 HG LEU A 492 4.883 -15.947 4.661 1.00 0.00 H new ATOM 0 HD11 LEU A 492 4.024 -14.690 6.599 1.00 0.00 H new ATOM 0 HD12 LEU A 492 5.773 -14.992 6.730 1.00 0.00 H new ATOM 0 HD13 LEU A 492 5.181 -13.382 6.257 1.00 0.00 H new ATOM 0 HD21 LEU A 492 2.965 -14.423 4.387 1.00 0.00 H new ATOM 0 HD22 LEU A 492 4.081 -13.104 3.959 1.00 0.00 H new ATOM 0 HD23 LEU A 492 3.941 -14.530 2.903 1.00 0.00 H new ATOM 233 N GLU A 493 8.477 -12.293 5.053 1.00 0.00 N ATOM 234 CA GLU A 493 9.107 -11.571 6.152 1.00 0.00 C ATOM 235 C GLU A 493 8.443 -10.213 6.361 1.00 0.00 C ATOM 236 O GLU A 493 8.011 -9.884 7.467 1.00 0.00 O ATOM 237 CB GLU A 493 10.601 -11.384 5.879 1.00 0.00 C ATOM 238 CG GLU A 493 11.424 -11.146 7.135 1.00 0.00 C ATOM 239 CD GLU A 493 12.913 -11.291 6.892 1.00 0.00 C ATOM 240 OE1 GLU A 493 13.301 -12.149 6.071 1.00 0.00 O ATOM 241 OE2 GLU A 493 13.692 -10.545 7.522 1.00 0.00 O ATOM 0 H GLU A 493 9.130 -12.781 4.440 1.00 0.00 H new ATOM 0 HA GLU A 493 8.982 -12.161 7.060 1.00 0.00 H new ATOM 0 HB2 GLU A 493 10.982 -12.268 5.367 1.00 0.00 H new ATOM 0 HB3 GLU A 493 10.735 -10.541 5.201 1.00 0.00 H new ATOM 0 HG2 GLU A 493 11.217 -10.146 7.516 1.00 0.00 H new ATOM 0 HG3 GLU A 493 11.115 -11.851 7.906 1.00 0.00 H new ATOM 248 N LEU A 494 8.367 -9.428 5.293 1.00 0.00 N ATOM 249 CA LEU A 494 7.756 -8.104 5.358 1.00 0.00 C ATOM 250 C LEU A 494 6.395 -8.165 6.042 1.00 0.00 C ATOM 251 O LEU A 494 5.999 -7.235 6.745 1.00 0.00 O ATOM 252 CB LEU A 494 7.608 -7.520 3.952 1.00 0.00 C ATOM 253 CG LEU A 494 6.296 -7.832 3.231 1.00 0.00 C ATOM 254 CD1 LEU A 494 5.192 -6.898 3.702 1.00 0.00 C ATOM 255 CD2 LEU A 494 6.478 -7.728 1.724 1.00 0.00 C ATOM 0 H LEU A 494 8.721 -9.684 4.371 1.00 0.00 H new ATOM 0 HA LEU A 494 8.408 -7.458 5.946 1.00 0.00 H new ATOM 0 HB2 LEU A 494 7.715 -6.437 4.017 1.00 0.00 H new ATOM 0 HB3 LEU A 494 8.432 -7.886 3.340 1.00 0.00 H new ATOM 0 HG LEU A 494 6.006 -8.855 3.472 1.00 0.00 H new ATOM 0 HD11 LEU A 494 4.266 -7.135 3.178 1.00 0.00 H new ATOM 0 HD12 LEU A 494 5.044 -7.022 4.775 1.00 0.00 H new ATOM 0 HD13 LEU A 494 5.474 -5.866 3.492 1.00 0.00 H new ATOM 0 HD21 LEU A 494 5.534 -7.953 1.227 1.00 0.00 H new ATOM 0 HD22 LEU A 494 6.793 -6.717 1.464 1.00 0.00 H new ATOM 0 HD23 LEU A 494 7.238 -8.439 1.399 1.00 0.00 H new ATOM 267 N TYR A 495 5.683 -9.267 5.833 1.00 0.00 N ATOM 268 CA TYR A 495 4.365 -9.450 6.430 1.00 0.00 C ATOM 269 C TYR A 495 4.480 -9.790 7.913 1.00 0.00 C ATOM 270 O TYR A 495 3.602 -9.456 8.708 1.00 0.00 O ATOM 271 CB TYR A 495 3.601 -10.556 5.700 1.00 0.00 C ATOM 272 CG TYR A 495 2.193 -10.759 6.213 1.00 0.00 C ATOM 273 CD1 TYR A 495 1.402 -9.677 6.578 1.00 0.00 C ATOM 274 CD2 TYR A 495 1.653 -12.034 6.331 1.00 0.00 C ATOM 275 CE1 TYR A 495 0.116 -9.858 7.048 1.00 0.00 C ATOM 276 CE2 TYR A 495 0.367 -12.225 6.799 1.00 0.00 C ATOM 277 CZ TYR A 495 -0.397 -11.134 7.157 1.00 0.00 C ATOM 278 OH TYR A 495 -1.679 -11.319 7.623 1.00 0.00 O ATOM 0 H TYR A 495 5.996 -10.047 5.255 1.00 0.00 H new ATOM 0 HA TYR A 495 3.817 -8.513 6.332 1.00 0.00 H new ATOM 0 HB2 TYR A 495 3.561 -10.318 4.637 1.00 0.00 H new ATOM 0 HB3 TYR A 495 4.152 -11.491 5.796 1.00 0.00 H new ATOM 0 HD1 TYR A 495 1.800 -8.677 6.493 1.00 0.00 H new ATOM 0 HD2 TYR A 495 2.249 -12.890 6.052 1.00 0.00 H new ATOM 0 HE1 TYR A 495 -0.485 -9.005 7.329 1.00 0.00 H new ATOM 0 HE2 TYR A 495 -0.038 -13.223 6.884 1.00 0.00 H new ATOM 0 HH TYR A 495 -1.887 -12.277 7.637 1.00 0.00 H new ATOM 288 N ARG A 496 5.571 -10.456 8.277 1.00 0.00 N ATOM 289 CA ARG A 496 5.803 -10.843 9.664 1.00 0.00 C ATOM 290 C ARG A 496 6.989 -10.081 10.249 1.00 0.00 C ATOM 291 O ARG A 496 7.956 -10.682 10.718 1.00 0.00 O ATOM 292 CB ARG A 496 6.052 -12.349 9.761 1.00 0.00 C ATOM 293 CG ARG A 496 4.901 -13.192 9.237 1.00 0.00 C ATOM 294 CD ARG A 496 3.611 -12.901 9.987 1.00 0.00 C ATOM 295 NE ARG A 496 2.735 -14.069 10.042 1.00 0.00 N ATOM 296 CZ ARG A 496 1.810 -14.250 10.978 1.00 0.00 C ATOM 297 NH1 ARG A 496 1.641 -13.344 11.932 1.00 0.00 N ATOM 298 NH2 ARG A 496 1.051 -15.338 10.961 1.00 0.00 N ATOM 0 H ARG A 496 6.308 -10.739 7.631 1.00 0.00 H new ATOM 0 HA ARG A 496 4.912 -10.592 10.239 1.00 0.00 H new ATOM 0 HB2 ARG A 496 6.955 -12.596 9.203 1.00 0.00 H new ATOM 0 HB3 ARG A 496 6.239 -12.611 10.802 1.00 0.00 H new ATOM 0 HG2 ARG A 496 4.758 -12.994 8.175 1.00 0.00 H new ATOM 0 HG3 ARG A 496 5.149 -14.249 9.334 1.00 0.00 H new ATOM 0 HD2 ARG A 496 3.846 -12.576 11.001 1.00 0.00 H new ATOM 0 HD3 ARG A 496 3.087 -12.077 9.502 1.00 0.00 H new ATOM 0 HE ARG A 496 2.839 -14.784 9.322 1.00 0.00 H new ATOM 0 HH11 ARG A 496 2.222 -12.506 11.948 1.00 0.00 H new ATOM 0 HH12 ARG A 496 0.930 -13.485 12.650 1.00 0.00 H new ATOM 0 HH21 ARG A 496 1.177 -16.037 10.229 1.00 0.00 H new ATOM 0 HH22 ARG A 496 0.341 -15.476 11.680 1.00 0.00 H new ATOM 312 N LYS A 497 6.907 -8.755 10.219 1.00 0.00 N ATOM 313 CA LYS A 497 7.972 -7.910 10.746 1.00 0.00 C ATOM 314 C LYS A 497 7.477 -7.089 11.932 1.00 0.00 C ATOM 315 O LYS A 497 6.355 -7.276 12.403 1.00 0.00 O ATOM 316 CB LYS A 497 8.502 -6.980 9.653 1.00 0.00 C ATOM 317 CG LYS A 497 10.003 -6.760 9.716 1.00 0.00 C ATOM 318 CD LYS A 497 10.749 -7.755 8.843 1.00 0.00 C ATOM 319 CE LYS A 497 12.236 -7.771 9.162 1.00 0.00 C ATOM 320 NZ LYS A 497 12.942 -6.595 8.581 1.00 0.00 N ATOM 0 H LYS A 497 6.113 -8.242 9.835 1.00 0.00 H new ATOM 0 HA LYS A 497 8.781 -8.557 11.086 1.00 0.00 H new ATOM 0 HB2 LYS A 497 8.245 -7.395 8.678 1.00 0.00 H new ATOM 0 HB3 LYS A 497 7.999 -6.016 9.732 1.00 0.00 H new ATOM 0 HG2 LYS A 497 10.237 -5.745 9.394 1.00 0.00 H new ATOM 0 HG3 LYS A 497 10.342 -6.853 10.748 1.00 0.00 H new ATOM 0 HD2 LYS A 497 10.334 -8.752 8.989 1.00 0.00 H new ATOM 0 HD3 LYS A 497 10.604 -7.500 7.793 1.00 0.00 H new ATOM 0 HE2 LYS A 497 12.375 -7.780 10.243 1.00 0.00 H new ATOM 0 HE3 LYS A 497 12.680 -8.688 8.776 1.00 0.00 H new ATOM 0 HZ1 LYS A 497 13.953 -6.643 8.821 1.00 0.00 H new ATOM 0 HZ2 LYS A 497 12.831 -6.600 7.547 1.00 0.00 H new ATOM 0 HZ3 LYS A 497 12.536 -5.720 8.969 1.00 0.00 H new ATOM 334 N GLN A 498 8.319 -6.177 12.408 1.00 0.00 N ATOM 335 CA GLN A 498 7.966 -5.327 13.538 1.00 0.00 C ATOM 336 C GLN A 498 6.478 -4.990 13.521 1.00 0.00 C ATOM 337 O GLN A 498 5.752 -5.289 14.470 1.00 0.00 O ATOM 338 CB GLN A 498 8.792 -4.040 13.514 1.00 0.00 C ATOM 339 CG GLN A 498 10.292 -4.280 13.571 1.00 0.00 C ATOM 340 CD GLN A 498 11.086 -2.992 13.671 1.00 0.00 C ATOM 341 OE1 GLN A 498 10.522 -1.897 13.633 1.00 0.00 O ATOM 342 NE2 GLN A 498 12.401 -3.115 13.800 1.00 0.00 N ATOM 0 H GLN A 498 9.250 -6.008 12.028 1.00 0.00 H new ATOM 0 HA GLN A 498 8.186 -5.874 14.454 1.00 0.00 H new ATOM 0 HB2 GLN A 498 8.556 -3.483 12.607 1.00 0.00 H new ATOM 0 HB3 GLN A 498 8.500 -3.415 14.358 1.00 0.00 H new ATOM 0 HG2 GLN A 498 10.523 -4.912 14.429 1.00 0.00 H new ATOM 0 HG3 GLN A 498 10.603 -4.826 12.680 1.00 0.00 H new ATOM 0 HE21 GLN A 498 12.826 -4.042 13.827 1.00 0.00 H new ATOM 0 HE22 GLN A 498 12.986 -2.283 13.872 1.00 0.00 H new ATOM 351 N LYS A 499 6.030 -4.365 12.438 1.00 0.00 N ATOM 352 CA LYS A 499 4.629 -3.987 12.296 1.00 0.00 C ATOM 353 C LYS A 499 3.719 -5.016 12.958 1.00 0.00 C ATOM 354 O LYS A 499 3.670 -6.175 12.545 1.00 0.00 O ATOM 355 CB LYS A 499 4.265 -3.846 10.816 1.00 0.00 C ATOM 356 CG LYS A 499 4.783 -2.566 10.182 1.00 0.00 C ATOM 357 CD LYS A 499 4.771 -2.651 8.665 1.00 0.00 C ATOM 358 CE LYS A 499 6.084 -3.199 8.127 1.00 0.00 C ATOM 359 NZ LYS A 499 6.052 -4.682 7.992 1.00 0.00 N ATOM 0 H LYS A 499 6.618 -4.109 11.645 1.00 0.00 H new ATOM 0 HA LYS A 499 4.485 -3.027 12.792 1.00 0.00 H new ATOM 0 HB2 LYS A 499 4.665 -4.700 10.269 1.00 0.00 H new ATOM 0 HB3 LYS A 499 3.180 -3.880 10.712 1.00 0.00 H new ATOM 0 HG2 LYS A 499 4.170 -1.725 10.505 1.00 0.00 H new ATOM 0 HG3 LYS A 499 5.798 -2.372 10.529 1.00 0.00 H new ATOM 0 HD2 LYS A 499 3.949 -3.290 8.342 1.00 0.00 H new ATOM 0 HD3 LYS A 499 4.589 -1.661 8.246 1.00 0.00 H new ATOM 0 HE2 LYS A 499 6.294 -2.750 7.156 1.00 0.00 H new ATOM 0 HE3 LYS A 499 6.898 -2.912 8.793 1.00 0.00 H new ATOM 0 HZ1 LYS A 499 6.771 -4.984 7.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 499 6.251 -5.119 8.915 1.00 0.00 H new ATOM 0 HZ3 LYS A 499 5.112 -4.980 7.663 1.00 0.00 H new ATOM 373 N LYS A 500 2.997 -4.586 13.987 1.00 0.00 N ATOM 374 CA LYS A 500 2.085 -5.468 14.706 1.00 0.00 C ATOM 375 C LYS A 500 1.429 -6.464 13.754 1.00 0.00 C ATOM 376 O LYS A 500 1.787 -7.642 13.729 1.00 0.00 O ATOM 377 CB LYS A 500 1.010 -4.649 15.424 1.00 0.00 C ATOM 378 CG LYS A 500 1.571 -3.654 16.425 1.00 0.00 C ATOM 379 CD LYS A 500 0.538 -3.275 17.473 1.00 0.00 C ATOM 380 CE LYS A 500 0.413 -4.347 18.545 1.00 0.00 C ATOM 381 NZ LYS A 500 -0.441 -3.899 19.680 1.00 0.00 N ATOM 0 H LYS A 500 3.026 -3.630 14.342 1.00 0.00 H new ATOM 0 HA LYS A 500 2.663 -6.024 15.444 1.00 0.00 H new ATOM 0 HB2 LYS A 500 0.419 -4.112 14.683 1.00 0.00 H new ATOM 0 HB3 LYS A 500 0.332 -5.328 15.941 1.00 0.00 H new ATOM 0 HG2 LYS A 500 2.446 -4.082 16.914 1.00 0.00 H new ATOM 0 HG3 LYS A 500 1.905 -2.758 15.901 1.00 0.00 H new ATOM 0 HD2 LYS A 500 0.817 -2.328 17.935 1.00 0.00 H new ATOM 0 HD3 LYS A 500 -0.429 -3.123 16.994 1.00 0.00 H new ATOM 0 HE2 LYS A 500 -0.010 -5.251 18.107 1.00 0.00 H new ATOM 0 HE3 LYS A 500 1.404 -4.606 18.917 1.00 0.00 H new ATOM 0 HZ1 LYS A 500 -0.501 -4.657 20.389 1.00 0.00 H new ATOM 0 HZ2 LYS A 500 -0.024 -3.051 20.114 1.00 0.00 H new ATOM 0 HZ3 LYS A 500 -1.395 -3.676 19.330 1.00 0.00 H new ATOM 395 N HIS A 501 0.468 -5.983 12.972 1.00 0.00 N ATOM 396 CA HIS A 501 -0.236 -6.832 12.017 1.00 0.00 C ATOM 397 C HIS A 501 -1.138 -5.998 11.112 1.00 0.00 C ATOM 398 O HIS A 501 -1.287 -4.791 11.308 1.00 0.00 O ATOM 399 CB HIS A 501 -1.064 -7.885 12.752 1.00 0.00 C ATOM 400 CG HIS A 501 -1.793 -7.348 13.945 1.00 0.00 C ATOM 401 ND1 HIS A 501 -2.961 -6.622 13.850 1.00 0.00 N ATOM 402 CD2 HIS A 501 -1.514 -7.437 15.267 1.00 0.00 C ATOM 403 CE1 HIS A 501 -3.369 -6.285 15.060 1.00 0.00 C ATOM 404 NE2 HIS A 501 -2.508 -6.768 15.939 1.00 0.00 N ATOM 0 H HIS A 501 0.159 -5.011 12.981 1.00 0.00 H new ATOM 0 HA HIS A 501 0.507 -7.334 11.397 1.00 0.00 H new ATOM 0 HB2 HIS A 501 -1.786 -8.316 12.059 1.00 0.00 H new ATOM 0 HB3 HIS A 501 -0.407 -8.694 13.072 1.00 0.00 H new ATOM 0 HD2 HIS A 501 -0.668 -7.940 15.711 1.00 0.00 H new ATOM 0 HE1 HIS A 501 -4.255 -5.712 15.292 1.00 0.00 H new ATOM 0 HE2 HIS A 501 -2.571 -6.661 16.951 1.00 0.00 H new ATOM 412 N LEU A 502 -1.739 -6.649 10.122 1.00 0.00 N ATOM 413 CA LEU A 502 -2.627 -5.968 9.186 1.00 0.00 C ATOM 414 C LEU A 502 -4.070 -6.425 9.374 1.00 0.00 C ATOM 415 O LEU A 502 -4.325 -7.561 9.770 1.00 0.00 O ATOM 416 CB LEU A 502 -2.180 -6.230 7.746 1.00 0.00 C ATOM 417 CG LEU A 502 -0.864 -5.577 7.322 1.00 0.00 C ATOM 418 CD1 LEU A 502 -0.518 -5.955 5.890 1.00 0.00 C ATOM 419 CD2 LEU A 502 -0.946 -4.065 7.472 1.00 0.00 C ATOM 0 H LEU A 502 -1.628 -7.648 9.947 1.00 0.00 H new ATOM 0 HA LEU A 502 -2.575 -4.898 9.387 1.00 0.00 H new ATOM 0 HB2 LEU A 502 -2.090 -7.307 7.605 1.00 0.00 H new ATOM 0 HB3 LEU A 502 -2.966 -5.885 7.074 1.00 0.00 H new ATOM 0 HG LEU A 502 -0.072 -5.944 7.974 1.00 0.00 H new ATOM 0 HD11 LEU A 502 0.422 -5.481 5.605 1.00 0.00 H new ATOM 0 HD12 LEU A 502 -0.416 -7.038 5.814 1.00 0.00 H new ATOM 0 HD13 LEU A 502 -1.311 -5.617 5.223 1.00 0.00 H new ATOM 0 HD21 LEU A 502 -0.001 -3.617 7.166 1.00 0.00 H new ATOM 0 HD22 LEU A 502 -1.750 -3.680 6.845 1.00 0.00 H new ATOM 0 HD23 LEU A 502 -1.146 -3.813 8.513 1.00 0.00 H new ATOM 431 N ASN A 503 -5.010 -5.531 9.085 1.00 0.00 N ATOM 432 CA ASN A 503 -6.428 -5.843 9.221 1.00 0.00 C ATOM 433 C ASN A 503 -6.992 -6.392 7.914 1.00 0.00 C ATOM 434 O ASN A 503 -6.461 -6.127 6.835 1.00 0.00 O ATOM 435 CB ASN A 503 -7.208 -4.595 9.642 1.00 0.00 C ATOM 436 CG ASN A 503 -7.285 -4.442 11.148 1.00 0.00 C ATOM 437 OD1 ASN A 503 -7.162 -5.418 11.890 1.00 0.00 O ATOM 438 ND2 ASN A 503 -7.491 -3.214 11.608 1.00 0.00 N ATOM 0 H ASN A 503 -4.816 -4.585 8.755 1.00 0.00 H new ATOM 0 HA ASN A 503 -6.534 -6.607 9.991 1.00 0.00 H new ATOM 0 HB2 ASN A 503 -6.734 -3.712 9.214 1.00 0.00 H new ATOM 0 HB3 ASN A 503 -8.217 -4.645 9.233 1.00 0.00 H new ATOM 0 HD21 ASN A 503 -7.553 -3.050 12.613 1.00 0.00 H new ATOM 0 HD22 ASN A 503 -7.587 -2.435 10.957 1.00 0.00 H new ATOM 445 N THR A 504 -8.073 -7.160 8.019 1.00 0.00 N ATOM 446 CA THR A 504 -8.709 -7.747 6.846 1.00 0.00 C ATOM 447 C THR A 504 -8.616 -6.814 5.645 1.00 0.00 C ATOM 448 O THR A 504 -8.022 -7.160 4.624 1.00 0.00 O ATOM 449 CB THR A 504 -10.190 -8.073 7.115 1.00 0.00 C ATOM 450 OG1 THR A 504 -10.305 -8.923 8.262 1.00 0.00 O ATOM 451 CG2 THR A 504 -10.822 -8.752 5.909 1.00 0.00 C ATOM 0 H THR A 504 -8.526 -7.390 8.904 1.00 0.00 H new ATOM 0 HA THR A 504 -8.175 -8.671 6.626 1.00 0.00 H new ATOM 0 HB THR A 504 -10.716 -7.137 7.303 1.00 0.00 H new ATOM 0 HG1 THR A 504 -11.250 -9.124 8.427 1.00 0.00 H new ATOM 0 HG21 THR A 504 -11.868 -8.973 6.122 1.00 0.00 H new ATOM 0 HG22 THR A 504 -10.760 -8.091 5.045 1.00 0.00 H new ATOM 0 HG23 THR A 504 -10.292 -9.680 5.695 1.00 0.00 H new ATOM 459 N GLN A 505 -9.205 -5.630 5.774 1.00 0.00 N ATOM 460 CA GLN A 505 -9.187 -4.647 4.697 1.00 0.00 C ATOM 461 C GLN A 505 -7.756 -4.314 4.286 1.00 0.00 C ATOM 462 O GLN A 505 -7.421 -4.330 3.102 1.00 0.00 O ATOM 463 CB GLN A 505 -9.916 -3.373 5.128 1.00 0.00 C ATOM 464 CG GLN A 505 -11.430 -3.503 5.113 1.00 0.00 C ATOM 465 CD GLN A 505 -12.129 -2.243 5.585 1.00 0.00 C ATOM 466 OE1 GLN A 505 -11.577 -1.469 6.366 1.00 0.00 O ATOM 467 NE2 GLN A 505 -13.351 -2.031 5.111 1.00 0.00 N ATOM 0 H GLN A 505 -9.700 -5.328 6.613 1.00 0.00 H new ATOM 0 HA GLN A 505 -9.701 -5.078 3.838 1.00 0.00 H new ATOM 0 HB2 GLN A 505 -9.593 -3.102 6.133 1.00 0.00 H new ATOM 0 HB3 GLN A 505 -9.623 -2.556 4.468 1.00 0.00 H new ATOM 0 HG2 GLN A 505 -11.760 -3.740 4.102 1.00 0.00 H new ATOM 0 HG3 GLN A 505 -11.725 -4.338 5.749 1.00 0.00 H new ATOM 0 HE21 GLN A 505 -13.771 -2.700 4.465 1.00 0.00 H new ATOM 0 HE22 GLN A 505 -13.870 -1.199 5.393 1.00 0.00 H new ATOM 476 N GLN A 506 -6.918 -4.013 5.273 1.00 0.00 N ATOM 477 CA GLN A 506 -5.523 -3.676 5.013 1.00 0.00 C ATOM 478 C GLN A 506 -4.865 -4.728 4.128 1.00 0.00 C ATOM 479 O GLN A 506 -4.094 -4.401 3.224 1.00 0.00 O ATOM 480 CB GLN A 506 -4.755 -3.545 6.329 1.00 0.00 C ATOM 481 CG GLN A 506 -5.247 -2.409 7.211 1.00 0.00 C ATOM 482 CD GLN A 506 -4.339 -2.157 8.399 1.00 0.00 C ATOM 483 OE1 GLN A 506 -3.784 -3.091 8.979 1.00 0.00 O ATOM 484 NE2 GLN A 506 -4.184 -0.891 8.768 1.00 0.00 N ATOM 0 H GLN A 506 -7.180 -3.996 6.259 1.00 0.00 H new ATOM 0 HA GLN A 506 -5.497 -2.720 4.489 1.00 0.00 H new ATOM 0 HB2 GLN A 506 -4.833 -4.482 6.880 1.00 0.00 H new ATOM 0 HB3 GLN A 506 -3.698 -3.392 6.110 1.00 0.00 H new ATOM 0 HG2 GLN A 506 -5.322 -1.499 6.616 1.00 0.00 H new ATOM 0 HG3 GLN A 506 -6.251 -2.640 7.568 1.00 0.00 H new ATOM 0 HE21 GLN A 506 -4.663 -0.149 8.258 1.00 0.00 H new ATOM 0 HE22 GLN A 506 -3.586 -0.661 9.561 1.00 0.00 H new ATOM 493 N LEU A 507 -5.172 -5.993 4.393 1.00 0.00 N ATOM 494 CA LEU A 507 -4.609 -7.095 3.620 1.00 0.00 C ATOM 495 C LEU A 507 -5.047 -7.017 2.161 1.00 0.00 C ATOM 496 O LEU A 507 -4.220 -7.050 1.250 1.00 0.00 O ATOM 497 CB LEU A 507 -5.035 -8.436 4.221 1.00 0.00 C ATOM 498 CG LEU A 507 -4.498 -8.746 5.619 1.00 0.00 C ATOM 499 CD1 LEU A 507 -5.150 -10.002 6.175 1.00 0.00 C ATOM 500 CD2 LEU A 507 -2.984 -8.899 5.586 1.00 0.00 C ATOM 0 H LEU A 507 -5.807 -6.281 5.137 1.00 0.00 H new ATOM 0 HA LEU A 507 -3.523 -7.015 3.659 1.00 0.00 H new ATOM 0 HB2 LEU A 507 -6.124 -8.466 4.257 1.00 0.00 H new ATOM 0 HB3 LEU A 507 -4.717 -9.231 3.547 1.00 0.00 H new ATOM 0 HG LEU A 507 -4.745 -7.912 6.276 1.00 0.00 H new ATOM 0 HD11 LEU A 507 -4.755 -10.207 7.170 1.00 0.00 H new ATOM 0 HD12 LEU A 507 -6.228 -9.856 6.235 1.00 0.00 H new ATOM 0 HD13 LEU A 507 -4.934 -10.845 5.519 1.00 0.00 H new ATOM 0 HD21 LEU A 507 -2.619 -9.119 6.589 1.00 0.00 H new ATOM 0 HD22 LEU A 507 -2.715 -9.715 4.915 1.00 0.00 H new ATOM 0 HD23 LEU A 507 -2.532 -7.973 5.231 1.00 0.00 H new ATOM 512 N THR A 508 -6.355 -6.911 1.946 1.00 0.00 N ATOM 513 CA THR A 508 -6.904 -6.827 0.599 1.00 0.00 C ATOM 514 C THR A 508 -6.179 -5.768 -0.225 1.00 0.00 C ATOM 515 O THR A 508 -5.806 -6.009 -1.373 1.00 0.00 O ATOM 516 CB THR A 508 -8.409 -6.500 0.624 1.00 0.00 C ATOM 517 OG1 THR A 508 -9.106 -7.464 1.422 1.00 0.00 O ATOM 518 CG2 THR A 508 -8.984 -6.488 -0.784 1.00 0.00 C ATOM 0 H THR A 508 -7.054 -6.881 2.689 1.00 0.00 H new ATOM 0 HA THR A 508 -6.760 -7.804 0.138 1.00 0.00 H new ATOM 0 HB THR A 508 -8.536 -5.509 1.059 1.00 0.00 H new ATOM 0 HG1 THR A 508 -10.062 -7.249 1.435 1.00 0.00 H new ATOM 0 HG21 THR A 508 -10.048 -6.255 -0.741 1.00 0.00 H new ATOM 0 HG22 THR A 508 -8.471 -5.733 -1.380 1.00 0.00 H new ATOM 0 HG23 THR A 508 -8.846 -7.467 -1.242 1.00 0.00 H new ATOM 526 N ALA A 509 -5.983 -4.596 0.369 1.00 0.00 N ATOM 527 CA ALA A 509 -5.300 -3.501 -0.310 1.00 0.00 C ATOM 528 C ALA A 509 -3.825 -3.823 -0.524 1.00 0.00 C ATOM 529 O ALA A 509 -3.286 -3.618 -1.612 1.00 0.00 O ATOM 530 CB ALA A 509 -5.451 -2.212 0.484 1.00 0.00 C ATOM 0 H ALA A 509 -6.287 -4.380 1.318 1.00 0.00 H new ATOM 0 HA ALA A 509 -5.762 -3.368 -1.288 1.00 0.00 H new ATOM 0 HB1 ALA A 509 -4.936 -1.403 -0.034 1.00 0.00 H new ATOM 0 HB2 ALA A 509 -6.508 -1.966 0.581 1.00 0.00 H new ATOM 0 HB3 ALA A 509 -5.016 -2.342 1.475 1.00 0.00 H new ATOM 536 N PHE A 510 -3.176 -4.326 0.521 1.00 0.00 N ATOM 537 CA PHE A 510 -1.762 -4.675 0.447 1.00 0.00 C ATOM 538 C PHE A 510 -1.472 -5.510 -0.796 1.00 0.00 C ATOM 539 O PHE A 510 -0.453 -5.320 -1.459 1.00 0.00 O ATOM 540 CB PHE A 510 -1.338 -5.442 1.702 1.00 0.00 C ATOM 541 CG PHE A 510 0.101 -5.871 1.684 1.00 0.00 C ATOM 542 CD1 PHE A 510 1.100 -4.974 1.340 1.00 0.00 C ATOM 543 CD2 PHE A 510 0.455 -7.169 2.012 1.00 0.00 C ATOM 544 CE1 PHE A 510 2.426 -5.366 1.323 1.00 0.00 C ATOM 545 CE2 PHE A 510 1.779 -7.567 1.997 1.00 0.00 C ATOM 546 CZ PHE A 510 2.765 -6.664 1.653 1.00 0.00 C ATOM 0 H PHE A 510 -3.607 -4.501 1.429 1.00 0.00 H new ATOM 0 HA PHE A 510 -1.188 -3.751 0.383 1.00 0.00 H new ATOM 0 HB2 PHE A 510 -1.511 -4.815 2.577 1.00 0.00 H new ATOM 0 HB3 PHE A 510 -1.970 -6.323 1.811 1.00 0.00 H new ATOM 0 HD1 PHE A 510 0.840 -3.958 1.082 1.00 0.00 H new ATOM 0 HD2 PHE A 510 -0.312 -7.879 2.283 1.00 0.00 H new ATOM 0 HE1 PHE A 510 3.196 -4.658 1.052 1.00 0.00 H new ATOM 0 HE2 PHE A 510 2.041 -8.583 2.254 1.00 0.00 H new ATOM 0 HZ PHE A 510 3.800 -6.972 1.642 1.00 0.00 H new ATOM 556 N GLN A 511 -2.375 -6.435 -1.104 1.00 0.00 N ATOM 557 CA GLN A 511 -2.215 -7.301 -2.267 1.00 0.00 C ATOM 558 C GLN A 511 -2.480 -6.533 -3.558 1.00 0.00 C ATOM 559 O GLN A 511 -1.706 -6.618 -4.513 1.00 0.00 O ATOM 560 CB GLN A 511 -3.160 -8.500 -2.170 1.00 0.00 C ATOM 561 CG GLN A 511 -2.749 -9.516 -1.117 1.00 0.00 C ATOM 562 CD GLN A 511 -3.931 -10.265 -0.535 1.00 0.00 C ATOM 563 OE1 GLN A 511 -4.576 -11.059 -1.220 1.00 0.00 O ATOM 564 NE2 GLN A 511 -4.223 -10.015 0.736 1.00 0.00 N ATOM 0 H GLN A 511 -3.224 -6.604 -0.565 1.00 0.00 H new ATOM 0 HA GLN A 511 -1.186 -7.659 -2.283 1.00 0.00 H new ATOM 0 HB2 GLN A 511 -4.165 -8.143 -1.945 1.00 0.00 H new ATOM 0 HB3 GLN A 511 -3.207 -8.994 -3.140 1.00 0.00 H new ATOM 0 HG2 GLN A 511 -2.053 -10.230 -1.558 1.00 0.00 H new ATOM 0 HG3 GLN A 511 -2.216 -9.006 -0.314 1.00 0.00 H new ATOM 0 HE21 GLN A 511 -3.662 -9.349 1.267 1.00 0.00 H new ATOM 0 HE22 GLN A 511 -5.009 -10.489 1.182 1.00 0.00 H new ATOM 573 N LEU A 512 -3.576 -5.783 -3.580 1.00 0.00 N ATOM 574 CA LEU A 512 -3.943 -4.999 -4.754 1.00 0.00 C ATOM 575 C LEU A 512 -2.813 -4.057 -5.155 1.00 0.00 C ATOM 576 O LEU A 512 -2.477 -3.938 -6.334 1.00 0.00 O ATOM 577 CB LEU A 512 -5.217 -4.199 -4.480 1.00 0.00 C ATOM 578 CG LEU A 512 -6.508 -5.010 -4.364 1.00 0.00 C ATOM 579 CD1 LEU A 512 -7.667 -4.115 -3.954 1.00 0.00 C ATOM 580 CD2 LEU A 512 -6.815 -5.714 -5.678 1.00 0.00 C ATOM 0 H LEU A 512 -4.226 -5.701 -2.798 1.00 0.00 H new ATOM 0 HA LEU A 512 -4.125 -5.689 -5.578 1.00 0.00 H new ATOM 0 HB2 LEU A 512 -5.079 -3.640 -3.555 1.00 0.00 H new ATOM 0 HB3 LEU A 512 -5.342 -3.468 -5.279 1.00 0.00 H new ATOM 0 HG LEU A 512 -6.370 -5.767 -3.592 1.00 0.00 H new ATOM 0 HD11 LEU A 512 -8.577 -4.710 -3.877 1.00 0.00 H new ATOM 0 HD12 LEU A 512 -7.450 -3.658 -2.989 1.00 0.00 H new ATOM 0 HD13 LEU A 512 -7.806 -3.335 -4.702 1.00 0.00 H new ATOM 0 HD21 LEU A 512 -7.737 -6.286 -5.577 1.00 0.00 H new ATOM 0 HD22 LEU A 512 -6.932 -4.973 -6.469 1.00 0.00 H new ATOM 0 HD23 LEU A 512 -5.996 -6.387 -5.930 1.00 0.00 H new ATOM 592 N LEU A 513 -2.227 -3.390 -4.166 1.00 0.00 N ATOM 593 CA LEU A 513 -1.132 -2.459 -4.415 1.00 0.00 C ATOM 594 C LEU A 513 0.109 -3.196 -4.907 1.00 0.00 C ATOM 595 O LEU A 513 0.670 -2.862 -5.950 1.00 0.00 O ATOM 596 CB LEU A 513 -0.803 -1.676 -3.142 1.00 0.00 C ATOM 597 CG LEU A 513 -1.773 -0.552 -2.776 1.00 0.00 C ATOM 598 CD1 LEU A 513 -1.445 0.009 -1.401 1.00 0.00 C ATOM 599 CD2 LEU A 513 -1.735 0.549 -3.826 1.00 0.00 C ATOM 0 H LEU A 513 -2.492 -3.477 -3.185 1.00 0.00 H new ATOM 0 HA LEU A 513 -1.450 -1.763 -5.191 1.00 0.00 H new ATOM 0 HB2 LEU A 513 -0.760 -2.377 -2.309 1.00 0.00 H new ATOM 0 HB3 LEU A 513 0.194 -1.248 -3.250 1.00 0.00 H new ATOM 0 HG LEU A 513 -2.782 -0.964 -2.747 1.00 0.00 H new ATOM 0 HD11 LEU A 513 -2.146 0.808 -1.157 1.00 0.00 H new ATOM 0 HD12 LEU A 513 -1.525 -0.783 -0.656 1.00 0.00 H new ATOM 0 HD13 LEU A 513 -0.429 0.405 -1.402 1.00 0.00 H new ATOM 0 HD21 LEU A 513 -2.432 1.340 -3.549 1.00 0.00 H new ATOM 0 HD22 LEU A 513 -0.727 0.958 -3.888 1.00 0.00 H new ATOM 0 HD23 LEU A 513 -2.020 0.138 -4.795 1.00 0.00 H new ATOM 611 N PHE A 514 0.531 -4.204 -4.150 1.00 0.00 N ATOM 612 CA PHE A 514 1.705 -4.990 -4.509 1.00 0.00 C ATOM 613 C PHE A 514 1.675 -5.368 -5.987 1.00 0.00 C ATOM 614 O PHE A 514 2.654 -5.176 -6.708 1.00 0.00 O ATOM 615 CB PHE A 514 1.781 -6.254 -3.650 1.00 0.00 C ATOM 616 CG PHE A 514 3.005 -7.085 -3.913 1.00 0.00 C ATOM 617 CD1 PHE A 514 3.181 -7.714 -5.134 1.00 0.00 C ATOM 618 CD2 PHE A 514 3.978 -7.237 -2.938 1.00 0.00 C ATOM 619 CE1 PHE A 514 4.306 -8.479 -5.380 1.00 0.00 C ATOM 620 CE2 PHE A 514 5.105 -8.000 -3.178 1.00 0.00 C ATOM 621 CZ PHE A 514 5.269 -8.623 -4.400 1.00 0.00 C ATOM 0 H PHE A 514 0.077 -4.495 -3.284 1.00 0.00 H new ATOM 0 HA PHE A 514 2.590 -4.380 -4.325 1.00 0.00 H new ATOM 0 HB2 PHE A 514 1.764 -5.970 -2.598 1.00 0.00 H new ATOM 0 HB3 PHE A 514 0.894 -6.861 -3.831 1.00 0.00 H new ATOM 0 HD1 PHE A 514 2.431 -7.606 -5.903 1.00 0.00 H new ATOM 0 HD2 PHE A 514 3.854 -6.754 -1.980 1.00 0.00 H new ATOM 0 HE1 PHE A 514 4.432 -8.963 -6.337 1.00 0.00 H new ATOM 0 HE2 PHE A 514 5.857 -8.109 -2.411 1.00 0.00 H new ATOM 0 HZ PHE A 514 6.148 -9.221 -4.589 1.00 0.00 H new ATOM 631 N ALA A 515 0.544 -5.906 -6.431 1.00 0.00 N ATOM 632 CA ALA A 515 0.385 -6.310 -7.823 1.00 0.00 C ATOM 633 C ALA A 515 0.578 -5.125 -8.764 1.00 0.00 C ATOM 634 O ALA A 515 1.452 -5.145 -9.630 1.00 0.00 O ATOM 635 CB ALA A 515 -0.985 -6.938 -8.037 1.00 0.00 C ATOM 0 H ALA A 515 -0.276 -6.072 -5.847 1.00 0.00 H new ATOM 0 HA ALA A 515 1.152 -7.050 -8.051 1.00 0.00 H new ATOM 0 HB1 ALA A 515 -1.090 -7.235 -9.080 1.00 0.00 H new ATOM 0 HB2 ALA A 515 -1.087 -7.815 -7.398 1.00 0.00 H new ATOM 0 HB3 ALA A 515 -1.760 -6.214 -7.786 1.00 0.00 H new ATOM 641 N TRP A 516 -0.243 -4.096 -8.587 1.00 0.00 N ATOM 642 CA TRP A 516 -0.162 -2.902 -9.422 1.00 0.00 C ATOM 643 C TRP A 516 1.273 -2.395 -9.508 1.00 0.00 C ATOM 644 O TRP A 516 1.822 -2.242 -10.600 1.00 0.00 O ATOM 645 CB TRP A 516 -1.071 -1.804 -8.867 1.00 0.00 C ATOM 646 CG TRP A 516 -0.805 -0.455 -9.463 1.00 0.00 C ATOM 647 CD1 TRP A 516 -1.384 0.077 -10.579 1.00 0.00 C ATOM 648 CD2 TRP A 516 0.110 0.532 -8.974 1.00 0.00 C ATOM 649 NE1 TRP A 516 -0.885 1.335 -10.814 1.00 0.00 N ATOM 650 CE2 TRP A 516 0.033 1.638 -9.843 1.00 0.00 C ATOM 651 CE3 TRP A 516 0.985 0.590 -7.886 1.00 0.00 C ATOM 652 CZ2 TRP A 516 0.799 2.785 -9.657 1.00 0.00 C ATOM 653 CZ3 TRP A 516 1.745 1.729 -7.703 1.00 0.00 C ATOM 654 CH2 TRP A 516 1.648 2.815 -8.584 1.00 0.00 C ATOM 0 H TRP A 516 -0.972 -4.064 -7.874 1.00 0.00 H new ATOM 0 HA TRP A 516 -0.495 -3.167 -10.425 1.00 0.00 H new ATOM 0 HB2 TRP A 516 -2.111 -2.076 -9.050 1.00 0.00 H new ATOM 0 HB3 TRP A 516 -0.942 -1.748 -7.786 1.00 0.00 H new ATOM 0 HD1 TRP A 516 -2.126 -0.419 -11.188 1.00 0.00 H new ATOM 0 HE1 TRP A 516 -1.154 1.945 -11.586 1.00 0.00 H new ATOM 0 HE3 TRP A 516 1.066 -0.241 -7.201 1.00 0.00 H new ATOM 0 HZ2 TRP A 516 0.726 3.622 -10.336 1.00 0.00 H new ATOM 0 HZ3 TRP A 516 2.426 1.784 -6.866 1.00 0.00 H new ATOM 0 HH2 TRP A 516 2.255 3.692 -8.413 1.00 0.00 H new ATOM 665 N ARG A 517 1.876 -2.136 -8.352 1.00 0.00 N ATOM 666 CA ARG A 517 3.247 -1.645 -8.299 1.00 0.00 C ATOM 667 C ARG A 517 4.142 -2.425 -9.257 1.00 0.00 C ATOM 668 O ARG A 517 4.817 -1.843 -10.106 1.00 0.00 O ATOM 669 CB ARG A 517 3.794 -1.749 -6.874 1.00 0.00 C ATOM 670 CG ARG A 517 5.258 -1.358 -6.753 1.00 0.00 C ATOM 671 CD ARG A 517 5.829 -1.749 -5.399 1.00 0.00 C ATOM 672 NE ARG A 517 6.047 -3.189 -5.292 1.00 0.00 N ATOM 673 CZ ARG A 517 6.713 -3.760 -4.295 1.00 0.00 C ATOM 674 NH1 ARG A 517 7.223 -3.016 -3.323 1.00 0.00 N ATOM 675 NH2 ARG A 517 6.870 -5.077 -4.268 1.00 0.00 N ATOM 0 H ARG A 517 1.436 -2.258 -7.440 1.00 0.00 H new ATOM 0 HA ARG A 517 3.243 -0.599 -8.604 1.00 0.00 H new ATOM 0 HB2 ARG A 517 3.201 -1.111 -6.219 1.00 0.00 H new ATOM 0 HB3 ARG A 517 3.670 -2.772 -6.520 1.00 0.00 H new ATOM 0 HG2 ARG A 517 5.831 -1.841 -7.544 1.00 0.00 H new ATOM 0 HG3 ARG A 517 5.361 -0.282 -6.896 1.00 0.00 H new ATOM 0 HD2 ARG A 517 6.772 -1.227 -5.239 1.00 0.00 H new ATOM 0 HD3 ARG A 517 5.148 -1.426 -4.611 1.00 0.00 H new ATOM 0 HE ARG A 517 5.667 -3.789 -6.024 1.00 0.00 H new ATOM 0 HH11 ARG A 517 7.104 -2.003 -3.340 1.00 0.00 H new ATOM 0 HH12 ARG A 517 7.734 -3.457 -2.558 1.00 0.00 H new ATOM 0 HH21 ARG A 517 6.479 -5.653 -5.014 1.00 0.00 H new ATOM 0 HH22 ARG A 517 7.382 -5.514 -3.502 1.00 0.00 H new ATOM 689 N ASP A 518 4.143 -3.746 -9.113 1.00 0.00 N ATOM 690 CA ASP A 518 4.955 -4.607 -9.966 1.00 0.00 C ATOM 691 C ASP A 518 4.401 -4.643 -11.387 1.00 0.00 C ATOM 692 O ASP A 518 5.136 -4.876 -12.346 1.00 0.00 O ATOM 693 CB ASP A 518 5.010 -6.024 -9.391 1.00 0.00 C ATOM 694 CG ASP A 518 6.162 -6.832 -9.955 1.00 0.00 C ATOM 695 OD1 ASP A 518 6.364 -6.799 -11.187 1.00 0.00 O ATOM 696 OD2 ASP A 518 6.862 -7.498 -9.163 1.00 0.00 O ATOM 0 H ASP A 518 3.591 -4.244 -8.414 1.00 0.00 H new ATOM 0 HA ASP A 518 5.964 -4.197 -9.999 1.00 0.00 H new ATOM 0 HB2 ASP A 518 5.104 -5.970 -8.306 1.00 0.00 H new ATOM 0 HB3 ASP A 518 4.072 -6.536 -9.604 1.00 0.00 H new ATOM 701 N LYS A 519 3.098 -4.412 -11.514 1.00 0.00 N ATOM 702 CA LYS A 519 2.444 -4.417 -12.817 1.00 0.00 C ATOM 703 C LYS A 519 2.941 -3.261 -13.680 1.00 0.00 C ATOM 704 O LYS A 519 3.320 -3.454 -14.836 1.00 0.00 O ATOM 705 CB LYS A 519 0.926 -4.325 -12.649 1.00 0.00 C ATOM 706 CG LYS A 519 0.174 -4.199 -13.963 1.00 0.00 C ATOM 707 CD LYS A 519 -1.114 -3.410 -13.796 1.00 0.00 C ATOM 708 CE LYS A 519 -0.853 -1.912 -13.791 1.00 0.00 C ATOM 709 NZ LYS A 519 -0.917 -1.333 -15.161 1.00 0.00 N ATOM 0 H LYS A 519 2.475 -4.219 -10.730 1.00 0.00 H new ATOM 0 HA LYS A 519 2.692 -5.353 -13.316 1.00 0.00 H new ATOM 0 HB2 LYS A 519 0.573 -5.211 -12.122 1.00 0.00 H new ATOM 0 HB3 LYS A 519 0.690 -3.466 -12.021 1.00 0.00 H new ATOM 0 HG2 LYS A 519 0.809 -3.709 -14.701 1.00 0.00 H new ATOM 0 HG3 LYS A 519 -0.054 -5.192 -14.349 1.00 0.00 H new ATOM 0 HD2 LYS A 519 -1.801 -3.658 -14.605 1.00 0.00 H new ATOM 0 HD3 LYS A 519 -1.601 -3.699 -12.864 1.00 0.00 H new ATOM 0 HE2 LYS A 519 -1.586 -1.418 -13.153 1.00 0.00 H new ATOM 0 HE3 LYS A 519 0.129 -1.716 -13.359 1.00 0.00 H new ATOM 0 HZ1 LYS A 519 -0.734 -0.310 -15.115 1.00 0.00 H new ATOM 0 HZ2 LYS A 519 -0.200 -1.786 -15.763 1.00 0.00 H new ATOM 0 HZ3 LYS A 519 -1.862 -1.497 -15.564 1.00 0.00 H new ATOM 723 N THR A 520 2.939 -2.060 -13.111 1.00 0.00 N ATOM 724 CA THR A 520 3.390 -0.874 -13.829 1.00 0.00 C ATOM 725 C THR A 520 4.886 -0.939 -14.113 1.00 0.00 C ATOM 726 O THR A 520 5.350 -0.479 -15.156 1.00 0.00 O ATOM 727 CB THR A 520 3.086 0.411 -13.036 1.00 0.00 C ATOM 728 OG1 THR A 520 1.675 0.536 -12.828 1.00 0.00 O ATOM 729 CG2 THR A 520 3.605 1.637 -13.772 1.00 0.00 C ATOM 0 H THR A 520 2.630 -1.883 -12.155 1.00 0.00 H new ATOM 0 HA THR A 520 2.844 -0.849 -14.772 1.00 0.00 H new ATOM 0 HB THR A 520 3.591 0.344 -12.072 1.00 0.00 H new ATOM 0 HG1 THR A 520 1.506 0.859 -11.918 1.00 0.00 H new ATOM 0 HG21 THR A 520 3.379 2.532 -13.193 1.00 0.00 H new ATOM 0 HG22 THR A 520 4.684 1.553 -13.903 1.00 0.00 H new ATOM 0 HG23 THR A 520 3.125 1.706 -14.748 1.00 0.00 H new ATOM 737 N ALA A 521 5.637 -1.515 -13.180 1.00 0.00 N ATOM 738 CA ALA A 521 7.081 -1.643 -13.333 1.00 0.00 C ATOM 739 C ALA A 521 7.452 -1.989 -14.771 1.00 0.00 C ATOM 740 O ALA A 521 8.424 -1.464 -15.314 1.00 0.00 O ATOM 741 CB ALA A 521 7.621 -2.697 -12.378 1.00 0.00 C ATOM 0 H ALA A 521 5.269 -1.900 -12.310 1.00 0.00 H new ATOM 0 HA ALA A 521 7.534 -0.682 -13.090 1.00 0.00 H new ATOM 0 HB1 ALA A 521 8.700 -2.782 -12.503 1.00 0.00 H new ATOM 0 HB2 ALA A 521 7.396 -2.407 -11.352 1.00 0.00 H new ATOM 0 HB3 ALA A 521 7.154 -3.658 -12.594 1.00 0.00 H new ATOM 747 N ARG A 522 6.673 -2.875 -15.381 1.00 0.00 N ATOM 748 CA ARG A 522 6.922 -3.293 -16.756 1.00 0.00 C ATOM 749 C ARG A 522 6.988 -2.086 -17.687 1.00 0.00 C ATOM 750 O ARG A 522 8.027 -1.809 -18.288 1.00 0.00 O ATOM 751 CB ARG A 522 5.827 -4.253 -17.226 1.00 0.00 C ATOM 752 CG ARG A 522 5.887 -5.618 -16.559 1.00 0.00 C ATOM 753 CD ARG A 522 5.348 -6.708 -17.472 1.00 0.00 C ATOM 754 NE ARG A 522 6.249 -6.983 -18.588 1.00 0.00 N ATOM 755 CZ ARG A 522 7.288 -7.805 -18.508 1.00 0.00 C ATOM 756 NH1 ARG A 522 7.557 -8.431 -17.370 1.00 0.00 N ATOM 757 NH2 ARG A 522 8.062 -8.004 -19.567 1.00 0.00 N ATOM 0 H ARG A 522 5.864 -3.318 -14.945 1.00 0.00 H new ATOM 0 HA ARG A 522 7.883 -3.806 -16.785 1.00 0.00 H new ATOM 0 HB2 ARG A 522 4.853 -3.804 -17.030 1.00 0.00 H new ATOM 0 HB3 ARG A 522 5.907 -4.381 -18.305 1.00 0.00 H new ATOM 0 HG2 ARG A 522 6.918 -5.846 -16.287 1.00 0.00 H new ATOM 0 HG3 ARG A 522 5.310 -5.598 -15.634 1.00 0.00 H new ATOM 0 HD2 ARG A 522 5.196 -7.621 -16.896 1.00 0.00 H new ATOM 0 HD3 ARG A 522 4.374 -6.408 -17.858 1.00 0.00 H new ATOM 0 HE ARG A 522 6.070 -6.518 -19.478 1.00 0.00 H new ATOM 0 HH11 ARG A 522 6.965 -8.281 -16.553 1.00 0.00 H new ATOM 0 HH12 ARG A 522 8.356 -9.062 -17.312 1.00 0.00 H new ATOM 0 HH21 ARG A 522 7.859 -7.525 -20.444 1.00 0.00 H new ATOM 0 HH22 ARG A 522 8.860 -8.636 -19.504 1.00 0.00 H new ATOM 771 N ARG A 523 5.874 -1.371 -17.801 1.00 0.00 N ATOM 772 CA ARG A 523 5.805 -0.195 -18.660 1.00 0.00 C ATOM 773 C ARG A 523 6.886 0.815 -18.287 1.00 0.00 C ATOM 774 O ARG A 523 7.466 1.466 -19.155 1.00 0.00 O ATOM 775 CB ARG A 523 4.425 0.458 -18.558 1.00 0.00 C ATOM 776 CG ARG A 523 4.017 1.218 -19.809 1.00 0.00 C ATOM 777 CD ARG A 523 3.470 0.283 -20.876 1.00 0.00 C ATOM 778 NE ARG A 523 3.489 0.894 -22.202 1.00 0.00 N ATOM 779 CZ ARG A 523 4.579 0.975 -22.958 1.00 0.00 C ATOM 780 NH1 ARG A 523 5.731 0.485 -22.521 1.00 0.00 N ATOM 781 NH2 ARG A 523 4.517 1.546 -24.154 1.00 0.00 N ATOM 0 H ARG A 523 5.007 -1.585 -17.309 1.00 0.00 H new ATOM 0 HA ARG A 523 5.972 -0.517 -19.688 1.00 0.00 H new ATOM 0 HB2 ARG A 523 3.682 -0.313 -18.353 1.00 0.00 H new ATOM 0 HB3 ARG A 523 4.418 1.142 -17.709 1.00 0.00 H new ATOM 0 HG2 ARG A 523 3.262 1.962 -19.554 1.00 0.00 H new ATOM 0 HG3 ARG A 523 4.877 1.759 -20.204 1.00 0.00 H new ATOM 0 HD2 ARG A 523 4.059 -0.634 -20.891 1.00 0.00 H new ATOM 0 HD3 ARG A 523 2.448 0.001 -20.622 1.00 0.00 H new ATOM 0 HE ARG A 523 2.618 1.280 -22.568 1.00 0.00 H new ATOM 0 HH11 ARG A 523 5.782 0.044 -21.602 1.00 0.00 H new ATOM 0 HH12 ARG A 523 6.566 0.549 -23.103 1.00 0.00 H new ATOM 0 HH21 ARG A 523 3.632 1.923 -24.494 1.00 0.00 H new ATOM 0 HH22 ARG A 523 5.354 1.608 -24.734 1.00 0.00 H new ATOM 795 N GLU A 524 7.151 0.938 -16.990 1.00 0.00 N ATOM 796 CA GLU A 524 8.162 1.870 -16.503 1.00 0.00 C ATOM 797 C GLU A 524 9.565 1.378 -16.845 1.00 0.00 C ATOM 798 O GLU A 524 10.492 2.173 -17.001 1.00 0.00 O ATOM 799 CB GLU A 524 8.029 2.055 -14.990 1.00 0.00 C ATOM 800 CG GLU A 524 7.098 3.189 -14.595 1.00 0.00 C ATOM 801 CD GLU A 524 7.315 4.439 -15.425 1.00 0.00 C ATOM 802 OE1 GLU A 524 8.192 5.249 -15.060 1.00 0.00 O ATOM 803 OE2 GLU A 524 6.608 4.606 -16.441 1.00 0.00 O ATOM 0 H GLU A 524 6.681 0.405 -16.259 1.00 0.00 H new ATOM 0 HA GLU A 524 8.003 2.830 -16.995 1.00 0.00 H new ATOM 0 HB2 GLU A 524 7.665 1.127 -14.550 1.00 0.00 H new ATOM 0 HB3 GLU A 524 9.016 2.242 -14.567 1.00 0.00 H new ATOM 0 HG2 GLU A 524 6.065 2.860 -14.704 1.00 0.00 H new ATOM 0 HG3 GLU A 524 7.248 3.426 -13.542 1.00 0.00 H new ATOM 810 N ASP A 525 9.713 0.063 -16.960 1.00 0.00 N ATOM 811 CA ASP A 525 11.002 -0.537 -17.284 1.00 0.00 C ATOM 812 C ASP A 525 12.107 0.042 -16.405 1.00 0.00 C ATOM 813 O ASP A 525 13.144 0.478 -16.902 1.00 0.00 O ATOM 814 CB ASP A 525 11.337 -0.311 -18.759 1.00 0.00 C ATOM 815 CG ASP A 525 10.899 1.055 -19.250 1.00 0.00 C ATOM 816 OD1 ASP A 525 11.685 2.016 -19.111 1.00 0.00 O ATOM 817 OD2 ASP A 525 9.771 1.163 -19.774 1.00 0.00 O ATOM 0 H ASP A 525 8.956 -0.608 -16.834 1.00 0.00 H new ATOM 0 HA ASP A 525 10.934 -1.608 -17.094 1.00 0.00 H new ATOM 0 HB2 ASP A 525 12.412 -0.419 -18.905 1.00 0.00 H new ATOM 0 HB3 ASP A 525 10.855 -1.082 -19.360 1.00 0.00 H new ATOM 822 N GLU A 526 11.874 0.042 -15.096 1.00 0.00 N ATOM 823 CA GLU A 526 12.849 0.569 -14.148 1.00 0.00 C ATOM 824 C GLU A 526 12.808 -0.210 -12.836 1.00 0.00 C ATOM 825 O GLU A 526 11.938 -1.056 -12.631 1.00 0.00 O ATOM 826 CB GLU A 526 12.585 2.052 -13.882 1.00 0.00 C ATOM 827 CG GLU A 526 13.345 2.982 -14.812 1.00 0.00 C ATOM 828 CD GLU A 526 12.561 3.322 -16.065 1.00 0.00 C ATOM 829 OE1 GLU A 526 11.554 4.052 -15.953 1.00 0.00 O ATOM 830 OE2 GLU A 526 12.955 2.860 -17.156 1.00 0.00 O ATOM 0 H GLU A 526 11.020 -0.316 -14.668 1.00 0.00 H new ATOM 0 HA GLU A 526 13.841 0.457 -14.586 1.00 0.00 H new ATOM 0 HB2 GLU A 526 11.517 2.246 -13.981 1.00 0.00 H new ATOM 0 HB3 GLU A 526 12.856 2.281 -12.851 1.00 0.00 H new ATOM 0 HG2 GLU A 526 13.590 3.901 -14.280 1.00 0.00 H new ATOM 0 HG3 GLU A 526 14.289 2.516 -15.094 1.00 0.00 H new ATOM 837 N SER A 527 13.756 0.083 -11.951 1.00 0.00 N ATOM 838 CA SER A 527 13.832 -0.592 -10.661 1.00 0.00 C ATOM 839 C SER A 527 12.548 -0.385 -9.863 1.00 0.00 C ATOM 840 O SER A 527 11.997 0.716 -9.827 1.00 0.00 O ATOM 841 CB SER A 527 15.031 -0.078 -9.862 1.00 0.00 C ATOM 842 OG SER A 527 16.225 -0.170 -10.619 1.00 0.00 O ATOM 0 H SER A 527 14.482 0.783 -12.104 1.00 0.00 H new ATOM 0 HA SER A 527 13.957 -1.659 -10.844 1.00 0.00 H new ATOM 0 HB2 SER A 527 14.860 0.958 -9.570 1.00 0.00 H new ATOM 0 HB3 SER A 527 15.134 -0.655 -8.943 1.00 0.00 H new ATOM 0 HG SER A 527 16.976 0.166 -10.087 1.00 0.00 H new ATOM 848 N TYR A 528 12.077 -1.451 -9.225 1.00 0.00 N ATOM 849 CA TYR A 528 10.857 -1.388 -8.430 1.00 0.00 C ATOM 850 C TYR A 528 10.877 -0.181 -7.496 1.00 0.00 C ATOM 851 O TYR A 528 9.985 0.665 -7.537 1.00 0.00 O ATOM 852 CB TYR A 528 10.685 -2.673 -7.618 1.00 0.00 C ATOM 853 CG TYR A 528 10.236 -3.856 -8.444 1.00 0.00 C ATOM 854 CD1 TYR A 528 9.097 -3.782 -9.237 1.00 0.00 C ATOM 855 CD2 TYR A 528 10.949 -5.048 -8.432 1.00 0.00 C ATOM 856 CE1 TYR A 528 8.681 -4.860 -9.993 1.00 0.00 C ATOM 857 CE2 TYR A 528 10.542 -6.131 -9.187 1.00 0.00 C ATOM 858 CZ TYR A 528 9.407 -6.033 -9.965 1.00 0.00 C ATOM 859 OH TYR A 528 8.998 -7.110 -10.717 1.00 0.00 O ATOM 0 H TYR A 528 12.522 -2.369 -9.243 1.00 0.00 H new ATOM 0 HA TYR A 528 10.014 -1.282 -9.113 1.00 0.00 H new ATOM 0 HB2 TYR A 528 11.631 -2.916 -7.134 1.00 0.00 H new ATOM 0 HB3 TYR A 528 9.958 -2.497 -6.825 1.00 0.00 H new ATOM 0 HD1 TYR A 528 8.527 -2.865 -9.262 1.00 0.00 H new ATOM 0 HD2 TYR A 528 11.837 -5.130 -7.822 1.00 0.00 H new ATOM 0 HE1 TYR A 528 7.793 -4.785 -10.603 1.00 0.00 H new ATOM 0 HE2 TYR A 528 11.110 -7.050 -9.168 1.00 0.00 H new ATOM 0 HH TYR A 528 8.192 -6.870 -11.220 1.00 0.00 H new ATOM 869 N GLY A 529 11.903 -0.111 -6.653 1.00 0.00 N ATOM 870 CA GLY A 529 12.022 0.995 -5.720 1.00 0.00 C ATOM 871 C GLY A 529 11.576 2.312 -6.323 1.00 0.00 C ATOM 872 O GLY A 529 10.711 2.994 -5.773 1.00 0.00 O ATOM 0 H GLY A 529 12.653 -0.800 -6.599 1.00 0.00 H new ATOM 0 HA2 GLY A 529 11.425 0.784 -4.833 1.00 0.00 H new ATOM 0 HA3 GLY A 529 13.058 1.081 -5.393 1.00 0.00 H new ATOM 876 N TYR A 530 12.170 2.673 -7.455 1.00 0.00 N ATOM 877 CA TYR A 530 11.832 3.921 -8.131 1.00 0.00 C ATOM 878 C TYR A 530 10.320 4.104 -8.212 1.00 0.00 C ATOM 879 O TYR A 530 9.799 5.186 -7.939 1.00 0.00 O ATOM 880 CB TYR A 530 12.435 3.943 -9.537 1.00 0.00 C ATOM 881 CG TYR A 530 11.976 5.115 -10.374 1.00 0.00 C ATOM 882 CD1 TYR A 530 12.625 6.341 -10.303 1.00 0.00 C ATOM 883 CD2 TYR A 530 10.892 4.997 -11.236 1.00 0.00 C ATOM 884 CE1 TYR A 530 12.209 7.415 -11.066 1.00 0.00 C ATOM 885 CE2 TYR A 530 10.470 6.065 -12.003 1.00 0.00 C ATOM 886 CZ TYR A 530 11.131 7.272 -11.915 1.00 0.00 C ATOM 887 OH TYR A 530 10.713 8.339 -12.676 1.00 0.00 O ATOM 0 H TYR A 530 12.887 2.120 -7.924 1.00 0.00 H new ATOM 0 HA TYR A 530 12.249 4.744 -7.550 1.00 0.00 H new ATOM 0 HB2 TYR A 530 13.522 3.968 -9.457 1.00 0.00 H new ATOM 0 HB3 TYR A 530 12.174 3.017 -10.050 1.00 0.00 H new ATOM 0 HD1 TYR A 530 13.470 6.457 -9.640 1.00 0.00 H new ATOM 0 HD2 TYR A 530 10.371 4.054 -11.307 1.00 0.00 H new ATOM 0 HE1 TYR A 530 12.725 8.361 -10.998 1.00 0.00 H new ATOM 0 HE2 TYR A 530 9.626 5.955 -12.668 1.00 0.00 H new ATOM 0 HH TYR A 530 9.943 8.071 -13.220 1.00 0.00 H new ATOM 897 N VAL A 531 9.620 3.039 -8.588 1.00 0.00 N ATOM 898 CA VAL A 531 8.167 3.080 -8.703 1.00 0.00 C ATOM 899 C VAL A 531 7.515 3.342 -7.350 1.00 0.00 C ATOM 900 O VAL A 531 6.870 4.372 -7.148 1.00 0.00 O ATOM 901 CB VAL A 531 7.612 1.764 -9.281 1.00 0.00 C ATOM 902 CG1 VAL A 531 6.094 1.813 -9.358 1.00 0.00 C ATOM 903 CG2 VAL A 531 8.215 1.489 -10.650 1.00 0.00 C ATOM 0 H VAL A 531 10.036 2.136 -8.818 1.00 0.00 H new ATOM 0 HA VAL A 531 7.927 3.897 -9.383 1.00 0.00 H new ATOM 0 HB VAL A 531 7.891 0.948 -8.615 1.00 0.00 H new ATOM 0 HG11 VAL A 531 5.720 0.875 -9.769 1.00 0.00 H new ATOM 0 HG12 VAL A 531 5.684 1.961 -8.359 1.00 0.00 H new ATOM 0 HG13 VAL A 531 5.789 2.638 -10.002 1.00 0.00 H new ATOM 0 HG21 VAL A 531 7.812 0.556 -11.044 1.00 0.00 H new ATOM 0 HG22 VAL A 531 7.967 2.306 -11.328 1.00 0.00 H new ATOM 0 HG23 VAL A 531 9.298 1.408 -10.561 1.00 0.00 H new ATOM 913 N LEU A 532 7.689 2.405 -6.424 1.00 0.00 N ATOM 914 CA LEU A 532 7.118 2.535 -5.088 1.00 0.00 C ATOM 915 C LEU A 532 7.847 1.634 -4.095 1.00 0.00 C ATOM 916 O LEU A 532 7.929 0.418 -4.267 1.00 0.00 O ATOM 917 CB LEU A 532 5.629 2.187 -5.112 1.00 0.00 C ATOM 918 CG LEU A 532 4.895 2.287 -3.774 1.00 0.00 C ATOM 919 CD1 LEU A 532 4.538 3.733 -3.469 1.00 0.00 C ATOM 920 CD2 LEU A 532 3.645 1.418 -3.786 1.00 0.00 C ATOM 0 H LEU A 532 8.221 1.548 -6.574 1.00 0.00 H new ATOM 0 HA LEU A 532 7.237 3.570 -4.767 1.00 0.00 H new ATOM 0 HB2 LEU A 532 5.134 2.846 -5.825 1.00 0.00 H new ATOM 0 HB3 LEU A 532 5.520 1.170 -5.488 1.00 0.00 H new ATOM 0 HG LEU A 532 5.558 1.924 -2.989 1.00 0.00 H new ATOM 0 HD11 LEU A 532 4.016 3.785 -2.513 1.00 0.00 H new ATOM 0 HD12 LEU A 532 5.449 4.330 -3.418 1.00 0.00 H new ATOM 0 HD13 LEU A 532 3.893 4.122 -4.256 1.00 0.00 H new ATOM 0 HD21 LEU A 532 3.135 1.501 -2.826 1.00 0.00 H new ATOM 0 HD22 LEU A 532 2.978 1.751 -4.581 1.00 0.00 H new ATOM 0 HD23 LEU A 532 3.926 0.379 -3.959 1.00 0.00 H new ATOM 932 N PRO A 533 8.387 2.244 -3.030 1.00 0.00 N ATOM 933 CA PRO A 533 9.116 1.516 -1.986 1.00 0.00 C ATOM 934 C PRO A 533 8.197 0.638 -1.142 1.00 0.00 C ATOM 935 O PRO A 533 6.975 0.747 -1.223 1.00 0.00 O ATOM 936 CB PRO A 533 9.722 2.632 -1.133 1.00 0.00 C ATOM 937 CG PRO A 533 8.825 3.802 -1.346 1.00 0.00 C ATOM 938 CD PRO A 533 8.328 3.690 -2.760 1.00 0.00 C ATOM 0 HA PRO A 533 9.855 0.833 -2.405 1.00 0.00 H new ATOM 0 HB2 PRO A 533 9.761 2.349 -0.081 1.00 0.00 H new ATOM 0 HB3 PRO A 533 10.743 2.855 -1.441 1.00 0.00 H new ATOM 0 HG2 PRO A 533 7.996 3.792 -0.639 1.00 0.00 H new ATOM 0 HG3 PRO A 533 9.362 4.738 -1.194 1.00 0.00 H new ATOM 0 HD2 PRO A 533 7.314 4.076 -2.861 1.00 0.00 H new ATOM 0 HD3 PRO A 533 8.954 4.254 -3.452 1.00 0.00 H new ATOM 946 N ASN A 534 8.795 -0.230 -0.333 1.00 0.00 N ATOM 947 CA ASN A 534 8.030 -1.126 0.526 1.00 0.00 C ATOM 948 C ASN A 534 7.342 -0.350 1.646 1.00 0.00 C ATOM 949 O ASN A 534 6.115 -0.327 1.736 1.00 0.00 O ATOM 950 CB ASN A 534 8.944 -2.200 1.121 1.00 0.00 C ATOM 951 CG ASN A 534 8.173 -3.417 1.595 1.00 0.00 C ATOM 952 OD1 ASN A 534 7.113 -3.293 2.209 1.00 0.00 O ATOM 953 ND2 ASN A 534 8.704 -4.600 1.312 1.00 0.00 N ATOM 0 H ASN A 534 9.807 -0.332 -0.254 1.00 0.00 H new ATOM 0 HA ASN A 534 7.264 -1.607 -0.083 1.00 0.00 H new ATOM 0 HB2 ASN A 534 9.676 -2.505 0.373 1.00 0.00 H new ATOM 0 HB3 ASN A 534 9.500 -1.777 1.958 1.00 0.00 H new ATOM 0 HD21 ASN A 534 8.231 -5.455 1.606 1.00 0.00 H new ATOM 0 HD22 ASN A 534 9.585 -4.654 0.801 1.00 0.00 H new ATOM 960 N HIS A 535 8.143 0.284 2.497 1.00 0.00 N ATOM 961 CA HIS A 535 7.611 1.062 3.611 1.00 0.00 C ATOM 962 C HIS A 535 6.377 1.849 3.183 1.00 0.00 C ATOM 963 O HIS A 535 5.329 1.774 3.824 1.00 0.00 O ATOM 964 CB HIS A 535 8.678 2.016 4.149 1.00 0.00 C ATOM 965 CG HIS A 535 8.804 3.281 3.357 1.00 0.00 C ATOM 966 ND1 HIS A 535 9.781 3.479 2.404 1.00 0.00 N ATOM 967 CD2 HIS A 535 8.068 4.417 3.380 1.00 0.00 C ATOM 968 CE1 HIS A 535 9.641 4.682 1.877 1.00 0.00 C ATOM 969 NE2 HIS A 535 8.608 5.271 2.451 1.00 0.00 N ATOM 0 H HIS A 535 9.161 0.274 2.437 1.00 0.00 H new ATOM 0 HA HIS A 535 7.322 0.369 4.401 1.00 0.00 H new ATOM 0 HB2 HIS A 535 8.442 2.266 5.183 1.00 0.00 H new ATOM 0 HB3 HIS A 535 9.640 1.504 4.157 1.00 0.00 H new ATOM 0 HD1 HIS A 535 10.499 2.802 2.146 1.00 0.00 H new ATOM 0 HD2 HIS A 535 7.215 4.615 4.012 1.00 0.00 H new ATOM 0 HE1 HIS A 535 10.265 5.111 1.107 1.00 0.00 H new ATOM 977 N MET A 536 6.509 2.604 2.097 1.00 0.00 N ATOM 978 CA MET A 536 5.404 3.405 1.584 1.00 0.00 C ATOM 979 C MET A 536 4.220 2.520 1.207 1.00 0.00 C ATOM 980 O MET A 536 3.141 2.629 1.790 1.00 0.00 O ATOM 981 CB MET A 536 5.855 4.218 0.370 1.00 0.00 C ATOM 982 CG MET A 536 4.845 5.266 -0.070 1.00 0.00 C ATOM 983 SD MET A 536 5.590 6.576 -1.060 1.00 0.00 S ATOM 984 CE MET A 536 6.935 7.084 0.008 1.00 0.00 C ATOM 0 H MET A 536 7.370 2.678 1.555 1.00 0.00 H new ATOM 0 HA MET A 536 5.088 4.088 2.372 1.00 0.00 H new ATOM 0 HB2 MET A 536 6.799 4.711 0.603 1.00 0.00 H new ATOM 0 HB3 MET A 536 6.047 3.539 -0.461 1.00 0.00 H new ATOM 0 HG2 MET A 536 4.055 4.784 -0.647 1.00 0.00 H new ATOM 0 HG3 MET A 536 4.375 5.704 0.810 1.00 0.00 H new ATOM 0 HE1 MET A 536 6.962 8.172 0.067 1.00 0.00 H new ATOM 0 HE2 MET A 536 6.784 6.671 1.005 1.00 0.00 H new ATOM 0 HE3 MET A 536 7.879 6.719 -0.397 1.00 0.00 H new ATOM 994 N MET A 537 4.429 1.645 0.229 1.00 0.00 N ATOM 995 CA MET A 537 3.379 0.740 -0.224 1.00 0.00 C ATOM 996 C MET A 537 2.485 0.320 0.937 1.00 0.00 C ATOM 997 O MET A 537 1.259 0.405 0.853 1.00 0.00 O ATOM 998 CB MET A 537 3.991 -0.496 -0.886 1.00 0.00 C ATOM 999 CG MET A 537 2.967 -1.396 -1.557 1.00 0.00 C ATOM 1000 SD MET A 537 3.715 -2.556 -2.717 1.00 0.00 S ATOM 1001 CE MET A 537 4.733 -3.531 -1.612 1.00 0.00 C ATOM 0 H MET A 537 5.316 1.543 -0.265 1.00 0.00 H new ATOM 0 HA MET A 537 2.769 1.269 -0.956 1.00 0.00 H new ATOM 0 HB2 MET A 537 4.723 -0.176 -1.628 1.00 0.00 H new ATOM 0 HB3 MET A 537 4.531 -1.071 -0.134 1.00 0.00 H new ATOM 0 HG2 MET A 537 2.422 -1.952 -0.794 1.00 0.00 H new ATOM 0 HG3 MET A 537 2.238 -0.780 -2.084 1.00 0.00 H new ATOM 0 HE1 MET A 537 5.092 -4.417 -2.135 1.00 0.00 H new ATOM 0 HE2 MET A 537 5.584 -2.936 -1.281 1.00 0.00 H new ATOM 0 HE3 MET A 537 4.144 -3.834 -0.747 1.00 0.00 H new ATOM 1011 N LEU A 538 3.105 -0.134 2.021 1.00 0.00 N ATOM 1012 CA LEU A 538 2.365 -0.569 3.201 1.00 0.00 C ATOM 1013 C LEU A 538 1.611 0.598 3.831 1.00 0.00 C ATOM 1014 O LEU A 538 0.410 0.510 4.087 1.00 0.00 O ATOM 1015 CB LEU A 538 3.317 -1.189 4.225 1.00 0.00 C ATOM 1016 CG LEU A 538 3.872 -2.570 3.875 1.00 0.00 C ATOM 1017 CD1 LEU A 538 5.084 -2.892 4.736 1.00 0.00 C ATOM 1018 CD2 LEU A 538 2.798 -3.635 4.042 1.00 0.00 C ATOM 0 H LEU A 538 4.118 -0.210 2.107 1.00 0.00 H new ATOM 0 HA LEU A 538 1.640 -1.320 2.888 1.00 0.00 H new ATOM 0 HB2 LEU A 538 4.156 -0.508 4.370 1.00 0.00 H new ATOM 0 HB3 LEU A 538 2.796 -1.260 5.180 1.00 0.00 H new ATOM 0 HG LEU A 538 4.186 -2.560 2.831 1.00 0.00 H new ATOM 0 HD11 LEU A 538 5.465 -3.879 4.473 1.00 0.00 H new ATOM 0 HD12 LEU A 538 5.860 -2.146 4.566 1.00 0.00 H new ATOM 0 HD13 LEU A 538 4.796 -2.883 5.787 1.00 0.00 H new ATOM 0 HD21 LEU A 538 3.211 -4.611 3.788 1.00 0.00 H new ATOM 0 HD22 LEU A 538 2.453 -3.644 5.076 1.00 0.00 H new ATOM 0 HD23 LEU A 538 1.960 -3.413 3.381 1.00 0.00 H new ATOM 1030 N LYS A 539 2.324 1.692 4.077 1.00 0.00 N ATOM 1031 CA LYS A 539 1.723 2.879 4.674 1.00 0.00 C ATOM 1032 C LYS A 539 0.345 3.149 4.079 1.00 0.00 C ATOM 1033 O LYS A 539 -0.601 3.467 4.800 1.00 0.00 O ATOM 1034 CB LYS A 539 2.629 4.094 4.464 1.00 0.00 C ATOM 1035 CG LYS A 539 2.188 5.322 5.242 1.00 0.00 C ATOM 1036 CD LYS A 539 3.087 6.514 4.957 1.00 0.00 C ATOM 1037 CE LYS A 539 2.507 7.798 5.530 1.00 0.00 C ATOM 1038 NZ LYS A 539 2.802 7.939 6.984 1.00 0.00 N ATOM 0 H LYS A 539 3.319 1.781 3.872 1.00 0.00 H new ATOM 0 HA LYS A 539 1.608 2.700 5.743 1.00 0.00 H new ATOM 0 HB2 LYS A 539 3.646 3.834 4.758 1.00 0.00 H new ATOM 0 HB3 LYS A 539 2.656 4.337 3.402 1.00 0.00 H new ATOM 0 HG2 LYS A 539 1.159 5.570 4.980 1.00 0.00 H new ATOM 0 HG3 LYS A 539 2.201 5.102 6.309 1.00 0.00 H new ATOM 0 HD2 LYS A 539 4.074 6.337 5.384 1.00 0.00 H new ATOM 0 HD3 LYS A 539 3.220 6.622 3.881 1.00 0.00 H new ATOM 0 HE2 LYS A 539 2.916 8.653 4.992 1.00 0.00 H new ATOM 0 HE3 LYS A 539 1.428 7.810 5.375 1.00 0.00 H new ATOM 0 HZ1 LYS A 539 2.390 8.826 7.337 1.00 0.00 H new ATOM 0 HZ2 LYS A 539 2.390 7.136 7.501 1.00 0.00 H new ATOM 0 HZ3 LYS A 539 3.832 7.953 7.130 1.00 0.00 H new ATOM 1052 N ILE A 540 0.239 3.019 2.761 1.00 0.00 N ATOM 1053 CA ILE A 540 -1.024 3.247 2.071 1.00 0.00 C ATOM 1054 C ILE A 540 -2.002 2.103 2.321 1.00 0.00 C ATOM 1055 O ILE A 540 -3.169 2.329 2.638 1.00 0.00 O ATOM 1056 CB ILE A 540 -0.816 3.406 0.553 1.00 0.00 C ATOM 1057 CG1 ILE A 540 0.200 4.514 0.270 1.00 0.00 C ATOM 1058 CG2 ILE A 540 -2.140 3.706 -0.135 1.00 0.00 C ATOM 1059 CD1 ILE A 540 0.914 4.355 -1.055 1.00 0.00 C ATOM 0 H ILE A 540 1.013 2.757 2.150 1.00 0.00 H new ATOM 0 HA ILE A 540 -1.439 4.172 2.472 1.00 0.00 H new ATOM 0 HB ILE A 540 -0.426 2.470 0.154 1.00 0.00 H new ATOM 0 HG12 ILE A 540 -0.311 5.477 0.285 1.00 0.00 H new ATOM 0 HG13 ILE A 540 0.938 4.532 1.072 1.00 0.00 H new ATOM 0 HG21 ILE A 540 -1.976 3.816 -1.207 1.00 0.00 H new ATOM 0 HG22 ILE A 540 -2.837 2.887 0.044 1.00 0.00 H new ATOM 0 HG23 ILE A 540 -2.557 4.631 0.265 1.00 0.00 H new ATOM 0 HD11 ILE A 540 1.619 5.175 -1.189 1.00 0.00 H new ATOM 0 HD12 ILE A 540 1.453 3.408 -1.066 1.00 0.00 H new ATOM 0 HD13 ILE A 540 0.185 4.367 -1.865 1.00 0.00 H new ATOM 1071 N ALA A 541 -1.515 0.874 2.178 1.00 0.00 N ATOM 1072 CA ALA A 541 -2.344 -0.305 2.392 1.00 0.00 C ATOM 1073 C ALA A 541 -2.966 -0.294 3.784 1.00 0.00 C ATOM 1074 O ALA A 541 -4.071 -0.795 3.984 1.00 0.00 O ATOM 1075 CB ALA A 541 -1.524 -1.571 2.188 1.00 0.00 C ATOM 0 H ALA A 541 -0.551 0.670 1.915 1.00 0.00 H new ATOM 0 HA ALA A 541 -3.153 -0.287 1.661 1.00 0.00 H new ATOM 0 HB1 ALA A 541 -2.156 -2.444 2.351 1.00 0.00 H new ATOM 0 HB2 ALA A 541 -1.133 -1.591 1.171 1.00 0.00 H new ATOM 0 HB3 ALA A 541 -0.695 -1.586 2.896 1.00 0.00 H new ATOM 1081 N GLU A 542 -2.247 0.280 4.744 1.00 0.00 N ATOM 1082 CA GLU A 542 -2.728 0.354 6.118 1.00 0.00 C ATOM 1083 C GLU A 542 -3.636 1.565 6.312 1.00 0.00 C ATOM 1084 O GLU A 542 -4.706 1.462 6.911 1.00 0.00 O ATOM 1085 CB GLU A 542 -1.550 0.426 7.092 1.00 0.00 C ATOM 1086 CG GLU A 542 -0.599 -0.755 6.984 1.00 0.00 C ATOM 1087 CD GLU A 542 0.091 -1.069 8.297 1.00 0.00 C ATOM 1088 OE1 GLU A 542 -0.617 -1.281 9.304 1.00 0.00 O ATOM 1089 OE2 GLU A 542 1.339 -1.102 8.319 1.00 0.00 O ATOM 0 H GLU A 542 -1.330 0.700 4.595 1.00 0.00 H new ATOM 0 HA GLU A 542 -3.305 -0.548 6.322 1.00 0.00 H new ATOM 0 HB2 GLU A 542 -0.995 1.347 6.911 1.00 0.00 H new ATOM 0 HB3 GLU A 542 -1.934 0.481 8.111 1.00 0.00 H new ATOM 0 HG2 GLU A 542 -1.152 -1.633 6.649 1.00 0.00 H new ATOM 0 HG3 GLU A 542 0.153 -0.543 6.224 1.00 0.00 H new ATOM 1096 N GLU A 543 -3.200 2.713 5.801 1.00 0.00 N ATOM 1097 CA GLU A 543 -3.973 3.943 5.919 1.00 0.00 C ATOM 1098 C GLU A 543 -5.366 3.771 5.320 1.00 0.00 C ATOM 1099 O GLU A 543 -6.363 4.198 5.904 1.00 0.00 O ATOM 1100 CB GLU A 543 -3.247 5.097 5.223 1.00 0.00 C ATOM 1101 CG GLU A 543 -2.179 5.750 6.084 1.00 0.00 C ATOM 1102 CD GLU A 543 -1.829 7.150 5.617 1.00 0.00 C ATOM 1103 OE1 GLU A 543 -2.068 7.457 4.430 1.00 0.00 O ATOM 1104 OE2 GLU A 543 -1.316 7.938 6.439 1.00 0.00 O ATOM 0 H GLU A 543 -2.316 2.816 5.302 1.00 0.00 H new ATOM 0 HA GLU A 543 -4.078 4.175 6.979 1.00 0.00 H new ATOM 0 HB2 GLU A 543 -2.787 4.726 4.307 1.00 0.00 H new ATOM 0 HB3 GLU A 543 -3.977 5.851 4.930 1.00 0.00 H new ATOM 0 HG2 GLU A 543 -2.525 5.791 7.117 1.00 0.00 H new ATOM 0 HG3 GLU A 543 -1.281 5.132 6.073 1.00 0.00 H new ATOM 1111 N LEU A 544 -5.428 3.142 4.151 1.00 0.00 N ATOM 1112 CA LEU A 544 -6.698 2.912 3.472 1.00 0.00 C ATOM 1113 C LEU A 544 -7.434 4.227 3.235 1.00 0.00 C ATOM 1114 O LEU A 544 -8.598 4.390 3.604 1.00 0.00 O ATOM 1115 CB LEU A 544 -7.574 1.964 4.293 1.00 0.00 C ATOM 1116 CG LEU A 544 -7.023 0.553 4.501 1.00 0.00 C ATOM 1117 CD1 LEU A 544 -8.059 -0.330 5.180 1.00 0.00 C ATOM 1118 CD2 LEU A 544 -6.593 -0.053 3.173 1.00 0.00 C ATOM 0 H LEU A 544 -4.613 2.782 3.654 1.00 0.00 H new ATOM 0 HA LEU A 544 -6.488 2.455 2.505 1.00 0.00 H new ATOM 0 HB2 LEU A 544 -7.744 2.414 5.271 1.00 0.00 H new ATOM 0 HB3 LEU A 544 -8.546 1.885 3.805 1.00 0.00 H new ATOM 0 HG LEU A 544 -6.149 0.617 5.149 1.00 0.00 H new ATOM 0 HD11 LEU A 544 -7.649 -1.330 5.320 1.00 0.00 H new ATOM 0 HD12 LEU A 544 -8.319 0.094 6.150 1.00 0.00 H new ATOM 0 HD13 LEU A 544 -8.952 -0.388 4.558 1.00 0.00 H new ATOM 0 HD21 LEU A 544 -6.203 -1.057 3.340 1.00 0.00 H new ATOM 0 HD22 LEU A 544 -7.450 -0.104 2.502 1.00 0.00 H new ATOM 0 HD23 LEU A 544 -5.817 0.567 2.724 1.00 0.00 H new ATOM 1130 N PRO A 545 -6.743 5.188 2.605 1.00 0.00 N ATOM 1131 CA PRO A 545 -7.313 6.504 2.302 1.00 0.00 C ATOM 1132 C PRO A 545 -8.390 6.436 1.225 1.00 0.00 C ATOM 1133 O PRO A 545 -8.104 6.145 0.064 1.00 0.00 O ATOM 1134 CB PRO A 545 -6.108 7.306 1.803 1.00 0.00 C ATOM 1135 CG PRO A 545 -5.163 6.281 1.277 1.00 0.00 C ATOM 1136 CD PRO A 545 -5.352 5.063 2.137 1.00 0.00 C ATOM 0 HA PRO A 545 -7.806 6.944 3.169 1.00 0.00 H new ATOM 0 HB2 PRO A 545 -6.398 8.013 1.026 1.00 0.00 H new ATOM 0 HB3 PRO A 545 -5.656 7.885 2.609 1.00 0.00 H new ATOM 0 HG2 PRO A 545 -5.373 6.057 0.231 1.00 0.00 H new ATOM 0 HG3 PRO A 545 -4.134 6.637 1.326 1.00 0.00 H new ATOM 0 HD2 PRO A 545 -5.200 4.144 1.571 1.00 0.00 H new ATOM 0 HD3 PRO A 545 -4.648 5.045 2.969 1.00 0.00 H new ATOM 1144 N LYS A 546 -9.631 6.706 1.618 1.00 0.00 N ATOM 1145 CA LYS A 546 -10.752 6.677 0.687 1.00 0.00 C ATOM 1146 C LYS A 546 -10.466 7.544 -0.535 1.00 0.00 C ATOM 1147 O LYS A 546 -10.594 7.091 -1.672 1.00 0.00 O ATOM 1148 CB LYS A 546 -12.029 7.158 1.379 1.00 0.00 C ATOM 1149 CG LYS A 546 -11.921 8.562 1.948 1.00 0.00 C ATOM 1150 CD LYS A 546 -13.068 8.870 2.896 1.00 0.00 C ATOM 1151 CE LYS A 546 -12.790 8.343 4.296 1.00 0.00 C ATOM 1152 NZ LYS A 546 -12.041 9.330 5.121 1.00 0.00 N ATOM 0 H LYS A 546 -9.885 6.947 2.576 1.00 0.00 H new ATOM 0 HA LYS A 546 -10.891 5.648 0.356 1.00 0.00 H new ATOM 0 HB2 LYS A 546 -12.853 7.127 0.666 1.00 0.00 H new ATOM 0 HB3 LYS A 546 -12.278 6.467 2.184 1.00 0.00 H new ATOM 0 HG2 LYS A 546 -10.973 8.670 2.475 1.00 0.00 H new ATOM 0 HG3 LYS A 546 -11.917 9.286 1.133 1.00 0.00 H new ATOM 0 HD2 LYS A 546 -13.229 9.947 2.937 1.00 0.00 H new ATOM 0 HD3 LYS A 546 -13.987 8.425 2.514 1.00 0.00 H new ATOM 0 HE2 LYS A 546 -13.733 8.100 4.787 1.00 0.00 H new ATOM 0 HE3 LYS A 546 -12.218 7.417 4.229 1.00 0.00 H new ATOM 0 HZ1 LYS A 546 -11.871 8.934 6.067 1.00 0.00 H new ATOM 0 HZ2 LYS A 546 -11.130 9.543 4.666 1.00 0.00 H new ATOM 0 HZ3 LYS A 546 -12.598 10.204 5.207 1.00 0.00 H new ATOM 1166 N GLU A 547 -10.079 8.793 -0.292 1.00 0.00 N ATOM 1167 CA GLU A 547 -9.775 9.722 -1.374 1.00 0.00 C ATOM 1168 C GLU A 547 -8.386 9.454 -1.947 1.00 0.00 C ATOM 1169 O GLU A 547 -7.532 8.837 -1.310 1.00 0.00 O ATOM 1170 CB GLU A 547 -9.864 11.166 -0.876 1.00 0.00 C ATOM 1171 CG GLU A 547 -11.248 11.775 -1.021 1.00 0.00 C ATOM 1172 CD GLU A 547 -11.461 12.424 -2.376 1.00 0.00 C ATOM 1173 OE1 GLU A 547 -11.910 11.721 -3.305 1.00 0.00 O ATOM 1174 OE2 GLU A 547 -11.180 13.633 -2.506 1.00 0.00 O ATOM 0 H GLU A 547 -9.969 9.184 0.644 1.00 0.00 H new ATOM 0 HA GLU A 547 -10.510 9.572 -2.165 1.00 0.00 H new ATOM 0 HB2 GLU A 547 -9.570 11.198 0.173 1.00 0.00 H new ATOM 0 HB3 GLU A 547 -9.148 11.776 -1.427 1.00 0.00 H new ATOM 0 HG2 GLU A 547 -11.999 11.000 -0.871 1.00 0.00 H new ATOM 0 HG3 GLU A 547 -11.397 12.519 -0.238 1.00 0.00 H new ATOM 1181 N PRO A 548 -8.153 9.930 -3.179 1.00 0.00 N ATOM 1182 CA PRO A 548 -6.869 9.755 -3.866 1.00 0.00 C ATOM 1183 C PRO A 548 -5.755 10.579 -3.231 1.00 0.00 C ATOM 1184 O PRO A 548 -4.573 10.299 -3.429 1.00 0.00 O ATOM 1185 CB PRO A 548 -7.157 10.248 -5.286 1.00 0.00 C ATOM 1186 CG PRO A 548 -8.292 11.201 -5.134 1.00 0.00 C ATOM 1187 CD PRO A 548 -9.124 10.675 -3.997 1.00 0.00 C ATOM 0 HA PRO A 548 -6.520 8.724 -3.821 1.00 0.00 H new ATOM 0 HB2 PRO A 548 -6.285 10.737 -5.720 1.00 0.00 H new ATOM 0 HB3 PRO A 548 -7.420 9.421 -5.946 1.00 0.00 H new ATOM 0 HG2 PRO A 548 -7.931 12.207 -4.921 1.00 0.00 H new ATOM 0 HG3 PRO A 548 -8.878 11.260 -6.051 1.00 0.00 H new ATOM 0 HD2 PRO A 548 -9.589 11.483 -3.432 1.00 0.00 H new ATOM 0 HD3 PRO A 548 -9.928 10.031 -4.352 1.00 0.00 H new ATOM 1195 N GLN A 549 -6.140 11.597 -2.467 1.00 0.00 N ATOM 1196 CA GLN A 549 -5.172 12.462 -1.803 1.00 0.00 C ATOM 1197 C GLN A 549 -4.320 11.670 -0.817 1.00 0.00 C ATOM 1198 O GLN A 549 -3.097 11.803 -0.791 1.00 0.00 O ATOM 1199 CB GLN A 549 -5.889 13.601 -1.076 1.00 0.00 C ATOM 1200 CG GLN A 549 -4.949 14.676 -0.553 1.00 0.00 C ATOM 1201 CD GLN A 549 -5.550 15.471 0.589 1.00 0.00 C ATOM 1202 OE1 GLN A 549 -6.477 15.014 1.258 1.00 0.00 O ATOM 1203 NE2 GLN A 549 -5.023 16.668 0.819 1.00 0.00 N ATOM 0 H GLN A 549 -7.115 11.842 -2.293 1.00 0.00 H new ATOM 0 HA GLN A 549 -4.516 12.883 -2.565 1.00 0.00 H new ATOM 0 HB2 GLN A 549 -6.609 14.058 -1.755 1.00 0.00 H new ATOM 0 HB3 GLN A 549 -6.456 13.188 -0.241 1.00 0.00 H new ATOM 0 HG2 GLN A 549 -4.022 14.211 -0.218 1.00 0.00 H new ATOM 0 HG3 GLN A 549 -4.690 15.354 -1.366 1.00 0.00 H new ATOM 0 HE21 GLN A 549 -4.255 17.007 0.239 1.00 0.00 H new ATOM 0 HE22 GLN A 549 -5.386 17.248 1.575 1.00 0.00 H new ATOM 1212 N GLY A 550 -4.975 10.845 -0.006 1.00 0.00 N ATOM 1213 CA GLY A 550 -4.262 10.044 0.972 1.00 0.00 C ATOM 1214 C GLY A 550 -3.170 9.200 0.344 1.00 0.00 C ATOM 1215 O GLY A 550 -2.238 8.773 1.026 1.00 0.00 O ATOM 0 H GLY A 550 -5.987 10.717 -0.009 1.00 0.00 H new ATOM 0 HA2 GLY A 550 -3.823 10.700 1.724 1.00 0.00 H new ATOM 0 HA3 GLY A 550 -4.968 9.394 1.489 1.00 0.00 H new ATOM 1219 N ILE A 551 -3.286 8.959 -0.957 1.00 0.00 N ATOM 1220 CA ILE A 551 -2.300 8.160 -1.675 1.00 0.00 C ATOM 1221 C ILE A 551 -1.123 9.017 -2.129 1.00 0.00 C ATOM 1222 O ILE A 551 -0.020 8.512 -2.338 1.00 0.00 O ATOM 1223 CB ILE A 551 -2.923 7.470 -2.904 1.00 0.00 C ATOM 1224 CG1 ILE A 551 -3.982 6.458 -2.466 1.00 0.00 C ATOM 1225 CG2 ILE A 551 -1.843 6.791 -3.733 1.00 0.00 C ATOM 1226 CD1 ILE A 551 -5.376 7.040 -2.380 1.00 0.00 C ATOM 0 H ILE A 551 -4.052 9.305 -1.535 1.00 0.00 H new ATOM 0 HA ILE A 551 -1.945 7.398 -0.981 1.00 0.00 H new ATOM 0 HB ILE A 551 -3.406 8.227 -3.522 1.00 0.00 H new ATOM 0 HG12 ILE A 551 -3.988 5.624 -3.168 1.00 0.00 H new ATOM 0 HG13 ILE A 551 -3.705 6.053 -1.492 1.00 0.00 H new ATOM 0 HG21 ILE A 551 -2.298 6.308 -4.598 1.00 0.00 H new ATOM 0 HG22 ILE A 551 -1.122 7.535 -4.071 1.00 0.00 H new ATOM 0 HG23 ILE A 551 -1.334 6.043 -3.125 1.00 0.00 H new ATOM 0 HD11 ILE A 551 -6.075 6.266 -2.064 1.00 0.00 H new ATOM 0 HD12 ILE A 551 -5.386 7.855 -1.657 1.00 0.00 H new ATOM 0 HD13 ILE A 551 -5.673 7.419 -3.358 1.00 0.00 H new ATOM 1238 N ILE A 552 -1.366 10.314 -2.277 1.00 0.00 N ATOM 1239 CA ILE A 552 -0.325 11.242 -2.703 1.00 0.00 C ATOM 1240 C ILE A 552 0.495 11.731 -1.514 1.00 0.00 C ATOM 1241 O ILE A 552 1.724 11.673 -1.529 1.00 0.00 O ATOM 1242 CB ILE A 552 -0.920 12.458 -3.437 1.00 0.00 C ATOM 1243 CG1 ILE A 552 -1.813 11.998 -4.591 1.00 0.00 C ATOM 1244 CG2 ILE A 552 0.190 13.364 -3.948 1.00 0.00 C ATOM 1245 CD1 ILE A 552 -2.486 13.136 -5.325 1.00 0.00 C ATOM 0 H ILE A 552 -2.274 10.747 -2.108 1.00 0.00 H new ATOM 0 HA ILE A 552 0.323 10.696 -3.389 1.00 0.00 H new ATOM 0 HB ILE A 552 -1.530 13.025 -2.734 1.00 0.00 H new ATOM 0 HG12 ILE A 552 -1.213 11.425 -5.298 1.00 0.00 H new ATOM 0 HG13 ILE A 552 -2.577 11.325 -4.202 1.00 0.00 H new ATOM 0 HG21 ILE A 552 -0.247 14.219 -4.464 1.00 0.00 H new ATOM 0 HG22 ILE A 552 0.789 13.715 -3.108 1.00 0.00 H new ATOM 0 HG23 ILE A 552 0.824 12.808 -4.639 1.00 0.00 H new ATOM 0 HD11 ILE A 552 -3.103 12.736 -6.130 1.00 0.00 H new ATOM 0 HD12 ILE A 552 -3.113 13.696 -4.631 1.00 0.00 H new ATOM 0 HD13 ILE A 552 -1.728 13.798 -5.744 1.00 0.00 H new ATOM 1257 N ALA A 553 -0.194 12.212 -0.484 1.00 0.00 N ATOM 1258 CA ALA A 553 0.470 12.707 0.715 1.00 0.00 C ATOM 1259 C ALA A 553 1.380 11.643 1.318 1.00 0.00 C ATOM 1260 O ALA A 553 2.371 11.961 1.977 1.00 0.00 O ATOM 1261 CB ALA A 553 -0.559 13.165 1.737 1.00 0.00 C ATOM 0 H ALA A 553 -1.212 12.269 -0.456 1.00 0.00 H new ATOM 0 HA ALA A 553 1.089 13.559 0.432 1.00 0.00 H new ATOM 0 HB1 ALA A 553 -0.049 13.532 2.628 1.00 0.00 H new ATOM 0 HB2 ALA A 553 -1.165 13.964 1.310 1.00 0.00 H new ATOM 0 HB3 ALA A 553 -1.202 12.327 2.007 1.00 0.00 H new ATOM 1267 N CYS A 554 1.037 10.380 1.090 1.00 0.00 N ATOM 1268 CA CYS A 554 1.823 9.268 1.613 1.00 0.00 C ATOM 1269 C CYS A 554 3.296 9.425 1.249 1.00 0.00 C ATOM 1270 O CYS A 554 4.179 9.019 2.006 1.00 0.00 O ATOM 1271 CB CYS A 554 1.290 7.940 1.072 1.00 0.00 C ATOM 1272 SG CYS A 554 1.911 7.510 -0.571 1.00 0.00 S ATOM 0 H CYS A 554 0.220 10.100 0.547 1.00 0.00 H new ATOM 0 HA CYS A 554 1.733 9.271 2.699 1.00 0.00 H new ATOM 0 HB2 CYS A 554 1.554 7.144 1.768 1.00 0.00 H new ATOM 0 HB3 CYS A 554 0.201 7.985 1.037 1.00 0.00 H new ATOM 0 HG CYS A 554 0.950 7.619 -1.440 1.00 0.00 H new ATOM 1278 N CYS A 555 3.553 10.014 0.087 1.00 0.00 N ATOM 1279 CA CYS A 555 4.920 10.222 -0.379 1.00 0.00 C ATOM 1280 C CYS A 555 5.307 11.694 -0.287 1.00 0.00 C ATOM 1281 O CYS A 555 4.452 12.576 -0.351 1.00 0.00 O ATOM 1282 CB CYS A 555 5.070 9.732 -1.820 1.00 0.00 C ATOM 1283 SG CYS A 555 6.777 9.395 -2.311 1.00 0.00 S ATOM 0 H CYS A 555 2.834 10.356 -0.550 1.00 0.00 H new ATOM 0 HA CYS A 555 5.588 9.648 0.263 1.00 0.00 H new ATOM 0 HB2 CYS A 555 4.481 8.824 -1.947 1.00 0.00 H new ATOM 0 HB3 CYS A 555 4.651 10.480 -2.492 1.00 0.00 H new ATOM 0 HG CYS A 555 7.288 10.457 -2.860 1.00 0.00 H new ATOM 1289 N ASN A 556 6.602 11.951 -0.135 1.00 0.00 N ATOM 1290 CA ASN A 556 7.103 13.317 -0.031 1.00 0.00 C ATOM 1291 C ASN A 556 8.624 13.350 -0.152 1.00 0.00 C ATOM 1292 O ASN A 556 9.352 12.930 0.748 1.00 0.00 O ATOM 1293 CB ASN A 556 6.672 13.941 1.298 1.00 0.00 C ATOM 1294 CG ASN A 556 6.611 15.455 1.233 1.00 0.00 C ATOM 1295 OD1 ASN A 556 5.554 16.035 0.982 1.00 0.00 O ATOM 1296 ND2 ASN A 556 7.748 16.103 1.459 1.00 0.00 N ATOM 0 H ASN A 556 7.323 11.232 -0.081 1.00 0.00 H new ATOM 0 HA ASN A 556 6.679 13.896 -0.851 1.00 0.00 H new ATOM 0 HB2 ASN A 556 5.693 13.552 1.578 1.00 0.00 H new ATOM 0 HB3 ASN A 556 7.370 13.641 2.080 1.00 0.00 H new ATOM 0 HD21 ASN A 556 7.769 17.122 1.428 1.00 0.00 H new ATOM 0 HD22 ASN A 556 8.600 15.581 1.663 1.00 0.00 H new ATOM 1303 N PRO A 557 9.116 13.861 -1.290 1.00 0.00 N ATOM 1304 CA PRO A 557 8.259 14.363 -2.368 1.00 0.00 C ATOM 1305 C PRO A 557 7.508 13.243 -3.081 1.00 0.00 C ATOM 1306 O PRO A 557 7.724 12.063 -2.804 1.00 0.00 O ATOM 1307 CB PRO A 557 9.249 15.035 -3.323 1.00 0.00 C ATOM 1308 CG PRO A 557 10.546 14.346 -3.072 1.00 0.00 C ATOM 1309 CD PRO A 557 10.548 13.987 -1.612 1.00 0.00 C ATOM 0 HA PRO A 557 7.484 15.032 -1.995 1.00 0.00 H new ATOM 0 HB2 PRO A 557 8.936 14.923 -4.361 1.00 0.00 H new ATOM 0 HB3 PRO A 557 9.325 16.104 -3.127 1.00 0.00 H new ATOM 0 HG2 PRO A 557 10.641 13.455 -3.693 1.00 0.00 H new ATOM 0 HG3 PRO A 557 11.387 14.996 -3.315 1.00 0.00 H new ATOM 0 HD2 PRO A 557 11.085 13.056 -1.428 1.00 0.00 H new ATOM 0 HD3 PRO A 557 11.029 14.757 -1.009 1.00 0.00 H new ATOM 1317 N VAL A 558 6.625 13.621 -4.000 1.00 0.00 N ATOM 1318 CA VAL A 558 5.843 12.648 -4.753 1.00 0.00 C ATOM 1319 C VAL A 558 6.292 12.591 -6.209 1.00 0.00 C ATOM 1320 O VAL A 558 6.362 13.606 -6.903 1.00 0.00 O ATOM 1321 CB VAL A 558 4.339 12.978 -4.704 1.00 0.00 C ATOM 1322 CG1 VAL A 558 3.546 11.982 -5.537 1.00 0.00 C ATOM 1323 CG2 VAL A 558 3.845 12.996 -3.265 1.00 0.00 C ATOM 0 H VAL A 558 6.434 14.594 -4.241 1.00 0.00 H new ATOM 0 HA VAL A 558 6.010 11.678 -4.286 1.00 0.00 H new ATOM 0 HB VAL A 558 4.188 13.971 -5.128 1.00 0.00 H new ATOM 0 HG11 VAL A 558 2.486 12.231 -5.490 1.00 0.00 H new ATOM 0 HG12 VAL A 558 3.883 12.024 -6.573 1.00 0.00 H new ATOM 0 HG13 VAL A 558 3.700 10.976 -5.146 1.00 0.00 H new ATOM 0 HG21 VAL A 558 2.781 13.231 -3.249 1.00 0.00 H new ATOM 0 HG22 VAL A 558 4.008 12.018 -2.812 1.00 0.00 H new ATOM 0 HG23 VAL A 558 4.392 13.752 -2.702 1.00 0.00 H new ATOM 1333 N PRO A 559 6.603 11.377 -6.685 1.00 0.00 N ATOM 1334 CA PRO A 559 7.050 11.158 -8.064 1.00 0.00 C ATOM 1335 C PRO A 559 5.932 11.376 -9.077 1.00 0.00 C ATOM 1336 O PRO A 559 4.761 11.521 -8.724 1.00 0.00 O ATOM 1337 CB PRO A 559 7.494 9.693 -8.064 1.00 0.00 C ATOM 1338 CG PRO A 559 6.715 9.060 -6.963 1.00 0.00 C ATOM 1339 CD PRO A 559 6.543 10.124 -5.914 1.00 0.00 C ATOM 0 HA PRO A 559 7.836 11.856 -8.354 1.00 0.00 H new ATOM 0 HB2 PRO A 559 7.285 9.216 -9.022 1.00 0.00 H new ATOM 0 HB3 PRO A 559 8.567 9.605 -7.891 1.00 0.00 H new ATOM 0 HG2 PRO A 559 5.749 8.706 -7.322 1.00 0.00 H new ATOM 0 HG3 PRO A 559 7.242 8.195 -6.559 1.00 0.00 H new ATOM 0 HD2 PRO A 559 5.593 10.021 -5.389 1.00 0.00 H new ATOM 0 HD3 PRO A 559 7.330 10.077 -5.162 1.00 0.00 H new ATOM 1347 N PRO A 560 6.297 11.399 -10.368 1.00 0.00 N ATOM 1348 CA PRO A 560 5.339 11.598 -11.459 1.00 0.00 C ATOM 1349 C PRO A 560 4.412 10.401 -11.642 1.00 0.00 C ATOM 1350 O PRO A 560 3.288 10.541 -12.124 1.00 0.00 O ATOM 1351 CB PRO A 560 6.233 11.775 -12.688 1.00 0.00 C ATOM 1352 CG PRO A 560 7.496 11.065 -12.344 1.00 0.00 C ATOM 1353 CD PRO A 560 7.675 11.233 -10.861 1.00 0.00 C ATOM 0 HA PRO A 560 4.677 12.443 -11.271 1.00 0.00 H new ATOM 0 HB2 PRO A 560 5.770 11.350 -13.579 1.00 0.00 H new ATOM 0 HB3 PRO A 560 6.416 12.829 -12.896 1.00 0.00 H new ATOM 0 HG2 PRO A 560 7.436 10.010 -12.613 1.00 0.00 H new ATOM 0 HG3 PRO A 560 8.341 11.486 -12.889 1.00 0.00 H new ATOM 0 HD2 PRO A 560 8.160 10.365 -10.414 1.00 0.00 H new ATOM 0 HD3 PRO A 560 8.293 12.100 -10.626 1.00 0.00 H new ATOM 1361 N LEU A 561 4.891 9.224 -11.254 1.00 0.00 N ATOM 1362 CA LEU A 561 4.105 8.001 -11.375 1.00 0.00 C ATOM 1363 C LEU A 561 2.952 7.993 -10.376 1.00 0.00 C ATOM 1364 O LEU A 561 1.785 8.071 -10.759 1.00 0.00 O ATOM 1365 CB LEU A 561 4.994 6.776 -11.154 1.00 0.00 C ATOM 1366 CG LEU A 561 6.207 6.651 -12.077 1.00 0.00 C ATOM 1367 CD1 LEU A 561 7.116 5.523 -11.615 1.00 0.00 C ATOM 1368 CD2 LEU A 561 5.762 6.425 -13.515 1.00 0.00 C ATOM 0 H LEU A 561 5.819 9.091 -10.853 1.00 0.00 H new ATOM 0 HA LEU A 561 3.689 7.964 -12.382 1.00 0.00 H new ATOM 0 HB2 LEU A 561 5.347 6.790 -10.123 1.00 0.00 H new ATOM 0 HB3 LEU A 561 4.381 5.882 -11.269 1.00 0.00 H new ATOM 0 HG LEU A 561 6.770 7.584 -12.034 1.00 0.00 H new ATOM 0 HD11 LEU A 561 7.973 5.449 -12.284 1.00 0.00 H new ATOM 0 HD12 LEU A 561 7.463 5.727 -10.602 1.00 0.00 H new ATOM 0 HD13 LEU A 561 6.564 4.583 -11.627 1.00 0.00 H new ATOM 0 HD21 LEU A 561 6.638 6.338 -14.158 1.00 0.00 H new ATOM 0 HD22 LEU A 561 5.176 5.508 -13.575 1.00 0.00 H new ATOM 0 HD23 LEU A 561 5.153 7.267 -13.844 1.00 0.00 H new ATOM 1380 N VAL A 562 3.288 7.901 -9.093 1.00 0.00 N ATOM 1381 CA VAL A 562 2.282 7.887 -8.039 1.00 0.00 C ATOM 1382 C VAL A 562 1.163 8.880 -8.333 1.00 0.00 C ATOM 1383 O VAL A 562 0.002 8.639 -8.003 1.00 0.00 O ATOM 1384 CB VAL A 562 2.900 8.220 -6.668 1.00 0.00 C ATOM 1385 CG1 VAL A 562 1.811 8.448 -5.631 1.00 0.00 C ATOM 1386 CG2 VAL A 562 3.844 7.111 -6.227 1.00 0.00 C ATOM 0 H VAL A 562 4.250 7.835 -8.759 1.00 0.00 H new ATOM 0 HA VAL A 562 1.871 6.878 -8.009 1.00 0.00 H new ATOM 0 HB VAL A 562 3.475 9.141 -6.762 1.00 0.00 H new ATOM 0 HG11 VAL A 562 2.268 8.682 -4.669 1.00 0.00 H new ATOM 0 HG12 VAL A 562 1.179 9.279 -5.944 1.00 0.00 H new ATOM 0 HG13 VAL A 562 1.205 7.547 -5.535 1.00 0.00 H new ATOM 0 HG21 VAL A 562 4.272 7.362 -5.257 1.00 0.00 H new ATOM 0 HG22 VAL A 562 3.293 6.174 -6.149 1.00 0.00 H new ATOM 0 HG23 VAL A 562 4.644 7.002 -6.959 1.00 0.00 H new ATOM 1396 N ARG A 563 1.521 9.998 -8.957 1.00 0.00 N ATOM 1397 CA ARG A 563 0.547 11.029 -9.296 1.00 0.00 C ATOM 1398 C ARG A 563 -0.162 10.697 -10.606 1.00 0.00 C ATOM 1399 O ARG A 563 -1.386 10.788 -10.700 1.00 0.00 O ATOM 1400 CB ARG A 563 1.233 12.392 -9.406 1.00 0.00 C ATOM 1401 CG ARG A 563 0.272 13.536 -9.684 1.00 0.00 C ATOM 1402 CD ARG A 563 -0.321 14.090 -8.397 1.00 0.00 C ATOM 1403 NE ARG A 563 -1.038 15.343 -8.620 1.00 0.00 N ATOM 1404 CZ ARG A 563 -1.368 16.184 -7.646 1.00 0.00 C ATOM 1405 NH1 ARG A 563 -1.045 15.908 -6.390 1.00 0.00 N ATOM 1406 NH2 ARG A 563 -2.021 17.304 -7.928 1.00 0.00 N ATOM 0 H ARG A 563 2.478 10.213 -9.238 1.00 0.00 H new ATOM 0 HA ARG A 563 -0.197 11.067 -8.500 1.00 0.00 H new ATOM 0 HB2 ARG A 563 1.769 12.596 -8.479 1.00 0.00 H new ATOM 0 HB3 ARG A 563 1.977 12.352 -10.202 1.00 0.00 H new ATOM 0 HG2 ARG A 563 0.795 14.330 -10.217 1.00 0.00 H new ATOM 0 HG3 ARG A 563 -0.530 13.189 -10.336 1.00 0.00 H new ATOM 0 HD2 ARG A 563 -1.001 13.355 -7.965 1.00 0.00 H new ATOM 0 HD3 ARG A 563 0.476 14.252 -7.671 1.00 0.00 H new ATOM 0 HE ARG A 563 -1.300 15.585 -9.576 1.00 0.00 H new ATOM 0 HH11 ARG A 563 -0.542 15.048 -6.170 1.00 0.00 H new ATOM 0 HH12 ARG A 563 -1.299 16.555 -5.644 1.00 0.00 H new ATOM 0 HH21 ARG A 563 -2.270 17.520 -8.893 1.00 0.00 H new ATOM 0 HH22 ARG A 563 -2.274 17.949 -7.180 1.00 0.00 H new ATOM 1420 N GLN A 564 0.615 10.313 -11.613 1.00 0.00 N ATOM 1421 CA GLN A 564 0.061 9.970 -12.918 1.00 0.00 C ATOM 1422 C GLN A 564 -0.955 8.839 -12.796 1.00 0.00 C ATOM 1423 O GLN A 564 -2.095 8.967 -13.243 1.00 0.00 O ATOM 1424 CB GLN A 564 1.179 9.565 -13.880 1.00 0.00 C ATOM 1425 CG GLN A 564 0.675 9.093 -15.234 1.00 0.00 C ATOM 1426 CD GLN A 564 1.782 8.989 -16.265 1.00 0.00 C ATOM 1427 OE1 GLN A 564 1.881 9.816 -17.172 1.00 0.00 O ATOM 1428 NE2 GLN A 564 2.623 7.970 -16.131 1.00 0.00 N ATOM 0 H GLN A 564 1.630 10.231 -11.551 1.00 0.00 H new ATOM 0 HA GLN A 564 -0.447 10.850 -13.313 1.00 0.00 H new ATOM 0 HB2 GLN A 564 1.847 10.414 -14.026 1.00 0.00 H new ATOM 0 HB3 GLN A 564 1.769 8.770 -13.424 1.00 0.00 H new ATOM 0 HG2 GLN A 564 0.197 8.120 -15.120 1.00 0.00 H new ATOM 0 HG3 GLN A 564 -0.088 9.783 -15.594 1.00 0.00 H new ATOM 0 HE21 GLN A 564 2.504 7.308 -15.364 1.00 0.00 H new ATOM 0 HE22 GLN A 564 3.388 7.849 -16.795 1.00 0.00 H new ATOM 1437 N GLN A 565 -0.534 7.734 -12.190 1.00 0.00 N ATOM 1438 CA GLN A 565 -1.408 6.581 -12.011 1.00 0.00 C ATOM 1439 C GLN A 565 -2.184 6.683 -10.702 1.00 0.00 C ATOM 1440 O GLN A 565 -2.771 5.705 -10.240 1.00 0.00 O ATOM 1441 CB GLN A 565 -0.592 5.287 -12.034 1.00 0.00 C ATOM 1442 CG GLN A 565 0.163 5.067 -13.335 1.00 0.00 C ATOM 1443 CD GLN A 565 -0.746 4.658 -14.476 1.00 0.00 C ATOM 1444 OE1 GLN A 565 -1.547 5.455 -14.964 1.00 0.00 O ATOM 1445 NE2 GLN A 565 -0.627 3.408 -14.909 1.00 0.00 N ATOM 0 H GLN A 565 0.407 7.613 -11.815 1.00 0.00 H new ATOM 0 HA GLN A 565 -2.122 6.567 -12.835 1.00 0.00 H new ATOM 0 HB2 GLN A 565 0.120 5.301 -11.209 1.00 0.00 H new ATOM 0 HB3 GLN A 565 -1.260 4.443 -11.864 1.00 0.00 H new ATOM 0 HG2 GLN A 565 0.688 5.983 -13.605 1.00 0.00 H new ATOM 0 HG3 GLN A 565 0.920 4.297 -13.185 1.00 0.00 H new ATOM 0 HE21 GLN A 565 0.050 2.780 -14.476 1.00 0.00 H new ATOM 0 HE22 GLN A 565 -1.213 3.076 -15.675 1.00 0.00 H new ATOM 1454 N ILE A 566 -2.182 7.873 -10.111 1.00 0.00 N ATOM 1455 CA ILE A 566 -2.886 8.102 -8.855 1.00 0.00 C ATOM 1456 C ILE A 566 -4.314 7.570 -8.921 1.00 0.00 C ATOM 1457 O ILE A 566 -4.810 6.976 -7.964 1.00 0.00 O ATOM 1458 CB ILE A 566 -2.925 9.600 -8.497 1.00 0.00 C ATOM 1459 CG1 ILE A 566 -3.478 9.794 -7.084 1.00 0.00 C ATOM 1460 CG2 ILE A 566 -3.764 10.365 -9.510 1.00 0.00 C ATOM 1461 CD1 ILE A 566 -2.868 8.860 -6.063 1.00 0.00 C ATOM 0 H ILE A 566 -1.701 8.693 -10.481 1.00 0.00 H new ATOM 0 HA ILE A 566 -2.336 7.566 -8.082 1.00 0.00 H new ATOM 0 HB ILE A 566 -1.909 9.992 -8.526 1.00 0.00 H new ATOM 0 HG12 ILE A 566 -3.303 10.824 -6.772 1.00 0.00 H new ATOM 0 HG13 ILE A 566 -4.558 9.645 -7.101 1.00 0.00 H new ATOM 0 HG21 ILE A 566 -3.782 11.422 -9.244 1.00 0.00 H new ATOM 0 HG22 ILE A 566 -3.331 10.249 -10.503 1.00 0.00 H new ATOM 0 HG23 ILE A 566 -4.781 9.973 -9.510 1.00 0.00 H new ATOM 0 HD11 ILE A 566 -3.307 9.054 -5.084 1.00 0.00 H new ATOM 0 HD12 ILE A 566 -3.065 7.827 -6.351 1.00 0.00 H new ATOM 0 HD13 ILE A 566 -1.791 9.025 -6.017 1.00 0.00 H new ATOM 1473 N ASN A 567 -4.968 7.785 -10.057 1.00 0.00 N ATOM 1474 CA ASN A 567 -6.339 7.325 -10.248 1.00 0.00 C ATOM 1475 C ASN A 567 -6.456 5.830 -9.965 1.00 0.00 C ATOM 1476 O ASN A 567 -7.330 5.397 -9.216 1.00 0.00 O ATOM 1477 CB ASN A 567 -6.805 7.623 -11.675 1.00 0.00 C ATOM 1478 CG ASN A 567 -6.428 9.021 -12.125 1.00 0.00 C ATOM 1479 OD1 ASN A 567 -5.574 9.196 -12.995 1.00 0.00 O ATOM 1480 ND2 ASN A 567 -7.066 10.025 -11.534 1.00 0.00 N ATOM 0 H ASN A 567 -4.571 8.275 -10.859 1.00 0.00 H new ATOM 0 HA ASN A 567 -6.977 7.861 -9.545 1.00 0.00 H new ATOM 0 HB2 ASN A 567 -6.367 6.894 -12.357 1.00 0.00 H new ATOM 0 HB3 ASN A 567 -7.887 7.505 -11.733 1.00 0.00 H new ATOM 0 HD21 ASN A 567 -6.855 10.988 -11.796 1.00 0.00 H new ATOM 0 HD22 ASN A 567 -7.767 9.833 -10.818 1.00 0.00 H new ATOM 1487 N GLU A 568 -5.568 5.048 -10.571 1.00 0.00 N ATOM 1488 CA GLU A 568 -5.572 3.601 -10.384 1.00 0.00 C ATOM 1489 C GLU A 568 -5.404 3.243 -8.910 1.00 0.00 C ATOM 1490 O GLU A 568 -6.204 2.496 -8.347 1.00 0.00 O ATOM 1491 CB GLU A 568 -4.457 2.955 -11.208 1.00 0.00 C ATOM 1492 CG GLU A 568 -4.562 1.442 -11.293 1.00 0.00 C ATOM 1493 CD GLU A 568 -5.753 0.984 -12.113 1.00 0.00 C ATOM 1494 OE1 GLU A 568 -6.899 1.211 -11.672 1.00 0.00 O ATOM 1495 OE2 GLU A 568 -5.538 0.400 -13.195 1.00 0.00 O ATOM 0 H GLU A 568 -4.838 5.391 -11.195 1.00 0.00 H new ATOM 0 HA GLU A 568 -6.534 3.218 -10.726 1.00 0.00 H new ATOM 0 HB2 GLU A 568 -4.475 3.369 -12.216 1.00 0.00 H new ATOM 0 HB3 GLU A 568 -3.494 3.220 -10.772 1.00 0.00 H new ATOM 0 HG2 GLU A 568 -3.648 1.042 -11.732 1.00 0.00 H new ATOM 0 HG3 GLU A 568 -4.639 1.030 -10.287 1.00 0.00 H new ATOM 1502 N MET A 569 -4.357 3.781 -8.292 1.00 0.00 N ATOM 1503 CA MET A 569 -4.084 3.518 -6.884 1.00 0.00 C ATOM 1504 C MET A 569 -5.331 3.748 -6.036 1.00 0.00 C ATOM 1505 O MET A 569 -5.739 2.878 -5.266 1.00 0.00 O ATOM 1506 CB MET A 569 -2.945 4.411 -6.388 1.00 0.00 C ATOM 1507 CG MET A 569 -1.670 4.279 -7.206 1.00 0.00 C ATOM 1508 SD MET A 569 -0.267 5.118 -6.445 1.00 0.00 S ATOM 1509 CE MET A 569 0.419 3.796 -5.450 1.00 0.00 C ATOM 0 H MET A 569 -3.685 4.401 -8.744 1.00 0.00 H new ATOM 0 HA MET A 569 -3.787 2.474 -6.786 1.00 0.00 H new ATOM 0 HB2 MET A 569 -3.274 5.450 -6.408 1.00 0.00 H new ATOM 0 HB3 MET A 569 -2.727 4.165 -5.349 1.00 0.00 H new ATOM 0 HG2 MET A 569 -1.432 3.223 -7.333 1.00 0.00 H new ATOM 0 HG3 MET A 569 -1.838 4.690 -8.202 1.00 0.00 H new ATOM 0 HE1 MET A 569 0.219 3.992 -4.397 1.00 0.00 H new ATOM 0 HE2 MET A 569 -0.040 2.850 -5.736 1.00 0.00 H new ATOM 0 HE3 MET A 569 1.496 3.741 -5.611 1.00 0.00 H new ATOM 1519 N HIS A 570 -5.933 4.924 -6.183 1.00 0.00 N ATOM 1520 CA HIS A 570 -7.134 5.267 -5.430 1.00 0.00 C ATOM 1521 C HIS A 570 -8.186 4.169 -5.555 1.00 0.00 C ATOM 1522 O HIS A 570 -8.740 3.709 -4.555 1.00 0.00 O ATOM 1523 CB HIS A 570 -7.708 6.597 -5.922 1.00 0.00 C ATOM 1524 CG HIS A 570 -9.095 6.870 -5.429 1.00 0.00 C ATOM 1525 ND1 HIS A 570 -9.987 7.680 -6.100 1.00 0.00 N ATOM 1526 CD2 HIS A 570 -9.743 6.435 -4.323 1.00 0.00 C ATOM 1527 CE1 HIS A 570 -11.123 7.732 -5.428 1.00 0.00 C ATOM 1528 NE2 HIS A 570 -11.001 6.984 -4.346 1.00 0.00 N ATOM 0 H HIS A 570 -5.609 5.655 -6.816 1.00 0.00 H new ATOM 0 HA HIS A 570 -6.859 5.365 -4.380 1.00 0.00 H new ATOM 0 HB2 HIS A 570 -7.052 7.407 -5.603 1.00 0.00 H new ATOM 0 HB3 HIS A 570 -7.711 6.601 -7.012 1.00 0.00 H new ATOM 0 HD1 HIS A 570 -9.799 8.163 -6.978 1.00 0.00 H new ATOM 0 HD2 HIS A 570 -9.344 5.778 -3.564 1.00 0.00 H new ATOM 0 HE1 HIS A 570 -12.002 8.291 -5.714 1.00 0.00 H new ATOM 1536 N LEU A 571 -8.457 3.754 -6.787 1.00 0.00 N ATOM 1537 CA LEU A 571 -9.443 2.709 -7.043 1.00 0.00 C ATOM 1538 C LEU A 571 -9.172 1.481 -6.180 1.00 0.00 C ATOM 1539 O LEU A 571 -10.074 0.962 -5.521 1.00 0.00 O ATOM 1540 CB LEU A 571 -9.431 2.320 -8.522 1.00 0.00 C ATOM 1541 CG LEU A 571 -9.851 3.412 -9.507 1.00 0.00 C ATOM 1542 CD1 LEU A 571 -9.450 3.035 -10.925 1.00 0.00 C ATOM 1543 CD2 LEU A 571 -11.350 3.657 -9.423 1.00 0.00 C ATOM 0 H LEU A 571 -8.008 4.125 -7.625 1.00 0.00 H new ATOM 0 HA LEU A 571 -10.427 3.101 -6.785 1.00 0.00 H new ATOM 0 HB2 LEU A 571 -8.425 1.991 -8.782 1.00 0.00 H new ATOM 0 HB3 LEU A 571 -10.091 1.463 -8.657 1.00 0.00 H new ATOM 0 HG LEU A 571 -9.336 4.334 -9.239 1.00 0.00 H new ATOM 0 HD11 LEU A 571 -9.757 3.824 -11.612 1.00 0.00 H new ATOM 0 HD12 LEU A 571 -8.368 2.910 -10.976 1.00 0.00 H new ATOM 0 HD13 LEU A 571 -9.937 2.101 -11.205 1.00 0.00 H new ATOM 0 HD21 LEU A 571 -11.631 4.437 -10.131 1.00 0.00 H new ATOM 0 HD22 LEU A 571 -11.883 2.738 -9.665 1.00 0.00 H new ATOM 0 HD23 LEU A 571 -11.611 3.972 -8.413 1.00 0.00 H new ATOM 1555 N LEU A 572 -7.925 1.023 -6.187 1.00 0.00 N ATOM 1556 CA LEU A 572 -7.534 -0.143 -5.402 1.00 0.00 C ATOM 1557 C LEU A 572 -7.949 0.018 -3.943 1.00 0.00 C ATOM 1558 O LEU A 572 -8.666 -0.820 -3.396 1.00 0.00 O ATOM 1559 CB LEU A 572 -6.023 -0.360 -5.494 1.00 0.00 C ATOM 1560 CG LEU A 572 -5.430 -0.369 -6.903 1.00 0.00 C ATOM 1561 CD1 LEU A 572 -3.912 -0.433 -6.844 1.00 0.00 C ATOM 1562 CD2 LEU A 572 -5.983 -1.537 -7.707 1.00 0.00 C ATOM 0 H LEU A 572 -7.168 1.441 -6.727 1.00 0.00 H new ATOM 0 HA LEU A 572 -8.046 -1.014 -5.811 1.00 0.00 H new ATOM 0 HB2 LEU A 572 -5.528 0.422 -4.918 1.00 0.00 H new ATOM 0 HB3 LEU A 572 -5.783 -1.309 -5.014 1.00 0.00 H new ATOM 0 HG LEU A 572 -5.715 0.558 -7.401 1.00 0.00 H new ATOM 0 HD11 LEU A 572 -3.508 -0.439 -7.857 1.00 0.00 H new ATOM 0 HD12 LEU A 572 -3.532 0.436 -6.307 1.00 0.00 H new ATOM 0 HD13 LEU A 572 -3.606 -1.342 -6.327 1.00 0.00 H new ATOM 0 HD21 LEU A 572 -5.550 -1.528 -8.707 1.00 0.00 H new ATOM 0 HD22 LEU A 572 -5.729 -2.473 -7.210 1.00 0.00 H new ATOM 0 HD23 LEU A 572 -7.067 -1.448 -7.780 1.00 0.00 H new ATOM 1574 N ILE A 573 -7.495 1.101 -3.321 1.00 0.00 N ATOM 1575 CA ILE A 573 -7.822 1.373 -1.927 1.00 0.00 C ATOM 1576 C ILE A 573 -9.319 1.232 -1.675 1.00 0.00 C ATOM 1577 O ILE A 573 -9.738 0.672 -0.663 1.00 0.00 O ATOM 1578 CB ILE A 573 -7.373 2.786 -1.509 1.00 0.00 C ATOM 1579 CG1 ILE A 573 -5.901 3.003 -1.865 1.00 0.00 C ATOM 1580 CG2 ILE A 573 -7.599 2.994 -0.019 1.00 0.00 C ATOM 1581 CD1 ILE A 573 -4.979 1.951 -1.291 1.00 0.00 C ATOM 0 H ILE A 573 -6.900 1.804 -3.760 1.00 0.00 H new ATOM 0 HA ILE A 573 -7.285 0.638 -1.328 1.00 0.00 H new ATOM 0 HB ILE A 573 -7.971 3.517 -2.053 1.00 0.00 H new ATOM 0 HG12 ILE A 573 -5.796 3.014 -2.950 1.00 0.00 H new ATOM 0 HG13 ILE A 573 -5.589 3.983 -1.505 1.00 0.00 H new ATOM 0 HG21 ILE A 573 -7.277 3.997 0.261 1.00 0.00 H new ATOM 0 HG22 ILE A 573 -8.659 2.876 0.208 1.00 0.00 H new ATOM 0 HG23 ILE A 573 -7.024 2.258 0.543 1.00 0.00 H new ATOM 0 HD11 ILE A 573 -3.952 2.169 -1.584 1.00 0.00 H new ATOM 0 HD12 ILE A 573 -5.055 1.955 -0.204 1.00 0.00 H new ATOM 0 HD13 ILE A 573 -5.265 0.970 -1.671 1.00 0.00 H new ATOM 1593 N GLN A 574 -10.120 1.743 -2.605 1.00 0.00 N ATOM 1594 CA GLN A 574 -11.572 1.673 -2.484 1.00 0.00 C ATOM 1595 C GLN A 574 -12.061 0.236 -2.626 1.00 0.00 C ATOM 1596 O GLN A 574 -13.074 -0.145 -2.039 1.00 0.00 O ATOM 1597 CB GLN A 574 -12.236 2.557 -3.542 1.00 0.00 C ATOM 1598 CG GLN A 574 -11.769 4.003 -3.506 1.00 0.00 C ATOM 1599 CD GLN A 574 -12.612 4.866 -2.587 1.00 0.00 C ATOM 1600 OE1 GLN A 574 -13.617 5.440 -3.006 1.00 0.00 O ATOM 1601 NE2 GLN A 574 -12.205 4.961 -1.327 1.00 0.00 N ATOM 0 H GLN A 574 -9.789 2.209 -3.449 1.00 0.00 H new ATOM 0 HA GLN A 574 -11.847 2.035 -1.493 1.00 0.00 H new ATOM 0 HB2 GLN A 574 -12.033 2.143 -4.529 1.00 0.00 H new ATOM 0 HB3 GLN A 574 -13.316 2.529 -3.401 1.00 0.00 H new ATOM 0 HG2 GLN A 574 -10.730 4.037 -3.178 1.00 0.00 H new ATOM 0 HG3 GLN A 574 -11.799 4.416 -4.514 1.00 0.00 H new ATOM 0 HE21 GLN A 574 -11.365 4.467 -1.024 1.00 0.00 H new ATOM 0 HE22 GLN A 574 -12.732 5.527 -0.662 1.00 0.00 H new ATOM 1610 N GLN A 575 -11.335 -0.557 -3.408 1.00 0.00 N ATOM 1611 CA GLN A 575 -11.697 -1.952 -3.627 1.00 0.00 C ATOM 1612 C GLN A 575 -11.426 -2.787 -2.380 1.00 0.00 C ATOM 1613 O GLN A 575 -12.068 -3.813 -2.156 1.00 0.00 O ATOM 1614 CB GLN A 575 -10.920 -2.522 -4.815 1.00 0.00 C ATOM 1615 CG GLN A 575 -11.379 -1.980 -6.159 1.00 0.00 C ATOM 1616 CD GLN A 575 -10.928 -2.842 -7.321 1.00 0.00 C ATOM 1617 OE1 GLN A 575 -11.741 -3.494 -7.977 1.00 0.00 O ATOM 1618 NE2 GLN A 575 -9.626 -2.849 -7.583 1.00 0.00 N ATOM 0 H GLN A 575 -10.493 -0.257 -3.900 1.00 0.00 H new ATOM 0 HA GLN A 575 -12.764 -1.994 -3.846 1.00 0.00 H new ATOM 0 HB2 GLN A 575 -9.861 -2.300 -4.686 1.00 0.00 H new ATOM 0 HB3 GLN A 575 -11.020 -3.607 -4.817 1.00 0.00 H new ATOM 0 HG2 GLN A 575 -12.467 -1.909 -6.165 1.00 0.00 H new ATOM 0 HG3 GLN A 575 -10.992 -0.969 -6.290 1.00 0.00 H new ATOM 0 HE21 GLN A 575 -8.988 -2.293 -7.013 1.00 0.00 H new ATOM 0 HE22 GLN A 575 -9.264 -3.410 -8.354 1.00 0.00 H new ATOM 1627 N ALA A 576 -10.472 -2.340 -1.570 1.00 0.00 N ATOM 1628 CA ALA A 576 -10.118 -3.045 -0.344 1.00 0.00 C ATOM 1629 C ALA A 576 -11.061 -2.673 0.795 1.00 0.00 C ATOM 1630 O ALA A 576 -11.328 -3.484 1.682 1.00 0.00 O ATOM 1631 CB ALA A 576 -8.677 -2.743 0.041 1.00 0.00 C ATOM 0 H ALA A 576 -9.930 -1.493 -1.741 1.00 0.00 H new ATOM 0 HA ALA A 576 -10.217 -4.115 -0.528 1.00 0.00 H new ATOM 0 HB1 ALA A 576 -8.426 -3.276 0.958 1.00 0.00 H new ATOM 0 HB2 ALA A 576 -8.011 -3.065 -0.760 1.00 0.00 H new ATOM 0 HB3 ALA A 576 -8.560 -1.671 0.201 1.00 0.00 H new ATOM 1637 N ARG A 577 -11.561 -1.442 0.765 1.00 0.00 N ATOM 1638 CA ARG A 577 -12.473 -0.963 1.797 1.00 0.00 C ATOM 1639 C ARG A 577 -13.909 -1.374 1.487 1.00 0.00 C ATOM 1640 O ARG A 577 -14.671 -1.727 2.386 1.00 0.00 O ATOM 1641 CB ARG A 577 -12.382 0.560 1.920 1.00 0.00 C ATOM 1642 CG ARG A 577 -11.178 1.036 2.715 1.00 0.00 C ATOM 1643 CD ARG A 577 -11.228 2.536 2.958 1.00 0.00 C ATOM 1644 NE ARG A 577 -12.428 2.932 3.690 1.00 0.00 N ATOM 1645 CZ ARG A 577 -13.593 3.190 3.107 1.00 0.00 C ATOM 1646 NH1 ARG A 577 -13.715 3.094 1.791 1.00 0.00 N ATOM 1647 NH2 ARG A 577 -14.640 3.545 3.842 1.00 0.00 N ATOM 0 H ARG A 577 -11.350 -0.759 0.038 1.00 0.00 H new ATOM 0 HA ARG A 577 -12.181 -1.416 2.744 1.00 0.00 H new ATOM 0 HB2 ARG A 577 -12.342 0.995 0.921 1.00 0.00 H new ATOM 0 HB3 ARG A 577 -13.290 0.933 2.394 1.00 0.00 H new ATOM 0 HG2 ARG A 577 -11.142 0.513 3.670 1.00 0.00 H new ATOM 0 HG3 ARG A 577 -10.263 0.784 2.178 1.00 0.00 H new ATOM 0 HD2 ARG A 577 -10.344 2.842 3.518 1.00 0.00 H new ATOM 0 HD3 ARG A 577 -11.197 3.059 2.002 1.00 0.00 H new ATOM 0 HE ARG A 577 -12.368 3.015 4.705 1.00 0.00 H new ATOM 0 HH11 ARG A 577 -12.913 2.821 1.223 1.00 0.00 H new ATOM 0 HH12 ARG A 577 -14.611 3.293 1.346 1.00 0.00 H new ATOM 0 HH21 ARG A 577 -14.550 3.620 4.855 1.00 0.00 H new ATOM 0 HH22 ARG A 577 -15.534 3.743 3.393 1.00 0.00 H new ATOM 1661 N GLU A 578 -14.271 -1.325 0.208 1.00 0.00 N ATOM 1662 CA GLU A 578 -15.616 -1.691 -0.219 1.00 0.00 C ATOM 1663 C GLU A 578 -16.147 -2.864 0.600 1.00 0.00 C ATOM 1664 O GLU A 578 -17.319 -2.894 0.973 1.00 0.00 O ATOM 1665 CB GLU A 578 -15.623 -2.049 -1.706 1.00 0.00 C ATOM 1666 CG GLU A 578 -15.258 -3.497 -1.985 1.00 0.00 C ATOM 1667 CD GLU A 578 -15.374 -3.856 -3.454 1.00 0.00 C ATOM 1668 OE1 GLU A 578 -16.474 -3.689 -4.021 1.00 0.00 O ATOM 1669 OE2 GLU A 578 -14.365 -4.304 -4.037 1.00 0.00 O ATOM 0 H GLU A 578 -13.652 -1.036 -0.549 1.00 0.00 H new ATOM 0 HA GLU A 578 -16.267 -0.832 -0.056 1.00 0.00 H new ATOM 0 HB2 GLU A 578 -16.613 -1.847 -2.115 1.00 0.00 H new ATOM 0 HB3 GLU A 578 -14.923 -1.399 -2.231 1.00 0.00 H new ATOM 0 HG2 GLU A 578 -14.238 -3.682 -1.649 1.00 0.00 H new ATOM 0 HG3 GLU A 578 -15.908 -4.150 -1.403 1.00 0.00 H new ATOM 1676 N MET A 579 -15.274 -3.828 0.876 1.00 0.00 N ATOM 1677 CA MET A 579 -15.655 -5.003 1.651 1.00 0.00 C ATOM 1678 C MET A 579 -15.578 -4.715 3.147 1.00 0.00 C ATOM 1679 O MET A 579 -14.699 -3.995 3.621 1.00 0.00 O ATOM 1680 CB MET A 579 -14.750 -6.186 1.301 1.00 0.00 C ATOM 1681 CG MET A 579 -13.277 -5.926 1.570 1.00 0.00 C ATOM 1682 SD MET A 579 -12.797 -6.333 3.259 1.00 0.00 S ATOM 1683 CE MET A 579 -13.270 -8.059 3.339 1.00 0.00 C ATOM 0 H MET A 579 -14.300 -3.818 0.575 1.00 0.00 H new ATOM 0 HA MET A 579 -16.685 -5.255 1.400 1.00 0.00 H new ATOM 0 HB2 MET A 579 -15.067 -7.057 1.874 1.00 0.00 H new ATOM 0 HB3 MET A 579 -14.880 -6.433 0.247 1.00 0.00 H new ATOM 0 HG2 MET A 579 -12.676 -6.512 0.874 1.00 0.00 H new ATOM 0 HG3 MET A 579 -13.056 -4.876 1.377 1.00 0.00 H new ATOM 0 HE1 MET A 579 -12.540 -8.609 3.932 1.00 0.00 H new ATOM 0 HE2 MET A 579 -14.253 -8.146 3.802 1.00 0.00 H new ATOM 0 HE3 MET A 579 -13.306 -8.474 2.332 1.00 0.00 H new ATOM 1693 N PRO A 580 -16.519 -5.290 3.911 1.00 0.00 N ATOM 1694 CA PRO A 580 -16.579 -5.110 5.364 1.00 0.00 C ATOM 1695 C PRO A 580 -15.430 -5.809 6.083 1.00 0.00 C ATOM 1696 O PRO A 580 -14.554 -6.398 5.448 1.00 0.00 O ATOM 1697 CB PRO A 580 -17.916 -5.749 5.746 1.00 0.00 C ATOM 1698 CG PRO A 580 -18.182 -6.745 4.670 1.00 0.00 C ATOM 1699 CD PRO A 580 -17.597 -6.162 3.413 1.00 0.00 C ATOM 0 HA PRO A 580 -16.496 -4.061 5.648 1.00 0.00 H new ATOM 0 HB2 PRO A 580 -17.861 -6.228 6.724 1.00 0.00 H new ATOM 0 HB3 PRO A 580 -18.710 -5.004 5.800 1.00 0.00 H new ATOM 0 HG2 PRO A 580 -17.723 -7.705 4.905 1.00 0.00 H new ATOM 0 HG3 PRO A 580 -19.252 -6.922 4.557 1.00 0.00 H new ATOM 0 HD2 PRO A 580 -17.213 -6.938 2.751 1.00 0.00 H new ATOM 0 HD3 PRO A 580 -18.340 -5.600 2.847 1.00 0.00 H new ATOM 1707 N LEU A 581 -15.439 -5.740 7.409 1.00 0.00 N ATOM 1708 CA LEU A 581 -14.397 -6.367 8.215 1.00 0.00 C ATOM 1709 C LEU A 581 -14.936 -7.597 8.940 1.00 0.00 C ATOM 1710 O LEU A 581 -15.631 -7.481 9.950 1.00 0.00 O ATOM 1711 CB LEU A 581 -13.838 -5.368 9.229 1.00 0.00 C ATOM 1712 CG LEU A 581 -13.013 -4.217 8.653 1.00 0.00 C ATOM 1713 CD1 LEU A 581 -13.113 -2.989 9.545 1.00 0.00 C ATOM 1714 CD2 LEU A 581 -11.561 -4.636 8.480 1.00 0.00 C ATOM 0 H LEU A 581 -16.156 -5.256 7.949 1.00 0.00 H new ATOM 0 HA LEU A 581 -13.596 -6.683 7.547 1.00 0.00 H new ATOM 0 HB2 LEU A 581 -14.672 -4.946 9.790 1.00 0.00 H new ATOM 0 HB3 LEU A 581 -13.218 -5.912 9.941 1.00 0.00 H new ATOM 0 HG LEU A 581 -13.416 -3.962 7.673 1.00 0.00 H new ATOM 0 HD11 LEU A 581 -12.519 -2.180 9.119 1.00 0.00 H new ATOM 0 HD12 LEU A 581 -14.154 -2.676 9.617 1.00 0.00 H new ATOM 0 HD13 LEU A 581 -12.737 -3.230 10.539 1.00 0.00 H new ATOM 0 HD21 LEU A 581 -10.989 -3.804 8.069 1.00 0.00 H new ATOM 0 HD22 LEU A 581 -11.146 -4.919 9.447 1.00 0.00 H new ATOM 0 HD23 LEU A 581 -11.506 -5.486 7.799 1.00 0.00 H new ATOM 1726 N LEU A 582 -14.608 -8.774 8.419 1.00 0.00 N ATOM 1727 CA LEU A 582 -15.056 -10.027 9.017 1.00 0.00 C ATOM 1728 C LEU A 582 -14.904 -9.991 10.534 1.00 0.00 C ATOM 1729 O LEU A 582 -13.790 -9.946 11.057 1.00 0.00 O ATOM 1730 CB LEU A 582 -14.264 -11.202 8.441 1.00 0.00 C ATOM 1731 CG LEU A 582 -14.631 -11.625 7.018 1.00 0.00 C ATOM 1732 CD1 LEU A 582 -16.000 -12.286 6.993 1.00 0.00 C ATOM 1733 CD2 LEU A 582 -14.597 -10.427 6.080 1.00 0.00 C ATOM 0 H LEU A 582 -14.033 -8.887 7.584 1.00 0.00 H new ATOM 0 HA LEU A 582 -16.112 -10.158 8.779 1.00 0.00 H new ATOM 0 HB2 LEU A 582 -13.205 -10.945 8.461 1.00 0.00 H new ATOM 0 HB3 LEU A 582 -14.396 -12.061 9.099 1.00 0.00 H new ATOM 0 HG LEU A 582 -13.894 -12.351 6.674 1.00 0.00 H new ATOM 0 HD11 LEU A 582 -16.244 -12.580 5.972 1.00 0.00 H new ATOM 0 HD12 LEU A 582 -15.989 -13.169 7.632 1.00 0.00 H new ATOM 0 HD13 LEU A 582 -16.750 -11.584 7.357 1.00 0.00 H new ATOM 0 HD21 LEU A 582 -14.861 -10.747 5.072 1.00 0.00 H new ATOM 0 HD22 LEU A 582 -15.311 -9.677 6.421 1.00 0.00 H new ATOM 0 HD23 LEU A 582 -13.595 -9.998 6.074 1.00 0.00 H new ATOM 1745 N LYS A 583 -16.031 -10.013 11.238 1.00 0.00 N ATOM 1746 CA LYS A 583 -16.025 -9.987 12.695 1.00 0.00 C ATOM 1747 C LYS A 583 -17.412 -10.291 13.251 1.00 0.00 C ATOM 1748 O LYS A 583 -18.423 -9.890 12.676 1.00 0.00 O ATOM 1749 CB LYS A 583 -15.549 -8.622 13.199 1.00 0.00 C ATOM 1750 CG LYS A 583 -16.569 -7.514 13.005 1.00 0.00 C ATOM 1751 CD LYS A 583 -16.189 -6.264 13.783 1.00 0.00 C ATOM 1752 CE LYS A 583 -15.020 -5.539 13.134 1.00 0.00 C ATOM 1753 NZ LYS A 583 -13.741 -6.280 13.309 1.00 0.00 N ATOM 0 H LYS A 583 -16.961 -10.049 10.822 1.00 0.00 H new ATOM 0 HA LYS A 583 -15.337 -10.757 13.044 1.00 0.00 H new ATOM 0 HB2 LYS A 583 -15.306 -8.700 14.259 1.00 0.00 H new ATOM 0 HB3 LYS A 583 -14.629 -8.353 12.680 1.00 0.00 H new ATOM 0 HG2 LYS A 583 -16.649 -7.274 11.945 1.00 0.00 H new ATOM 0 HG3 LYS A 583 -17.550 -7.861 13.328 1.00 0.00 H new ATOM 0 HD2 LYS A 583 -17.047 -5.595 13.840 1.00 0.00 H new ATOM 0 HD3 LYS A 583 -15.928 -6.536 14.806 1.00 0.00 H new ATOM 0 HE2 LYS A 583 -15.220 -5.406 12.071 1.00 0.00 H new ATOM 0 HE3 LYS A 583 -14.925 -4.543 13.567 1.00 0.00 H new ATOM 0 HZ1 LYS A 583 -12.984 -5.612 13.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 583 -13.847 -6.981 14.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 583 -13.497 -6.766 12.422 1.00 0.00 H new ATOM 1767 N SER A 584 -17.452 -11.001 14.374 1.00 0.00 N ATOM 1768 CA SER A 584 -18.716 -11.360 15.007 1.00 0.00 C ATOM 1769 C SER A 584 -19.705 -10.200 14.942 1.00 0.00 C ATOM 1770 O SER A 584 -20.829 -10.356 14.466 1.00 0.00 O ATOM 1771 CB SER A 584 -18.485 -11.766 16.464 1.00 0.00 C ATOM 1772 OG SER A 584 -19.702 -12.131 17.091 1.00 0.00 O ATOM 0 H SER A 584 -16.624 -11.339 14.864 1.00 0.00 H new ATOM 0 HA SER A 584 -19.138 -12.206 14.464 1.00 0.00 H new ATOM 0 HB2 SER A 584 -17.786 -12.601 16.505 1.00 0.00 H new ATOM 0 HB3 SER A 584 -18.026 -10.939 17.007 1.00 0.00 H new ATOM 0 HG SER A 584 -19.527 -12.388 18.020 1.00 0.00 H new ATOM 1778 N GLU A 585 -19.277 -9.038 15.424 1.00 0.00 N ATOM 1779 CA GLU A 585 -20.125 -7.852 15.421 1.00 0.00 C ATOM 1780 C GLU A 585 -20.579 -7.510 14.004 1.00 0.00 C ATOM 1781 O GLU A 585 -19.786 -7.055 13.180 1.00 0.00 O ATOM 1782 CB GLU A 585 -19.379 -6.663 16.030 1.00 0.00 C ATOM 1783 CG GLU A 585 -19.407 -6.641 17.549 1.00 0.00 C ATOM 1784 CD GLU A 585 -18.747 -5.403 18.126 1.00 0.00 C ATOM 1785 OE1 GLU A 585 -19.444 -4.380 18.289 1.00 0.00 O ATOM 1786 OE2 GLU A 585 -17.534 -5.458 18.416 1.00 0.00 O ATOM 0 H GLU A 585 -18.349 -8.892 15.821 1.00 0.00 H new ATOM 0 HA GLU A 585 -21.007 -8.066 16.024 1.00 0.00 H new ATOM 0 HB2 GLU A 585 -18.342 -6.685 15.694 1.00 0.00 H new ATOM 0 HB3 GLU A 585 -19.817 -5.739 15.653 1.00 0.00 H new ATOM 0 HG2 GLU A 585 -20.441 -6.690 17.891 1.00 0.00 H new ATOM 0 HG3 GLU A 585 -18.903 -7.529 17.931 1.00 0.00 H new ATOM 1793 N VAL A 586 -21.860 -7.734 13.729 1.00 0.00 N ATOM 1794 CA VAL A 586 -22.420 -7.450 12.413 1.00 0.00 C ATOM 1795 C VAL A 586 -22.489 -5.948 12.158 1.00 0.00 C ATOM 1796 O VAL A 586 -22.851 -5.174 13.043 1.00 0.00 O ATOM 1797 CB VAL A 586 -23.830 -8.051 12.262 1.00 0.00 C ATOM 1798 CG1 VAL A 586 -24.771 -7.474 13.308 1.00 0.00 C ATOM 1799 CG2 VAL A 586 -24.365 -7.806 10.859 1.00 0.00 C ATOM 0 H VAL A 586 -22.529 -8.111 14.400 1.00 0.00 H new ATOM 0 HA VAL A 586 -21.757 -7.910 11.680 1.00 0.00 H new ATOM 0 HB VAL A 586 -23.766 -9.128 12.420 1.00 0.00 H new ATOM 0 HG11 VAL A 586 -25.762 -7.910 13.186 1.00 0.00 H new ATOM 0 HG12 VAL A 586 -24.393 -7.705 14.304 1.00 0.00 H new ATOM 0 HG13 VAL A 586 -24.833 -6.393 13.185 1.00 0.00 H new ATOM 0 HG21 VAL A 586 -25.362 -8.237 10.769 1.00 0.00 H new ATOM 0 HG22 VAL A 586 -24.415 -6.734 10.671 1.00 0.00 H new ATOM 0 HG23 VAL A 586 -23.702 -8.272 10.130 1.00 0.00 H new ATOM 1809 N ALA A 587 -22.140 -5.544 10.941 1.00 0.00 N ATOM 1810 CA ALA A 587 -22.165 -4.135 10.568 1.00 0.00 C ATOM 1811 C ALA A 587 -23.148 -3.886 9.429 1.00 0.00 C ATOM 1812 O ALA A 587 -22.782 -3.950 8.256 1.00 0.00 O ATOM 1813 CB ALA A 587 -20.771 -3.668 10.176 1.00 0.00 C ATOM 0 H ALA A 587 -21.837 -6.172 10.197 1.00 0.00 H new ATOM 0 HA ALA A 587 -22.499 -3.562 11.433 1.00 0.00 H new ATOM 0 HB1 ALA A 587 -20.805 -2.614 9.900 1.00 0.00 H new ATOM 0 HB2 ALA A 587 -20.092 -3.801 11.019 1.00 0.00 H new ATOM 0 HB3 ALA A 587 -20.416 -4.254 9.328 1.00 0.00 H new ATOM 1819 N ALA A 588 -24.397 -3.603 9.783 1.00 0.00 N ATOM 1820 CA ALA A 588 -25.433 -3.344 8.791 1.00 0.00 C ATOM 1821 C ALA A 588 -25.100 -2.109 7.960 1.00 0.00 C ATOM 1822 O ALA A 588 -24.183 -1.357 8.288 1.00 0.00 O ATOM 1823 CB ALA A 588 -26.784 -3.177 9.469 1.00 0.00 C ATOM 0 H ALA A 588 -24.716 -3.547 10.750 1.00 0.00 H new ATOM 0 HA ALA A 588 -25.480 -4.201 8.119 1.00 0.00 H new ATOM 0 HB1 ALA A 588 -27.548 -2.984 8.716 1.00 0.00 H new ATOM 0 HB2 ALA A 588 -27.033 -4.088 10.013 1.00 0.00 H new ATOM 0 HB3 ALA A 588 -26.741 -2.339 10.165 1.00 0.00 H new ATOM 1829 N GLY A 589 -25.850 -1.906 6.881 1.00 0.00 N ATOM 1830 CA GLY A 589 -25.618 -0.762 6.020 1.00 0.00 C ATOM 1831 C GLY A 589 -26.300 0.493 6.527 1.00 0.00 C ATOM 1832 O GLY A 589 -27.447 0.449 6.973 1.00 0.00 O ATOM 0 H GLY A 589 -26.615 -2.514 6.588 1.00 0.00 H new ATOM 0 HA2 GLY A 589 -24.546 -0.582 5.941 1.00 0.00 H new ATOM 0 HA3 GLY A 589 -25.978 -0.988 5.016 1.00 0.00 H new ATOM 1836 N VAL A 590 -25.593 1.617 6.461 1.00 0.00 N ATOM 1837 CA VAL A 590 -26.137 2.890 6.918 1.00 0.00 C ATOM 1838 C VAL A 590 -27.522 3.138 6.332 1.00 0.00 C ATOM 1839 O VAL A 590 -27.818 2.723 5.211 1.00 0.00 O ATOM 1840 CB VAL A 590 -25.214 4.064 6.538 1.00 0.00 C ATOM 1841 CG1 VAL A 590 -23.859 3.917 7.214 1.00 0.00 C ATOM 1842 CG2 VAL A 590 -25.058 4.152 5.028 1.00 0.00 C ATOM 0 H VAL A 590 -24.642 1.672 6.095 1.00 0.00 H new ATOM 0 HA VAL A 590 -26.210 2.831 8.004 1.00 0.00 H new ATOM 0 HB VAL A 590 -25.670 4.990 6.888 1.00 0.00 H new ATOM 0 HG11 VAL A 590 -23.220 4.755 6.934 1.00 0.00 H new ATOM 0 HG12 VAL A 590 -23.991 3.907 8.296 1.00 0.00 H new ATOM 0 HG13 VAL A 590 -23.393 2.984 6.897 1.00 0.00 H new ATOM 0 HG21 VAL A 590 -24.403 4.987 4.778 1.00 0.00 H new ATOM 0 HG22 VAL A 590 -24.624 3.225 4.652 1.00 0.00 H new ATOM 0 HG23 VAL A 590 -26.035 4.307 4.570 1.00 0.00 H new ATOM 1852 N LYS A 591 -28.369 3.818 7.097 1.00 0.00 N ATOM 1853 CA LYS A 591 -29.725 4.124 6.654 1.00 0.00 C ATOM 1854 C LYS A 591 -30.058 5.593 6.898 1.00 0.00 C ATOM 1855 O LYS A 591 -29.992 6.075 8.029 1.00 0.00 O ATOM 1856 CB LYS A 591 -30.734 3.233 7.381 1.00 0.00 C ATOM 1857 CG LYS A 591 -32.055 3.086 6.647 1.00 0.00 C ATOM 1858 CD LYS A 591 -31.952 2.082 5.510 1.00 0.00 C ATOM 1859 CE LYS A 591 -33.186 2.118 4.621 1.00 0.00 C ATOM 1860 NZ LYS A 591 -34.334 1.397 5.237 1.00 0.00 N ATOM 0 H LYS A 591 -28.141 4.168 8.027 1.00 0.00 H new ATOM 0 HA LYS A 591 -29.784 3.929 5.583 1.00 0.00 H new ATOM 0 HB2 LYS A 591 -30.296 2.245 7.525 1.00 0.00 H new ATOM 0 HB3 LYS A 591 -30.923 3.646 8.372 1.00 0.00 H new ATOM 0 HG2 LYS A 591 -32.828 2.767 7.347 1.00 0.00 H new ATOM 0 HG3 LYS A 591 -32.363 4.054 6.252 1.00 0.00 H new ATOM 0 HD2 LYS A 591 -31.066 2.297 4.913 1.00 0.00 H new ATOM 0 HD3 LYS A 591 -31.826 1.079 5.919 1.00 0.00 H new ATOM 0 HE2 LYS A 591 -33.467 3.154 4.432 1.00 0.00 H new ATOM 0 HE3 LYS A 591 -32.951 1.670 3.656 1.00 0.00 H new ATOM 0 HZ1 LYS A 591 -35.155 1.444 4.601 1.00 0.00 H new ATOM 0 HZ2 LYS A 591 -34.075 0.402 5.395 1.00 0.00 H new ATOM 0 HZ3 LYS A 591 -34.575 1.840 6.146 1.00 0.00 H new ATOM 1874 N LYS A 592 -30.418 6.298 5.831 1.00 0.00 N ATOM 1875 CA LYS A 592 -30.765 7.711 5.929 1.00 0.00 C ATOM 1876 C LYS A 592 -32.189 7.957 5.442 1.00 0.00 C ATOM 1877 O LYS A 592 -32.757 7.138 4.719 1.00 0.00 O ATOM 1878 CB LYS A 592 -29.783 8.556 5.115 1.00 0.00 C ATOM 1879 CG LYS A 592 -29.716 8.168 3.648 1.00 0.00 C ATOM 1880 CD LYS A 592 -30.730 8.940 2.821 1.00 0.00 C ATOM 1881 CE LYS A 592 -30.195 10.304 2.415 1.00 0.00 C ATOM 1882 NZ LYS A 592 -30.290 11.291 3.526 1.00 0.00 N ATOM 0 H LYS A 592 -30.477 5.914 4.888 1.00 0.00 H new ATOM 0 HA LYS A 592 -30.703 8.002 6.977 1.00 0.00 H new ATOM 0 HB2 LYS A 592 -30.069 9.605 5.192 1.00 0.00 H new ATOM 0 HB3 LYS A 592 -28.789 8.464 5.552 1.00 0.00 H new ATOM 0 HG2 LYS A 592 -28.713 8.358 3.266 1.00 0.00 H new ATOM 0 HG3 LYS A 592 -29.899 7.098 3.545 1.00 0.00 H new ATOM 0 HD2 LYS A 592 -30.985 8.368 1.929 1.00 0.00 H new ATOM 0 HD3 LYS A 592 -31.649 9.064 3.394 1.00 0.00 H new ATOM 0 HE2 LYS A 592 -29.155 10.208 2.103 1.00 0.00 H new ATOM 0 HE3 LYS A 592 -30.754 10.672 1.554 1.00 0.00 H new ATOM 0 HZ1 LYS A 592 -30.466 12.238 3.135 1.00 0.00 H new ATOM 0 HZ2 LYS A 592 -31.072 11.027 4.159 1.00 0.00 H new ATOM 0 HZ3 LYS A 592 -29.398 11.298 4.061 1.00 0.00 H new ATOM 1896 N SER A 593 -32.759 9.089 5.840 1.00 0.00 N ATOM 1897 CA SER A 593 -34.118 9.441 5.445 1.00 0.00 C ATOM 1898 C SER A 593 -34.312 9.257 3.943 1.00 0.00 C ATOM 1899 O SER A 593 -33.698 9.956 3.137 1.00 0.00 O ATOM 1900 CB SER A 593 -34.428 10.887 5.838 1.00 0.00 C ATOM 1901 OG SER A 593 -33.458 11.777 5.312 1.00 0.00 O ATOM 0 H SER A 593 -32.301 9.779 6.436 1.00 0.00 H new ATOM 0 HA SER A 593 -34.806 8.775 5.967 1.00 0.00 H new ATOM 0 HB2 SER A 593 -35.417 11.163 5.471 1.00 0.00 H new ATOM 0 HB3 SER A 593 -34.455 10.974 6.924 1.00 0.00 H new ATOM 0 HG SER A 593 -33.199 11.485 4.413 1.00 0.00 H new ATOM 1907 N SER A 594 -35.171 8.312 3.575 1.00 0.00 N ATOM 1908 CA SER A 594 -35.444 8.032 2.170 1.00 0.00 C ATOM 1909 C SER A 594 -36.683 7.155 2.022 1.00 0.00 C ATOM 1910 O SER A 594 -36.843 6.162 2.730 1.00 0.00 O ATOM 1911 CB SER A 594 -34.239 7.347 1.521 1.00 0.00 C ATOM 1912 OG SER A 594 -34.065 6.035 2.027 1.00 0.00 O ATOM 0 H SER A 594 -35.690 7.727 4.230 1.00 0.00 H new ATOM 0 HA SER A 594 -35.629 8.980 1.665 1.00 0.00 H new ATOM 0 HB2 SER A 594 -34.377 7.308 0.440 1.00 0.00 H new ATOM 0 HB3 SER A 594 -33.339 7.934 1.706 1.00 0.00 H new ATOM 0 HG SER A 594 -33.677 6.080 2.926 1.00 0.00 H new ATOM 1918 N GLY A 595 -37.559 7.530 1.094 1.00 0.00 N ATOM 1919 CA GLY A 595 -38.773 6.768 0.869 1.00 0.00 C ATOM 1920 C GLY A 595 -39.480 7.169 -0.411 1.00 0.00 C ATOM 1921 O GLY A 595 -40.411 7.974 -0.406 1.00 0.00 O ATOM 0 H GLY A 595 -37.449 8.348 0.494 1.00 0.00 H new ATOM 0 HA2 GLY A 595 -38.530 5.706 0.829 1.00 0.00 H new ATOM 0 HA3 GLY A 595 -39.448 6.909 1.713 1.00 0.00 H new ATOM 1925 N PRO A 596 -39.033 6.601 -1.541 1.00 0.00 N ATOM 1926 CA PRO A 596 -39.614 6.889 -2.856 1.00 0.00 C ATOM 1927 C PRO A 596 -41.018 6.315 -3.007 1.00 0.00 C ATOM 1928 O PRO A 596 -41.937 7.006 -3.449 1.00 0.00 O ATOM 1929 CB PRO A 596 -38.649 6.205 -3.828 1.00 0.00 C ATOM 1930 CG PRO A 596 -38.018 5.115 -3.031 1.00 0.00 C ATOM 1931 CD PRO A 596 -37.926 5.633 -1.622 1.00 0.00 C ATOM 0 HA PRO A 596 -39.725 7.960 -3.027 1.00 0.00 H new ATOM 0 HB2 PRO A 596 -39.176 5.807 -4.695 1.00 0.00 H new ATOM 0 HB3 PRO A 596 -37.902 6.905 -4.203 1.00 0.00 H new ATOM 0 HG2 PRO A 596 -38.615 4.204 -3.074 1.00 0.00 H new ATOM 0 HG3 PRO A 596 -37.031 4.867 -3.421 1.00 0.00 H new ATOM 0 HD2 PRO A 596 -38.038 4.832 -0.891 1.00 0.00 H new ATOM 0 HD3 PRO A 596 -36.963 6.107 -1.430 1.00 0.00 H new ATOM 1939 N SER A 597 -41.178 5.048 -2.638 1.00 0.00 N ATOM 1940 CA SER A 597 -42.471 4.381 -2.736 1.00 0.00 C ATOM 1941 C SER A 597 -43.245 4.872 -3.955 1.00 0.00 C ATOM 1942 O SER A 597 -44.443 5.142 -3.877 1.00 0.00 O ATOM 1943 CB SER A 597 -43.291 4.622 -1.467 1.00 0.00 C ATOM 1944 OG SER A 597 -43.555 6.002 -1.285 1.00 0.00 O ATOM 0 H SER A 597 -40.429 4.463 -2.269 1.00 0.00 H new ATOM 0 HA SER A 597 -42.292 3.312 -2.847 1.00 0.00 H new ATOM 0 HB2 SER A 597 -44.231 4.074 -1.528 1.00 0.00 H new ATOM 0 HB3 SER A 597 -42.752 4.235 -0.603 1.00 0.00 H new ATOM 0 HG SER A 597 -44.082 6.129 -0.468 1.00 0.00 H new ATOM 1950 N SER A 598 -42.550 4.985 -5.083 1.00 0.00 N ATOM 1951 CA SER A 598 -43.169 5.447 -6.320 1.00 0.00 C ATOM 1952 C SER A 598 -43.010 4.411 -7.427 1.00 0.00 C ATOM 1953 O SER A 598 -42.135 3.548 -7.365 1.00 0.00 O ATOM 1954 CB SER A 598 -42.553 6.777 -6.757 1.00 0.00 C ATOM 1955 OG SER A 598 -41.253 6.587 -7.288 1.00 0.00 O ATOM 0 H SER A 598 -41.558 4.763 -5.165 1.00 0.00 H new ATOM 0 HA SER A 598 -44.233 5.592 -6.133 1.00 0.00 H new ATOM 0 HB2 SER A 598 -43.190 7.248 -7.506 1.00 0.00 H new ATOM 0 HB3 SER A 598 -42.506 7.457 -5.906 1.00 0.00 H new ATOM 0 HG SER A 598 -40.882 7.452 -7.562 1.00 0.00 H new ATOM 1961 N GLY A 599 -43.863 4.503 -8.443 1.00 0.00 N ATOM 1962 CA GLY A 599 -43.802 3.567 -9.551 1.00 0.00 C ATOM 1963 C GLY A 599 -45.056 2.725 -9.669 1.00 0.00 C ATOM 1964 O GLY A 599 -45.077 1.568 -9.250 1.00 0.00 O ATOM 0 H GLY A 599 -44.595 5.209 -8.519 1.00 0.00 H new ATOM 0 HA2 GLY A 599 -43.649 4.117 -10.479 1.00 0.00 H new ATOM 0 HA3 GLY A 599 -42.940 2.913 -9.423 1.00 0.00 H new TER 1968 GLY A 599