USER MOD reduce.3.24.130724 H: found=0, std=0, add=993, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 991 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 570 HIS : no HE2:sc= -1.74! K(o=-3.2!,f=-5.9) USER MOD Set 1.2: A 574 GLN :FLIP amide:sc= -1.46 F(o=-6.1!,f=-3.2) USER MOD Set 2.1: A 554 CYS SG : rot -39:sc= -2.73 USER MOD Set 2.2: A 555 CYS SG : rot 25:sc= -1.72 USER MOD Set 3.1: A 503 ASN :FLIP amide:sc= 0.326 F(o=-1.2,f=-0.6) USER MOD Set 3.2: A 506 GLN : amide:sc= -0.93 K(o=-0.6,f=-4.8!) USER MOD Set 4.1: A 491 TYR OH : rot -39:sc= 1.41 USER MOD Set 4.2: A 537 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 477 SER OG : rot -11:sc= 0.144 USER MOD Single : A 478 SER OG : rot -9:sc= 0.827 USER MOD Single : A 480 SER OG : rot 180:sc= 0 USER MOD Single : A 481 SER OG : rot 180:sc= 0 USER MOD Single : A 483 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.019) USER MOD Single : A 487 THR OG1 : rot 180:sc= 0 USER MOD Single : A 490 SER OG : rot 180:sc= 0 USER MOD Single : A 495 TYR OH : rot -116:sc= -5.8! USER MOD Single : A 497 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 498 GLN :FLIP amide:sc= -0.671 F(o=-1.4!,f=-0.67) USER MOD Single : A 499 LYS NZ :NH3+ -131:sc= 0.0206 (180deg=0) USER MOD Single : A 500 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 501 HIS :FLIP no HD1:sc= -0.0865 F(o=-0.59,f=-0.086) USER MOD Single : A 504 THR OG1 : rot 180:sc= 0 USER MOD Single : A 505 GLN : amide:sc= -1.27 K(o=-1.3,f=-3.2!) USER MOD Single : A 508 THR OG1 : rot 180:sc= 0 USER MOD Single : A 511 GLN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 519 LYS NZ :NH3+ -115:sc= 0.251 (180deg=0) USER MOD Single : A 520 THR OG1 : rot 149:sc= 0.0419 USER MOD Single : A 527 SER OG : rot 180:sc= 0 USER MOD Single : A 528 TYR OH : rot -12:sc= 0.0273 USER MOD Single : A 530 TYR OH : rot 180:sc= 0 USER MOD Single : A 534 ASN : amide:sc= -0.111 X(o=-0.11,f=-0.11) USER MOD Single : A 535 HIS : no HD1:sc= -0.723 X(o=-0.72,f=-1.1) USER MOD Single : A 536 MET CE :methyl -162:sc= -2.4! (180deg=-3.39!) USER MOD Single : A 539 LYS NZ :NH3+ 174:sc= 0.242 (180deg=0.23) USER MOD Single : A 546 LYS NZ :NH3+ -139:sc= 1 (180deg=0.0618) USER MOD Single : A 549 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 556 ASN : amide:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 564 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 565 GLN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 567 ASN : amide:sc= -0.197 X(o=-0.2,f=-0.21) USER MOD Single : A 569 MET CE :methyl 145:sc= -0.0494 (180deg=-1.45) USER MOD Single : A 575 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 579 MET CE :methyl -150:sc= -3.09 (180deg=-5.41!) USER MOD Single : A 583 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 584 SER OG : rot 180:sc= 0 USER MOD Single : A 591 LYS NZ :NH3+ -146:sc= -0.0288 (180deg=-0.974) USER MOD Single : A 592 LYS NZ :NH3+ -162:sc= -0.0139 (180deg=-0.168) USER MOD Single : A 593 SER OG : rot 180:sc= 0 USER MOD Single : A 594 SER OG : rot 180:sc= 0 USER MOD Single : A 597 SER OG : rot 180:sc= 0 USER MOD Single : A 598 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 476 21.619 -6.250 -13.803 1.00 0.00 N ATOM 2 CA GLY A 476 20.963 -5.225 -13.013 1.00 0.00 C ATOM 3 C GLY A 476 19.956 -4.428 -13.819 1.00 0.00 C ATOM 4 O GLY A 476 19.984 -4.443 -15.049 1.00 0.00 O ATOM 0 HA2 GLY A 476 20.459 -5.690 -12.166 1.00 0.00 H new ATOM 0 HA3 GLY A 476 21.714 -4.549 -12.605 1.00 0.00 H new ATOM 8 N SER A 477 19.062 -3.731 -13.123 1.00 0.00 N ATOM 9 CA SER A 477 18.038 -2.929 -13.782 1.00 0.00 C ATOM 10 C SER A 477 17.555 -3.608 -15.060 1.00 0.00 C ATOM 11 O SER A 477 17.370 -2.959 -16.089 1.00 0.00 O ATOM 12 CB SER A 477 18.581 -1.536 -14.106 1.00 0.00 C ATOM 13 OG SER A 477 19.559 -1.595 -15.129 1.00 0.00 O ATOM 0 H SER A 477 19.027 -3.706 -12.104 1.00 0.00 H new ATOM 0 HA SER A 477 17.193 -2.833 -13.100 1.00 0.00 H new ATOM 0 HB2 SER A 477 17.763 -0.887 -14.418 1.00 0.00 H new ATOM 0 HB3 SER A 477 19.015 -1.094 -13.209 1.00 0.00 H new ATOM 0 HG SER A 477 19.809 -2.529 -15.289 1.00 0.00 H new ATOM 19 N SER A 478 17.352 -4.920 -14.985 1.00 0.00 N ATOM 20 CA SER A 478 16.894 -5.689 -16.136 1.00 0.00 C ATOM 21 C SER A 478 16.254 -7.001 -15.693 1.00 0.00 C ATOM 22 O SER A 478 16.902 -7.842 -15.072 1.00 0.00 O ATOM 23 CB SER A 478 18.061 -5.973 -17.084 1.00 0.00 C ATOM 24 OG SER A 478 18.566 -4.773 -17.644 1.00 0.00 O ATOM 0 H SER A 478 17.497 -5.472 -14.140 1.00 0.00 H new ATOM 0 HA SER A 478 16.144 -5.098 -16.661 1.00 0.00 H new ATOM 0 HB2 SER A 478 18.855 -6.489 -16.544 1.00 0.00 H new ATOM 0 HB3 SER A 478 17.732 -6.640 -17.881 1.00 0.00 H new ATOM 0 HG SER A 478 17.966 -4.031 -17.422 1.00 0.00 H new ATOM 30 N GLY A 479 14.975 -7.168 -16.017 1.00 0.00 N ATOM 31 CA GLY A 479 14.268 -8.379 -15.644 1.00 0.00 C ATOM 32 C GLY A 479 14.628 -9.556 -16.529 1.00 0.00 C ATOM 33 O GLY A 479 15.804 -9.868 -16.710 1.00 0.00 O ATOM 0 H GLY A 479 14.416 -6.486 -16.531 1.00 0.00 H new ATOM 0 HA2 GLY A 479 14.497 -8.625 -14.607 1.00 0.00 H new ATOM 0 HA3 GLY A 479 13.194 -8.201 -15.700 1.00 0.00 H new ATOM 37 N SER A 480 13.612 -10.213 -17.079 1.00 0.00 N ATOM 38 CA SER A 480 13.827 -11.366 -17.945 1.00 0.00 C ATOM 39 C SER A 480 13.689 -10.976 -19.414 1.00 0.00 C ATOM 40 O SER A 480 12.843 -10.158 -19.773 1.00 0.00 O ATOM 41 CB SER A 480 12.832 -12.478 -17.606 1.00 0.00 C ATOM 42 OG SER A 480 13.361 -13.752 -17.928 1.00 0.00 O ATOM 0 H SER A 480 12.632 -9.967 -16.940 1.00 0.00 H new ATOM 0 HA SER A 480 14.840 -11.731 -17.777 1.00 0.00 H new ATOM 0 HB2 SER A 480 12.588 -12.440 -16.544 1.00 0.00 H new ATOM 0 HB3 SER A 480 11.903 -12.318 -18.153 1.00 0.00 H new ATOM 0 HG SER A 480 12.707 -14.445 -17.700 1.00 0.00 H new ATOM 48 N SER A 481 14.528 -11.569 -20.258 1.00 0.00 N ATOM 49 CA SER A 481 14.504 -11.281 -21.687 1.00 0.00 C ATOM 50 C SER A 481 13.096 -11.446 -22.251 1.00 0.00 C ATOM 51 O SER A 481 12.524 -10.509 -22.806 1.00 0.00 O ATOM 52 CB SER A 481 15.474 -12.201 -22.430 1.00 0.00 C ATOM 53 OG SER A 481 16.818 -11.915 -22.081 1.00 0.00 O ATOM 0 H SER A 481 15.232 -12.251 -19.977 1.00 0.00 H new ATOM 0 HA SER A 481 14.815 -10.246 -21.829 1.00 0.00 H new ATOM 0 HB2 SER A 481 15.247 -13.241 -22.194 1.00 0.00 H new ATOM 0 HB3 SER A 481 15.341 -12.082 -23.505 1.00 0.00 H new ATOM 0 HG SER A 481 17.418 -12.518 -22.568 1.00 0.00 H new ATOM 59 N GLY A 482 12.543 -12.647 -22.104 1.00 0.00 N ATOM 60 CA GLY A 482 11.207 -12.914 -22.603 1.00 0.00 C ATOM 61 C GLY A 482 10.127 -12.401 -21.672 1.00 0.00 C ATOM 62 O GLY A 482 10.396 -11.597 -20.779 1.00 0.00 O ATOM 0 H GLY A 482 12.997 -13.439 -21.648 1.00 0.00 H new ATOM 0 HA2 GLY A 482 11.089 -12.450 -23.582 1.00 0.00 H new ATOM 0 HA3 GLY A 482 11.082 -13.988 -22.742 1.00 0.00 H new ATOM 66 N LYS A 483 8.899 -12.866 -21.880 1.00 0.00 N ATOM 67 CA LYS A 483 7.773 -12.449 -21.053 1.00 0.00 C ATOM 68 C LYS A 483 8.194 -12.303 -19.594 1.00 0.00 C ATOM 69 O LYS A 483 9.099 -12.985 -19.113 1.00 0.00 O ATOM 70 CB LYS A 483 6.630 -13.460 -21.166 1.00 0.00 C ATOM 71 CG LYS A 483 7.018 -14.868 -20.748 1.00 0.00 C ATOM 72 CD LYS A 483 6.779 -15.095 -19.265 1.00 0.00 C ATOM 73 CE LYS A 483 7.015 -16.548 -18.878 1.00 0.00 C ATOM 74 NZ LYS A 483 8.446 -16.934 -19.023 1.00 0.00 N ATOM 0 H LYS A 483 8.659 -13.532 -22.614 1.00 0.00 H new ATOM 0 HA LYS A 483 7.430 -11.479 -21.412 1.00 0.00 H new ATOM 0 HB2 LYS A 483 5.797 -13.124 -20.549 1.00 0.00 H new ATOM 0 HB3 LYS A 483 6.275 -13.481 -22.197 1.00 0.00 H new ATOM 0 HG2 LYS A 483 6.442 -15.592 -21.325 1.00 0.00 H new ATOM 0 HG3 LYS A 483 8.069 -15.040 -20.979 1.00 0.00 H new ATOM 0 HD2 LYS A 483 7.441 -14.451 -18.686 1.00 0.00 H new ATOM 0 HD3 LYS A 483 5.757 -14.811 -19.012 1.00 0.00 H new ATOM 0 HE2 LYS A 483 6.699 -16.705 -17.847 1.00 0.00 H new ATOM 0 HE3 LYS A 483 6.399 -17.195 -19.502 1.00 0.00 H new ATOM 0 HZ1 LYS A 483 8.578 -17.909 -18.686 1.00 0.00 H new ATOM 0 HZ2 LYS A 483 8.722 -16.873 -20.024 1.00 0.00 H new ATOM 0 HZ3 LYS A 483 9.038 -16.290 -18.460 1.00 0.00 H new ATOM 88 N PRO A 484 7.522 -11.395 -18.871 1.00 0.00 N ATOM 89 CA PRO A 484 7.807 -11.140 -17.456 1.00 0.00 C ATOM 90 C PRO A 484 7.392 -12.303 -16.562 1.00 0.00 C ATOM 91 O PRO A 484 6.313 -12.873 -16.731 1.00 0.00 O ATOM 92 CB PRO A 484 6.969 -9.898 -17.143 1.00 0.00 C ATOM 93 CG PRO A 484 5.856 -9.933 -18.133 1.00 0.00 C ATOM 94 CD PRO A 484 6.430 -10.547 -19.380 1.00 0.00 C ATOM 0 HA PRO A 484 8.873 -11.008 -17.273 1.00 0.00 H new ATOM 0 HB2 PRO A 484 6.591 -9.923 -16.121 1.00 0.00 H new ATOM 0 HB3 PRO A 484 7.559 -8.987 -17.243 1.00 0.00 H new ATOM 0 HG2 PRO A 484 5.019 -10.522 -17.758 1.00 0.00 H new ATOM 0 HG3 PRO A 484 5.478 -8.930 -18.330 1.00 0.00 H new ATOM 0 HD2 PRO A 484 5.685 -11.132 -19.920 1.00 0.00 H new ATOM 0 HD3 PRO A 484 6.799 -9.787 -20.069 1.00 0.00 H new ATOM 102 N ILE A 485 8.252 -12.649 -15.611 1.00 0.00 N ATOM 103 CA ILE A 485 7.973 -13.743 -14.690 1.00 0.00 C ATOM 104 C ILE A 485 6.921 -13.341 -13.661 1.00 0.00 C ATOM 105 O ILE A 485 5.998 -14.103 -13.371 1.00 0.00 O ATOM 106 CB ILE A 485 9.246 -14.199 -13.953 1.00 0.00 C ATOM 107 CG1 ILE A 485 10.319 -14.622 -14.959 1.00 0.00 C ATOM 108 CG2 ILE A 485 8.927 -15.340 -12.999 1.00 0.00 C ATOM 109 CD1 ILE A 485 11.729 -14.506 -14.422 1.00 0.00 C ATOM 0 H ILE A 485 9.149 -12.187 -15.458 1.00 0.00 H new ATOM 0 HA ILE A 485 7.595 -14.570 -15.290 1.00 0.00 H new ATOM 0 HB ILE A 485 9.630 -13.362 -13.370 1.00 0.00 H new ATOM 0 HG12 ILE A 485 10.137 -15.654 -15.260 1.00 0.00 H new ATOM 0 HG13 ILE A 485 10.228 -14.008 -15.855 1.00 0.00 H new ATOM 0 HG21 ILE A 485 9.837 -15.651 -12.486 1.00 0.00 H new ATOM 0 HG22 ILE A 485 8.193 -15.007 -12.266 1.00 0.00 H new ATOM 0 HG23 ILE A 485 8.522 -16.182 -13.561 1.00 0.00 H new ATOM 0 HD11 ILE A 485 12.437 -14.822 -15.188 1.00 0.00 H new ATOM 0 HD12 ILE A 485 11.930 -13.470 -14.147 1.00 0.00 H new ATOM 0 HD13 ILE A 485 11.837 -15.142 -13.543 1.00 0.00 H new ATOM 121 N PHE A 486 7.065 -12.138 -13.115 1.00 0.00 N ATOM 122 CA PHE A 486 6.127 -11.633 -12.119 1.00 0.00 C ATOM 123 C PHE A 486 6.241 -12.419 -10.816 1.00 0.00 C ATOM 124 O PHE A 486 5.242 -12.684 -10.147 1.00 0.00 O ATOM 125 CB PHE A 486 4.694 -11.712 -12.651 1.00 0.00 C ATOM 126 CG PHE A 486 3.789 -10.652 -12.094 1.00 0.00 C ATOM 127 CD1 PHE A 486 4.009 -9.314 -12.378 1.00 0.00 C ATOM 128 CD2 PHE A 486 2.716 -10.993 -11.285 1.00 0.00 C ATOM 129 CE1 PHE A 486 3.177 -8.336 -11.865 1.00 0.00 C ATOM 130 CE2 PHE A 486 1.881 -10.020 -10.770 1.00 0.00 C ATOM 131 CZ PHE A 486 2.111 -8.690 -11.061 1.00 0.00 C ATOM 0 H PHE A 486 7.822 -11.495 -13.345 1.00 0.00 H new ATOM 0 HA PHE A 486 6.376 -10.591 -11.917 1.00 0.00 H new ATOM 0 HB2 PHE A 486 4.713 -11.628 -13.738 1.00 0.00 H new ATOM 0 HB3 PHE A 486 4.281 -12.692 -12.414 1.00 0.00 H new ATOM 0 HD1 PHE A 486 4.840 -9.032 -13.007 1.00 0.00 H new ATOM 0 HD2 PHE A 486 2.531 -12.032 -11.055 1.00 0.00 H new ATOM 0 HE1 PHE A 486 3.360 -7.296 -12.093 1.00 0.00 H new ATOM 0 HE2 PHE A 486 1.049 -10.300 -10.140 1.00 0.00 H new ATOM 0 HZ PHE A 486 1.459 -7.928 -10.661 1.00 0.00 H new ATOM 141 N THR A 487 7.468 -12.790 -10.462 1.00 0.00 N ATOM 142 CA THR A 487 7.715 -13.547 -9.241 1.00 0.00 C ATOM 143 C THR A 487 6.736 -13.150 -8.141 1.00 0.00 C ATOM 144 O THR A 487 6.348 -11.987 -8.032 1.00 0.00 O ATOM 145 CB THR A 487 9.153 -13.338 -8.732 1.00 0.00 C ATOM 146 OG1 THR A 487 10.091 -13.670 -9.763 1.00 0.00 O ATOM 147 CG2 THR A 487 9.421 -14.193 -7.502 1.00 0.00 C ATOM 0 H THR A 487 8.306 -12.578 -11.004 1.00 0.00 H new ATOM 0 HA THR A 487 7.574 -14.599 -9.487 1.00 0.00 H new ATOM 0 HB THR A 487 9.269 -12.289 -8.459 1.00 0.00 H new ATOM 0 HG1 THR A 487 11.003 -13.533 -9.432 1.00 0.00 H new ATOM 0 HG21 THR A 487 10.443 -14.029 -7.160 1.00 0.00 H new ATOM 0 HG22 THR A 487 8.725 -13.919 -6.709 1.00 0.00 H new ATOM 0 HG23 THR A 487 9.287 -15.245 -7.754 1.00 0.00 H new ATOM 155 N ASP A 488 6.342 -14.124 -7.328 1.00 0.00 N ATOM 156 CA ASP A 488 5.409 -13.875 -6.235 1.00 0.00 C ATOM 157 C ASP A 488 6.088 -13.107 -5.105 1.00 0.00 C ATOM 158 O ASP A 488 7.283 -12.821 -5.168 1.00 0.00 O ATOM 159 CB ASP A 488 4.849 -15.196 -5.704 1.00 0.00 C ATOM 160 CG ASP A 488 4.416 -16.130 -6.817 1.00 0.00 C ATOM 161 OD1 ASP A 488 3.832 -15.642 -7.808 1.00 0.00 O ATOM 162 OD2 ASP A 488 4.661 -17.348 -6.698 1.00 0.00 O ATOM 0 H ASP A 488 6.654 -15.092 -7.405 1.00 0.00 H new ATOM 0 HA ASP A 488 4.589 -13.269 -6.621 1.00 0.00 H new ATOM 0 HB2 ASP A 488 5.606 -15.689 -5.094 1.00 0.00 H new ATOM 0 HB3 ASP A 488 3.999 -14.992 -5.054 1.00 0.00 H new ATOM 167 N GLU A 489 5.317 -12.774 -4.075 1.00 0.00 N ATOM 168 CA GLU A 489 5.844 -12.037 -2.933 1.00 0.00 C ATOM 169 C GLU A 489 7.074 -12.732 -2.357 1.00 0.00 C ATOM 170 O GLU A 489 6.960 -13.733 -1.649 1.00 0.00 O ATOM 171 CB GLU A 489 4.772 -11.893 -1.851 1.00 0.00 C ATOM 172 CG GLU A 489 4.188 -13.219 -1.394 1.00 0.00 C ATOM 173 CD GLU A 489 2.761 -13.088 -0.898 1.00 0.00 C ATOM 174 OE1 GLU A 489 2.438 -12.045 -0.291 1.00 0.00 O ATOM 175 OE2 GLU A 489 1.968 -14.027 -1.116 1.00 0.00 O ATOM 0 H GLU A 489 4.325 -13.003 -4.008 1.00 0.00 H new ATOM 0 HA GLU A 489 6.137 -11.045 -3.278 1.00 0.00 H new ATOM 0 HB2 GLU A 489 5.202 -11.379 -0.991 1.00 0.00 H new ATOM 0 HB3 GLU A 489 3.968 -11.262 -2.230 1.00 0.00 H new ATOM 0 HG2 GLU A 489 4.218 -13.929 -2.221 1.00 0.00 H new ATOM 0 HG3 GLU A 489 4.809 -13.630 -0.598 1.00 0.00 H new ATOM 182 N SER A 490 8.250 -12.196 -2.667 1.00 0.00 N ATOM 183 CA SER A 490 9.502 -12.767 -2.185 1.00 0.00 C ATOM 184 C SER A 490 10.025 -11.990 -0.980 1.00 0.00 C ATOM 185 O SER A 490 10.604 -12.566 -0.059 1.00 0.00 O ATOM 186 CB SER A 490 10.550 -12.768 -3.299 1.00 0.00 C ATOM 187 OG SER A 490 11.780 -13.301 -2.842 1.00 0.00 O ATOM 0 H SER A 490 8.362 -11.367 -3.250 1.00 0.00 H new ATOM 0 HA SER A 490 9.309 -13.795 -1.877 1.00 0.00 H new ATOM 0 HB2 SER A 490 10.187 -13.355 -4.143 1.00 0.00 H new ATOM 0 HB3 SER A 490 10.703 -11.751 -3.660 1.00 0.00 H new ATOM 0 HG SER A 490 12.432 -13.292 -3.573 1.00 0.00 H new ATOM 193 N TYR A 491 9.816 -10.678 -0.995 1.00 0.00 N ATOM 194 CA TYR A 491 10.268 -9.820 0.094 1.00 0.00 C ATOM 195 C TYR A 491 9.209 -9.725 1.188 1.00 0.00 C ATOM 196 O TYR A 491 9.117 -8.719 1.894 1.00 0.00 O ATOM 197 CB TYR A 491 10.600 -8.423 -0.433 1.00 0.00 C ATOM 198 CG TYR A 491 9.551 -7.864 -1.369 1.00 0.00 C ATOM 199 CD1 TYR A 491 8.206 -7.877 -1.022 1.00 0.00 C ATOM 200 CD2 TYR A 491 9.906 -7.325 -2.599 1.00 0.00 C ATOM 201 CE1 TYR A 491 7.244 -7.369 -1.874 1.00 0.00 C ATOM 202 CE2 TYR A 491 8.952 -6.813 -3.456 1.00 0.00 C ATOM 203 CZ TYR A 491 7.622 -6.837 -3.089 1.00 0.00 C ATOM 204 OH TYR A 491 6.668 -6.329 -3.941 1.00 0.00 O ATOM 0 H TYR A 491 9.337 -10.186 -1.749 1.00 0.00 H new ATOM 0 HA TYR A 491 11.168 -10.263 0.522 1.00 0.00 H new ATOM 0 HB2 TYR A 491 10.720 -7.744 0.411 1.00 0.00 H new ATOM 0 HB3 TYR A 491 11.557 -8.458 -0.953 1.00 0.00 H new ATOM 0 HD1 TYR A 491 7.907 -8.291 -0.070 1.00 0.00 H new ATOM 0 HD2 TYR A 491 10.946 -7.306 -2.890 1.00 0.00 H new ATOM 0 HE1 TYR A 491 6.202 -7.388 -1.590 1.00 0.00 H new ATOM 0 HE2 TYR A 491 9.245 -6.396 -4.408 1.00 0.00 H new ATOM 0 HH TYR A 491 5.872 -6.900 -3.918 1.00 0.00 H new ATOM 214 N LEU A 492 8.412 -10.779 1.324 1.00 0.00 N ATOM 215 CA LEU A 492 7.359 -10.817 2.333 1.00 0.00 C ATOM 216 C LEU A 492 7.825 -10.167 3.631 1.00 0.00 C ATOM 217 O LEU A 492 7.014 -9.674 4.415 1.00 0.00 O ATOM 218 CB LEU A 492 6.931 -12.261 2.597 1.00 0.00 C ATOM 219 CG LEU A 492 5.780 -12.788 1.739 1.00 0.00 C ATOM 220 CD1 LEU A 492 5.468 -14.234 2.093 1.00 0.00 C ATOM 221 CD2 LEU A 492 4.544 -11.917 1.911 1.00 0.00 C ATOM 0 H LEU A 492 8.475 -11.619 0.748 1.00 0.00 H new ATOM 0 HA LEU A 492 6.505 -10.255 1.953 1.00 0.00 H new ATOM 0 HB2 LEU A 492 7.795 -12.908 2.447 1.00 0.00 H new ATOM 0 HB3 LEU A 492 6.646 -12.348 3.645 1.00 0.00 H new ATOM 0 HG LEU A 492 6.085 -12.749 0.693 1.00 0.00 H new ATOM 0 HD11 LEU A 492 4.646 -14.591 1.472 1.00 0.00 H new ATOM 0 HD12 LEU A 492 6.350 -14.850 1.918 1.00 0.00 H new ATOM 0 HD13 LEU A 492 5.184 -14.298 3.143 1.00 0.00 H new ATOM 0 HD21 LEU A 492 3.735 -12.307 1.293 1.00 0.00 H new ATOM 0 HD22 LEU A 492 4.237 -11.923 2.957 1.00 0.00 H new ATOM 0 HD23 LEU A 492 4.773 -10.896 1.606 1.00 0.00 H new ATOM 233 N GLU A 493 9.136 -10.167 3.850 1.00 0.00 N ATOM 234 CA GLU A 493 9.709 -9.576 5.054 1.00 0.00 C ATOM 235 C GLU A 493 8.957 -8.308 5.448 1.00 0.00 C ATOM 236 O GLU A 493 8.495 -8.174 6.582 1.00 0.00 O ATOM 237 CB GLU A 493 11.190 -9.257 4.837 1.00 0.00 C ATOM 238 CG GLU A 493 11.863 -8.638 6.050 1.00 0.00 C ATOM 239 CD GLU A 493 12.489 -9.676 6.962 1.00 0.00 C ATOM 240 OE1 GLU A 493 11.761 -10.242 7.804 1.00 0.00 O ATOM 241 OE2 GLU A 493 13.706 -9.922 6.833 1.00 0.00 O ATOM 0 H GLU A 493 9.821 -10.569 3.210 1.00 0.00 H new ATOM 0 HA GLU A 493 9.615 -10.300 5.863 1.00 0.00 H new ATOM 0 HB2 GLU A 493 11.715 -10.174 4.569 1.00 0.00 H new ATOM 0 HB3 GLU A 493 11.286 -8.576 3.991 1.00 0.00 H new ATOM 0 HG2 GLU A 493 12.632 -7.940 5.718 1.00 0.00 H new ATOM 0 HG3 GLU A 493 11.130 -8.060 6.613 1.00 0.00 H new ATOM 248 N LEU A 494 8.838 -7.380 4.505 1.00 0.00 N ATOM 249 CA LEU A 494 8.143 -6.122 4.753 1.00 0.00 C ATOM 250 C LEU A 494 6.830 -6.362 5.492 1.00 0.00 C ATOM 251 O LEU A 494 6.469 -5.608 6.396 1.00 0.00 O ATOM 252 CB LEU A 494 7.873 -5.397 3.433 1.00 0.00 C ATOM 253 CG LEU A 494 6.555 -5.739 2.737 1.00 0.00 C ATOM 254 CD1 LEU A 494 6.291 -4.775 1.591 1.00 0.00 C ATOM 255 CD2 LEU A 494 6.573 -7.175 2.235 1.00 0.00 C ATOM 0 H LEU A 494 9.214 -7.475 3.562 1.00 0.00 H new ATOM 0 HA LEU A 494 8.782 -5.499 5.379 1.00 0.00 H new ATOM 0 HB2 LEU A 494 7.894 -4.323 3.620 1.00 0.00 H new ATOM 0 HB3 LEU A 494 8.691 -5.617 2.747 1.00 0.00 H new ATOM 0 HG LEU A 494 5.747 -5.639 3.462 1.00 0.00 H new ATOM 0 HD11 LEU A 494 5.349 -5.034 1.108 1.00 0.00 H new ATOM 0 HD12 LEU A 494 6.233 -3.757 1.978 1.00 0.00 H new ATOM 0 HD13 LEU A 494 7.102 -4.842 0.865 1.00 0.00 H new ATOM 0 HD21 LEU A 494 5.627 -7.400 1.743 1.00 0.00 H new ATOM 0 HD22 LEU A 494 7.391 -7.302 1.525 1.00 0.00 H new ATOM 0 HD23 LEU A 494 6.714 -7.853 3.077 1.00 0.00 H new ATOM 267 N TYR A 495 6.123 -7.416 5.103 1.00 0.00 N ATOM 268 CA TYR A 495 4.850 -7.756 5.729 1.00 0.00 C ATOM 269 C TYR A 495 4.975 -7.761 7.249 1.00 0.00 C ATOM 270 O TYR A 495 4.090 -7.281 7.958 1.00 0.00 O ATOM 271 CB TYR A 495 4.366 -9.122 5.241 1.00 0.00 C ATOM 272 CG TYR A 495 2.902 -9.379 5.515 1.00 0.00 C ATOM 273 CD1 TYR A 495 2.409 -9.389 6.814 1.00 0.00 C ATOM 274 CD2 TYR A 495 2.011 -9.614 4.475 1.00 0.00 C ATOM 275 CE1 TYR A 495 1.072 -9.624 7.069 1.00 0.00 C ATOM 276 CE2 TYR A 495 0.672 -9.848 4.720 1.00 0.00 C ATOM 277 CZ TYR A 495 0.207 -9.852 6.019 1.00 0.00 C ATOM 278 OH TYR A 495 -1.126 -10.087 6.268 1.00 0.00 O ATOM 0 H TYR A 495 6.409 -8.050 4.357 1.00 0.00 H new ATOM 0 HA TYR A 495 4.121 -6.997 5.445 1.00 0.00 H new ATOM 0 HB2 TYR A 495 4.545 -9.200 4.169 1.00 0.00 H new ATOM 0 HB3 TYR A 495 4.959 -9.901 5.721 1.00 0.00 H new ATOM 0 HD1 TYR A 495 3.083 -9.210 7.639 1.00 0.00 H new ATOM 0 HD2 TYR A 495 2.372 -9.614 3.457 1.00 0.00 H new ATOM 0 HE1 TYR A 495 0.706 -9.629 8.085 1.00 0.00 H new ATOM 0 HE2 TYR A 495 -0.007 -10.027 3.899 1.00 0.00 H new ATOM 0 HH TYR A 495 -1.358 -10.994 5.980 1.00 0.00 H new ATOM 288 N ARG A 496 6.081 -8.307 7.744 1.00 0.00 N ATOM 289 CA ARG A 496 6.323 -8.376 9.180 1.00 0.00 C ATOM 290 C ARG A 496 7.502 -7.492 9.576 1.00 0.00 C ATOM 291 O ARG A 496 8.068 -7.642 10.659 1.00 0.00 O ATOM 292 CB ARG A 496 6.590 -9.821 9.605 1.00 0.00 C ATOM 293 CG ARG A 496 7.714 -10.487 8.828 1.00 0.00 C ATOM 294 CD ARG A 496 9.034 -10.405 9.578 1.00 0.00 C ATOM 295 NE ARG A 496 9.261 -11.580 10.416 1.00 0.00 N ATOM 296 CZ ARG A 496 9.551 -12.783 9.933 1.00 0.00 C ATOM 297 NH1 ARG A 496 9.650 -12.968 8.624 1.00 0.00 N ATOM 298 NH2 ARG A 496 9.743 -13.803 10.759 1.00 0.00 N ATOM 0 H ARG A 496 6.824 -8.708 7.172 1.00 0.00 H new ATOM 0 HA ARG A 496 5.431 -8.013 9.691 1.00 0.00 H new ATOM 0 HB2 ARG A 496 6.834 -9.839 10.667 1.00 0.00 H new ATOM 0 HB3 ARG A 496 5.677 -10.403 9.477 1.00 0.00 H new ATOM 0 HG2 ARG A 496 7.462 -11.532 8.645 1.00 0.00 H new ATOM 0 HG3 ARG A 496 7.817 -10.009 7.854 1.00 0.00 H new ATOM 0 HD2 ARG A 496 9.851 -10.306 8.864 1.00 0.00 H new ATOM 0 HD3 ARG A 496 9.043 -9.509 10.199 1.00 0.00 H new ATOM 0 HE ARG A 496 9.193 -11.471 11.428 1.00 0.00 H new ATOM 0 HH11 ARG A 496 9.503 -12.186 7.986 1.00 0.00 H new ATOM 0 HH12 ARG A 496 9.873 -13.892 8.255 1.00 0.00 H new ATOM 0 HH21 ARG A 496 9.668 -13.664 11.767 1.00 0.00 H new ATOM 0 HH22 ARG A 496 9.966 -14.726 10.386 1.00 0.00 H new ATOM 312 N LYS A 497 7.867 -6.570 8.691 1.00 0.00 N ATOM 313 CA LYS A 497 8.977 -5.661 8.947 1.00 0.00 C ATOM 314 C LYS A 497 8.486 -4.370 9.594 1.00 0.00 C ATOM 315 O LYS A 497 9.077 -3.885 10.558 1.00 0.00 O ATOM 316 CB LYS A 497 9.713 -5.343 7.643 1.00 0.00 C ATOM 317 CG LYS A 497 11.123 -4.819 7.853 1.00 0.00 C ATOM 318 CD LYS A 497 12.034 -5.190 6.694 1.00 0.00 C ATOM 319 CE LYS A 497 13.419 -4.583 6.858 1.00 0.00 C ATOM 320 NZ LYS A 497 13.487 -3.199 6.313 1.00 0.00 N ATOM 0 H LYS A 497 7.409 -6.433 7.790 1.00 0.00 H new ATOM 0 HA LYS A 497 9.665 -6.152 9.635 1.00 0.00 H new ATOM 0 HB2 LYS A 497 9.757 -6.244 7.031 1.00 0.00 H new ATOM 0 HB3 LYS A 497 9.140 -4.605 7.083 1.00 0.00 H new ATOM 0 HG2 LYS A 497 11.097 -3.735 7.964 1.00 0.00 H new ATOM 0 HG3 LYS A 497 11.529 -5.224 8.780 1.00 0.00 H new ATOM 0 HD2 LYS A 497 12.116 -6.275 6.627 1.00 0.00 H new ATOM 0 HD3 LYS A 497 11.593 -4.846 5.758 1.00 0.00 H new ATOM 0 HE2 LYS A 497 13.687 -4.571 7.914 1.00 0.00 H new ATOM 0 HE3 LYS A 497 14.152 -5.210 6.350 1.00 0.00 H new ATOM 0 HZ1 LYS A 497 14.447 -2.821 6.444 1.00 0.00 H new ATOM 0 HZ2 LYS A 497 13.256 -3.213 5.299 1.00 0.00 H new ATOM 0 HZ3 LYS A 497 12.805 -2.594 6.815 1.00 0.00 H new ATOM 334 N GLN A 498 7.401 -3.821 9.058 1.00 0.00 N ATOM 335 CA GLN A 498 6.830 -2.587 9.585 1.00 0.00 C ATOM 336 C GLN A 498 6.232 -2.812 10.970 1.00 0.00 C ATOM 337 O GLN A 498 6.761 -2.331 11.972 1.00 0.00 O ATOM 338 CB GLN A 498 5.759 -2.049 8.635 1.00 0.00 C ATOM 339 CG GLN A 498 6.319 -1.200 7.504 1.00 0.00 C ATOM 340 CD GLN A 498 7.193 -0.066 8.004 1.00 0.00 C ATOM 341 OE1 GLN A 498 8.486 -0.332 8.144 1.00 0.00 O flip ATOM 342 NE2 GLN A 498 6.710 1.037 8.261 1.00 0.00 N flip ATOM 0 H GLN A 498 6.900 -4.211 8.260 1.00 0.00 H new ATOM 0 HA GLN A 498 7.631 -1.853 9.670 1.00 0.00 H new ATOM 0 HB2 GLN A 498 5.208 -2.888 8.210 1.00 0.00 H new ATOM 0 HB3 GLN A 498 5.045 -1.455 9.205 1.00 0.00 H new ATOM 0 HG2 GLN A 498 6.900 -1.833 6.833 1.00 0.00 H new ATOM 0 HG3 GLN A 498 5.495 -0.789 6.921 1.00 0.00 H new ATOM 0 HE21 GLN A 498 5.710 1.197 8.139 1.00 0.00 H new ATOM 0 HE22 GLN A 498 7.310 1.791 8.596 1.00 0.00 H new ATOM 351 N LYS A 499 5.125 -3.544 11.018 1.00 0.00 N ATOM 352 CA LYS A 499 4.454 -3.834 12.280 1.00 0.00 C ATOM 353 C LYS A 499 3.799 -5.212 12.244 1.00 0.00 C ATOM 354 O LYS A 499 3.946 -5.955 11.273 1.00 0.00 O ATOM 355 CB LYS A 499 3.400 -2.765 12.579 1.00 0.00 C ATOM 356 CG LYS A 499 2.373 -2.597 11.472 1.00 0.00 C ATOM 357 CD LYS A 499 1.087 -1.980 11.994 1.00 0.00 C ATOM 358 CE LYS A 499 1.241 -0.485 12.230 1.00 0.00 C ATOM 359 NZ LYS A 499 1.146 0.289 10.962 1.00 0.00 N ATOM 0 H LYS A 499 4.673 -3.948 10.198 1.00 0.00 H new ATOM 0 HA LYS A 499 5.204 -3.828 13.071 1.00 0.00 H new ATOM 0 HB2 LYS A 499 2.885 -3.023 13.505 1.00 0.00 H new ATOM 0 HB3 LYS A 499 3.900 -1.811 12.747 1.00 0.00 H new ATOM 0 HG2 LYS A 499 2.786 -1.967 10.684 1.00 0.00 H new ATOM 0 HG3 LYS A 499 2.157 -3.567 11.025 1.00 0.00 H new ATOM 0 HD2 LYS A 499 0.282 -2.156 11.280 1.00 0.00 H new ATOM 0 HD3 LYS A 499 0.800 -2.469 12.925 1.00 0.00 H new ATOM 0 HE2 LYS A 499 0.470 -0.145 12.922 1.00 0.00 H new ATOM 0 HE3 LYS A 499 2.203 -0.289 12.704 1.00 0.00 H new ATOM 0 HZ1 LYS A 499 1.942 0.955 10.902 1.00 0.00 H new ATOM 0 HZ2 LYS A 499 1.179 -0.364 10.153 1.00 0.00 H new ATOM 0 HZ3 LYS A 499 0.250 0.817 10.944 1.00 0.00 H new ATOM 373 N LYS A 500 3.075 -5.545 13.306 1.00 0.00 N ATOM 374 CA LYS A 500 2.394 -6.832 13.396 1.00 0.00 C ATOM 375 C LYS A 500 1.654 -7.147 12.100 1.00 0.00 C ATOM 376 O LYS A 500 1.547 -6.300 11.213 1.00 0.00 O ATOM 377 CB LYS A 500 1.413 -6.832 14.570 1.00 0.00 C ATOM 378 CG LYS A 500 2.037 -7.267 15.885 1.00 0.00 C ATOM 379 CD LYS A 500 2.771 -6.120 16.559 1.00 0.00 C ATOM 380 CE LYS A 500 3.397 -6.556 17.875 1.00 0.00 C ATOM 381 NZ LYS A 500 4.629 -7.365 17.662 1.00 0.00 N ATOM 0 H LYS A 500 2.944 -4.941 14.118 1.00 0.00 H new ATOM 0 HA LYS A 500 3.147 -7.603 13.560 1.00 0.00 H new ATOM 0 HB2 LYS A 500 1.000 -5.830 14.687 1.00 0.00 H new ATOM 0 HB3 LYS A 500 0.580 -7.495 14.336 1.00 0.00 H new ATOM 0 HG2 LYS A 500 1.260 -7.644 16.550 1.00 0.00 H new ATOM 0 HG3 LYS A 500 2.730 -8.089 15.706 1.00 0.00 H new ATOM 0 HD2 LYS A 500 3.547 -5.742 15.893 1.00 0.00 H new ATOM 0 HD3 LYS A 500 2.078 -5.299 16.739 1.00 0.00 H new ATOM 0 HE2 LYS A 500 3.639 -5.676 18.471 1.00 0.00 H new ATOM 0 HE3 LYS A 500 2.674 -7.139 18.446 1.00 0.00 H new ATOM 0 HZ1 LYS A 500 5.025 -7.643 18.583 1.00 0.00 H new ATOM 0 HZ2 LYS A 500 4.394 -8.218 17.115 1.00 0.00 H new ATOM 0 HZ3 LYS A 500 5.329 -6.800 17.140 1.00 0.00 H new ATOM 395 N HIS A 501 1.142 -8.370 11.999 1.00 0.00 N ATOM 396 CA HIS A 501 0.410 -8.796 10.812 1.00 0.00 C ATOM 397 C HIS A 501 -0.612 -7.742 10.397 1.00 0.00 C ATOM 398 O HIS A 501 -0.823 -6.754 11.102 1.00 0.00 O ATOM 399 CB HIS A 501 -0.292 -10.129 11.071 1.00 0.00 C ATOM 400 CG HIS A 501 -1.093 -10.148 12.336 1.00 0.00 C ATOM 401 ND1 HIS A 501 -1.809 -9.174 12.946 1.00 0.00 N flip ATOM 402 CD2 HIS A 501 -1.221 -11.269 13.130 1.00 0.00 C flip ATOM 403 CE1 HIS A 501 -2.352 -9.719 14.084 1.00 0.00 C flip ATOM 404 NE2 HIS A 501 -1.982 -10.984 14.171 1.00 0.00 N flip ATOM 0 H HIS A 501 1.221 -9.083 12.725 1.00 0.00 H new ATOM 0 HA HIS A 501 1.126 -8.923 10.000 1.00 0.00 H new ATOM 0 HB2 HIS A 501 -0.949 -10.353 10.231 1.00 0.00 H new ATOM 0 HB3 HIS A 501 0.455 -10.922 11.112 1.00 0.00 H new ATOM 0 HD2 HIS A 501 -0.769 -12.230 12.931 1.00 0.00 H new ATOM 0 HE1 HIS A 501 -2.979 -9.198 14.792 1.00 0.00 H new ATOM 0 HE2 HIS A 501 -2.240 -11.631 14.916 1.00 0.00 H new ATOM 412 N LEU A 502 -1.244 -7.957 9.248 1.00 0.00 N ATOM 413 CA LEU A 502 -2.243 -7.025 8.738 1.00 0.00 C ATOM 414 C LEU A 502 -3.648 -7.605 8.873 1.00 0.00 C ATOM 415 O LEU A 502 -3.821 -8.819 8.976 1.00 0.00 O ATOM 416 CB LEU A 502 -1.957 -6.689 7.273 1.00 0.00 C ATOM 417 CG LEU A 502 -0.621 -6.000 6.992 1.00 0.00 C ATOM 418 CD1 LEU A 502 -0.259 -6.119 5.520 1.00 0.00 C ATOM 419 CD2 LEU A 502 -0.675 -4.539 7.414 1.00 0.00 C ATOM 0 H LEU A 502 -1.082 -8.769 8.652 1.00 0.00 H new ATOM 0 HA LEU A 502 -2.187 -6.112 9.331 1.00 0.00 H new ATOM 0 HB2 LEU A 502 -1.996 -7.612 6.695 1.00 0.00 H new ATOM 0 HB3 LEU A 502 -2.758 -6.048 6.905 1.00 0.00 H new ATOM 0 HG LEU A 502 0.153 -6.497 7.577 1.00 0.00 H new ATOM 0 HD11 LEU A 502 0.695 -5.623 5.339 1.00 0.00 H new ATOM 0 HD12 LEU A 502 -0.178 -7.172 5.249 1.00 0.00 H new ATOM 0 HD13 LEU A 502 -1.034 -5.648 4.915 1.00 0.00 H new ATOM 0 HD21 LEU A 502 0.284 -4.065 7.207 1.00 0.00 H new ATOM 0 HD22 LEU A 502 -1.460 -4.028 6.857 1.00 0.00 H new ATOM 0 HD23 LEU A 502 -0.888 -4.476 8.481 1.00 0.00 H new ATOM 431 N ASN A 503 -4.647 -6.729 8.870 1.00 0.00 N ATOM 432 CA ASN A 503 -6.037 -7.154 8.991 1.00 0.00 C ATOM 433 C ASN A 503 -6.622 -7.496 7.624 1.00 0.00 C ATOM 434 O ASN A 503 -5.931 -7.432 6.606 1.00 0.00 O ATOM 435 CB ASN A 503 -6.872 -6.058 9.656 1.00 0.00 C ATOM 436 CG ASN A 503 -6.470 -5.820 11.098 1.00 0.00 C ATOM 437 OD1 ASN A 503 -7.058 -6.585 12.010 1.00 0.00 O flip ATOM 438 ND2 ASN A 503 -5.639 -4.959 11.389 1.00 0.00 N flip ATOM 0 H ASN A 503 -4.520 -5.720 8.785 1.00 0.00 H new ATOM 0 HA ASN A 503 -6.064 -8.049 9.613 1.00 0.00 H new ATOM 0 HB2 ASN A 503 -6.763 -5.131 9.094 1.00 0.00 H new ATOM 0 HB3 ASN A 503 -7.926 -6.333 9.616 1.00 0.00 H new ATOM 0 HD21 ASN A 503 -5.212 -4.394 10.655 1.00 0.00 H new ATOM 0 HD22 ASN A 503 -5.378 -4.811 12.364 1.00 0.00 H new ATOM 445 N THR A 504 -7.901 -7.858 7.607 1.00 0.00 N ATOM 446 CA THR A 504 -8.579 -8.210 6.366 1.00 0.00 C ATOM 447 C THR A 504 -8.470 -7.086 5.342 1.00 0.00 C ATOM 448 O THR A 504 -7.885 -7.263 4.274 1.00 0.00 O ATOM 449 CB THR A 504 -10.068 -8.524 6.609 1.00 0.00 C ATOM 450 OG1 THR A 504 -10.199 -9.486 7.662 1.00 0.00 O ATOM 451 CG2 THR A 504 -10.722 -9.058 5.343 1.00 0.00 C ATOM 0 H THR A 504 -8.488 -7.915 8.439 1.00 0.00 H new ATOM 0 HA THR A 504 -8.085 -9.101 5.978 1.00 0.00 H new ATOM 0 HB THR A 504 -10.570 -7.600 6.896 1.00 0.00 H new ATOM 0 HG1 THR A 504 -11.148 -9.679 7.812 1.00 0.00 H new ATOM 0 HG21 THR A 504 -11.773 -9.273 5.539 1.00 0.00 H new ATOM 0 HG22 THR A 504 -10.645 -8.312 4.552 1.00 0.00 H new ATOM 0 HG23 THR A 504 -10.217 -9.972 5.030 1.00 0.00 H new ATOM 459 N GLN A 505 -9.036 -5.930 5.675 1.00 0.00 N ATOM 460 CA GLN A 505 -9.002 -4.778 4.783 1.00 0.00 C ATOM 461 C GLN A 505 -7.573 -4.468 4.349 1.00 0.00 C ATOM 462 O GLN A 505 -7.267 -4.450 3.157 1.00 0.00 O ATOM 463 CB GLN A 505 -9.616 -3.556 5.469 1.00 0.00 C ATOM 464 CG GLN A 505 -11.135 -3.541 5.438 1.00 0.00 C ATOM 465 CD GLN A 505 -11.716 -2.229 5.930 1.00 0.00 C ATOM 466 OE1 GLN A 505 -11.159 -1.586 6.821 1.00 0.00 O ATOM 467 NE2 GLN A 505 -12.840 -1.825 5.351 1.00 0.00 N ATOM 0 H GLN A 505 -9.523 -5.767 6.556 1.00 0.00 H new ATOM 0 HA GLN A 505 -9.588 -5.020 3.896 1.00 0.00 H new ATOM 0 HB2 GLN A 505 -9.282 -3.526 6.506 1.00 0.00 H new ATOM 0 HB3 GLN A 505 -9.242 -2.653 4.987 1.00 0.00 H new ATOM 0 HG2 GLN A 505 -11.476 -3.725 4.419 1.00 0.00 H new ATOM 0 HG3 GLN A 505 -11.515 -4.356 6.054 1.00 0.00 H new ATOM 0 HE21 GLN A 505 -13.267 -2.390 4.617 1.00 0.00 H new ATOM 0 HE22 GLN A 505 -13.277 -0.950 5.640 1.00 0.00 H new ATOM 476 N GLN A 506 -6.704 -4.223 5.325 1.00 0.00 N ATOM 477 CA GLN A 506 -5.307 -3.913 5.043 1.00 0.00 C ATOM 478 C GLN A 506 -4.766 -4.802 3.928 1.00 0.00 C ATOM 479 O GLN A 506 -4.290 -4.311 2.904 1.00 0.00 O ATOM 480 CB GLN A 506 -4.460 -4.083 6.305 1.00 0.00 C ATOM 481 CG GLN A 506 -4.759 -3.053 7.382 1.00 0.00 C ATOM 482 CD GLN A 506 -3.731 -3.060 8.496 1.00 0.00 C ATOM 483 OE1 GLN A 506 -3.678 -3.988 9.303 1.00 0.00 O ATOM 484 NE2 GLN A 506 -2.906 -2.020 8.547 1.00 0.00 N ATOM 0 H GLN A 506 -6.942 -4.233 6.317 1.00 0.00 H new ATOM 0 HA GLN A 506 -5.251 -2.875 4.714 1.00 0.00 H new ATOM 0 HB2 GLN A 506 -4.626 -5.080 6.712 1.00 0.00 H new ATOM 0 HB3 GLN A 506 -3.406 -4.020 6.036 1.00 0.00 H new ATOM 0 HG2 GLN A 506 -4.794 -2.061 6.931 1.00 0.00 H new ATOM 0 HG3 GLN A 506 -5.746 -3.248 7.802 1.00 0.00 H new ATOM 0 HE21 GLN A 506 -2.985 -1.272 7.858 1.00 0.00 H new ATOM 0 HE22 GLN A 506 -2.194 -1.969 9.275 1.00 0.00 H new ATOM 493 N LEU A 507 -4.842 -6.112 4.134 1.00 0.00 N ATOM 494 CA LEU A 507 -4.359 -7.071 3.147 1.00 0.00 C ATOM 495 C LEU A 507 -4.904 -6.746 1.760 1.00 0.00 C ATOM 496 O LEU A 507 -4.148 -6.422 0.843 1.00 0.00 O ATOM 497 CB LEU A 507 -4.763 -8.491 3.546 1.00 0.00 C ATOM 498 CG LEU A 507 -3.893 -9.163 4.609 1.00 0.00 C ATOM 499 CD1 LEU A 507 -4.487 -10.502 5.017 1.00 0.00 C ATOM 500 CD2 LEU A 507 -2.471 -9.341 4.100 1.00 0.00 C ATOM 0 H LEU A 507 -5.234 -6.534 4.976 1.00 0.00 H new ATOM 0 HA LEU A 507 -3.271 -7.005 3.115 1.00 0.00 H new ATOM 0 HB2 LEU A 507 -5.791 -8.466 3.909 1.00 0.00 H new ATOM 0 HB3 LEU A 507 -4.755 -9.114 2.652 1.00 0.00 H new ATOM 0 HG LEU A 507 -3.865 -8.519 5.488 1.00 0.00 H new ATOM 0 HD11 LEU A 507 -3.854 -10.965 5.774 1.00 0.00 H new ATOM 0 HD12 LEU A 507 -5.486 -10.348 5.424 1.00 0.00 H new ATOM 0 HD13 LEU A 507 -4.547 -11.154 4.146 1.00 0.00 H new ATOM 0 HD21 LEU A 507 -1.866 -9.821 4.870 1.00 0.00 H new ATOM 0 HD22 LEU A 507 -2.480 -9.964 3.205 1.00 0.00 H new ATOM 0 HD23 LEU A 507 -2.046 -8.367 3.860 1.00 0.00 H new ATOM 512 N THR A 508 -6.223 -6.832 1.613 1.00 0.00 N ATOM 513 CA THR A 508 -6.870 -6.546 0.339 1.00 0.00 C ATOM 514 C THR A 508 -6.172 -5.403 -0.388 1.00 0.00 C ATOM 515 O THR A 508 -5.910 -5.485 -1.588 1.00 0.00 O ATOM 516 CB THR A 508 -8.356 -6.186 0.531 1.00 0.00 C ATOM 517 OG1 THR A 508 -9.028 -7.239 1.232 1.00 0.00 O ATOM 518 CG2 THR A 508 -9.033 -5.949 -0.810 1.00 0.00 C ATOM 0 H THR A 508 -6.864 -7.098 2.361 1.00 0.00 H new ATOM 0 HA THR A 508 -6.798 -7.453 -0.262 1.00 0.00 H new ATOM 0 HB THR A 508 -8.413 -5.267 1.115 1.00 0.00 H new ATOM 0 HG1 THR A 508 -9.971 -7.002 1.352 1.00 0.00 H new ATOM 0 HG21 THR A 508 -10.081 -5.696 -0.649 1.00 0.00 H new ATOM 0 HG22 THR A 508 -8.537 -5.128 -1.328 1.00 0.00 H new ATOM 0 HG23 THR A 508 -8.967 -6.853 -1.416 1.00 0.00 H new ATOM 526 N ALA A 509 -5.873 -4.336 0.346 1.00 0.00 N ATOM 527 CA ALA A 509 -5.202 -3.176 -0.229 1.00 0.00 C ATOM 528 C ALA A 509 -3.750 -3.494 -0.568 1.00 0.00 C ATOM 529 O ALA A 509 -3.260 -3.137 -1.640 1.00 0.00 O ATOM 530 CB ALA A 509 -5.277 -1.996 0.728 1.00 0.00 C ATOM 0 H ALA A 509 -6.085 -4.251 1.340 1.00 0.00 H new ATOM 0 HA ALA A 509 -5.714 -2.912 -1.155 1.00 0.00 H new ATOM 0 HB1 ALA A 509 -4.772 -1.137 0.286 1.00 0.00 H new ATOM 0 HB2 ALA A 509 -6.321 -1.746 0.916 1.00 0.00 H new ATOM 0 HB3 ALA A 509 -4.791 -2.258 1.668 1.00 0.00 H new ATOM 536 N PHE A 510 -3.066 -4.167 0.351 1.00 0.00 N ATOM 537 CA PHE A 510 -1.669 -4.532 0.150 1.00 0.00 C ATOM 538 C PHE A 510 -1.504 -5.381 -1.107 1.00 0.00 C ATOM 539 O PHE A 510 -0.645 -5.107 -1.944 1.00 0.00 O ATOM 540 CB PHE A 510 -1.138 -5.293 1.366 1.00 0.00 C ATOM 541 CG PHE A 510 0.335 -5.580 1.298 1.00 0.00 C ATOM 542 CD1 PHE A 510 1.256 -4.659 1.772 1.00 0.00 C ATOM 543 CD2 PHE A 510 0.799 -6.769 0.760 1.00 0.00 C ATOM 544 CE1 PHE A 510 2.612 -4.920 1.710 1.00 0.00 C ATOM 545 CE2 PHE A 510 2.154 -7.036 0.696 1.00 0.00 C ATOM 546 CZ PHE A 510 3.061 -6.110 1.172 1.00 0.00 C ATOM 0 H PHE A 510 -3.457 -4.471 1.243 1.00 0.00 H new ATOM 0 HA PHE A 510 -1.094 -3.614 0.025 1.00 0.00 H new ATOM 0 HB2 PHE A 510 -1.346 -4.714 2.266 1.00 0.00 H new ATOM 0 HB3 PHE A 510 -1.679 -6.234 1.460 1.00 0.00 H new ATOM 0 HD1 PHE A 510 0.910 -3.727 2.194 1.00 0.00 H new ATOM 0 HD2 PHE A 510 0.094 -7.496 0.386 1.00 0.00 H new ATOM 0 HE1 PHE A 510 3.320 -4.194 2.082 1.00 0.00 H new ATOM 0 HE2 PHE A 510 2.502 -7.967 0.274 1.00 0.00 H new ATOM 0 HZ PHE A 510 4.120 -6.316 1.124 1.00 0.00 H new ATOM 556 N GLN A 511 -2.333 -6.412 -1.231 1.00 0.00 N ATOM 557 CA GLN A 511 -2.279 -7.302 -2.384 1.00 0.00 C ATOM 558 C GLN A 511 -2.553 -6.537 -3.675 1.00 0.00 C ATOM 559 O GLN A 511 -1.856 -6.716 -4.675 1.00 0.00 O ATOM 560 CB GLN A 511 -3.291 -8.438 -2.227 1.00 0.00 C ATOM 561 CG GLN A 511 -2.754 -9.626 -1.445 1.00 0.00 C ATOM 562 CD GLN A 511 -3.837 -10.622 -1.079 1.00 0.00 C ATOM 563 OE1 GLN A 511 -4.731 -10.905 -1.878 1.00 0.00 O ATOM 564 NE2 GLN A 511 -3.764 -11.159 0.133 1.00 0.00 N ATOM 0 H GLN A 511 -3.050 -6.652 -0.547 1.00 0.00 H new ATOM 0 HA GLN A 511 -1.275 -7.724 -2.438 1.00 0.00 H new ATOM 0 HB2 GLN A 511 -4.180 -8.055 -1.726 1.00 0.00 H new ATOM 0 HB3 GLN A 511 -3.603 -8.775 -3.216 1.00 0.00 H new ATOM 0 HG2 GLN A 511 -1.988 -10.129 -2.036 1.00 0.00 H new ATOM 0 HG3 GLN A 511 -2.272 -9.269 -0.535 1.00 0.00 H new ATOM 0 HE21 GLN A 511 -3.006 -10.896 0.763 1.00 0.00 H new ATOM 0 HE22 GLN A 511 -4.466 -11.835 0.434 1.00 0.00 H new ATOM 573 N LEU A 512 -3.571 -5.684 -3.647 1.00 0.00 N ATOM 574 CA LEU A 512 -3.937 -4.891 -4.815 1.00 0.00 C ATOM 575 C LEU A 512 -2.759 -4.048 -5.293 1.00 0.00 C ATOM 576 O LEU A 512 -2.453 -4.008 -6.485 1.00 0.00 O ATOM 577 CB LEU A 512 -5.128 -3.987 -4.490 1.00 0.00 C ATOM 578 CG LEU A 512 -6.498 -4.666 -4.462 1.00 0.00 C ATOM 579 CD1 LEU A 512 -7.564 -3.697 -3.975 1.00 0.00 C ATOM 580 CD2 LEU A 512 -6.854 -5.206 -5.839 1.00 0.00 C ATOM 0 H LEU A 512 -4.158 -5.524 -2.828 1.00 0.00 H new ATOM 0 HA LEU A 512 -4.217 -5.576 -5.615 1.00 0.00 H new ATOM 0 HB2 LEU A 512 -4.954 -3.525 -3.518 1.00 0.00 H new ATOM 0 HB3 LEU A 512 -5.159 -3.182 -5.224 1.00 0.00 H new ATOM 0 HG LEU A 512 -6.453 -5.504 -3.766 1.00 0.00 H new ATOM 0 HD11 LEU A 512 -8.532 -4.198 -3.962 1.00 0.00 H new ATOM 0 HD12 LEU A 512 -7.316 -3.359 -2.969 1.00 0.00 H new ATOM 0 HD13 LEU A 512 -7.609 -2.838 -4.645 1.00 0.00 H new ATOM 0 HD21 LEU A 512 -7.832 -5.686 -5.800 1.00 0.00 H new ATOM 0 HD22 LEU A 512 -6.881 -4.385 -6.556 1.00 0.00 H new ATOM 0 HD23 LEU A 512 -6.105 -5.934 -6.149 1.00 0.00 H new ATOM 592 N LEU A 513 -2.100 -3.377 -4.354 1.00 0.00 N ATOM 593 CA LEU A 513 -0.954 -2.535 -4.678 1.00 0.00 C ATOM 594 C LEU A 513 0.227 -3.380 -5.146 1.00 0.00 C ATOM 595 O LEU A 513 0.819 -3.112 -6.192 1.00 0.00 O ATOM 596 CB LEU A 513 -0.548 -1.702 -3.461 1.00 0.00 C ATOM 597 CG LEU A 513 -1.496 -0.565 -3.080 1.00 0.00 C ATOM 598 CD1 LEU A 513 -1.138 -0.007 -1.711 1.00 0.00 C ATOM 599 CD2 LEU A 513 -1.461 0.534 -4.131 1.00 0.00 C ATOM 0 H LEU A 513 -2.340 -3.400 -3.363 1.00 0.00 H new ATOM 0 HA LEU A 513 -1.243 -1.866 -5.489 1.00 0.00 H new ATOM 0 HB2 LEU A 513 -0.451 -2.370 -2.605 1.00 0.00 H new ATOM 0 HB3 LEU A 513 0.439 -1.278 -3.648 1.00 0.00 H new ATOM 0 HG LEU A 513 -2.509 -0.964 -3.034 1.00 0.00 H new ATOM 0 HD11 LEU A 513 -1.824 0.801 -1.457 1.00 0.00 H new ATOM 0 HD12 LEU A 513 -1.216 -0.797 -0.964 1.00 0.00 H new ATOM 0 HD13 LEU A 513 -0.117 0.375 -1.729 1.00 0.00 H new ATOM 0 HD21 LEU A 513 -2.142 1.335 -3.843 1.00 0.00 H new ATOM 0 HD22 LEU A 513 -0.448 0.930 -4.210 1.00 0.00 H new ATOM 0 HD23 LEU A 513 -1.767 0.126 -5.094 1.00 0.00 H new ATOM 611 N PHE A 514 0.562 -4.403 -4.367 1.00 0.00 N ATOM 612 CA PHE A 514 1.671 -5.289 -4.702 1.00 0.00 C ATOM 613 C PHE A 514 1.633 -5.672 -6.179 1.00 0.00 C ATOM 614 O PHE A 514 2.626 -5.532 -6.893 1.00 0.00 O ATOM 615 CB PHE A 514 1.625 -6.549 -3.836 1.00 0.00 C ATOM 616 CG PHE A 514 2.731 -7.521 -4.132 1.00 0.00 C ATOM 617 CD1 PHE A 514 2.787 -8.177 -5.351 1.00 0.00 C ATOM 618 CD2 PHE A 514 3.715 -7.779 -3.191 1.00 0.00 C ATOM 619 CE1 PHE A 514 3.804 -9.071 -5.627 1.00 0.00 C ATOM 620 CE2 PHE A 514 4.734 -8.672 -3.462 1.00 0.00 C ATOM 621 CZ PHE A 514 4.778 -9.320 -4.681 1.00 0.00 C ATOM 0 H PHE A 514 0.081 -4.639 -3.499 1.00 0.00 H new ATOM 0 HA PHE A 514 2.601 -4.756 -4.506 1.00 0.00 H new ATOM 0 HB2 PHE A 514 1.677 -6.261 -2.786 1.00 0.00 H new ATOM 0 HB3 PHE A 514 0.666 -7.046 -3.983 1.00 0.00 H new ATOM 0 HD1 PHE A 514 2.027 -7.987 -6.094 1.00 0.00 H new ATOM 0 HD2 PHE A 514 3.685 -7.277 -2.235 1.00 0.00 H new ATOM 0 HE1 PHE A 514 3.837 -9.574 -6.582 1.00 0.00 H new ATOM 0 HE2 PHE A 514 5.496 -8.863 -2.721 1.00 0.00 H new ATOM 0 HZ PHE A 514 5.573 -10.020 -4.894 1.00 0.00 H new ATOM 631 N ALA A 515 0.481 -6.156 -6.630 1.00 0.00 N ATOM 632 CA ALA A 515 0.313 -6.557 -8.021 1.00 0.00 C ATOM 633 C ALA A 515 0.463 -5.364 -8.959 1.00 0.00 C ATOM 634 O ALA A 515 1.192 -5.429 -9.948 1.00 0.00 O ATOM 635 CB ALA A 515 -1.043 -7.220 -8.219 1.00 0.00 C ATOM 0 H ALA A 515 -0.350 -6.280 -6.052 1.00 0.00 H new ATOM 0 HA ALA A 515 1.096 -7.276 -8.263 1.00 0.00 H new ATOM 0 HB1 ALA A 515 -1.155 -7.514 -9.262 1.00 0.00 H new ATOM 0 HB2 ALA A 515 -1.113 -8.103 -7.583 1.00 0.00 H new ATOM 0 HB3 ALA A 515 -1.833 -6.518 -7.953 1.00 0.00 H new ATOM 641 N TRP A 516 -0.232 -4.278 -8.642 1.00 0.00 N ATOM 642 CA TRP A 516 -0.177 -3.070 -9.458 1.00 0.00 C ATOM 643 C TRP A 516 1.267 -2.641 -9.696 1.00 0.00 C ATOM 644 O TRP A 516 1.692 -2.468 -10.839 1.00 0.00 O ATOM 645 CB TRP A 516 -0.954 -1.938 -8.784 1.00 0.00 C ATOM 646 CG TRP A 516 -0.664 -0.589 -9.369 1.00 0.00 C ATOM 647 CD1 TRP A 516 -1.299 -0.001 -10.425 1.00 0.00 C ATOM 648 CD2 TRP A 516 0.334 0.338 -8.931 1.00 0.00 C ATOM 649 NE1 TRP A 516 -0.754 1.237 -10.670 1.00 0.00 N ATOM 650 CE2 TRP A 516 0.249 1.469 -9.767 1.00 0.00 C ATOM 651 CE3 TRP A 516 1.292 0.325 -7.913 1.00 0.00 C ATOM 652 CZ2 TRP A 516 1.085 2.572 -9.615 1.00 0.00 C ATOM 653 CZ3 TRP A 516 2.121 1.420 -7.763 1.00 0.00 C ATOM 654 CH2 TRP A 516 2.013 2.532 -8.610 1.00 0.00 C ATOM 0 H TRP A 516 -0.840 -4.209 -7.826 1.00 0.00 H new ATOM 0 HA TRP A 516 -0.635 -3.291 -10.422 1.00 0.00 H new ATOM 0 HB2 TRP A 516 -2.022 -2.140 -8.867 1.00 0.00 H new ATOM 0 HB3 TRP A 516 -0.714 -1.925 -7.721 1.00 0.00 H new ATOM 0 HD1 TRP A 516 -2.110 -0.443 -10.985 1.00 0.00 H new ATOM 0 HE1 TRP A 516 -1.049 1.879 -11.406 1.00 0.00 H new ATOM 0 HE3 TRP A 516 1.383 -0.527 -7.255 1.00 0.00 H new ATOM 0 HZ2 TRP A 516 1.004 3.429 -10.267 1.00 0.00 H new ATOM 0 HZ3 TRP A 516 2.865 1.419 -6.980 1.00 0.00 H new ATOM 0 HH2 TRP A 516 2.675 3.373 -8.467 1.00 0.00 H new ATOM 665 N ARG A 517 2.016 -2.471 -8.612 1.00 0.00 N ATOM 666 CA ARG A 517 3.412 -2.061 -8.704 1.00 0.00 C ATOM 667 C ARG A 517 4.185 -2.972 -9.653 1.00 0.00 C ATOM 668 O ARG A 517 4.792 -2.508 -10.619 1.00 0.00 O ATOM 669 CB ARG A 517 4.063 -2.078 -7.320 1.00 0.00 C ATOM 670 CG ARG A 517 5.354 -1.279 -7.245 1.00 0.00 C ATOM 671 CD ARG A 517 6.188 -1.680 -6.038 1.00 0.00 C ATOM 672 NE ARG A 517 7.071 -2.806 -6.333 1.00 0.00 N ATOM 673 CZ ARG A 517 7.972 -3.277 -5.478 1.00 0.00 C ATOM 674 NH1 ARG A 517 8.108 -2.723 -4.281 1.00 0.00 N ATOM 675 NH2 ARG A 517 8.739 -4.304 -5.819 1.00 0.00 N ATOM 0 H ARG A 517 1.680 -2.611 -7.659 1.00 0.00 H new ATOM 0 HA ARG A 517 3.441 -1.046 -9.099 1.00 0.00 H new ATOM 0 HB2 ARG A 517 3.357 -1.681 -6.591 1.00 0.00 H new ATOM 0 HB3 ARG A 517 4.267 -3.110 -7.036 1.00 0.00 H new ATOM 0 HG2 ARG A 517 5.932 -1.434 -8.156 1.00 0.00 H new ATOM 0 HG3 ARG A 517 5.122 -0.215 -7.191 1.00 0.00 H new ATOM 0 HD2 ARG A 517 6.784 -0.828 -5.710 1.00 0.00 H new ATOM 0 HD3 ARG A 517 5.527 -1.944 -5.212 1.00 0.00 H new ATOM 0 HE ARG A 517 6.991 -3.255 -7.245 1.00 0.00 H new ATOM 0 HH11 ARG A 517 7.520 -1.933 -4.015 1.00 0.00 H new ATOM 0 HH12 ARG A 517 8.801 -3.087 -3.626 1.00 0.00 H new ATOM 0 HH21 ARG A 517 8.637 -4.733 -6.739 1.00 0.00 H new ATOM 0 HH22 ARG A 517 9.430 -4.665 -5.162 1.00 0.00 H new ATOM 689 N ASP A 518 4.158 -4.270 -9.372 1.00 0.00 N ATOM 690 CA ASP A 518 4.855 -5.247 -10.200 1.00 0.00 C ATOM 691 C ASP A 518 4.409 -5.143 -11.655 1.00 0.00 C ATOM 692 O ASP A 518 5.192 -5.382 -12.575 1.00 0.00 O ATOM 693 CB ASP A 518 4.606 -6.662 -9.677 1.00 0.00 C ATOM 694 CG ASP A 518 5.602 -7.665 -10.222 1.00 0.00 C ATOM 695 OD1 ASP A 518 6.219 -7.380 -11.270 1.00 0.00 O ATOM 696 OD2 ASP A 518 5.766 -8.736 -9.601 1.00 0.00 O ATOM 0 H ASP A 518 3.661 -4.670 -8.577 1.00 0.00 H new ATOM 0 HA ASP A 518 5.923 -5.033 -10.150 1.00 0.00 H new ATOM 0 HB2 ASP A 518 4.658 -6.658 -8.588 1.00 0.00 H new ATOM 0 HB3 ASP A 518 3.597 -6.973 -9.947 1.00 0.00 H new ATOM 701 N LYS A 519 3.145 -4.785 -11.857 1.00 0.00 N ATOM 702 CA LYS A 519 2.593 -4.649 -13.199 1.00 0.00 C ATOM 703 C LYS A 519 3.182 -3.435 -13.909 1.00 0.00 C ATOM 704 O LYS A 519 3.825 -3.563 -14.952 1.00 0.00 O ATOM 705 CB LYS A 519 1.069 -4.527 -13.136 1.00 0.00 C ATOM 706 CG LYS A 519 0.419 -4.308 -14.491 1.00 0.00 C ATOM 707 CD LYS A 519 -0.866 -3.507 -14.371 1.00 0.00 C ATOM 708 CE LYS A 519 -0.584 -2.034 -14.122 1.00 0.00 C ATOM 709 NZ LYS A 519 -1.790 -1.313 -13.628 1.00 0.00 N ATOM 0 H LYS A 519 2.484 -4.584 -11.107 1.00 0.00 H new ATOM 0 HA LYS A 519 2.857 -5.542 -13.765 1.00 0.00 H new ATOM 0 HB2 LYS A 519 0.659 -5.432 -12.688 1.00 0.00 H new ATOM 0 HB3 LYS A 519 0.806 -3.698 -12.478 1.00 0.00 H new ATOM 0 HG2 LYS A 519 1.114 -3.786 -15.149 1.00 0.00 H new ATOM 0 HG3 LYS A 519 0.206 -5.272 -14.953 1.00 0.00 H new ATOM 0 HD2 LYS A 519 -1.451 -3.617 -15.284 1.00 0.00 H new ATOM 0 HD3 LYS A 519 -1.470 -3.906 -13.556 1.00 0.00 H new ATOM 0 HE2 LYS A 519 0.221 -1.937 -13.393 1.00 0.00 H new ATOM 0 HE3 LYS A 519 -0.236 -1.570 -15.045 1.00 0.00 H new ATOM 0 HZ1 LYS A 519 -2.085 -0.607 -14.332 1.00 0.00 H new ATOM 0 HZ2 LYS A 519 -2.562 -1.993 -13.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 519 -1.566 -0.835 -12.732 1.00 0.00 H new ATOM 723 N THR A 520 2.960 -2.255 -13.338 1.00 0.00 N ATOM 724 CA THR A 520 3.469 -1.018 -13.916 1.00 0.00 C ATOM 725 C THR A 520 4.980 -1.082 -14.109 1.00 0.00 C ATOM 726 O THR A 520 5.517 -0.524 -15.065 1.00 0.00 O ATOM 727 CB THR A 520 3.126 0.197 -13.034 1.00 0.00 C ATOM 728 OG1 THR A 520 1.715 0.248 -12.797 1.00 0.00 O ATOM 729 CG2 THR A 520 3.582 1.490 -13.692 1.00 0.00 C ATOM 0 H THR A 520 2.431 -2.130 -12.475 1.00 0.00 H new ATOM 0 HA THR A 520 2.987 -0.901 -14.886 1.00 0.00 H new ATOM 0 HB THR A 520 3.650 0.087 -12.084 1.00 0.00 H new ATOM 0 HG1 THR A 520 1.545 0.644 -11.917 1.00 0.00 H new ATOM 0 HG21 THR A 520 3.329 2.334 -13.050 1.00 0.00 H new ATOM 0 HG22 THR A 520 4.661 1.460 -13.843 1.00 0.00 H new ATOM 0 HG23 THR A 520 3.084 1.604 -14.655 1.00 0.00 H new ATOM 737 N ALA A 521 5.660 -1.766 -13.194 1.00 0.00 N ATOM 738 CA ALA A 521 7.109 -1.905 -13.266 1.00 0.00 C ATOM 739 C ALA A 521 7.568 -2.142 -14.701 1.00 0.00 C ATOM 740 O ALA A 521 8.555 -1.561 -15.150 1.00 0.00 O ATOM 741 CB ALA A 521 7.575 -3.040 -12.366 1.00 0.00 C ATOM 0 H ALA A 521 5.230 -2.232 -12.395 1.00 0.00 H new ATOM 0 HA ALA A 521 7.556 -0.973 -12.919 1.00 0.00 H new ATOM 0 HB1 ALA A 521 8.659 -3.133 -12.429 1.00 0.00 H new ATOM 0 HB2 ALA A 521 7.288 -2.829 -11.336 1.00 0.00 H new ATOM 0 HB3 ALA A 521 7.112 -3.973 -12.687 1.00 0.00 H new ATOM 747 N ARG A 522 6.845 -2.999 -15.414 1.00 0.00 N ATOM 748 CA ARG A 522 7.179 -3.314 -16.798 1.00 0.00 C ATOM 749 C ARG A 522 6.911 -2.119 -17.708 1.00 0.00 C ATOM 750 O ARG A 522 7.790 -1.681 -18.450 1.00 0.00 O ATOM 751 CB ARG A 522 6.375 -4.524 -17.277 1.00 0.00 C ATOM 752 CG ARG A 522 6.786 -5.829 -16.615 1.00 0.00 C ATOM 753 CD ARG A 522 8.056 -6.392 -17.233 1.00 0.00 C ATOM 754 NE ARG A 522 7.867 -6.761 -18.633 1.00 0.00 N ATOM 755 CZ ARG A 522 8.092 -5.935 -19.648 1.00 0.00 C ATOM 756 NH1 ARG A 522 8.514 -4.699 -19.420 1.00 0.00 N ATOM 757 NH2 ARG A 522 7.896 -6.345 -20.895 1.00 0.00 N ATOM 0 H ARG A 522 6.024 -3.488 -15.056 1.00 0.00 H new ATOM 0 HA ARG A 522 8.242 -3.552 -16.843 1.00 0.00 H new ATOM 0 HB2 ARG A 522 5.317 -4.346 -17.084 1.00 0.00 H new ATOM 0 HB3 ARG A 522 6.490 -4.622 -18.356 1.00 0.00 H new ATOM 0 HG2 ARG A 522 6.941 -5.664 -15.549 1.00 0.00 H new ATOM 0 HG3 ARG A 522 5.980 -6.556 -16.711 1.00 0.00 H new ATOM 0 HD2 ARG A 522 8.854 -5.653 -17.158 1.00 0.00 H new ATOM 0 HD3 ARG A 522 8.377 -7.267 -16.668 1.00 0.00 H new ATOM 0 HE ARG A 522 7.544 -7.706 -18.843 1.00 0.00 H new ATOM 0 HH11 ARG A 522 8.667 -4.381 -18.463 1.00 0.00 H new ATOM 0 HH12 ARG A 522 8.686 -4.067 -20.202 1.00 0.00 H new ATOM 0 HH21 ARG A 522 7.572 -7.295 -21.074 1.00 0.00 H new ATOM 0 HH22 ARG A 522 8.069 -5.710 -21.674 1.00 0.00 H new ATOM 771 N ARG A 523 5.690 -1.596 -17.645 1.00 0.00 N ATOM 772 CA ARG A 523 5.306 -0.453 -18.464 1.00 0.00 C ATOM 773 C ARG A 523 6.355 0.651 -18.383 1.00 0.00 C ATOM 774 O ARG A 523 6.833 1.142 -19.406 1.00 0.00 O ATOM 775 CB ARG A 523 3.946 0.087 -18.017 1.00 0.00 C ATOM 776 CG ARG A 523 2.842 -0.958 -18.029 1.00 0.00 C ATOM 777 CD ARG A 523 2.379 -1.264 -19.445 1.00 0.00 C ATOM 778 NE ARG A 523 1.173 -2.088 -19.461 1.00 0.00 N ATOM 779 CZ ARG A 523 -0.038 -1.623 -19.177 1.00 0.00 C ATOM 780 NH1 ARG A 523 -0.204 -0.347 -18.857 1.00 0.00 N ATOM 781 NH2 ARG A 523 -1.087 -2.435 -19.213 1.00 0.00 N ATOM 0 H ARG A 523 4.951 -1.946 -17.036 1.00 0.00 H new ATOM 0 HA ARG A 523 5.235 -0.787 -19.499 1.00 0.00 H new ATOM 0 HB2 ARG A 523 4.039 0.493 -17.010 1.00 0.00 H new ATOM 0 HB3 ARG A 523 3.660 0.913 -18.669 1.00 0.00 H new ATOM 0 HG2 ARG A 523 3.200 -1.873 -17.557 1.00 0.00 H new ATOM 0 HG3 ARG A 523 1.998 -0.604 -17.438 1.00 0.00 H new ATOM 0 HD2 ARG A 523 2.187 -0.330 -19.973 1.00 0.00 H new ATOM 0 HD3 ARG A 523 3.176 -1.777 -19.984 1.00 0.00 H new ATOM 0 HE ARG A 523 1.266 -3.074 -19.704 1.00 0.00 H new ATOM 0 HH11 ARG A 523 0.600 0.280 -18.828 1.00 0.00 H new ATOM 0 HH12 ARG A 523 -1.135 0.007 -18.639 1.00 0.00 H new ATOM 0 HH21 ARG A 523 -0.963 -3.417 -19.459 1.00 0.00 H new ATOM 0 HH22 ARG A 523 -2.017 -2.077 -18.995 1.00 0.00 H new ATOM 795 N GLU A 524 6.708 1.037 -17.161 1.00 0.00 N ATOM 796 CA GLU A 524 7.700 2.084 -16.948 1.00 0.00 C ATOM 797 C GLU A 524 9.108 1.566 -17.228 1.00 0.00 C ATOM 798 O GLU A 524 9.995 2.325 -17.619 1.00 0.00 O ATOM 799 CB GLU A 524 7.616 2.614 -15.515 1.00 0.00 C ATOM 800 CG GLU A 524 6.409 3.503 -15.265 1.00 0.00 C ATOM 801 CD GLU A 524 6.287 4.620 -16.284 1.00 0.00 C ATOM 802 OE1 GLU A 524 7.330 5.063 -16.808 1.00 0.00 O ATOM 803 OE2 GLU A 524 5.147 5.050 -16.557 1.00 0.00 O ATOM 0 H GLU A 524 6.322 0.641 -16.304 1.00 0.00 H new ATOM 0 HA GLU A 524 7.486 2.897 -17.642 1.00 0.00 H new ATOM 0 HB2 GLU A 524 7.584 1.770 -14.826 1.00 0.00 H new ATOM 0 HB3 GLU A 524 8.523 3.175 -15.290 1.00 0.00 H new ATOM 0 HG2 GLU A 524 5.504 2.896 -15.287 1.00 0.00 H new ATOM 0 HG3 GLU A 524 6.480 3.933 -14.266 1.00 0.00 H new ATOM 810 N ASP A 525 9.305 0.268 -17.025 1.00 0.00 N ATOM 811 CA ASP A 525 10.604 -0.353 -17.255 1.00 0.00 C ATOM 812 C ASP A 525 11.661 0.238 -16.328 1.00 0.00 C ATOM 813 O ASP A 525 12.764 0.569 -16.761 1.00 0.00 O ATOM 814 CB ASP A 525 11.028 -0.173 -18.714 1.00 0.00 C ATOM 815 CG ASP A 525 10.024 -0.759 -19.686 1.00 0.00 C ATOM 816 OD1 ASP A 525 10.157 -1.953 -20.028 1.00 0.00 O ATOM 817 OD2 ASP A 525 9.105 -0.025 -20.105 1.00 0.00 O ATOM 0 H ASP A 525 8.582 -0.374 -16.702 1.00 0.00 H new ATOM 0 HA ASP A 525 10.513 -1.418 -17.040 1.00 0.00 H new ATOM 0 HB2 ASP A 525 11.155 0.889 -18.924 1.00 0.00 H new ATOM 0 HB3 ASP A 525 11.998 -0.647 -18.868 1.00 0.00 H new ATOM 822 N GLU A 526 11.316 0.367 -15.051 1.00 0.00 N ATOM 823 CA GLU A 526 12.235 0.920 -14.063 1.00 0.00 C ATOM 824 C GLU A 526 12.402 -0.032 -12.882 1.00 0.00 C ATOM 825 O GLU A 526 11.640 -0.986 -12.728 1.00 0.00 O ATOM 826 CB GLU A 526 11.733 2.279 -13.571 1.00 0.00 C ATOM 827 CG GLU A 526 12.246 3.451 -14.391 1.00 0.00 C ATOM 828 CD GLU A 526 11.548 3.575 -15.731 1.00 0.00 C ATOM 829 OE1 GLU A 526 10.434 4.139 -15.769 1.00 0.00 O ATOM 830 OE2 GLU A 526 12.115 3.109 -16.741 1.00 0.00 O ATOM 0 H GLU A 526 10.407 0.096 -14.676 1.00 0.00 H new ATOM 0 HA GLU A 526 13.206 1.051 -14.541 1.00 0.00 H new ATOM 0 HB2 GLU A 526 10.643 2.283 -13.590 1.00 0.00 H new ATOM 0 HB3 GLU A 526 12.034 2.414 -12.532 1.00 0.00 H new ATOM 0 HG2 GLU A 526 12.107 4.373 -13.826 1.00 0.00 H new ATOM 0 HG3 GLU A 526 13.318 3.335 -14.553 1.00 0.00 H new ATOM 837 N SER A 527 13.404 0.236 -12.051 1.00 0.00 N ATOM 838 CA SER A 527 13.675 -0.598 -10.886 1.00 0.00 C ATOM 839 C SER A 527 12.480 -0.610 -9.937 1.00 0.00 C ATOM 840 O SER A 527 11.888 0.432 -9.654 1.00 0.00 O ATOM 841 CB SER A 527 14.919 -0.096 -10.151 1.00 0.00 C ATOM 842 OG SER A 527 16.093 -0.353 -10.902 1.00 0.00 O ATOM 0 H SER A 527 14.042 1.024 -12.163 1.00 0.00 H new ATOM 0 HA SER A 527 13.853 -1.616 -11.232 1.00 0.00 H new ATOM 0 HB2 SER A 527 14.829 0.974 -9.966 1.00 0.00 H new ATOM 0 HB3 SER A 527 14.992 -0.583 -9.178 1.00 0.00 H new ATOM 0 HG SER A 527 16.874 -0.021 -10.412 1.00 0.00 H new ATOM 848 N TYR A 528 12.132 -1.795 -9.450 1.00 0.00 N ATOM 849 CA TYR A 528 11.006 -1.945 -8.535 1.00 0.00 C ATOM 850 C TYR A 528 10.974 -0.806 -7.520 1.00 0.00 C ATOM 851 O TYR A 528 10.011 -0.043 -7.456 1.00 0.00 O ATOM 852 CB TYR A 528 11.088 -3.288 -7.808 1.00 0.00 C ATOM 853 CG TYR A 528 10.660 -4.463 -8.657 1.00 0.00 C ATOM 854 CD1 TYR A 528 9.376 -4.532 -9.185 1.00 0.00 C ATOM 855 CD2 TYR A 528 11.538 -5.505 -8.931 1.00 0.00 C ATOM 856 CE1 TYR A 528 8.980 -5.604 -9.961 1.00 0.00 C ATOM 857 CE2 TYR A 528 11.151 -6.580 -9.707 1.00 0.00 C ATOM 858 CZ TYR A 528 9.871 -6.625 -10.220 1.00 0.00 C ATOM 859 OH TYR A 528 9.481 -7.695 -10.992 1.00 0.00 O ATOM 0 H TYR A 528 12.613 -2.666 -9.673 1.00 0.00 H new ATOM 0 HA TYR A 528 10.087 -1.912 -9.121 1.00 0.00 H new ATOM 0 HB2 TYR A 528 12.112 -3.448 -7.472 1.00 0.00 H new ATOM 0 HB3 TYR A 528 10.462 -3.248 -6.916 1.00 0.00 H new ATOM 0 HD1 TYR A 528 8.676 -3.734 -8.985 1.00 0.00 H new ATOM 0 HD2 TYR A 528 12.540 -5.474 -8.530 1.00 0.00 H new ATOM 0 HE1 TYR A 528 7.978 -5.643 -10.363 1.00 0.00 H new ATOM 0 HE2 TYR A 528 11.846 -7.381 -9.911 1.00 0.00 H new ATOM 0 HH TYR A 528 8.508 -7.679 -11.106 1.00 0.00 H new ATOM 869 N GLY A 529 12.037 -0.697 -6.729 1.00 0.00 N ATOM 870 CA GLY A 529 12.112 0.351 -5.728 1.00 0.00 C ATOM 871 C GLY A 529 11.734 1.711 -6.282 1.00 0.00 C ATOM 872 O GLY A 529 10.830 2.369 -5.766 1.00 0.00 O ATOM 0 H GLY A 529 12.847 -1.316 -6.764 1.00 0.00 H new ATOM 0 HA2 GLY A 529 11.451 0.104 -4.898 1.00 0.00 H new ATOM 0 HA3 GLY A 529 13.125 0.394 -5.327 1.00 0.00 H new ATOM 876 N TYR A 530 12.426 2.133 -7.333 1.00 0.00 N ATOM 877 CA TYR A 530 12.161 3.424 -7.955 1.00 0.00 C ATOM 878 C TYR A 530 10.661 3.651 -8.120 1.00 0.00 C ATOM 879 O TYR A 530 10.150 4.734 -7.833 1.00 0.00 O ATOM 880 CB TYR A 530 12.854 3.511 -9.316 1.00 0.00 C ATOM 881 CG TYR A 530 12.290 4.589 -10.215 1.00 0.00 C ATOM 882 CD1 TYR A 530 11.185 4.342 -11.020 1.00 0.00 C ATOM 883 CD2 TYR A 530 12.863 5.854 -10.258 1.00 0.00 C ATOM 884 CE1 TYR A 530 10.668 5.324 -11.843 1.00 0.00 C ATOM 885 CE2 TYR A 530 12.352 6.842 -11.077 1.00 0.00 C ATOM 886 CZ TYR A 530 11.255 6.572 -11.868 1.00 0.00 C ATOM 887 OH TYR A 530 10.742 7.553 -12.686 1.00 0.00 O ATOM 0 H TYR A 530 13.176 1.599 -7.773 1.00 0.00 H new ATOM 0 HA TYR A 530 12.559 4.201 -7.303 1.00 0.00 H new ATOM 0 HB2 TYR A 530 13.917 3.697 -9.162 1.00 0.00 H new ATOM 0 HB3 TYR A 530 12.769 2.548 -9.820 1.00 0.00 H new ATOM 0 HD1 TYR A 530 10.722 3.366 -11.002 1.00 0.00 H new ATOM 0 HD2 TYR A 530 13.723 6.069 -9.640 1.00 0.00 H new ATOM 0 HE1 TYR A 530 9.809 5.116 -12.463 1.00 0.00 H new ATOM 0 HE2 TYR A 530 12.809 7.820 -11.098 1.00 0.00 H new ATOM 0 HH TYR A 530 11.270 8.373 -12.584 1.00 0.00 H new ATOM 897 N VAL A 531 9.961 2.621 -8.585 1.00 0.00 N ATOM 898 CA VAL A 531 8.520 2.706 -8.788 1.00 0.00 C ATOM 899 C VAL A 531 7.800 3.041 -7.486 1.00 0.00 C ATOM 900 O VAL A 531 7.158 4.085 -7.369 1.00 0.00 O ATOM 901 CB VAL A 531 7.954 1.388 -9.350 1.00 0.00 C ATOM 902 CG1 VAL A 531 6.448 1.491 -9.538 1.00 0.00 C ATOM 903 CG2 VAL A 531 8.640 1.030 -10.659 1.00 0.00 C ATOM 0 H VAL A 531 10.369 1.718 -8.828 1.00 0.00 H new ATOM 0 HA VAL A 531 8.349 3.504 -9.510 1.00 0.00 H new ATOM 0 HB VAL A 531 8.153 0.592 -8.633 1.00 0.00 H new ATOM 0 HG11 VAL A 531 6.066 0.551 -9.936 1.00 0.00 H new ATOM 0 HG12 VAL A 531 5.975 1.698 -8.578 1.00 0.00 H new ATOM 0 HG13 VAL A 531 6.223 2.298 -10.235 1.00 0.00 H new ATOM 0 HG21 VAL A 531 8.228 0.096 -11.042 1.00 0.00 H new ATOM 0 HG22 VAL A 531 8.474 1.825 -11.386 1.00 0.00 H new ATOM 0 HG23 VAL A 531 9.710 0.912 -10.489 1.00 0.00 H new ATOM 913 N LEU A 532 7.913 2.148 -6.508 1.00 0.00 N ATOM 914 CA LEU A 532 7.274 2.349 -5.212 1.00 0.00 C ATOM 915 C LEU A 532 7.963 1.522 -4.131 1.00 0.00 C ATOM 916 O LEU A 532 8.002 0.292 -4.186 1.00 0.00 O ATOM 917 CB LEU A 532 5.793 1.976 -5.289 1.00 0.00 C ATOM 918 CG LEU A 532 4.963 2.259 -4.036 1.00 0.00 C ATOM 919 CD1 LEU A 532 4.655 3.744 -3.924 1.00 0.00 C ATOM 920 CD2 LEU A 532 3.677 1.446 -4.052 1.00 0.00 C ATOM 0 H LEU A 532 8.441 1.279 -6.588 1.00 0.00 H new ATOM 0 HA LEU A 532 7.364 3.403 -4.949 1.00 0.00 H new ATOM 0 HB2 LEU A 532 5.347 2.514 -6.125 1.00 0.00 H new ATOM 0 HB3 LEU A 532 5.718 0.913 -5.517 1.00 0.00 H new ATOM 0 HG LEU A 532 5.546 1.962 -3.164 1.00 0.00 H new ATOM 0 HD11 LEU A 532 4.064 3.926 -3.027 1.00 0.00 H new ATOM 0 HD12 LEU A 532 5.587 4.305 -3.865 1.00 0.00 H new ATOM 0 HD13 LEU A 532 4.093 4.066 -4.800 1.00 0.00 H new ATOM 0 HD21 LEU A 532 3.100 1.661 -3.153 1.00 0.00 H new ATOM 0 HD22 LEU A 532 3.090 1.711 -4.932 1.00 0.00 H new ATOM 0 HD23 LEU A 532 3.919 0.384 -4.083 1.00 0.00 H new ATOM 932 N PRO A 533 8.519 2.210 -3.123 1.00 0.00 N ATOM 933 CA PRO A 533 9.214 1.559 -2.009 1.00 0.00 C ATOM 934 C PRO A 533 8.259 0.800 -1.094 1.00 0.00 C ATOM 935 O PRO A 533 7.043 0.852 -1.270 1.00 0.00 O ATOM 936 CB PRO A 533 9.856 2.730 -1.259 1.00 0.00 C ATOM 937 CG PRO A 533 9.004 3.905 -1.591 1.00 0.00 C ATOM 938 CD PRO A 533 8.511 3.677 -2.993 1.00 0.00 C ATOM 0 HA PRO A 533 9.929 0.813 -2.355 1.00 0.00 H new ATOM 0 HB2 PRO A 533 9.878 2.548 -0.185 1.00 0.00 H new ATOM 0 HB3 PRO A 533 10.887 2.886 -1.577 1.00 0.00 H new ATOM 0 HG2 PRO A 533 8.171 3.992 -0.894 1.00 0.00 H new ATOM 0 HG3 PRO A 533 9.574 4.832 -1.524 1.00 0.00 H new ATOM 0 HD2 PRO A 533 7.512 4.088 -3.140 1.00 0.00 H new ATOM 0 HD3 PRO A 533 9.161 4.149 -3.729 1.00 0.00 H new ATOM 946 N ASN A 534 8.819 0.096 -0.116 1.00 0.00 N ATOM 947 CA ASN A 534 8.016 -0.675 0.827 1.00 0.00 C ATOM 948 C ASN A 534 7.307 0.246 1.816 1.00 0.00 C ATOM 949 O ASN A 534 6.078 0.321 1.839 1.00 0.00 O ATOM 950 CB ASN A 534 8.897 -1.672 1.583 1.00 0.00 C ATOM 951 CG ASN A 534 9.898 -2.362 0.676 1.00 0.00 C ATOM 952 OD1 ASN A 534 11.108 -2.259 0.877 1.00 0.00 O ATOM 953 ND2 ASN A 534 9.396 -3.070 -0.329 1.00 0.00 N ATOM 0 H ASN A 534 9.825 0.043 0.045 1.00 0.00 H new ATOM 0 HA ASN A 534 7.262 -1.223 0.262 1.00 0.00 H new ATOM 0 HB2 ASN A 534 9.430 -1.151 2.378 1.00 0.00 H new ATOM 0 HB3 ASN A 534 8.266 -2.422 2.060 1.00 0.00 H new ATOM 0 HD21 ASN A 534 10.021 -3.556 -0.972 1.00 0.00 H new ATOM 0 HD22 ASN A 534 8.386 -3.128 -0.458 1.00 0.00 H new ATOM 960 N HIS A 535 8.090 0.944 2.633 1.00 0.00 N ATOM 961 CA HIS A 535 7.538 1.861 3.624 1.00 0.00 C ATOM 962 C HIS A 535 6.334 2.610 3.059 1.00 0.00 C ATOM 963 O HIS A 535 5.318 2.769 3.735 1.00 0.00 O ATOM 964 CB HIS A 535 8.605 2.856 4.079 1.00 0.00 C ATOM 965 CG HIS A 535 8.680 4.086 3.227 1.00 0.00 C ATOM 966 ND1 HIS A 535 9.404 4.145 2.055 1.00 0.00 N ATOM 967 CD2 HIS A 535 8.115 5.306 3.381 1.00 0.00 C ATOM 968 CE1 HIS A 535 9.283 5.350 1.526 1.00 0.00 C ATOM 969 NE2 HIS A 535 8.505 6.073 2.311 1.00 0.00 N ATOM 0 H HIS A 535 9.109 0.892 2.628 1.00 0.00 H new ATOM 0 HA HIS A 535 7.209 1.275 4.482 1.00 0.00 H new ATOM 0 HB2 HIS A 535 8.401 3.149 5.109 1.00 0.00 H new ATOM 0 HB3 HIS A 535 9.576 2.362 4.075 1.00 0.00 H new ATOM 0 HD2 HIS A 535 7.476 5.618 4.194 1.00 0.00 H new ATOM 0 HE1 HIS A 535 9.742 5.686 0.608 1.00 0.00 H new ATOM 0 HE2 HIS A 535 8.237 7.044 2.149 1.00 0.00 H new ATOM 977 N MET A 536 6.457 3.067 1.818 1.00 0.00 N ATOM 978 CA MET A 536 5.378 3.799 1.163 1.00 0.00 C ATOM 979 C MET A 536 4.191 2.883 0.884 1.00 0.00 C ATOM 980 O MET A 536 3.075 3.144 1.332 1.00 0.00 O ATOM 981 CB MET A 536 5.875 4.422 -0.143 1.00 0.00 C ATOM 982 CG MET A 536 4.855 5.330 -0.810 1.00 0.00 C ATOM 983 SD MET A 536 5.598 6.434 -2.026 1.00 0.00 S ATOM 984 CE MET A 536 6.557 7.512 -0.964 1.00 0.00 C ATOM 0 H MET A 536 7.292 2.944 1.245 1.00 0.00 H new ATOM 0 HA MET A 536 5.051 4.593 1.834 1.00 0.00 H new ATOM 0 HB2 MET A 536 6.781 4.993 0.058 1.00 0.00 H new ATOM 0 HB3 MET A 536 6.148 3.625 -0.835 1.00 0.00 H new ATOM 0 HG2 MET A 536 4.094 4.720 -1.296 1.00 0.00 H new ATOM 0 HG3 MET A 536 4.349 5.923 -0.048 1.00 0.00 H new ATOM 0 HE1 MET A 536 6.812 8.423 -1.505 1.00 0.00 H new ATOM 0 HE2 MET A 536 5.972 7.767 -0.081 1.00 0.00 H new ATOM 0 HE3 MET A 536 7.471 7.003 -0.659 1.00 0.00 H new ATOM 994 N MET A 537 4.440 1.810 0.140 1.00 0.00 N ATOM 995 CA MET A 537 3.391 0.855 -0.198 1.00 0.00 C ATOM 996 C MET A 537 2.608 0.444 1.046 1.00 0.00 C ATOM 997 O MET A 537 1.384 0.573 1.092 1.00 0.00 O ATOM 998 CB MET A 537 3.993 -0.382 -0.867 1.00 0.00 C ATOM 999 CG MET A 537 2.985 -1.194 -1.664 1.00 0.00 C ATOM 1000 SD MET A 537 3.763 -2.217 -2.929 1.00 0.00 S ATOM 1001 CE MET A 537 4.625 -3.414 -1.914 1.00 0.00 C ATOM 0 H MET A 537 5.358 1.580 -0.240 1.00 0.00 H new ATOM 0 HA MET A 537 2.706 1.338 -0.894 1.00 0.00 H new ATOM 0 HB2 MET A 537 4.801 -0.070 -1.529 1.00 0.00 H new ATOM 0 HB3 MET A 537 4.437 -1.019 -0.102 1.00 0.00 H new ATOM 0 HG2 MET A 537 2.419 -1.831 -0.985 1.00 0.00 H new ATOM 0 HG3 MET A 537 2.272 -0.518 -2.136 1.00 0.00 H new ATOM 0 HE1 MET A 537 5.156 -4.118 -2.554 1.00 0.00 H new ATOM 0 HE2 MET A 537 5.338 -2.899 -1.271 1.00 0.00 H new ATOM 0 HE3 MET A 537 3.906 -3.954 -1.299 1.00 0.00 H new ATOM 1011 N LEU A 538 3.321 -0.051 2.051 1.00 0.00 N ATOM 1012 CA LEU A 538 2.693 -0.481 3.296 1.00 0.00 C ATOM 1013 C LEU A 538 1.890 0.655 3.921 1.00 0.00 C ATOM 1014 O LEU A 538 0.705 0.502 4.220 1.00 0.00 O ATOM 1015 CB LEU A 538 3.754 -0.973 4.282 1.00 0.00 C ATOM 1016 CG LEU A 538 4.267 -2.397 4.060 1.00 0.00 C ATOM 1017 CD1 LEU A 538 5.610 -2.593 4.745 1.00 0.00 C ATOM 1018 CD2 LEU A 538 3.254 -3.413 4.567 1.00 0.00 C ATOM 0 H LEU A 538 4.334 -0.165 2.029 1.00 0.00 H new ATOM 0 HA LEU A 538 2.011 -1.300 3.066 1.00 0.00 H new ATOM 0 HB2 LEU A 538 4.604 -0.291 4.241 1.00 0.00 H new ATOM 0 HB3 LEU A 538 3.343 -0.909 5.289 1.00 0.00 H new ATOM 0 HG LEU A 538 4.403 -2.552 2.990 1.00 0.00 H new ATOM 0 HD11 LEU A 538 5.959 -3.612 4.576 1.00 0.00 H new ATOM 0 HD12 LEU A 538 6.334 -1.889 4.335 1.00 0.00 H new ATOM 0 HD13 LEU A 538 5.501 -2.419 5.816 1.00 0.00 H new ATOM 0 HD21 LEU A 538 3.635 -4.421 4.401 1.00 0.00 H new ATOM 0 HD22 LEU A 538 3.087 -3.259 5.633 1.00 0.00 H new ATOM 0 HD23 LEU A 538 2.313 -3.288 4.030 1.00 0.00 H new ATOM 1030 N LYS A 539 2.541 1.797 4.114 1.00 0.00 N ATOM 1031 CA LYS A 539 1.888 2.962 4.700 1.00 0.00 C ATOM 1032 C LYS A 539 0.499 3.164 4.104 1.00 0.00 C ATOM 1033 O LYS A 539 -0.480 3.334 4.832 1.00 0.00 O ATOM 1034 CB LYS A 539 2.738 4.215 4.477 1.00 0.00 C ATOM 1035 CG LYS A 539 2.017 5.507 4.821 1.00 0.00 C ATOM 1036 CD LYS A 539 2.975 6.686 4.861 1.00 0.00 C ATOM 1037 CE LYS A 539 2.361 7.879 5.576 1.00 0.00 C ATOM 1038 NZ LYS A 539 3.230 9.085 5.489 1.00 0.00 N ATOM 0 H LYS A 539 3.522 1.941 3.873 1.00 0.00 H new ATOM 0 HA LYS A 539 1.783 2.788 5.771 1.00 0.00 H new ATOM 0 HB2 LYS A 539 3.643 4.142 5.080 1.00 0.00 H new ATOM 0 HB3 LYS A 539 3.052 4.250 3.434 1.00 0.00 H new ATOM 0 HG2 LYS A 539 1.236 5.696 4.084 1.00 0.00 H new ATOM 0 HG3 LYS A 539 1.525 5.404 5.788 1.00 0.00 H new ATOM 0 HD2 LYS A 539 3.895 6.392 5.366 1.00 0.00 H new ATOM 0 HD3 LYS A 539 3.247 6.970 3.844 1.00 0.00 H new ATOM 0 HE2 LYS A 539 1.387 8.101 5.141 1.00 0.00 H new ATOM 0 HE3 LYS A 539 2.192 7.628 6.623 1.00 0.00 H new ATOM 0 HZ1 LYS A 539 2.733 9.901 5.899 1.00 0.00 H new ATOM 0 HZ2 LYS A 539 4.111 8.917 6.015 1.00 0.00 H new ATOM 0 HZ3 LYS A 539 3.454 9.281 4.492 1.00 0.00 H new ATOM 1052 N ILE A 540 0.420 3.142 2.778 1.00 0.00 N ATOM 1053 CA ILE A 540 -0.850 3.321 2.086 1.00 0.00 C ATOM 1054 C ILE A 540 -1.781 2.139 2.332 1.00 0.00 C ATOM 1055 O ILE A 540 -2.884 2.303 2.853 1.00 0.00 O ATOM 1056 CB ILE A 540 -0.645 3.490 0.568 1.00 0.00 C ATOM 1057 CG1 ILE A 540 0.177 4.748 0.280 1.00 0.00 C ATOM 1058 CG2 ILE A 540 -1.988 3.555 -0.143 1.00 0.00 C ATOM 1059 CD1 ILE A 540 0.672 4.833 -1.147 1.00 0.00 C ATOM 0 H ILE A 540 1.220 3.002 2.161 1.00 0.00 H new ATOM 0 HA ILE A 540 -1.303 4.228 2.487 1.00 0.00 H new ATOM 0 HB ILE A 540 -0.097 2.626 0.191 1.00 0.00 H new ATOM 0 HG12 ILE A 540 -0.430 5.627 0.498 1.00 0.00 H new ATOM 0 HG13 ILE A 540 1.032 4.776 0.955 1.00 0.00 H new ATOM 0 HG21 ILE A 540 -1.827 3.674 -1.214 1.00 0.00 H new ATOM 0 HG22 ILE A 540 -2.542 2.634 0.040 1.00 0.00 H new ATOM 0 HG23 ILE A 540 -2.559 4.403 0.235 1.00 0.00 H new ATOM 0 HD11 ILE A 540 1.247 5.750 -1.279 1.00 0.00 H new ATOM 0 HD12 ILE A 540 1.306 3.973 -1.364 1.00 0.00 H new ATOM 0 HD13 ILE A 540 -0.179 4.837 -1.828 1.00 0.00 H new ATOM 1071 N ALA A 541 -1.329 0.947 1.957 1.00 0.00 N ATOM 1072 CA ALA A 541 -2.120 -0.263 2.141 1.00 0.00 C ATOM 1073 C ALA A 541 -2.747 -0.303 3.530 1.00 0.00 C ATOM 1074 O ALA A 541 -3.864 -0.791 3.702 1.00 0.00 O ATOM 1075 CB ALA A 541 -1.258 -1.496 1.914 1.00 0.00 C ATOM 0 H ALA A 541 -0.418 0.794 1.524 1.00 0.00 H new ATOM 0 HA ALA A 541 -2.926 -0.256 1.407 1.00 0.00 H new ATOM 0 HB1 ALA A 541 -1.861 -2.393 2.055 1.00 0.00 H new ATOM 0 HB2 ALA A 541 -0.862 -1.481 0.899 1.00 0.00 H new ATOM 0 HB3 ALA A 541 -0.432 -1.499 2.626 1.00 0.00 H new ATOM 1081 N GLU A 542 -2.022 0.213 4.517 1.00 0.00 N ATOM 1082 CA GLU A 542 -2.509 0.235 5.891 1.00 0.00 C ATOM 1083 C GLU A 542 -3.382 1.461 6.140 1.00 0.00 C ATOM 1084 O GLU A 542 -4.357 1.399 6.889 1.00 0.00 O ATOM 1085 CB GLU A 542 -1.334 0.224 6.872 1.00 0.00 C ATOM 1086 CG GLU A 542 -0.366 -0.926 6.650 1.00 0.00 C ATOM 1087 CD GLU A 542 0.968 -0.705 7.336 1.00 0.00 C ATOM 1088 OE1 GLU A 542 1.626 0.314 7.042 1.00 0.00 O ATOM 1089 OE2 GLU A 542 1.354 -1.553 8.168 1.00 0.00 O ATOM 0 H GLU A 542 -1.096 0.621 4.391 1.00 0.00 H new ATOM 0 HA GLU A 542 -3.114 -0.658 6.049 1.00 0.00 H new ATOM 0 HB2 GLU A 542 -0.792 1.166 6.787 1.00 0.00 H new ATOM 0 HB3 GLU A 542 -1.722 0.170 7.889 1.00 0.00 H new ATOM 0 HG2 GLU A 542 -0.813 -1.849 7.020 1.00 0.00 H new ATOM 0 HG3 GLU A 542 -0.203 -1.058 5.580 1.00 0.00 H new ATOM 1096 N GLU A 543 -3.024 2.574 5.507 1.00 0.00 N ATOM 1097 CA GLU A 543 -3.775 3.814 5.661 1.00 0.00 C ATOM 1098 C GLU A 543 -5.203 3.653 5.149 1.00 0.00 C ATOM 1099 O GLU A 543 -6.163 4.023 5.827 1.00 0.00 O ATOM 1100 CB GLU A 543 -3.079 4.953 4.913 1.00 0.00 C ATOM 1101 CG GLU A 543 -2.049 5.692 5.751 1.00 0.00 C ATOM 1102 CD GLU A 543 -2.662 6.795 6.591 1.00 0.00 C ATOM 1103 OE1 GLU A 543 -3.280 6.475 7.629 1.00 0.00 O ATOM 1104 OE2 GLU A 543 -2.525 7.977 6.212 1.00 0.00 O ATOM 0 H GLU A 543 -2.220 2.642 4.884 1.00 0.00 H new ATOM 0 HA GLU A 543 -3.814 4.056 6.723 1.00 0.00 H new ATOM 0 HB2 GLU A 543 -2.591 4.549 4.026 1.00 0.00 H new ATOM 0 HB3 GLU A 543 -3.831 5.663 4.568 1.00 0.00 H new ATOM 0 HG2 GLU A 543 -1.541 4.983 6.404 1.00 0.00 H new ATOM 0 HG3 GLU A 543 -1.291 6.119 5.094 1.00 0.00 H new ATOM 1111 N LEU A 544 -5.336 3.100 3.949 1.00 0.00 N ATOM 1112 CA LEU A 544 -6.647 2.890 3.344 1.00 0.00 C ATOM 1113 C LEU A 544 -7.349 4.220 3.089 1.00 0.00 C ATOM 1114 O LEU A 544 -8.496 4.430 3.482 1.00 0.00 O ATOM 1115 CB LEU A 544 -7.512 2.009 4.248 1.00 0.00 C ATOM 1116 CG LEU A 544 -6.962 0.616 4.554 1.00 0.00 C ATOM 1117 CD1 LEU A 544 -7.994 -0.213 5.304 1.00 0.00 C ATOM 1118 CD2 LEU A 544 -6.543 -0.085 3.270 1.00 0.00 C ATOM 0 H LEU A 544 -4.552 2.789 3.375 1.00 0.00 H new ATOM 0 HA LEU A 544 -6.502 2.388 2.388 1.00 0.00 H new ATOM 0 HB2 LEU A 544 -7.666 2.532 5.192 1.00 0.00 H new ATOM 0 HB3 LEU A 544 -8.491 1.897 3.783 1.00 0.00 H new ATOM 0 HG LEU A 544 -6.083 0.725 5.189 1.00 0.00 H new ATOM 0 HD11 LEU A 544 -7.585 -1.201 5.513 1.00 0.00 H new ATOM 0 HD12 LEU A 544 -8.246 0.281 6.242 1.00 0.00 H new ATOM 0 HD13 LEU A 544 -8.892 -0.314 4.695 1.00 0.00 H new ATOM 0 HD21 LEU A 544 -6.154 -1.075 3.506 1.00 0.00 H new ATOM 0 HD22 LEU A 544 -7.405 -0.182 2.610 1.00 0.00 H new ATOM 0 HD23 LEU A 544 -5.769 0.499 2.772 1.00 0.00 H new ATOM 1130 N PRO A 545 -6.645 5.139 2.412 1.00 0.00 N ATOM 1131 CA PRO A 545 -7.181 6.464 2.086 1.00 0.00 C ATOM 1132 C PRO A 545 -8.289 6.400 1.040 1.00 0.00 C ATOM 1133 O PRO A 545 -8.028 6.467 -0.162 1.00 0.00 O ATOM 1134 CB PRO A 545 -5.966 7.212 1.532 1.00 0.00 C ATOM 1135 CG PRO A 545 -5.068 6.143 1.012 1.00 0.00 C ATOM 1136 CD PRO A 545 -5.272 4.957 1.912 1.00 0.00 C ATOM 0 HA PRO A 545 -7.636 6.944 2.953 1.00 0.00 H new ATOM 0 HB2 PRO A 545 -6.254 7.906 0.742 1.00 0.00 H new ATOM 0 HB3 PRO A 545 -5.475 7.799 2.308 1.00 0.00 H new ATOM 0 HG2 PRO A 545 -5.313 5.896 -0.021 1.00 0.00 H new ATOM 0 HG3 PRO A 545 -4.027 6.467 1.024 1.00 0.00 H new ATOM 0 HD2 PRO A 545 -5.163 4.018 1.370 1.00 0.00 H new ATOM 0 HD3 PRO A 545 -4.547 4.941 2.726 1.00 0.00 H new ATOM 1144 N LYS A 546 -9.527 6.268 1.504 1.00 0.00 N ATOM 1145 CA LYS A 546 -10.676 6.196 0.609 1.00 0.00 C ATOM 1146 C LYS A 546 -10.546 7.206 -0.527 1.00 0.00 C ATOM 1147 O LYS A 546 -11.051 6.985 -1.626 1.00 0.00 O ATOM 1148 CB LYS A 546 -11.970 6.450 1.386 1.00 0.00 C ATOM 1149 CG LYS A 546 -12.175 7.906 1.768 1.00 0.00 C ATOM 1150 CD LYS A 546 -11.574 8.215 3.129 1.00 0.00 C ATOM 1151 CE LYS A 546 -11.121 9.664 3.222 1.00 0.00 C ATOM 1152 NZ LYS A 546 -12.273 10.600 3.338 1.00 0.00 N ATOM 0 H LYS A 546 -9.760 6.209 2.495 1.00 0.00 H new ATOM 0 HA LYS A 546 -10.708 5.195 0.179 1.00 0.00 H new ATOM 0 HB2 LYS A 546 -12.816 6.119 0.784 1.00 0.00 H new ATOM 0 HB3 LYS A 546 -11.965 5.843 2.291 1.00 0.00 H new ATOM 0 HG2 LYS A 546 -11.720 8.548 1.014 1.00 0.00 H new ATOM 0 HG3 LYS A 546 -13.241 8.133 1.780 1.00 0.00 H new ATOM 0 HD2 LYS A 546 -12.310 8.012 3.907 1.00 0.00 H new ATOM 0 HD3 LYS A 546 -10.726 7.555 3.312 1.00 0.00 H new ATOM 0 HE2 LYS A 546 -10.467 9.785 4.085 1.00 0.00 H new ATOM 0 HE3 LYS A 546 -10.534 9.918 2.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 546 -12.099 11.440 2.750 1.00 0.00 H new ATOM 0 HZ2 LYS A 546 -13.140 10.125 3.015 1.00 0.00 H new ATOM 0 HZ3 LYS A 546 -12.386 10.890 4.330 1.00 0.00 H new ATOM 1166 N GLU A 547 -9.864 8.314 -0.252 1.00 0.00 N ATOM 1167 CA GLU A 547 -9.668 9.357 -1.252 1.00 0.00 C ATOM 1168 C GLU A 547 -8.305 9.216 -1.925 1.00 0.00 C ATOM 1169 O GLU A 547 -7.361 8.663 -1.361 1.00 0.00 O ATOM 1170 CB GLU A 547 -9.791 10.740 -0.610 1.00 0.00 C ATOM 1171 CG GLU A 547 -11.225 11.153 -0.323 1.00 0.00 C ATOM 1172 CD GLU A 547 -11.318 12.502 0.362 1.00 0.00 C ATOM 1173 OE1 GLU A 547 -11.177 12.549 1.602 1.00 0.00 O ATOM 1174 OE2 GLU A 547 -11.530 13.511 -0.342 1.00 0.00 O ATOM 0 H GLU A 547 -9.439 8.512 0.654 1.00 0.00 H new ATOM 0 HA GLU A 547 -10.442 9.247 -2.011 1.00 0.00 H new ATOM 0 HB2 GLU A 547 -9.226 10.750 0.322 1.00 0.00 H new ATOM 0 HB3 GLU A 547 -9.334 11.479 -1.268 1.00 0.00 H new ATOM 0 HG2 GLU A 547 -11.784 11.186 -1.258 1.00 0.00 H new ATOM 0 HG3 GLU A 547 -11.698 10.398 0.305 1.00 0.00 H new ATOM 1181 N PRO A 548 -8.200 9.727 -3.160 1.00 0.00 N ATOM 1182 CA PRO A 548 -6.958 9.671 -3.937 1.00 0.00 C ATOM 1183 C PRO A 548 -5.874 10.577 -3.364 1.00 0.00 C ATOM 1184 O PRO A 548 -4.691 10.402 -3.652 1.00 0.00 O ATOM 1185 CB PRO A 548 -7.385 10.159 -5.324 1.00 0.00 C ATOM 1186 CG PRO A 548 -8.582 11.010 -5.074 1.00 0.00 C ATOM 1187 CD PRO A 548 -9.285 10.400 -3.894 1.00 0.00 C ATOM 0 HA PRO A 548 -6.522 8.672 -3.937 1.00 0.00 H new ATOM 0 HB2 PRO A 548 -6.589 10.727 -5.806 1.00 0.00 H new ATOM 0 HB3 PRO A 548 -7.624 9.323 -5.982 1.00 0.00 H new ATOM 0 HG2 PRO A 548 -8.292 12.040 -4.866 1.00 0.00 H new ATOM 0 HG3 PRO A 548 -9.234 11.033 -5.947 1.00 0.00 H new ATOM 0 HD2 PRO A 548 -9.774 11.158 -3.282 1.00 0.00 H new ATOM 0 HD3 PRO A 548 -10.056 9.696 -4.206 1.00 0.00 H new ATOM 1195 N GLN A 549 -6.287 11.545 -2.552 1.00 0.00 N ATOM 1196 CA GLN A 549 -5.349 12.478 -1.939 1.00 0.00 C ATOM 1197 C GLN A 549 -4.452 11.767 -0.932 1.00 0.00 C ATOM 1198 O GLN A 549 -3.237 11.960 -0.922 1.00 0.00 O ATOM 1199 CB GLN A 549 -6.106 13.616 -1.251 1.00 0.00 C ATOM 1200 CG GLN A 549 -5.250 14.843 -0.985 1.00 0.00 C ATOM 1201 CD GLN A 549 -5.829 15.737 0.094 1.00 0.00 C ATOM 1202 OE1 GLN A 549 -6.584 16.666 -0.192 1.00 0.00 O ATOM 1203 NE2 GLN A 549 -5.477 15.459 1.344 1.00 0.00 N ATOM 0 H GLN A 549 -7.264 11.703 -2.304 1.00 0.00 H new ATOM 0 HA GLN A 549 -4.721 12.892 -2.727 1.00 0.00 H new ATOM 0 HB2 GLN A 549 -6.955 13.903 -1.871 1.00 0.00 H new ATOM 0 HB3 GLN A 549 -6.510 13.253 -0.306 1.00 0.00 H new ATOM 0 HG2 GLN A 549 -4.249 14.526 -0.691 1.00 0.00 H new ATOM 0 HG3 GLN A 549 -5.145 15.415 -1.907 1.00 0.00 H new ATOM 0 HE21 GLN A 549 -4.848 14.679 1.535 1.00 0.00 H new ATOM 0 HE22 GLN A 549 -5.835 16.026 2.113 1.00 0.00 H new ATOM 1212 N GLY A 550 -5.060 10.941 -0.085 1.00 0.00 N ATOM 1213 CA GLY A 550 -4.301 10.214 0.915 1.00 0.00 C ATOM 1214 C GLY A 550 -3.139 9.447 0.316 1.00 0.00 C ATOM 1215 O GLY A 550 -2.140 9.193 0.991 1.00 0.00 O ATOM 0 H GLY A 550 -6.064 10.763 -0.074 1.00 0.00 H new ATOM 0 HA2 GLY A 550 -3.924 10.914 1.661 1.00 0.00 H new ATOM 0 HA3 GLY A 550 -4.962 9.520 1.434 1.00 0.00 H new ATOM 1219 N ILE A 551 -3.268 9.076 -0.953 1.00 0.00 N ATOM 1220 CA ILE A 551 -2.220 8.333 -1.643 1.00 0.00 C ATOM 1221 C ILE A 551 -1.115 9.265 -2.129 1.00 0.00 C ATOM 1222 O ILE A 551 0.012 8.833 -2.373 1.00 0.00 O ATOM 1223 CB ILE A 551 -2.782 7.551 -2.844 1.00 0.00 C ATOM 1224 CG1 ILE A 551 -3.911 6.621 -2.392 1.00 0.00 C ATOM 1225 CG2 ILE A 551 -1.676 6.758 -3.524 1.00 0.00 C ATOM 1226 CD1 ILE A 551 -5.282 7.254 -2.470 1.00 0.00 C ATOM 0 H ILE A 551 -4.088 9.278 -1.525 1.00 0.00 H new ATOM 0 HA ILE A 551 -1.806 7.627 -0.922 1.00 0.00 H new ATOM 0 HB ILE A 551 -3.188 8.262 -3.564 1.00 0.00 H new ATOM 0 HG12 ILE A 551 -3.899 5.722 -3.008 1.00 0.00 H new ATOM 0 HG13 ILE A 551 -3.723 6.306 -1.366 1.00 0.00 H new ATOM 0 HG21 ILE A 551 -2.089 6.210 -4.371 1.00 0.00 H new ATOM 0 HG22 ILE A 551 -0.902 7.441 -3.875 1.00 0.00 H new ATOM 0 HG23 ILE A 551 -1.243 6.054 -2.813 1.00 0.00 H new ATOM 0 HD11 ILE A 551 -6.033 6.538 -2.135 1.00 0.00 H new ATOM 0 HD12 ILE A 551 -5.312 8.137 -1.832 1.00 0.00 H new ATOM 0 HD13 ILE A 551 -5.491 7.544 -3.500 1.00 0.00 H new ATOM 1238 N ILE A 552 -1.445 10.545 -2.266 1.00 0.00 N ATOM 1239 CA ILE A 552 -0.479 11.538 -2.720 1.00 0.00 C ATOM 1240 C ILE A 552 0.219 12.205 -1.540 1.00 0.00 C ATOM 1241 O ILE A 552 1.403 12.533 -1.611 1.00 0.00 O ATOM 1242 CB ILE A 552 -1.151 12.621 -3.584 1.00 0.00 C ATOM 1243 CG1 ILE A 552 -1.920 11.978 -4.740 1.00 0.00 C ATOM 1244 CG2 ILE A 552 -0.110 13.597 -4.112 1.00 0.00 C ATOM 1245 CD1 ILE A 552 -2.702 12.971 -5.572 1.00 0.00 C ATOM 0 H ILE A 552 -2.373 10.919 -2.069 1.00 0.00 H new ATOM 0 HA ILE A 552 0.259 11.009 -3.323 1.00 0.00 H new ATOM 0 HB ILE A 552 -1.858 13.173 -2.965 1.00 0.00 H new ATOM 0 HG12 ILE A 552 -1.217 11.450 -5.384 1.00 0.00 H new ATOM 0 HG13 ILE A 552 -2.606 11.232 -4.339 1.00 0.00 H new ATOM 0 HG21 ILE A 552 -0.600 14.357 -4.721 1.00 0.00 H new ATOM 0 HG22 ILE A 552 0.398 14.075 -3.275 1.00 0.00 H new ATOM 0 HG23 ILE A 552 0.618 13.059 -4.719 1.00 0.00 H new ATOM 0 HD11 ILE A 552 -3.222 12.445 -6.373 1.00 0.00 H new ATOM 0 HD12 ILE A 552 -3.429 13.481 -4.941 1.00 0.00 H new ATOM 0 HD13 ILE A 552 -2.019 13.703 -6.003 1.00 0.00 H new ATOM 1257 N ALA A 553 -0.522 12.401 -0.454 1.00 0.00 N ATOM 1258 CA ALA A 553 0.027 13.026 0.743 1.00 0.00 C ATOM 1259 C ALA A 553 0.991 12.086 1.459 1.00 0.00 C ATOM 1260 O ALA A 553 2.008 12.521 2.002 1.00 0.00 O ATOM 1261 CB ALA A 553 -1.095 13.448 1.680 1.00 0.00 C ATOM 0 H ALA A 553 -1.504 12.136 -0.379 1.00 0.00 H new ATOM 0 HA ALA A 553 0.583 13.912 0.438 1.00 0.00 H new ATOM 0 HB1 ALA A 553 -0.670 13.913 2.570 1.00 0.00 H new ATOM 0 HB2 ALA A 553 -1.744 14.161 1.172 1.00 0.00 H new ATOM 0 HB3 ALA A 553 -1.675 12.572 1.970 1.00 0.00 H new ATOM 1267 N CYS A 554 0.665 10.798 1.458 1.00 0.00 N ATOM 1268 CA CYS A 554 1.503 9.797 2.109 1.00 0.00 C ATOM 1269 C CYS A 554 2.958 9.939 1.675 1.00 0.00 C ATOM 1270 O CYS A 554 3.876 9.620 2.431 1.00 0.00 O ATOM 1271 CB CYS A 554 0.996 8.391 1.787 1.00 0.00 C ATOM 1272 SG CYS A 554 1.120 7.944 0.039 1.00 0.00 S ATOM 0 H CYS A 554 -0.173 10.423 1.014 1.00 0.00 H new ATOM 0 HA CYS A 554 1.448 9.957 3.186 1.00 0.00 H new ATOM 0 HB2 CYS A 554 1.561 7.669 2.377 1.00 0.00 H new ATOM 0 HB3 CYS A 554 -0.046 8.312 2.098 1.00 0.00 H new ATOM 0 HG CYS A 554 0.820 8.974 -0.695 1.00 0.00 H new ATOM 1278 N CYS A 555 3.161 10.418 0.452 1.00 0.00 N ATOM 1279 CA CYS A 555 4.505 10.600 -0.085 1.00 0.00 C ATOM 1280 C CYS A 555 4.908 12.070 -0.053 1.00 0.00 C ATOM 1281 O CYS A 555 4.102 12.952 -0.343 1.00 0.00 O ATOM 1282 CB CYS A 555 4.580 10.069 -1.517 1.00 0.00 C ATOM 1283 SG CYS A 555 3.085 10.358 -2.491 1.00 0.00 S ATOM 0 H CYS A 555 2.412 10.687 -0.186 1.00 0.00 H new ATOM 0 HA CYS A 555 5.199 10.038 0.540 1.00 0.00 H new ATOM 0 HB2 CYS A 555 5.426 10.536 -2.022 1.00 0.00 H new ATOM 0 HB3 CYS A 555 4.779 8.998 -1.486 1.00 0.00 H new ATOM 0 HG CYS A 555 2.447 11.384 -2.012 1.00 0.00 H new ATOM 1289 N ASN A 556 6.163 12.326 0.305 1.00 0.00 N ATOM 1290 CA ASN A 556 6.673 13.691 0.377 1.00 0.00 C ATOM 1291 C ASN A 556 8.193 13.710 0.247 1.00 0.00 C ATOM 1292 O ASN A 556 8.924 13.316 1.157 1.00 0.00 O ATOM 1293 CB ASN A 556 6.254 14.345 1.695 1.00 0.00 C ATOM 1294 CG ASN A 556 6.218 15.858 1.604 1.00 0.00 C ATOM 1295 OD1 ASN A 556 7.259 16.513 1.546 1.00 0.00 O ATOM 1296 ND2 ASN A 556 5.015 16.421 1.591 1.00 0.00 N ATOM 0 H ASN A 556 6.844 11.607 0.549 1.00 0.00 H new ATOM 0 HA ASN A 556 6.248 14.256 -0.452 1.00 0.00 H new ATOM 0 HB2 ASN A 556 5.269 13.978 1.983 1.00 0.00 H new ATOM 0 HB3 ASN A 556 6.947 14.047 2.482 1.00 0.00 H new ATOM 0 HD21 ASN A 556 4.927 17.435 1.531 1.00 0.00 H new ATOM 0 HD22 ASN A 556 4.179 15.839 1.641 1.00 0.00 H new ATOM 1303 N PRO A 557 8.682 14.181 -0.909 1.00 0.00 N ATOM 1304 CA PRO A 557 7.822 14.653 -1.999 1.00 0.00 C ATOM 1305 C PRO A 557 7.061 13.515 -2.670 1.00 0.00 C ATOM 1306 O PRO A 557 7.188 12.354 -2.281 1.00 0.00 O ATOM 1307 CB PRO A 557 8.810 15.288 -2.981 1.00 0.00 C ATOM 1308 CG PRO A 557 10.104 14.600 -2.714 1.00 0.00 C ATOM 1309 CD PRO A 557 10.113 14.288 -1.243 1.00 0.00 C ATOM 0 HA PRO A 557 7.053 15.339 -1.644 1.00 0.00 H new ATOM 0 HB2 PRO A 557 8.490 15.144 -4.013 1.00 0.00 H new ATOM 0 HB3 PRO A 557 8.893 16.363 -2.820 1.00 0.00 H new ATOM 0 HG2 PRO A 557 10.191 13.689 -3.306 1.00 0.00 H new ATOM 0 HG3 PRO A 557 10.947 15.237 -2.983 1.00 0.00 H new ATOM 0 HD2 PRO A 557 10.645 13.361 -1.032 1.00 0.00 H new ATOM 0 HD3 PRO A 557 10.602 15.074 -0.668 1.00 0.00 H new ATOM 1317 N VAL A 558 6.269 13.855 -3.682 1.00 0.00 N ATOM 1318 CA VAL A 558 5.488 12.862 -4.409 1.00 0.00 C ATOM 1319 C VAL A 558 6.178 12.464 -5.709 1.00 0.00 C ATOM 1320 O VAL A 558 6.643 13.306 -6.477 1.00 0.00 O ATOM 1321 CB VAL A 558 4.075 13.384 -4.730 1.00 0.00 C ATOM 1322 CG1 VAL A 558 3.273 12.331 -5.480 1.00 0.00 C ATOM 1323 CG2 VAL A 558 3.359 13.802 -3.454 1.00 0.00 C ATOM 0 H VAL A 558 6.152 14.811 -4.017 1.00 0.00 H new ATOM 0 HA VAL A 558 5.406 11.989 -3.762 1.00 0.00 H new ATOM 0 HB VAL A 558 4.168 14.260 -5.372 1.00 0.00 H new ATOM 0 HG11 VAL A 558 2.278 12.718 -5.698 1.00 0.00 H new ATOM 0 HG12 VAL A 558 3.779 12.085 -6.414 1.00 0.00 H new ATOM 0 HG13 VAL A 558 3.187 11.434 -4.867 1.00 0.00 H new ATOM 0 HG21 VAL A 558 2.362 14.168 -3.699 1.00 0.00 H new ATOM 0 HG22 VAL A 558 3.276 12.945 -2.786 1.00 0.00 H new ATOM 0 HG23 VAL A 558 3.925 14.593 -2.962 1.00 0.00 H new ATOM 1333 N PRO A 559 6.247 11.149 -5.964 1.00 0.00 N ATOM 1334 CA PRO A 559 6.878 10.608 -7.171 1.00 0.00 C ATOM 1335 C PRO A 559 6.072 10.909 -8.430 1.00 0.00 C ATOM 1336 O PRO A 559 4.864 11.142 -8.383 1.00 0.00 O ATOM 1337 CB PRO A 559 6.915 9.101 -6.908 1.00 0.00 C ATOM 1338 CG PRO A 559 5.801 8.856 -5.950 1.00 0.00 C ATOM 1339 CD PRO A 559 5.714 10.088 -5.092 1.00 0.00 C ATOM 0 HA PRO A 559 7.860 11.047 -7.349 1.00 0.00 H new ATOM 0 HB2 PRO A 559 6.777 8.535 -7.829 1.00 0.00 H new ATOM 0 HB3 PRO A 559 7.873 8.796 -6.487 1.00 0.00 H new ATOM 0 HG2 PRO A 559 4.864 8.681 -6.478 1.00 0.00 H new ATOM 0 HG3 PRO A 559 5.995 7.971 -5.344 1.00 0.00 H new ATOM 0 HD2 PRO A 559 4.688 10.295 -4.789 1.00 0.00 H new ATOM 0 HD3 PRO A 559 6.301 9.985 -4.180 1.00 0.00 H new ATOM 1347 N PRO A 560 6.754 10.904 -9.586 1.00 0.00 N ATOM 1348 CA PRO A 560 6.121 11.174 -10.880 1.00 0.00 C ATOM 1349 C PRO A 560 5.186 10.049 -11.313 1.00 0.00 C ATOM 1350 O PRO A 560 4.529 10.140 -12.351 1.00 0.00 O ATOM 1351 CB PRO A 560 7.308 11.282 -11.840 1.00 0.00 C ATOM 1352 CG PRO A 560 8.387 10.478 -11.201 1.00 0.00 C ATOM 1353 CD PRO A 560 8.196 10.634 -9.717 1.00 0.00 C ATOM 0 HA PRO A 560 5.497 12.067 -10.850 1.00 0.00 H new ATOM 0 HB2 PRO A 560 7.056 10.893 -12.826 1.00 0.00 H new ATOM 0 HB3 PRO A 560 7.615 12.319 -11.975 1.00 0.00 H new ATOM 0 HG2 PRO A 560 8.320 9.431 -11.495 1.00 0.00 H new ATOM 0 HG3 PRO A 560 9.371 10.832 -11.507 1.00 0.00 H new ATOM 0 HD2 PRO A 560 8.487 9.733 -9.177 1.00 0.00 H new ATOM 0 HD3 PRO A 560 8.796 11.452 -9.318 1.00 0.00 H new ATOM 1361 N LEU A 561 5.130 8.991 -10.512 1.00 0.00 N ATOM 1362 CA LEU A 561 4.275 7.848 -10.813 1.00 0.00 C ATOM 1363 C LEU A 561 2.971 7.921 -10.023 1.00 0.00 C ATOM 1364 O LEU A 561 1.906 8.174 -10.586 1.00 0.00 O ATOM 1365 CB LEU A 561 5.005 6.542 -10.495 1.00 0.00 C ATOM 1366 CG LEU A 561 6.276 6.270 -11.300 1.00 0.00 C ATOM 1367 CD1 LEU A 561 7.004 5.053 -10.753 1.00 0.00 C ATOM 1368 CD2 LEU A 561 5.943 6.078 -12.773 1.00 0.00 C ATOM 0 H LEU A 561 5.666 8.901 -9.649 1.00 0.00 H new ATOM 0 HA LEU A 561 4.036 7.874 -11.876 1.00 0.00 H new ATOM 0 HB2 LEU A 561 5.263 6.542 -9.436 1.00 0.00 H new ATOM 0 HB3 LEU A 561 4.314 5.715 -10.655 1.00 0.00 H new ATOM 0 HG LEU A 561 6.935 7.134 -11.206 1.00 0.00 H new ATOM 0 HD11 LEU A 561 7.906 4.875 -11.339 1.00 0.00 H new ATOM 0 HD12 LEU A 561 7.276 5.229 -9.712 1.00 0.00 H new ATOM 0 HD13 LEU A 561 6.353 4.181 -10.815 1.00 0.00 H new ATOM 0 HD21 LEU A 561 6.859 5.885 -13.331 1.00 0.00 H new ATOM 0 HD22 LEU A 561 5.265 5.232 -12.885 1.00 0.00 H new ATOM 0 HD23 LEU A 561 5.466 6.979 -13.159 1.00 0.00 H new ATOM 1380 N VAL A 562 3.064 7.700 -8.716 1.00 0.00 N ATOM 1381 CA VAL A 562 1.894 7.743 -7.848 1.00 0.00 C ATOM 1382 C VAL A 562 0.936 8.850 -8.273 1.00 0.00 C ATOM 1383 O VAL A 562 -0.283 8.697 -8.188 1.00 0.00 O ATOM 1384 CB VAL A 562 2.293 7.962 -6.377 1.00 0.00 C ATOM 1385 CG1 VAL A 562 1.058 8.162 -5.512 1.00 0.00 C ATOM 1386 CG2 VAL A 562 3.124 6.792 -5.872 1.00 0.00 C ATOM 0 H VAL A 562 3.938 7.489 -8.235 1.00 0.00 H new ATOM 0 HA VAL A 562 1.395 6.778 -7.941 1.00 0.00 H new ATOM 0 HB VAL A 562 2.901 8.865 -6.314 1.00 0.00 H new ATOM 0 HG11 VAL A 562 1.360 8.315 -4.476 1.00 0.00 H new ATOM 0 HG12 VAL A 562 0.506 9.035 -5.862 1.00 0.00 H new ATOM 0 HG13 VAL A 562 0.421 7.280 -5.577 1.00 0.00 H new ATOM 0 HG21 VAL A 562 3.398 6.963 -4.831 1.00 0.00 H new ATOM 0 HG22 VAL A 562 2.543 5.873 -5.948 1.00 0.00 H new ATOM 0 HG23 VAL A 562 4.028 6.701 -6.474 1.00 0.00 H new ATOM 1396 N ARG A 563 1.495 9.966 -8.731 1.00 0.00 N ATOM 1397 CA ARG A 563 0.690 11.100 -9.169 1.00 0.00 C ATOM 1398 C ARG A 563 0.048 10.820 -10.525 1.00 0.00 C ATOM 1399 O ARG A 563 -1.113 11.158 -10.754 1.00 0.00 O ATOM 1400 CB ARG A 563 1.551 12.362 -9.251 1.00 0.00 C ATOM 1401 CG ARG A 563 0.749 13.633 -9.478 1.00 0.00 C ATOM 1402 CD ARG A 563 0.046 14.082 -8.207 1.00 0.00 C ATOM 1403 NE ARG A 563 -0.674 15.339 -8.394 1.00 0.00 N ATOM 1404 CZ ARG A 563 -0.089 16.532 -8.365 1.00 0.00 C ATOM 1405 NH1 ARG A 563 1.217 16.629 -8.157 1.00 0.00 N ATOM 1406 NH2 ARG A 563 -0.812 17.630 -8.544 1.00 0.00 N ATOM 0 H ARG A 563 2.502 10.109 -8.808 1.00 0.00 H new ATOM 0 HA ARG A 563 -0.102 11.256 -8.437 1.00 0.00 H new ATOM 0 HB2 ARG A 563 2.122 12.463 -8.328 1.00 0.00 H new ATOM 0 HB3 ARG A 563 2.272 12.248 -10.061 1.00 0.00 H new ATOM 0 HG2 ARG A 563 1.411 14.425 -9.828 1.00 0.00 H new ATOM 0 HG3 ARG A 563 0.012 13.464 -10.263 1.00 0.00 H new ATOM 0 HD2 ARG A 563 -0.652 13.309 -7.886 1.00 0.00 H new ATOM 0 HD3 ARG A 563 0.780 14.200 -7.409 1.00 0.00 H new ATOM 0 HE ARG A 563 -1.680 15.299 -8.556 1.00 0.00 H new ATOM 0 HH11 ARG A 563 1.775 15.787 -8.019 1.00 0.00 H new ATOM 0 HH12 ARG A 563 1.663 17.546 -8.135 1.00 0.00 H new ATOM 0 HH21 ARG A 563 -1.817 17.559 -8.704 1.00 0.00 H new ATOM 0 HH22 ARG A 563 -0.363 18.546 -8.522 1.00 0.00 H new ATOM 1420 N GLN A 564 0.813 10.201 -11.419 1.00 0.00 N ATOM 1421 CA GLN A 564 0.318 9.877 -12.752 1.00 0.00 C ATOM 1422 C GLN A 564 -0.731 8.772 -12.690 1.00 0.00 C ATOM 1423 O GLN A 564 -1.840 8.928 -13.199 1.00 0.00 O ATOM 1424 CB GLN A 564 1.474 9.449 -13.658 1.00 0.00 C ATOM 1425 CG GLN A 564 2.146 10.608 -14.376 1.00 0.00 C ATOM 1426 CD GLN A 564 2.866 10.175 -15.638 1.00 0.00 C ATOM 1427 OE1 GLN A 564 2.550 10.635 -16.736 1.00 0.00 O ATOM 1428 NE2 GLN A 564 3.839 9.284 -15.488 1.00 0.00 N ATOM 0 H GLN A 564 1.776 9.914 -11.245 1.00 0.00 H new ATOM 0 HA GLN A 564 -0.147 10.771 -13.166 1.00 0.00 H new ATOM 0 HB2 GLN A 564 2.218 8.923 -13.060 1.00 0.00 H new ATOM 0 HB3 GLN A 564 1.101 8.741 -14.398 1.00 0.00 H new ATOM 0 HG2 GLN A 564 1.396 11.357 -14.629 1.00 0.00 H new ATOM 0 HG3 GLN A 564 2.858 11.084 -13.702 1.00 0.00 H new ATOM 0 HE21 GLN A 564 4.067 8.930 -14.559 1.00 0.00 H new ATOM 0 HE22 GLN A 564 4.358 8.954 -16.302 1.00 0.00 H new ATOM 1437 N GLN A 565 -0.371 7.656 -12.064 1.00 0.00 N ATOM 1438 CA GLN A 565 -1.282 6.525 -11.937 1.00 0.00 C ATOM 1439 C GLN A 565 -2.096 6.623 -10.651 1.00 0.00 C ATOM 1440 O GLN A 565 -2.608 5.621 -10.151 1.00 0.00 O ATOM 1441 CB GLN A 565 -0.502 5.209 -11.961 1.00 0.00 C ATOM 1442 CG GLN A 565 0.375 5.045 -13.192 1.00 0.00 C ATOM 1443 CD GLN A 565 -0.426 4.730 -14.441 1.00 0.00 C ATOM 1444 OE1 GLN A 565 -1.044 5.614 -15.035 1.00 0.00 O ATOM 1445 NE2 GLN A 565 -0.419 3.466 -14.846 1.00 0.00 N ATOM 0 H GLN A 565 0.544 7.511 -11.637 1.00 0.00 H new ATOM 0 HA GLN A 565 -1.969 6.548 -12.783 1.00 0.00 H new ATOM 0 HB2 GLN A 565 0.122 5.150 -11.070 1.00 0.00 H new ATOM 0 HB3 GLN A 565 -1.206 4.378 -11.913 1.00 0.00 H new ATOM 0 HG2 GLN A 565 0.945 5.960 -13.352 1.00 0.00 H new ATOM 0 HG3 GLN A 565 1.096 4.247 -13.016 1.00 0.00 H new ATOM 0 HE21 GLN A 565 0.107 2.766 -14.323 1.00 0.00 H new ATOM 0 HE22 GLN A 565 -0.940 3.195 -15.680 1.00 0.00 H new ATOM 1454 N ILE A 566 -2.212 7.836 -10.121 1.00 0.00 N ATOM 1455 CA ILE A 566 -2.965 8.064 -8.894 1.00 0.00 C ATOM 1456 C ILE A 566 -4.382 7.515 -9.009 1.00 0.00 C ATOM 1457 O ILE A 566 -4.917 6.947 -8.057 1.00 0.00 O ATOM 1458 CB ILE A 566 -3.034 9.563 -8.547 1.00 0.00 C ATOM 1459 CG1 ILE A 566 -3.598 9.757 -7.138 1.00 0.00 C ATOM 1460 CG2 ILE A 566 -3.881 10.305 -9.570 1.00 0.00 C ATOM 1461 CD1 ILE A 566 -2.895 8.928 -6.086 1.00 0.00 C ATOM 0 H ILE A 566 -1.794 8.676 -10.522 1.00 0.00 H new ATOM 0 HA ILE A 566 -2.438 7.539 -8.098 1.00 0.00 H new ATOM 0 HB ILE A 566 -2.025 9.974 -8.574 1.00 0.00 H new ATOM 0 HG12 ILE A 566 -3.524 10.810 -6.868 1.00 0.00 H new ATOM 0 HG13 ILE A 566 -4.658 9.502 -7.141 1.00 0.00 H new ATOM 0 HG21 ILE A 566 -3.920 11.363 -9.311 1.00 0.00 H new ATOM 0 HG22 ILE A 566 -3.440 10.190 -10.560 1.00 0.00 H new ATOM 0 HG23 ILE A 566 -4.891 9.894 -9.573 1.00 0.00 H new ATOM 0 HD11 ILE A 566 -3.347 9.116 -5.112 1.00 0.00 H new ATOM 0 HD12 ILE A 566 -2.991 7.870 -6.332 1.00 0.00 H new ATOM 0 HD13 ILE A 566 -1.840 9.199 -6.054 1.00 0.00 H new ATOM 1473 N ASN A 567 -4.985 7.686 -10.181 1.00 0.00 N ATOM 1474 CA ASN A 567 -6.341 7.206 -10.421 1.00 0.00 C ATOM 1475 C ASN A 567 -6.452 5.715 -10.114 1.00 0.00 C ATOM 1476 O ASN A 567 -7.368 5.283 -9.415 1.00 0.00 O ATOM 1477 CB ASN A 567 -6.750 7.472 -11.871 1.00 0.00 C ATOM 1478 CG ASN A 567 -6.462 8.898 -12.300 1.00 0.00 C ATOM 1479 OD1 ASN A 567 -5.487 9.161 -13.005 1.00 0.00 O ATOM 1480 ND2 ASN A 567 -7.311 9.826 -11.876 1.00 0.00 N ATOM 0 H ASN A 567 -4.556 8.154 -10.980 1.00 0.00 H new ATOM 0 HA ASN A 567 -7.014 7.747 -9.756 1.00 0.00 H new ATOM 0 HB2 ASN A 567 -6.219 6.783 -12.528 1.00 0.00 H new ATOM 0 HB3 ASN A 567 -7.814 7.268 -11.989 1.00 0.00 H new ATOM 0 HD21 ASN A 567 -7.169 10.803 -12.133 1.00 0.00 H new ATOM 0 HD22 ASN A 567 -8.106 9.562 -11.293 1.00 0.00 H new ATOM 1487 N GLU A 568 -5.514 4.936 -10.643 1.00 0.00 N ATOM 1488 CA GLU A 568 -5.507 3.495 -10.426 1.00 0.00 C ATOM 1489 C GLU A 568 -5.360 3.168 -8.943 1.00 0.00 C ATOM 1490 O GLU A 568 -6.186 2.461 -8.367 1.00 0.00 O ATOM 1491 CB GLU A 568 -4.372 2.842 -11.218 1.00 0.00 C ATOM 1492 CG GLU A 568 -4.350 1.327 -11.114 1.00 0.00 C ATOM 1493 CD GLU A 568 -5.569 0.681 -11.744 1.00 0.00 C ATOM 1494 OE1 GLU A 568 -6.680 0.858 -11.203 1.00 0.00 O ATOM 1495 OE2 GLU A 568 -5.411 -0.001 -12.778 1.00 0.00 O ATOM 0 H GLU A 568 -4.749 5.279 -11.225 1.00 0.00 H new ATOM 0 HA GLU A 568 -6.460 3.097 -10.775 1.00 0.00 H new ATOM 0 HB2 GLU A 568 -4.463 3.124 -12.267 1.00 0.00 H new ATOM 0 HB3 GLU A 568 -3.420 3.236 -10.863 1.00 0.00 H new ATOM 0 HG2 GLU A 568 -3.451 0.946 -11.598 1.00 0.00 H new ATOM 0 HG3 GLU A 568 -4.293 1.039 -10.064 1.00 0.00 H new ATOM 1502 N MET A 569 -4.301 3.689 -8.331 1.00 0.00 N ATOM 1503 CA MET A 569 -4.046 3.453 -6.914 1.00 0.00 C ATOM 1504 C MET A 569 -5.300 3.711 -6.085 1.00 0.00 C ATOM 1505 O MET A 569 -5.731 2.855 -5.311 1.00 0.00 O ATOM 1506 CB MET A 569 -2.905 4.347 -6.425 1.00 0.00 C ATOM 1507 CG MET A 569 -1.638 4.225 -7.256 1.00 0.00 C ATOM 1508 SD MET A 569 -0.205 4.966 -6.450 1.00 0.00 S ATOM 1509 CE MET A 569 0.403 3.577 -5.496 1.00 0.00 C ATOM 0 H MET A 569 -3.607 4.276 -8.793 1.00 0.00 H new ATOM 0 HA MET A 569 -3.759 2.409 -6.791 1.00 0.00 H new ATOM 0 HB2 MET A 569 -3.238 5.385 -6.435 1.00 0.00 H new ATOM 0 HB3 MET A 569 -2.676 4.096 -5.389 1.00 0.00 H new ATOM 0 HG2 MET A 569 -1.436 3.172 -7.451 1.00 0.00 H new ATOM 0 HG3 MET A 569 -1.794 4.704 -8.223 1.00 0.00 H new ATOM 0 HE1 MET A 569 1.492 3.610 -5.459 1.00 0.00 H new ATOM 0 HE2 MET A 569 0.004 3.629 -4.483 1.00 0.00 H new ATOM 0 HE3 MET A 569 0.084 2.646 -5.965 1.00 0.00 H new ATOM 1519 N HIS A 570 -5.882 4.894 -6.252 1.00 0.00 N ATOM 1520 CA HIS A 570 -7.088 5.263 -5.519 1.00 0.00 C ATOM 1521 C HIS A 570 -8.155 4.181 -5.648 1.00 0.00 C ATOM 1522 O HIS A 570 -8.730 3.739 -4.652 1.00 0.00 O ATOM 1523 CB HIS A 570 -7.633 6.597 -6.031 1.00 0.00 C ATOM 1524 CG HIS A 570 -9.045 6.868 -5.610 1.00 0.00 C ATOM 1525 ND1 HIS A 570 -9.915 7.642 -6.349 1.00 0.00 N ATOM 1526 CD2 HIS A 570 -9.737 6.461 -4.521 1.00 0.00 C ATOM 1527 CE1 HIS A 570 -11.081 7.702 -5.731 1.00 0.00 C ATOM 1528 NE2 HIS A 570 -11.000 6.993 -4.619 1.00 0.00 N ATOM 0 H HIS A 570 -5.538 5.613 -6.888 1.00 0.00 H new ATOM 0 HA HIS A 570 -6.826 5.366 -4.466 1.00 0.00 H new ATOM 0 HB2 HIS A 570 -6.994 7.403 -5.671 1.00 0.00 H new ATOM 0 HB3 HIS A 570 -7.578 6.609 -7.120 1.00 0.00 H new ATOM 0 HD1 HIS A 570 -9.693 8.097 -7.234 1.00 0.00 H new ATOM 0 HD2 HIS A 570 -9.366 5.835 -3.723 1.00 0.00 H new ATOM 0 HE1 HIS A 570 -11.952 8.239 -6.076 1.00 0.00 H new ATOM 1536 N LEU A 571 -8.416 3.757 -6.880 1.00 0.00 N ATOM 1537 CA LEU A 571 -9.414 2.726 -7.140 1.00 0.00 C ATOM 1538 C LEU A 571 -9.177 1.504 -6.259 1.00 0.00 C ATOM 1539 O LEU A 571 -10.113 0.949 -5.683 1.00 0.00 O ATOM 1540 CB LEU A 571 -9.386 2.321 -8.614 1.00 0.00 C ATOM 1541 CG LEU A 571 -9.955 3.340 -9.602 1.00 0.00 C ATOM 1542 CD1 LEU A 571 -9.705 2.892 -11.034 1.00 0.00 C ATOM 1543 CD2 LEU A 571 -11.443 3.546 -9.358 1.00 0.00 C ATOM 0 H LEU A 571 -7.950 4.112 -7.715 1.00 0.00 H new ATOM 0 HA LEU A 571 -10.395 3.137 -6.902 1.00 0.00 H new ATOM 0 HB2 LEU A 571 -8.353 2.112 -8.893 1.00 0.00 H new ATOM 0 HB3 LEU A 571 -9.941 1.389 -8.724 1.00 0.00 H new ATOM 0 HG LEU A 571 -9.446 4.291 -9.446 1.00 0.00 H new ATOM 0 HD11 LEU A 571 -10.117 3.629 -11.723 1.00 0.00 H new ATOM 0 HD12 LEU A 571 -8.632 2.796 -11.203 1.00 0.00 H new ATOM 0 HD13 LEU A 571 -10.186 1.929 -11.203 1.00 0.00 H new ATOM 0 HD21 LEU A 571 -11.831 4.274 -10.070 1.00 0.00 H new ATOM 0 HD22 LEU A 571 -11.967 2.599 -9.486 1.00 0.00 H new ATOM 0 HD23 LEU A 571 -11.598 3.913 -8.343 1.00 0.00 H new ATOM 1555 N LEU A 572 -7.919 1.090 -6.158 1.00 0.00 N ATOM 1556 CA LEU A 572 -7.557 -0.066 -5.346 1.00 0.00 C ATOM 1557 C LEU A 572 -7.986 0.131 -3.895 1.00 0.00 C ATOM 1558 O LEU A 572 -8.677 -0.711 -3.322 1.00 0.00 O ATOM 1559 CB LEU A 572 -6.048 -0.310 -5.414 1.00 0.00 C ATOM 1560 CG LEU A 572 -5.435 -0.334 -6.815 1.00 0.00 C ATOM 1561 CD1 LEU A 572 -3.928 -0.523 -6.735 1.00 0.00 C ATOM 1562 CD2 LEU A 572 -6.068 -1.432 -7.656 1.00 0.00 C ATOM 0 H LEU A 572 -7.132 1.538 -6.628 1.00 0.00 H new ATOM 0 HA LEU A 572 -8.078 -0.936 -5.745 1.00 0.00 H new ATOM 0 HB2 LEU A 572 -5.548 0.465 -4.834 1.00 0.00 H new ATOM 0 HB3 LEU A 572 -5.832 -1.261 -4.928 1.00 0.00 H new ATOM 0 HG LEU A 572 -5.636 0.624 -7.295 1.00 0.00 H new ATOM 0 HD11 LEU A 572 -3.509 -0.538 -7.741 1.00 0.00 H new ATOM 0 HD12 LEU A 572 -3.488 0.299 -6.171 1.00 0.00 H new ATOM 0 HD13 LEU A 572 -3.706 -1.466 -6.236 1.00 0.00 H new ATOM 0 HD21 LEU A 572 -5.619 -1.434 -8.649 1.00 0.00 H new ATOM 0 HD22 LEU A 572 -5.899 -2.398 -7.180 1.00 0.00 H new ATOM 0 HD23 LEU A 572 -7.140 -1.252 -7.742 1.00 0.00 H new ATOM 1574 N ILE A 573 -7.573 1.250 -3.309 1.00 0.00 N ATOM 1575 CA ILE A 573 -7.918 1.560 -1.927 1.00 0.00 C ATOM 1576 C ILE A 573 -9.419 1.426 -1.692 1.00 0.00 C ATOM 1577 O ILE A 573 -9.852 0.949 -0.644 1.00 0.00 O ATOM 1578 CB ILE A 573 -7.474 2.983 -1.541 1.00 0.00 C ATOM 1579 CG1 ILE A 573 -5.982 3.170 -1.826 1.00 0.00 C ATOM 1580 CG2 ILE A 573 -7.777 3.253 -0.075 1.00 0.00 C ATOM 1581 CD1 ILE A 573 -5.100 2.183 -1.095 1.00 0.00 C ATOM 0 H ILE A 573 -6.999 1.957 -3.770 1.00 0.00 H new ATOM 0 HA ILE A 573 -7.389 0.841 -1.301 1.00 0.00 H new ATOM 0 HB ILE A 573 -8.032 3.698 -2.145 1.00 0.00 H new ATOM 0 HG12 ILE A 573 -5.810 3.074 -2.898 1.00 0.00 H new ATOM 0 HG13 ILE A 573 -5.691 4.182 -1.546 1.00 0.00 H new ATOM 0 HG21 ILE A 573 -7.457 4.263 0.183 1.00 0.00 H new ATOM 0 HG22 ILE A 573 -8.849 3.156 0.099 1.00 0.00 H new ATOM 0 HG23 ILE A 573 -7.242 2.534 0.545 1.00 0.00 H new ATOM 0 HD11 ILE A 573 -4.056 2.374 -1.344 1.00 0.00 H new ATOM 0 HD12 ILE A 573 -5.243 2.294 -0.020 1.00 0.00 H new ATOM 0 HD13 ILE A 573 -5.364 1.168 -1.393 1.00 0.00 H new ATOM 1593 N GLN A 574 -10.207 1.849 -2.676 1.00 0.00 N ATOM 1594 CA GLN A 574 -11.659 1.776 -2.576 1.00 0.00 C ATOM 1595 C GLN A 574 -12.136 0.328 -2.635 1.00 0.00 C ATOM 1596 O GLN A 574 -13.130 -0.033 -2.004 1.00 0.00 O ATOM 1597 CB GLN A 574 -12.311 2.586 -3.698 1.00 0.00 C ATOM 1598 CG GLN A 574 -11.854 4.035 -3.746 1.00 0.00 C ATOM 1599 CD GLN A 574 -12.717 4.947 -2.897 1.00 0.00 C ATOM 1600 OE1 GLN A 574 -12.451 4.972 -1.597 1.00 0.00 O flip ATOM 1601 NE2 GLN A 574 -13.612 5.623 -3.405 1.00 0.00 N flip ATOM 0 H GLN A 574 -9.864 2.246 -3.551 1.00 0.00 H new ATOM 0 HA GLN A 574 -11.953 2.198 -1.615 1.00 0.00 H new ATOM 0 HB2 GLN A 574 -12.089 2.112 -4.654 1.00 0.00 H new ATOM 0 HB3 GLN A 574 -13.393 2.559 -3.573 1.00 0.00 H new ATOM 0 HG2 GLN A 574 -10.821 4.098 -3.405 1.00 0.00 H new ATOM 0 HG3 GLN A 574 -11.870 4.383 -4.779 1.00 0.00 H new ATOM 0 HE21 GLN A 574 -13.782 5.573 -4.410 1.00 0.00 H new ATOM 0 HE22 GLN A 574 -14.184 6.234 -2.821 1.00 0.00 H new ATOM 1610 N GLN A 575 -11.422 -0.495 -3.396 1.00 0.00 N ATOM 1611 CA GLN A 575 -11.774 -1.902 -3.538 1.00 0.00 C ATOM 1612 C GLN A 575 -11.471 -2.671 -2.256 1.00 0.00 C ATOM 1613 O GLN A 575 -12.077 -3.707 -1.983 1.00 0.00 O ATOM 1614 CB GLN A 575 -11.015 -2.524 -4.711 1.00 0.00 C ATOM 1615 CG GLN A 575 -11.453 -1.996 -6.067 1.00 0.00 C ATOM 1616 CD GLN A 575 -11.146 -2.961 -7.196 1.00 0.00 C ATOM 1617 OE1 GLN A 575 -12.049 -3.435 -7.886 1.00 0.00 O ATOM 1618 NE2 GLN A 575 -9.866 -3.257 -7.390 1.00 0.00 N ATOM 0 H GLN A 575 -10.596 -0.211 -3.924 1.00 0.00 H new ATOM 0 HA GLN A 575 -12.845 -1.964 -3.733 1.00 0.00 H new ATOM 0 HB2 GLN A 575 -9.949 -2.336 -4.584 1.00 0.00 H new ATOM 0 HB3 GLN A 575 -11.152 -3.605 -4.690 1.00 0.00 H new ATOM 0 HG2 GLN A 575 -12.524 -1.796 -6.046 1.00 0.00 H new ATOM 0 HG3 GLN A 575 -10.955 -1.046 -6.261 1.00 0.00 H new ATOM 0 HE21 GLN A 575 -9.150 -2.841 -6.794 1.00 0.00 H new ATOM 0 HE22 GLN A 575 -9.599 -3.900 -8.135 1.00 0.00 H new ATOM 1627 N ALA A 576 -10.530 -2.156 -1.472 1.00 0.00 N ATOM 1628 CA ALA A 576 -10.147 -2.793 -0.218 1.00 0.00 C ATOM 1629 C ALA A 576 -11.046 -2.336 0.927 1.00 0.00 C ATOM 1630 O ALA A 576 -11.250 -3.065 1.897 1.00 0.00 O ATOM 1631 CB ALA A 576 -8.690 -2.496 0.102 1.00 0.00 C ATOM 0 H ALA A 576 -10.019 -1.299 -1.683 1.00 0.00 H new ATOM 0 HA ALA A 576 -10.269 -3.870 -0.334 1.00 0.00 H new ATOM 0 HB1 ALA A 576 -8.418 -2.978 1.041 1.00 0.00 H new ATOM 0 HB2 ALA A 576 -8.056 -2.878 -0.699 1.00 0.00 H new ATOM 0 HB3 ALA A 576 -8.550 -1.419 0.193 1.00 0.00 H new ATOM 1637 N ARG A 577 -11.580 -1.125 0.806 1.00 0.00 N ATOM 1638 CA ARG A 577 -12.455 -0.570 1.831 1.00 0.00 C ATOM 1639 C ARG A 577 -13.902 -0.996 1.600 1.00 0.00 C ATOM 1640 O ARG A 577 -14.613 -1.346 2.541 1.00 0.00 O ATOM 1641 CB ARG A 577 -12.357 0.956 1.844 1.00 0.00 C ATOM 1642 CG ARG A 577 -11.126 1.482 2.564 1.00 0.00 C ATOM 1643 CD ARG A 577 -11.288 2.944 2.949 1.00 0.00 C ATOM 1644 NE ARG A 577 -12.390 3.144 3.887 1.00 0.00 N ATOM 1645 CZ ARG A 577 -12.317 2.849 5.180 1.00 0.00 C ATOM 1646 NH1 ARG A 577 -11.201 2.344 5.686 1.00 0.00 N ATOM 1647 NH2 ARG A 577 -13.363 3.060 5.969 1.00 0.00 N ATOM 0 H ARG A 577 -11.422 -0.510 0.008 1.00 0.00 H new ATOM 0 HA ARG A 577 -12.131 -0.956 2.797 1.00 0.00 H new ATOM 0 HB2 ARG A 577 -12.349 1.320 0.817 1.00 0.00 H new ATOM 0 HB3 ARG A 577 -13.248 1.365 2.320 1.00 0.00 H new ATOM 0 HG2 ARG A 577 -10.945 0.887 3.459 1.00 0.00 H new ATOM 0 HG3 ARG A 577 -10.252 1.368 1.923 1.00 0.00 H new ATOM 0 HD2 ARG A 577 -10.362 3.306 3.395 1.00 0.00 H new ATOM 0 HD3 ARG A 577 -11.463 3.538 2.052 1.00 0.00 H new ATOM 0 HE ARG A 577 -13.263 3.531 3.529 1.00 0.00 H new ATOM 0 HH11 ARG A 577 -10.395 2.181 5.082 1.00 0.00 H new ATOM 0 HH12 ARG A 577 -11.148 2.118 6.679 1.00 0.00 H new ATOM 0 HH21 ARG A 577 -14.223 3.449 5.582 1.00 0.00 H new ATOM 0 HH22 ARG A 577 -13.307 2.833 6.962 1.00 0.00 H new ATOM 1661 N GLU A 578 -14.329 -0.963 0.341 1.00 0.00 N ATOM 1662 CA GLU A 578 -15.691 -1.345 -0.013 1.00 0.00 C ATOM 1663 C GLU A 578 -16.170 -2.512 0.846 1.00 0.00 C ATOM 1664 O GLU A 578 -17.310 -2.529 1.308 1.00 0.00 O ATOM 1665 CB GLU A 578 -15.771 -1.721 -1.494 1.00 0.00 C ATOM 1666 CG GLU A 578 -15.336 -3.147 -1.784 1.00 0.00 C ATOM 1667 CD GLU A 578 -15.192 -3.423 -3.268 1.00 0.00 C ATOM 1668 OE1 GLU A 578 -15.899 -2.770 -4.064 1.00 0.00 O ATOM 1669 OE2 GLU A 578 -14.373 -4.292 -3.633 1.00 0.00 O ATOM 0 H GLU A 578 -13.752 -0.676 -0.450 1.00 0.00 H new ATOM 0 HA GLU A 578 -16.340 -0.489 0.173 1.00 0.00 H new ATOM 0 HB2 GLU A 578 -16.796 -1.585 -1.840 1.00 0.00 H new ATOM 0 HB3 GLU A 578 -15.147 -1.036 -2.068 1.00 0.00 H new ATOM 0 HG2 GLU A 578 -14.385 -3.341 -1.288 1.00 0.00 H new ATOM 0 HG3 GLU A 578 -16.063 -3.838 -1.359 1.00 0.00 H new ATOM 1676 N MET A 579 -15.289 -3.485 1.055 1.00 0.00 N ATOM 1677 CA MET A 579 -15.621 -4.656 1.859 1.00 0.00 C ATOM 1678 C MET A 579 -15.448 -4.362 3.345 1.00 0.00 C ATOM 1679 O MET A 579 -14.527 -3.658 3.760 1.00 0.00 O ATOM 1680 CB MET A 579 -14.744 -5.843 1.455 1.00 0.00 C ATOM 1681 CG MET A 579 -13.256 -5.583 1.622 1.00 0.00 C ATOM 1682 SD MET A 579 -12.681 -5.893 3.303 1.00 0.00 S ATOM 1683 CE MET A 579 -12.845 -7.674 3.394 1.00 0.00 C ATOM 0 H MET A 579 -14.341 -3.486 0.679 1.00 0.00 H new ATOM 0 HA MET A 579 -16.666 -4.907 1.677 1.00 0.00 H new ATOM 0 HB2 MET A 579 -15.022 -6.710 2.054 1.00 0.00 H new ATOM 0 HB3 MET A 579 -14.946 -6.096 0.414 1.00 0.00 H new ATOM 0 HG2 MET A 579 -12.701 -6.216 0.930 1.00 0.00 H new ATOM 0 HG3 MET A 579 -13.039 -4.549 1.353 1.00 0.00 H new ATOM 0 HE1 MET A 579 -13.054 -7.968 4.423 1.00 0.00 H new ATOM 0 HE2 MET A 579 -13.663 -7.997 2.751 1.00 0.00 H new ATOM 0 HE3 MET A 579 -11.917 -8.142 3.064 1.00 0.00 H new ATOM 1693 N PRO A 580 -16.353 -4.913 4.168 1.00 0.00 N ATOM 1694 CA PRO A 580 -16.320 -4.723 5.621 1.00 0.00 C ATOM 1695 C PRO A 580 -15.145 -5.444 6.273 1.00 0.00 C ATOM 1696 O PRO A 580 -14.293 -6.010 5.588 1.00 0.00 O ATOM 1697 CB PRO A 580 -17.645 -5.331 6.088 1.00 0.00 C ATOM 1698 CG PRO A 580 -17.997 -6.326 5.037 1.00 0.00 C ATOM 1699 CD PRO A 580 -17.478 -5.763 3.743 1.00 0.00 C ATOM 0 HA PRO A 580 -16.197 -3.675 5.892 1.00 0.00 H new ATOM 0 HB2 PRO A 580 -17.541 -5.806 7.064 1.00 0.00 H new ATOM 0 HB3 PRO A 580 -18.418 -4.568 6.186 1.00 0.00 H new ATOM 0 HG2 PRO A 580 -17.545 -7.295 5.250 1.00 0.00 H new ATOM 0 HG3 PRO A 580 -19.075 -6.480 4.991 1.00 0.00 H new ATOM 0 HD2 PRO A 580 -17.152 -6.551 3.064 1.00 0.00 H new ATOM 0 HD3 PRO A 580 -18.242 -5.187 3.220 1.00 0.00 H new ATOM 1707 N LEU A 581 -15.105 -5.419 7.601 1.00 0.00 N ATOM 1708 CA LEU A 581 -14.034 -6.071 8.346 1.00 0.00 C ATOM 1709 C LEU A 581 -14.571 -7.247 9.156 1.00 0.00 C ATOM 1710 O LEU A 581 -15.480 -7.089 9.971 1.00 0.00 O ATOM 1711 CB LEU A 581 -13.349 -5.067 9.276 1.00 0.00 C ATOM 1712 CG LEU A 581 -12.322 -4.141 8.624 1.00 0.00 C ATOM 1713 CD1 LEU A 581 -12.174 -2.858 9.428 1.00 0.00 C ATOM 1714 CD2 LEU A 581 -10.980 -4.845 8.487 1.00 0.00 C ATOM 0 H LEU A 581 -15.802 -4.954 8.183 1.00 0.00 H new ATOM 0 HA LEU A 581 -13.305 -6.450 7.630 1.00 0.00 H new ATOM 0 HB2 LEU A 581 -14.118 -4.452 9.743 1.00 0.00 H new ATOM 0 HB3 LEU A 581 -12.854 -5.620 10.074 1.00 0.00 H new ATOM 0 HG LEU A 581 -12.677 -3.882 7.626 1.00 0.00 H new ATOM 0 HD11 LEU A 581 -11.439 -2.211 8.949 1.00 0.00 H new ATOM 0 HD12 LEU A 581 -13.134 -2.344 9.474 1.00 0.00 H new ATOM 0 HD13 LEU A 581 -11.842 -3.098 10.438 1.00 0.00 H new ATOM 0 HD21 LEU A 581 -10.261 -4.171 8.021 1.00 0.00 H new ATOM 0 HD22 LEU A 581 -10.619 -5.135 9.474 1.00 0.00 H new ATOM 0 HD23 LEU A 581 -11.097 -5.734 7.868 1.00 0.00 H new ATOM 1726 N LEU A 582 -14.001 -8.425 8.927 1.00 0.00 N ATOM 1727 CA LEU A 582 -14.421 -9.628 9.636 1.00 0.00 C ATOM 1728 C LEU A 582 -13.527 -9.887 10.845 1.00 0.00 C ATOM 1729 O LEU A 582 -12.479 -10.524 10.731 1.00 0.00 O ATOM 1730 CB LEU A 582 -14.390 -10.835 8.697 1.00 0.00 C ATOM 1731 CG LEU A 582 -15.259 -10.731 7.443 1.00 0.00 C ATOM 1732 CD1 LEU A 582 -14.488 -10.064 6.314 1.00 0.00 C ATOM 1733 CD2 LEU A 582 -15.747 -12.108 7.017 1.00 0.00 C ATOM 0 H LEU A 582 -13.247 -8.572 8.256 1.00 0.00 H new ATOM 0 HA LEU A 582 -15.441 -9.475 9.987 1.00 0.00 H new ATOM 0 HB2 LEU A 582 -13.359 -11.003 8.387 1.00 0.00 H new ATOM 0 HB3 LEU A 582 -14.702 -11.716 9.259 1.00 0.00 H new ATOM 0 HG LEU A 582 -16.128 -10.115 7.676 1.00 0.00 H new ATOM 0 HD11 LEU A 582 -15.122 -9.998 5.430 1.00 0.00 H new ATOM 0 HD12 LEU A 582 -14.188 -9.062 6.621 1.00 0.00 H new ATOM 0 HD13 LEU A 582 -13.601 -10.653 6.082 1.00 0.00 H new ATOM 0 HD21 LEU A 582 -16.364 -12.015 6.123 1.00 0.00 H new ATOM 0 HD22 LEU A 582 -14.891 -12.747 6.802 1.00 0.00 H new ATOM 0 HD23 LEU A 582 -16.337 -12.550 7.820 1.00 0.00 H new ATOM 1745 N LYS A 583 -13.949 -9.392 12.003 1.00 0.00 N ATOM 1746 CA LYS A 583 -13.189 -9.572 13.235 1.00 0.00 C ATOM 1747 C LYS A 583 -14.122 -9.769 14.425 1.00 0.00 C ATOM 1748 O LYS A 583 -15.324 -9.523 14.331 1.00 0.00 O ATOM 1749 CB LYS A 583 -12.281 -8.364 13.480 1.00 0.00 C ATOM 1750 CG LYS A 583 -10.971 -8.423 12.714 1.00 0.00 C ATOM 1751 CD LYS A 583 -9.995 -9.397 13.353 1.00 0.00 C ATOM 1752 CE LYS A 583 -9.238 -8.753 14.504 1.00 0.00 C ATOM 1753 NZ LYS A 583 -8.449 -9.752 15.276 1.00 0.00 N ATOM 0 H LYS A 583 -14.814 -8.863 12.115 1.00 0.00 H new ATOM 0 HA LYS A 583 -12.574 -10.465 13.126 1.00 0.00 H new ATOM 0 HB2 LYS A 583 -12.815 -7.456 13.200 1.00 0.00 H new ATOM 0 HB3 LYS A 583 -12.066 -8.292 14.546 1.00 0.00 H new ATOM 0 HG2 LYS A 583 -11.164 -8.723 11.684 1.00 0.00 H new ATOM 0 HG3 LYS A 583 -10.524 -7.429 12.678 1.00 0.00 H new ATOM 0 HD2 LYS A 583 -10.536 -10.271 13.716 1.00 0.00 H new ATOM 0 HD3 LYS A 583 -9.287 -9.749 12.603 1.00 0.00 H new ATOM 0 HE2 LYS A 583 -8.570 -7.985 14.115 1.00 0.00 H new ATOM 0 HE3 LYS A 583 -9.943 -8.255 15.169 1.00 0.00 H new ATOM 0 HZ1 LYS A 583 -7.948 -9.274 16.052 1.00 0.00 H new ATOM 0 HZ2 LYS A 583 -9.089 -10.471 15.669 1.00 0.00 H new ATOM 0 HZ3 LYS A 583 -7.758 -10.210 14.647 1.00 0.00 H new ATOM 1767 N SER A 584 -13.560 -10.214 15.545 1.00 0.00 N ATOM 1768 CA SER A 584 -14.342 -10.446 16.753 1.00 0.00 C ATOM 1769 C SER A 584 -15.343 -9.317 16.978 1.00 0.00 C ATOM 1770 O SER A 584 -15.050 -8.152 16.712 1.00 0.00 O ATOM 1771 CB SER A 584 -13.419 -10.574 17.967 1.00 0.00 C ATOM 1772 OG SER A 584 -13.993 -11.408 18.958 1.00 0.00 O ATOM 0 H SER A 584 -12.566 -10.421 15.640 1.00 0.00 H new ATOM 0 HA SER A 584 -14.894 -11.377 16.625 1.00 0.00 H new ATOM 0 HB2 SER A 584 -12.458 -10.983 17.655 1.00 0.00 H new ATOM 0 HB3 SER A 584 -13.225 -9.587 18.386 1.00 0.00 H new ATOM 0 HG SER A 584 -13.383 -11.475 19.722 1.00 0.00 H new ATOM 1778 N GLU A 585 -16.526 -9.672 17.470 1.00 0.00 N ATOM 1779 CA GLU A 585 -17.571 -8.689 17.730 1.00 0.00 C ATOM 1780 C GLU A 585 -17.027 -7.521 18.547 1.00 0.00 C ATOM 1781 O GLU A 585 -16.020 -7.650 19.243 1.00 0.00 O ATOM 1782 CB GLU A 585 -18.743 -9.340 18.467 1.00 0.00 C ATOM 1783 CG GLU A 585 -19.687 -10.104 17.555 1.00 0.00 C ATOM 1784 CD GLU A 585 -19.050 -11.346 16.962 1.00 0.00 C ATOM 1785 OE1 GLU A 585 -18.497 -12.156 17.735 1.00 0.00 O ATOM 1786 OE2 GLU A 585 -19.103 -11.507 15.725 1.00 0.00 O ATOM 0 H GLU A 585 -16.784 -10.632 17.696 1.00 0.00 H new ATOM 0 HA GLU A 585 -17.922 -8.307 16.771 1.00 0.00 H new ATOM 0 HB2 GLU A 585 -18.352 -10.020 19.224 1.00 0.00 H new ATOM 0 HB3 GLU A 585 -19.305 -8.568 18.992 1.00 0.00 H new ATOM 0 HG2 GLU A 585 -20.576 -10.390 18.117 1.00 0.00 H new ATOM 0 HG3 GLU A 585 -20.016 -9.449 16.748 1.00 0.00 H new ATOM 1793 N VAL A 586 -17.702 -6.379 18.456 1.00 0.00 N ATOM 1794 CA VAL A 586 -17.288 -5.187 19.187 1.00 0.00 C ATOM 1795 C VAL A 586 -18.366 -4.110 19.138 1.00 0.00 C ATOM 1796 O VAL A 586 -19.044 -3.942 18.125 1.00 0.00 O ATOM 1797 CB VAL A 586 -15.976 -4.610 18.623 1.00 0.00 C ATOM 1798 CG1 VAL A 586 -16.192 -4.063 17.220 1.00 0.00 C ATOM 1799 CG2 VAL A 586 -15.428 -3.532 19.546 1.00 0.00 C ATOM 0 H VAL A 586 -18.537 -6.254 17.884 1.00 0.00 H new ATOM 0 HA VAL A 586 -17.128 -5.490 20.222 1.00 0.00 H new ATOM 0 HB VAL A 586 -15.242 -5.414 18.564 1.00 0.00 H new ATOM 0 HG11 VAL A 586 -15.254 -3.660 16.838 1.00 0.00 H new ATOM 0 HG12 VAL A 586 -16.535 -4.864 16.566 1.00 0.00 H new ATOM 0 HG13 VAL A 586 -16.942 -3.272 17.249 1.00 0.00 H new ATOM 0 HG21 VAL A 586 -14.501 -3.135 19.132 1.00 0.00 H new ATOM 0 HG22 VAL A 586 -16.157 -2.727 19.639 1.00 0.00 H new ATOM 0 HG23 VAL A 586 -15.233 -3.960 20.529 1.00 0.00 H new ATOM 1809 N ALA A 587 -18.519 -3.382 20.239 1.00 0.00 N ATOM 1810 CA ALA A 587 -19.513 -2.319 20.321 1.00 0.00 C ATOM 1811 C ALA A 587 -19.321 -1.301 19.202 1.00 0.00 C ATOM 1812 O ALA A 587 -18.479 -0.409 19.299 1.00 0.00 O ATOM 1813 CB ALA A 587 -19.443 -1.635 21.678 1.00 0.00 C ATOM 0 H ALA A 587 -17.967 -3.509 21.087 1.00 0.00 H new ATOM 0 HA ALA A 587 -20.500 -2.767 20.203 1.00 0.00 H new ATOM 0 HB1 ALA A 587 -20.191 -0.843 21.725 1.00 0.00 H new ATOM 0 HB2 ALA A 587 -19.637 -2.365 22.464 1.00 0.00 H new ATOM 0 HB3 ALA A 587 -18.451 -1.206 21.818 1.00 0.00 H new ATOM 1819 N ALA A 588 -20.108 -1.441 18.140 1.00 0.00 N ATOM 1820 CA ALA A 588 -20.025 -0.532 17.003 1.00 0.00 C ATOM 1821 C ALA A 588 -21.238 -0.681 16.092 1.00 0.00 C ATOM 1822 O ALA A 588 -21.649 -1.794 15.766 1.00 0.00 O ATOM 1823 CB ALA A 588 -18.742 -0.779 16.223 1.00 0.00 C ATOM 0 H ALA A 588 -20.810 -2.175 18.043 1.00 0.00 H new ATOM 0 HA ALA A 588 -20.014 0.489 17.385 1.00 0.00 H new ATOM 0 HB1 ALA A 588 -18.693 -0.094 15.377 1.00 0.00 H new ATOM 0 HB2 ALA A 588 -17.883 -0.614 16.874 1.00 0.00 H new ATOM 0 HB3 ALA A 588 -18.730 -1.806 15.859 1.00 0.00 H new ATOM 1829 N GLY A 589 -21.808 0.448 15.683 1.00 0.00 N ATOM 1830 CA GLY A 589 -22.970 0.421 14.814 1.00 0.00 C ATOM 1831 C GLY A 589 -22.602 0.184 13.362 1.00 0.00 C ATOM 1832 O GLY A 589 -22.249 1.119 12.643 1.00 0.00 O ATOM 0 H GLY A 589 -21.486 1.382 15.938 1.00 0.00 H new ATOM 0 HA2 GLY A 589 -23.650 -0.363 15.146 1.00 0.00 H new ATOM 0 HA3 GLY A 589 -23.507 1.366 14.900 1.00 0.00 H new ATOM 1836 N VAL A 590 -22.683 -1.071 12.930 1.00 0.00 N ATOM 1837 CA VAL A 590 -22.355 -1.428 11.555 1.00 0.00 C ATOM 1838 C VAL A 590 -23.562 -2.025 10.840 1.00 0.00 C ATOM 1839 O VAL A 590 -24.266 -2.873 11.388 1.00 0.00 O ATOM 1840 CB VAL A 590 -21.189 -2.433 11.499 1.00 0.00 C ATOM 1841 CG1 VAL A 590 -20.847 -2.774 10.057 1.00 0.00 C ATOM 1842 CG2 VAL A 590 -19.974 -1.881 12.228 1.00 0.00 C ATOM 0 H VAL A 590 -22.973 -1.857 13.512 1.00 0.00 H new ATOM 0 HA VAL A 590 -22.056 -0.509 11.051 1.00 0.00 H new ATOM 0 HB VAL A 590 -21.498 -3.350 12.000 1.00 0.00 H new ATOM 0 HG11 VAL A 590 -20.021 -3.485 10.037 1.00 0.00 H new ATOM 0 HG12 VAL A 590 -21.717 -3.215 9.571 1.00 0.00 H new ATOM 0 HG13 VAL A 590 -20.557 -1.866 9.527 1.00 0.00 H new ATOM 0 HG21 VAL A 590 -19.160 -2.604 12.178 1.00 0.00 H new ATOM 0 HG22 VAL A 590 -19.660 -0.949 11.758 1.00 0.00 H new ATOM 0 HG23 VAL A 590 -20.230 -1.694 13.271 1.00 0.00 H new ATOM 1852 N LYS A 591 -23.795 -1.577 9.611 1.00 0.00 N ATOM 1853 CA LYS A 591 -24.915 -2.068 8.817 1.00 0.00 C ATOM 1854 C LYS A 591 -24.604 -1.986 7.326 1.00 0.00 C ATOM 1855 O LYS A 591 -23.593 -1.410 6.923 1.00 0.00 O ATOM 1856 CB LYS A 591 -26.179 -1.263 9.129 1.00 0.00 C ATOM 1857 CG LYS A 591 -26.029 0.227 8.877 1.00 0.00 C ATOM 1858 CD LYS A 591 -27.377 0.897 8.671 1.00 0.00 C ATOM 1859 CE LYS A 591 -28.079 1.157 9.995 1.00 0.00 C ATOM 1860 NZ LYS A 591 -28.811 -0.046 10.480 1.00 0.00 N ATOM 0 H LYS A 591 -23.223 -0.874 9.143 1.00 0.00 H new ATOM 0 HA LYS A 591 -25.082 -3.113 9.078 1.00 0.00 H new ATOM 0 HB2 LYS A 591 -27.001 -1.644 8.523 1.00 0.00 H new ATOM 0 HB3 LYS A 591 -26.452 -1.421 10.172 1.00 0.00 H new ATOM 0 HG2 LYS A 591 -25.517 0.690 9.721 1.00 0.00 H new ATOM 0 HG3 LYS A 591 -25.404 0.387 7.998 1.00 0.00 H new ATOM 0 HD2 LYS A 591 -27.239 1.839 8.140 1.00 0.00 H new ATOM 0 HD3 LYS A 591 -28.006 0.266 8.042 1.00 0.00 H new ATOM 0 HE2 LYS A 591 -27.345 1.461 10.742 1.00 0.00 H new ATOM 0 HE3 LYS A 591 -28.778 1.985 9.879 1.00 0.00 H new ATOM 0 HZ1 LYS A 591 -29.674 0.250 10.979 1.00 0.00 H new ATOM 0 HZ2 LYS A 591 -29.068 -0.646 9.670 1.00 0.00 H new ATOM 0 HZ3 LYS A 591 -28.203 -0.584 11.130 1.00 0.00 H new ATOM 1874 N LYS A 592 -25.478 -2.565 6.511 1.00 0.00 N ATOM 1875 CA LYS A 592 -25.299 -2.556 5.064 1.00 0.00 C ATOM 1876 C LYS A 592 -26.526 -1.979 4.367 1.00 0.00 C ATOM 1877 O LYS A 592 -27.554 -1.736 4.999 1.00 0.00 O ATOM 1878 CB LYS A 592 -25.029 -3.974 4.554 1.00 0.00 C ATOM 1879 CG LYS A 592 -23.556 -4.344 4.537 1.00 0.00 C ATOM 1880 CD LYS A 592 -23.248 -5.359 3.449 1.00 0.00 C ATOM 1881 CE LYS A 592 -23.447 -6.784 3.944 1.00 0.00 C ATOM 1882 NZ LYS A 592 -22.381 -7.193 4.899 1.00 0.00 N ATOM 0 H LYS A 592 -26.319 -3.047 6.828 1.00 0.00 H new ATOM 0 HA LYS A 592 -24.442 -1.924 4.833 1.00 0.00 H new ATOM 0 HB2 LYS A 592 -25.566 -4.685 5.181 1.00 0.00 H new ATOM 0 HB3 LYS A 592 -25.431 -4.071 3.546 1.00 0.00 H new ATOM 0 HG2 LYS A 592 -22.957 -3.447 4.379 1.00 0.00 H new ATOM 0 HG3 LYS A 592 -23.271 -4.751 5.507 1.00 0.00 H new ATOM 0 HD2 LYS A 592 -23.892 -5.178 2.588 1.00 0.00 H new ATOM 0 HD3 LYS A 592 -22.220 -5.230 3.110 1.00 0.00 H new ATOM 0 HE2 LYS A 592 -24.420 -6.868 4.428 1.00 0.00 H new ATOM 0 HE3 LYS A 592 -23.454 -7.466 3.094 1.00 0.00 H new ATOM 0 HZ1 LYS A 592 -22.365 -8.230 4.978 1.00 0.00 H new ATOM 0 HZ2 LYS A 592 -21.459 -6.857 4.555 1.00 0.00 H new ATOM 0 HZ3 LYS A 592 -22.574 -6.778 5.833 1.00 0.00 H new ATOM 1896 N SER A 593 -26.413 -1.763 3.060 1.00 0.00 N ATOM 1897 CA SER A 593 -27.513 -1.213 2.278 1.00 0.00 C ATOM 1898 C SER A 593 -28.078 -2.260 1.323 1.00 0.00 C ATOM 1899 O SER A 593 -27.477 -3.314 1.113 1.00 0.00 O ATOM 1900 CB SER A 593 -27.043 0.011 1.489 1.00 0.00 C ATOM 1901 OG SER A 593 -28.141 0.816 1.095 1.00 0.00 O ATOM 0 H SER A 593 -25.570 -1.961 2.521 1.00 0.00 H new ATOM 0 HA SER A 593 -28.302 -0.912 2.968 1.00 0.00 H new ATOM 0 HB2 SER A 593 -26.357 0.599 2.099 1.00 0.00 H new ATOM 0 HB3 SER A 593 -26.489 -0.311 0.607 1.00 0.00 H new ATOM 0 HG SER A 593 -27.814 1.592 0.594 1.00 0.00 H new ATOM 1907 N SER A 594 -29.239 -1.962 0.748 1.00 0.00 N ATOM 1908 CA SER A 594 -29.889 -2.878 -0.182 1.00 0.00 C ATOM 1909 C SER A 594 -30.424 -2.129 -1.399 1.00 0.00 C ATOM 1910 O SER A 594 -30.796 -0.960 -1.308 1.00 0.00 O ATOM 1911 CB SER A 594 -31.030 -3.622 0.516 1.00 0.00 C ATOM 1912 OG SER A 594 -31.743 -4.435 -0.400 1.00 0.00 O ATOM 0 H SER A 594 -29.749 -1.093 0.910 1.00 0.00 H new ATOM 0 HA SER A 594 -29.146 -3.601 -0.520 1.00 0.00 H new ATOM 0 HB2 SER A 594 -30.628 -4.240 1.319 1.00 0.00 H new ATOM 0 HB3 SER A 594 -31.709 -2.904 0.975 1.00 0.00 H new ATOM 0 HG SER A 594 -32.466 -4.901 0.070 1.00 0.00 H new ATOM 1918 N GLY A 595 -30.458 -2.813 -2.539 1.00 0.00 N ATOM 1919 CA GLY A 595 -30.948 -2.197 -3.758 1.00 0.00 C ATOM 1920 C GLY A 595 -32.303 -2.735 -4.175 1.00 0.00 C ATOM 1921 O GLY A 595 -32.491 -3.939 -4.346 1.00 0.00 O ATOM 0 H GLY A 595 -30.155 -3.782 -2.640 1.00 0.00 H new ATOM 0 HA2 GLY A 595 -31.017 -1.119 -3.614 1.00 0.00 H new ATOM 0 HA3 GLY A 595 -30.230 -2.366 -4.561 1.00 0.00 H new ATOM 1925 N PRO A 596 -33.277 -1.829 -4.343 1.00 0.00 N ATOM 1926 CA PRO A 596 -34.639 -2.195 -4.743 1.00 0.00 C ATOM 1927 C PRO A 596 -34.708 -2.682 -6.186 1.00 0.00 C ATOM 1928 O PRO A 596 -33.682 -2.853 -6.843 1.00 0.00 O ATOM 1929 CB PRO A 596 -35.420 -0.889 -4.581 1.00 0.00 C ATOM 1930 CG PRO A 596 -34.398 0.185 -4.727 1.00 0.00 C ATOM 1931 CD PRO A 596 -33.125 -0.376 -4.156 1.00 0.00 C ATOM 0 HA PRO A 596 -35.031 -3.018 -4.146 1.00 0.00 H new ATOM 0 HB2 PRO A 596 -36.200 -0.798 -5.337 1.00 0.00 H new ATOM 0 HB3 PRO A 596 -35.910 -0.839 -3.609 1.00 0.00 H new ATOM 0 HG2 PRO A 596 -34.268 0.461 -5.774 1.00 0.00 H new ATOM 0 HG3 PRO A 596 -34.701 1.087 -4.195 1.00 0.00 H new ATOM 0 HD2 PRO A 596 -32.248 0.007 -4.678 1.00 0.00 H new ATOM 0 HD3 PRO A 596 -33.008 -0.117 -3.104 1.00 0.00 H new ATOM 1939 N SER A 597 -35.925 -2.902 -6.674 1.00 0.00 N ATOM 1940 CA SER A 597 -36.128 -3.372 -8.040 1.00 0.00 C ATOM 1941 C SER A 597 -37.281 -2.626 -8.705 1.00 0.00 C ATOM 1942 O SER A 597 -38.012 -1.882 -8.053 1.00 0.00 O ATOM 1943 CB SER A 597 -36.406 -4.876 -8.048 1.00 0.00 C ATOM 1944 OG SER A 597 -35.201 -5.617 -8.133 1.00 0.00 O ATOM 0 H SER A 597 -36.785 -2.762 -6.144 1.00 0.00 H new ATOM 0 HA SER A 597 -35.217 -3.175 -8.605 1.00 0.00 H new ATOM 0 HB2 SER A 597 -36.945 -5.154 -7.142 1.00 0.00 H new ATOM 0 HB3 SER A 597 -37.050 -5.125 -8.891 1.00 0.00 H new ATOM 0 HG SER A 597 -35.406 -6.575 -8.135 1.00 0.00 H new ATOM 1950 N SER A 598 -37.435 -2.832 -10.009 1.00 0.00 N ATOM 1951 CA SER A 598 -38.496 -2.178 -10.766 1.00 0.00 C ATOM 1952 C SER A 598 -39.867 -2.692 -10.336 1.00 0.00 C ATOM 1953 O SER A 598 -40.701 -1.934 -9.843 1.00 0.00 O ATOM 1954 CB SER A 598 -38.299 -2.408 -12.265 1.00 0.00 C ATOM 1955 OG SER A 598 -39.448 -2.015 -12.997 1.00 0.00 O ATOM 0 H SER A 598 -36.839 -3.446 -10.563 1.00 0.00 H new ATOM 0 HA SER A 598 -38.448 -1.109 -10.561 1.00 0.00 H new ATOM 0 HB2 SER A 598 -37.433 -1.845 -12.612 1.00 0.00 H new ATOM 0 HB3 SER A 598 -38.089 -3.461 -12.450 1.00 0.00 H new ATOM 0 HG SER A 598 -39.296 -2.171 -13.953 1.00 0.00 H new ATOM 1961 N GLY A 599 -40.092 -3.989 -10.529 1.00 0.00 N ATOM 1962 CA GLY A 599 -41.362 -4.584 -10.157 1.00 0.00 C ATOM 1963 C GLY A 599 -41.926 -5.474 -11.246 1.00 0.00 C ATOM 1964 O GLY A 599 -41.188 -6.212 -11.899 1.00 0.00 O ATOM 0 H GLY A 599 -39.418 -4.637 -10.936 1.00 0.00 H new ATOM 0 HA2 GLY A 599 -41.233 -5.168 -9.245 1.00 0.00 H new ATOM 0 HA3 GLY A 599 -42.078 -3.794 -9.931 1.00 0.00 H new TER 1968 GLY A 599