USER MOD reduce.3.24.130724 H: found=0, std=0, add=635, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 637 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 581 MET CE :methyl 136:sc= -6.91 (180deg=-7.55!) USER MOD Set 1.2: A 595 HIS : no HD1:sc= -2.88 K(o=-9.8,f=-6.7!) USER MOD Set 2.1: A 574 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 604 HIS : no HD1:sc= -0.27 X(o=-0.27,f=-0.23) USER MOD Set 3.1: A 571 THR OG1 : rot -21:sc= -0.0249 USER MOD Set 3.2: A 572 THR OG1 : rot 180:sc= 0.263 USER MOD Set 3.3: A 575 GLN : amide:sc= 1.1 K(o=1.3,f=-7.7!) USER MOD Single : A 542 SER OG : rot 180:sc= 0 USER MOD Single : A 543 TYR OH : rot 180:sc= 0 USER MOD Single : A 545 THR OG1 : rot 180:sc= 0.0342 USER MOD Single : A 547 CYS SG : rot 180:sc= 0 USER MOD Single : A 548 SER OG : rot 180:sc= 0.302 USER MOD Single : A 551 SER OG : rot 180:sc= 0 USER MOD Single : A 558 CYS SG : rot 14:sc= 0.305 USER MOD Single : A 559 SER OG : rot 180:sc= 0 USER MOD Single : A 560 SER OG : rot 180:sc= 0 USER MOD Single : A 561 CYS SG : rot -41:sc= -0.174 USER MOD Single : A 564 TYR OH : rot 180:sc= 0 USER MOD Single : A 566 THR OG1 : rot 28:sc= -0.206 USER MOD Single : A 567 THR OG1 : rot 43:sc= 0.304 USER MOD Single : A 568 GLN : amide:sc= -0.772 X(o=-0.77,f=-0.77) USER MOD Single : A 578 HIS : no HD1:sc= -0.252 X(o=-0.25,f=-0.027) USER MOD Single : A 579 TYR OH : rot -176:sc= -4.27! USER MOD Single : A 580 SER OG : rot -81:sc= 1.24 USER MOD Single : A 586 SER OG : rot -72:sc= 0.087 USER MOD Single : A 588 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 592 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 599 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0111) USER MOD Single : A 606 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 608 HIS : no HD1:sc= -0.0702 X(o=-0.07,f=-0.33) USER MOD Single : A 611 SER OG : rot 180:sc= 0.128 USER MOD Single : A 612 SER OG : rot -57:sc= -0.0312 USER MOD Single : A 614 SER OG : rot 180:sc= 0 USER MOD Single : A 615 HIS : no HD1:sc= -0.108 X(o=-0.11,f=-0.0019) USER MOD Single : A 619 THR OG1 : rot 180:sc= -0.215 USER MOD Single : A 621 SER OG : rot 180:sc= -0.406 USER MOD Single : A 622 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 541 18.576 18.121 4.064 1.00 0.00 N ATOM 2 CA GLY A 541 18.363 16.883 3.264 1.00 0.00 C ATOM 3 C GLY A 541 17.701 17.163 1.930 1.00 0.00 C ATOM 4 O GLY A 541 17.619 18.313 1.497 1.00 0.00 O ATOM 0 HA2 GLY A 541 19.322 16.394 3.095 1.00 0.00 H new ATOM 0 HA3 GLY A 541 17.746 16.187 3.833 1.00 0.00 H new ATOM 9 N SER A 542 17.226 16.109 1.273 1.00 0.00 N ATOM 10 CA SER A 542 16.569 16.246 -0.021 1.00 0.00 C ATOM 11 C SER A 542 15.342 15.344 -0.106 1.00 0.00 C ATOM 12 O SER A 542 14.222 15.818 -0.297 1.00 0.00 O ATOM 13 CB SER A 542 17.542 15.908 -1.150 1.00 0.00 C ATOM 14 OG SER A 542 18.378 14.819 -0.796 1.00 0.00 O ATOM 0 H SER A 542 17.284 15.150 1.616 1.00 0.00 H new ATOM 0 HA SER A 542 16.246 17.282 -0.128 1.00 0.00 H new ATOM 0 HB2 SER A 542 16.984 15.663 -2.054 1.00 0.00 H new ATOM 0 HB3 SER A 542 18.154 16.780 -1.380 1.00 0.00 H new ATOM 0 HG SER A 542 18.990 14.622 -1.536 1.00 0.00 H new ATOM 20 N TYR A 543 15.560 14.041 0.036 1.00 0.00 N ATOM 21 CA TYR A 543 14.473 13.071 -0.025 1.00 0.00 C ATOM 22 C TYR A 543 13.773 12.949 1.327 1.00 0.00 C ATOM 23 O TYR A 543 14.351 13.271 2.365 1.00 0.00 O ATOM 24 CB TYR A 543 15.005 11.705 -0.461 1.00 0.00 C ATOM 25 CG TYR A 543 15.349 11.629 -1.931 1.00 0.00 C ATOM 26 CD1 TYR A 543 14.401 11.233 -2.866 1.00 0.00 C ATOM 27 CD2 TYR A 543 16.622 11.954 -2.384 1.00 0.00 C ATOM 28 CE1 TYR A 543 14.712 11.162 -4.211 1.00 0.00 C ATOM 29 CE2 TYR A 543 16.940 11.886 -3.727 1.00 0.00 C ATOM 30 CZ TYR A 543 15.982 11.489 -4.636 1.00 0.00 C ATOM 31 OH TYR A 543 16.295 11.420 -5.974 1.00 0.00 O ATOM 0 H TYR A 543 16.481 13.632 0.194 1.00 0.00 H new ATOM 0 HA TYR A 543 13.747 13.423 -0.758 1.00 0.00 H new ATOM 0 HB2 TYR A 543 15.893 11.467 0.124 1.00 0.00 H new ATOM 0 HB3 TYR A 543 14.259 10.944 -0.231 1.00 0.00 H new ATOM 0 HD1 TYR A 543 13.405 10.976 -2.537 1.00 0.00 H new ATOM 0 HD2 TYR A 543 17.375 12.265 -1.675 1.00 0.00 H new ATOM 0 HE1 TYR A 543 13.964 10.852 -4.925 1.00 0.00 H new ATOM 0 HE2 TYR A 543 17.934 12.142 -4.063 1.00 0.00 H new ATOM 0 HH TYR A 543 17.230 11.684 -6.105 1.00 0.00 H new ATOM 41 N PRO A 544 12.514 12.479 1.331 1.00 0.00 N ATOM 42 CA PRO A 544 11.737 12.314 2.565 1.00 0.00 C ATOM 43 C PRO A 544 12.305 11.220 3.463 1.00 0.00 C ATOM 44 O PRO A 544 12.638 10.132 2.995 1.00 0.00 O ATOM 45 CB PRO A 544 10.343 11.925 2.063 1.00 0.00 C ATOM 46 CG PRO A 544 10.575 11.333 0.717 1.00 0.00 C ATOM 47 CD PRO A 544 11.750 12.071 0.138 1.00 0.00 C ATOM 0 HA PRO A 544 11.746 13.217 3.175 1.00 0.00 H new ATOM 0 HB2 PRO A 544 9.867 11.209 2.733 1.00 0.00 H new ATOM 0 HB3 PRO A 544 9.687 12.793 2.005 1.00 0.00 H new ATOM 0 HG2 PRO A 544 10.782 10.265 0.791 1.00 0.00 H new ATOM 0 HG3 PRO A 544 9.694 11.444 0.085 1.00 0.00 H new ATOM 0 HD2 PRO A 544 12.341 11.434 -0.520 1.00 0.00 H new ATOM 0 HD3 PRO A 544 11.434 12.932 -0.451 1.00 0.00 H new ATOM 55 N THR A 545 12.412 11.516 4.754 1.00 0.00 N ATOM 56 CA THR A 545 12.941 10.557 5.717 1.00 0.00 C ATOM 57 C THR A 545 12.099 9.285 5.739 1.00 0.00 C ATOM 58 O THR A 545 12.609 8.196 6.000 1.00 0.00 O ATOM 59 CB THR A 545 12.985 11.177 7.115 1.00 0.00 C ATOM 60 OG1 THR A 545 13.375 12.538 7.047 1.00 0.00 O ATOM 61 CG2 THR A 545 13.941 10.473 8.052 1.00 0.00 C ATOM 0 H THR A 545 12.139 12.412 5.158 1.00 0.00 H new ATOM 0 HA THR A 545 13.954 10.295 5.411 1.00 0.00 H new ATOM 0 HB THR A 545 11.974 11.074 7.509 1.00 0.00 H new ATOM 0 HG1 THR A 545 13.396 12.918 7.950 1.00 0.00 H new ATOM 0 HG21 THR A 545 13.923 10.963 9.025 1.00 0.00 H new ATOM 0 HG22 THR A 545 13.639 9.432 8.164 1.00 0.00 H new ATOM 0 HG23 THR A 545 14.950 10.516 7.642 1.00 0.00 H new ATOM 69 N ASP A 546 10.808 9.431 5.463 1.00 0.00 N ATOM 70 CA ASP A 546 9.897 8.292 5.451 1.00 0.00 C ATOM 71 C ASP A 546 9.037 8.294 4.190 1.00 0.00 C ATOM 72 O ASP A 546 8.490 9.326 3.801 1.00 0.00 O ATOM 73 CB ASP A 546 9.005 8.313 6.693 1.00 0.00 C ATOM 74 CG ASP A 546 9.576 7.486 7.828 1.00 0.00 C ATOM 75 OD1 ASP A 546 10.685 7.812 8.300 1.00 0.00 O ATOM 76 OD2 ASP A 546 8.913 6.514 8.246 1.00 0.00 O ATOM 0 H ASP A 546 10.369 10.325 5.245 1.00 0.00 H new ATOM 0 HA ASP A 546 10.495 7.381 5.458 1.00 0.00 H new ATOM 0 HB2 ASP A 546 8.875 9.343 7.027 1.00 0.00 H new ATOM 0 HB3 ASP A 546 8.016 7.935 6.433 1.00 0.00 H new ATOM 81 N CYS A 547 8.923 7.131 3.554 1.00 0.00 N ATOM 82 CA CYS A 547 8.131 7.001 2.337 1.00 0.00 C ATOM 83 C CYS A 547 6.638 7.087 2.644 1.00 0.00 C ATOM 84 O CYS A 547 6.159 6.524 3.629 1.00 0.00 O ATOM 85 CB CYS A 547 8.452 5.685 1.631 1.00 0.00 C ATOM 86 SG CYS A 547 9.699 5.831 0.329 1.00 0.00 S ATOM 0 H CYS A 547 9.369 6.267 3.862 1.00 0.00 H new ATOM 0 HA CYS A 547 8.390 7.827 1.675 1.00 0.00 H new ATOM 0 HB2 CYS A 547 8.797 4.963 2.371 1.00 0.00 H new ATOM 0 HB3 CYS A 547 7.535 5.284 1.198 1.00 0.00 H new ATOM 0 HG CYS A 547 9.904 4.665 -0.208 1.00 0.00 H new ATOM 92 N SER A 548 5.914 7.807 1.795 1.00 0.00 N ATOM 93 CA SER A 548 4.476 7.989 1.960 1.00 0.00 C ATOM 94 C SER A 548 3.694 7.147 0.961 1.00 0.00 C ATOM 95 O SER A 548 4.178 6.859 -0.132 1.00 0.00 O ATOM 96 CB SER A 548 4.106 9.462 1.767 1.00 0.00 C ATOM 97 OG SER A 548 4.211 9.834 0.401 1.00 0.00 O ATOM 0 H SER A 548 6.303 8.278 0.978 1.00 0.00 H new ATOM 0 HA SER A 548 4.216 7.668 2.969 1.00 0.00 H new ATOM 0 HB2 SER A 548 3.089 9.635 2.118 1.00 0.00 H new ATOM 0 HB3 SER A 548 4.763 10.089 2.371 1.00 0.00 H new ATOM 0 HG SER A 548 3.969 10.778 0.300 1.00 0.00 H new ATOM 103 N ILE A 549 2.471 6.785 1.330 1.00 0.00 N ATOM 104 CA ILE A 549 1.610 6.009 0.447 1.00 0.00 C ATOM 105 C ILE A 549 1.279 6.826 -0.797 1.00 0.00 C ATOM 106 O ILE A 549 1.030 6.278 -1.869 1.00 0.00 O ATOM 107 CB ILE A 549 0.293 5.609 1.143 1.00 0.00 C ATOM 108 CG1 ILE A 549 0.574 4.951 2.496 1.00 0.00 C ATOM 109 CG2 ILE A 549 -0.520 4.679 0.251 1.00 0.00 C ATOM 110 CD1 ILE A 549 1.239 3.597 2.388 1.00 0.00 C ATOM 0 H ILE A 549 2.054 7.016 2.232 1.00 0.00 H new ATOM 0 HA ILE A 549 2.149 5.101 0.176 1.00 0.00 H new ATOM 0 HB ILE A 549 -0.290 6.513 1.320 1.00 0.00 H new ATOM 0 HG12 ILE A 549 1.209 5.612 3.086 1.00 0.00 H new ATOM 0 HG13 ILE A 549 -0.365 4.842 3.039 1.00 0.00 H new ATOM 0 HG21 ILE A 549 -1.446 4.407 0.757 1.00 0.00 H new ATOM 0 HG22 ILE A 549 -0.754 5.186 -0.685 1.00 0.00 H new ATOM 0 HG23 ILE A 549 0.058 3.779 0.042 1.00 0.00 H new ATOM 0 HD11 ILE A 549 1.406 3.193 3.387 1.00 0.00 H new ATOM 0 HD12 ILE A 549 0.596 2.920 1.826 1.00 0.00 H new ATOM 0 HD13 ILE A 549 2.194 3.701 1.874 1.00 0.00 H new ATOM 122 N VAL A 550 1.279 8.150 -0.635 1.00 0.00 N ATOM 123 CA VAL A 550 0.979 9.063 -1.731 1.00 0.00 C ATOM 124 C VAL A 550 2.031 8.963 -2.833 1.00 0.00 C ATOM 125 O VAL A 550 1.699 8.805 -4.008 1.00 0.00 O ATOM 126 CB VAL A 550 0.905 10.519 -1.220 1.00 0.00 C ATOM 127 CG1 VAL A 550 0.774 11.502 -2.373 1.00 0.00 C ATOM 128 CG2 VAL A 550 -0.249 10.678 -0.240 1.00 0.00 C ATOM 0 H VAL A 550 1.485 8.612 0.250 1.00 0.00 H new ATOM 0 HA VAL A 550 0.011 8.777 -2.143 1.00 0.00 H new ATOM 0 HB VAL A 550 1.836 10.743 -0.699 1.00 0.00 H new ATOM 0 HG11 VAL A 550 0.724 12.518 -1.981 1.00 0.00 H new ATOM 0 HG12 VAL A 550 1.638 11.409 -3.031 1.00 0.00 H new ATOM 0 HG13 VAL A 550 -0.135 11.285 -2.935 1.00 0.00 H new ATOM 0 HG21 VAL A 550 -0.288 11.709 0.111 1.00 0.00 H new ATOM 0 HG22 VAL A 550 -1.186 10.428 -0.738 1.00 0.00 H new ATOM 0 HG23 VAL A 550 -0.100 10.011 0.609 1.00 0.00 H new ATOM 138 N SER A 551 3.300 9.039 -2.445 1.00 0.00 N ATOM 139 CA SER A 551 4.392 8.940 -3.406 1.00 0.00 C ATOM 140 C SER A 551 4.615 7.484 -3.789 1.00 0.00 C ATOM 141 O SER A 551 4.925 7.164 -4.938 1.00 0.00 O ATOM 142 CB SER A 551 5.676 9.534 -2.821 1.00 0.00 C ATOM 143 OG SER A 551 5.554 10.933 -2.638 1.00 0.00 O ATOM 0 H SER A 551 3.596 9.168 -1.478 1.00 0.00 H new ATOM 0 HA SER A 551 4.125 9.506 -4.298 1.00 0.00 H new ATOM 0 HB2 SER A 551 5.899 9.057 -1.866 1.00 0.00 H new ATOM 0 HB3 SER A 551 6.514 9.323 -3.486 1.00 0.00 H new ATOM 0 HG SER A 551 6.387 11.288 -2.262 1.00 0.00 H new ATOM 149 N PHE A 552 4.440 6.607 -2.808 1.00 0.00 N ATOM 150 CA PHE A 552 4.604 5.176 -3.008 1.00 0.00 C ATOM 151 C PHE A 552 3.603 4.662 -4.041 1.00 0.00 C ATOM 152 O PHE A 552 3.964 3.919 -4.954 1.00 0.00 O ATOM 153 CB PHE A 552 4.427 4.457 -1.665 1.00 0.00 C ATOM 154 CG PHE A 552 4.022 3.016 -1.774 1.00 0.00 C ATOM 155 CD1 PHE A 552 2.982 2.526 -1.004 1.00 0.00 C ATOM 156 CD2 PHE A 552 4.679 2.154 -2.636 1.00 0.00 C ATOM 157 CE1 PHE A 552 2.602 1.205 -1.089 1.00 0.00 C ATOM 158 CE2 PHE A 552 4.304 0.828 -2.728 1.00 0.00 C ATOM 159 CZ PHE A 552 3.263 0.351 -1.953 1.00 0.00 C ATOM 0 H PHE A 552 4.182 6.868 -1.856 1.00 0.00 H new ATOM 0 HA PHE A 552 5.605 4.974 -3.390 1.00 0.00 H new ATOM 0 HB2 PHE A 552 5.364 4.516 -1.110 1.00 0.00 H new ATOM 0 HB3 PHE A 552 3.676 4.988 -1.080 1.00 0.00 H new ATOM 0 HD1 PHE A 552 2.462 3.188 -0.328 1.00 0.00 H new ATOM 0 HD2 PHE A 552 5.493 2.522 -3.243 1.00 0.00 H new ATOM 0 HE1 PHE A 552 1.789 0.836 -0.482 1.00 0.00 H new ATOM 0 HE2 PHE A 552 4.823 0.165 -3.404 1.00 0.00 H new ATOM 0 HZ PHE A 552 2.967 -0.685 -2.022 1.00 0.00 H new ATOM 169 N LEU A 553 2.346 5.068 -3.894 1.00 0.00 N ATOM 170 CA LEU A 553 1.297 4.654 -4.818 1.00 0.00 C ATOM 171 C LEU A 553 1.433 5.386 -6.148 1.00 0.00 C ATOM 172 O LEU A 553 1.235 4.801 -7.213 1.00 0.00 O ATOM 173 CB LEU A 553 -0.085 4.920 -4.217 1.00 0.00 C ATOM 174 CG LEU A 553 -0.560 3.883 -3.199 1.00 0.00 C ATOM 175 CD1 LEU A 553 -1.943 4.241 -2.676 1.00 0.00 C ATOM 176 CD2 LEU A 553 -0.566 2.494 -3.819 1.00 0.00 C ATOM 0 H LEU A 553 2.029 5.683 -3.144 1.00 0.00 H new ATOM 0 HA LEU A 553 1.405 3.584 -4.994 1.00 0.00 H new ATOM 0 HB2 LEU A 553 -0.073 5.899 -3.737 1.00 0.00 H new ATOM 0 HB3 LEU A 553 -0.813 4.971 -5.027 1.00 0.00 H new ATOM 0 HG LEU A 553 0.134 3.882 -2.358 1.00 0.00 H new ATOM 0 HD11 LEU A 553 -2.264 3.491 -1.953 1.00 0.00 H new ATOM 0 HD12 LEU A 553 -1.908 5.218 -2.194 1.00 0.00 H new ATOM 0 HD13 LEU A 553 -2.649 4.270 -3.506 1.00 0.00 H new ATOM 0 HD21 LEU A 553 -0.907 1.768 -3.081 1.00 0.00 H new ATOM 0 HD22 LEU A 553 -1.238 2.482 -4.677 1.00 0.00 H new ATOM 0 HD23 LEU A 553 0.442 2.236 -4.144 1.00 0.00 H new ATOM 188 N ALA A 554 1.775 6.670 -6.078 1.00 0.00 N ATOM 189 CA ALA A 554 1.943 7.481 -7.278 1.00 0.00 C ATOM 190 C ALA A 554 2.961 6.851 -8.221 1.00 0.00 C ATOM 191 O ALA A 554 2.796 6.881 -9.441 1.00 0.00 O ATOM 192 CB ALA A 554 2.366 8.894 -6.907 1.00 0.00 C ATOM 0 H ALA A 554 1.941 7.169 -5.204 1.00 0.00 H new ATOM 0 HA ALA A 554 0.985 7.528 -7.795 1.00 0.00 H new ATOM 0 HB1 ALA A 554 2.487 9.487 -7.813 1.00 0.00 H new ATOM 0 HB2 ALA A 554 1.603 9.348 -6.275 1.00 0.00 H new ATOM 0 HB3 ALA A 554 3.312 8.860 -6.366 1.00 0.00 H new ATOM 198 N ARG A 555 4.010 6.275 -7.645 1.00 0.00 N ATOM 199 CA ARG A 555 5.054 5.629 -8.430 1.00 0.00 C ATOM 200 C ARG A 555 4.517 4.380 -9.121 1.00 0.00 C ATOM 201 O ARG A 555 5.000 3.991 -10.185 1.00 0.00 O ATOM 202 CB ARG A 555 6.242 5.265 -7.536 1.00 0.00 C ATOM 203 CG ARG A 555 7.587 5.682 -8.110 1.00 0.00 C ATOM 204 CD ARG A 555 7.912 4.911 -9.380 1.00 0.00 C ATOM 205 NE ARG A 555 9.336 4.969 -9.705 1.00 0.00 N ATOM 206 CZ ARG A 555 9.833 4.697 -10.909 1.00 0.00 C ATOM 207 NH1 ARG A 555 9.027 4.348 -11.904 1.00 0.00 N ATOM 208 NH2 ARG A 555 11.140 4.776 -11.119 1.00 0.00 N ATOM 0 H ARG A 555 4.160 6.242 -6.637 1.00 0.00 H new ATOM 0 HA ARG A 555 5.388 6.330 -9.195 1.00 0.00 H new ATOM 0 HB2 ARG A 555 6.110 5.736 -6.562 1.00 0.00 H new ATOM 0 HB3 ARG A 555 6.245 4.188 -7.371 1.00 0.00 H new ATOM 0 HG2 ARG A 555 7.577 6.751 -8.324 1.00 0.00 H new ATOM 0 HG3 ARG A 555 8.369 5.512 -7.370 1.00 0.00 H new ATOM 0 HD2 ARG A 555 7.609 3.871 -9.260 1.00 0.00 H new ATOM 0 HD3 ARG A 555 7.334 5.318 -10.209 1.00 0.00 H new ATOM 0 HE ARG A 555 9.987 5.233 -8.965 1.00 0.00 H new ATOM 0 HH11 ARG A 555 8.021 4.287 -11.748 1.00 0.00 H new ATOM 0 HH12 ARG A 555 9.414 4.141 -12.825 1.00 0.00 H new ATOM 0 HH21 ARG A 555 11.763 5.045 -10.358 1.00 0.00 H new ATOM 0 HH22 ARG A 555 11.522 4.568 -12.042 1.00 0.00 H new ATOM 222 N LEU A 556 3.514 3.755 -8.510 1.00 0.00 N ATOM 223 CA LEU A 556 2.910 2.550 -9.067 1.00 0.00 C ATOM 224 C LEU A 556 1.673 2.887 -9.898 1.00 0.00 C ATOM 225 O LEU A 556 1.222 2.077 -10.710 1.00 0.00 O ATOM 226 CB LEU A 556 2.535 1.577 -7.947 1.00 0.00 C ATOM 227 CG LEU A 556 3.610 1.377 -6.876 1.00 0.00 C ATOM 228 CD1 LEU A 556 3.012 0.738 -5.633 1.00 0.00 C ATOM 229 CD2 LEU A 556 4.749 0.528 -7.419 1.00 0.00 C ATOM 0 H LEU A 556 3.103 4.064 -7.629 1.00 0.00 H new ATOM 0 HA LEU A 556 3.644 2.079 -9.720 1.00 0.00 H new ATOM 0 HB2 LEU A 556 1.625 1.935 -7.465 1.00 0.00 H new ATOM 0 HB3 LEU A 556 2.301 0.609 -8.390 1.00 0.00 H new ATOM 0 HG LEU A 556 4.009 2.353 -6.601 1.00 0.00 H new ATOM 0 HD11 LEU A 556 3.791 0.603 -4.882 1.00 0.00 H new ATOM 0 HD12 LEU A 556 2.230 1.383 -5.233 1.00 0.00 H new ATOM 0 HD13 LEU A 556 2.586 -0.231 -5.891 1.00 0.00 H new ATOM 0 HD21 LEU A 556 5.505 0.395 -6.645 1.00 0.00 H new ATOM 0 HD22 LEU A 556 4.365 -0.446 -7.722 1.00 0.00 H new ATOM 0 HD23 LEU A 556 5.195 1.025 -8.280 1.00 0.00 H new ATOM 241 N GLY A 557 1.128 4.083 -9.694 1.00 0.00 N ATOM 242 CA GLY A 557 -0.048 4.497 -10.434 1.00 0.00 C ATOM 243 C GLY A 557 -1.337 4.028 -9.789 1.00 0.00 C ATOM 244 O GLY A 557 -2.217 3.492 -10.463 1.00 0.00 O ATOM 0 H GLY A 557 1.481 4.772 -9.029 1.00 0.00 H new ATOM 0 HA2 GLY A 557 -0.060 5.584 -10.512 1.00 0.00 H new ATOM 0 HA3 GLY A 557 0.010 4.105 -11.449 1.00 0.00 H new ATOM 248 N CYS A 558 -1.450 4.229 -8.479 1.00 0.00 N ATOM 249 CA CYS A 558 -2.642 3.821 -7.744 1.00 0.00 C ATOM 250 C CYS A 558 -2.941 4.792 -6.606 1.00 0.00 C ATOM 251 O CYS A 558 -3.248 4.380 -5.487 1.00 0.00 O ATOM 252 CB CYS A 558 -2.466 2.406 -7.192 1.00 0.00 C ATOM 253 SG CYS A 558 -2.585 1.106 -8.443 1.00 0.00 S ATOM 0 H CYS A 558 -0.731 4.671 -7.906 1.00 0.00 H new ATOM 0 HA CYS A 558 -3.485 3.832 -8.435 1.00 0.00 H new ATOM 0 HB2 CYS A 558 -1.495 2.337 -6.703 1.00 0.00 H new ATOM 0 HB3 CYS A 558 -3.222 2.229 -6.427 1.00 0.00 H new ATOM 0 HG CYS A 558 -2.501 1.635 -9.628 1.00 0.00 H new ATOM 259 N SER A 559 -2.852 6.085 -6.897 1.00 0.00 N ATOM 260 CA SER A 559 -3.115 7.114 -5.897 1.00 0.00 C ATOM 261 C SER A 559 -4.543 7.011 -5.369 1.00 0.00 C ATOM 262 O SER A 559 -4.813 7.336 -4.214 1.00 0.00 O ATOM 263 CB SER A 559 -2.878 8.504 -6.491 1.00 0.00 C ATOM 264 OG SER A 559 -2.295 9.374 -5.537 1.00 0.00 O ATOM 0 H SER A 559 -2.600 6.446 -7.817 1.00 0.00 H new ATOM 0 HA SER A 559 -2.428 6.959 -5.065 1.00 0.00 H new ATOM 0 HB2 SER A 559 -2.227 8.425 -7.361 1.00 0.00 H new ATOM 0 HB3 SER A 559 -3.824 8.921 -6.838 1.00 0.00 H new ATOM 0 HG SER A 559 -2.152 10.255 -5.942 1.00 0.00 H new ATOM 270 N SER A 560 -5.452 6.557 -6.224 1.00 0.00 N ATOM 271 CA SER A 560 -6.854 6.412 -5.845 1.00 0.00 C ATOM 272 C SER A 560 -7.019 5.392 -4.722 1.00 0.00 C ATOM 273 O SER A 560 -7.979 5.452 -3.953 1.00 0.00 O ATOM 274 CB SER A 560 -7.690 5.992 -7.056 1.00 0.00 C ATOM 275 OG SER A 560 -8.227 7.122 -7.721 1.00 0.00 O ATOM 0 H SER A 560 -5.244 6.283 -7.184 1.00 0.00 H new ATOM 0 HA SER A 560 -7.205 7.379 -5.484 1.00 0.00 H new ATOM 0 HB2 SER A 560 -7.072 5.419 -7.747 1.00 0.00 H new ATOM 0 HB3 SER A 560 -8.499 5.337 -6.734 1.00 0.00 H new ATOM 0 HG SER A 560 -8.755 6.827 -8.492 1.00 0.00 H new ATOM 281 N CYS A 561 -6.081 4.453 -4.633 1.00 0.00 N ATOM 282 CA CYS A 561 -6.129 3.419 -3.605 1.00 0.00 C ATOM 283 C CYS A 561 -5.832 3.994 -2.222 1.00 0.00 C ATOM 284 O CYS A 561 -6.166 3.386 -1.205 1.00 0.00 O ATOM 285 CB CYS A 561 -5.135 2.302 -3.926 1.00 0.00 C ATOM 286 SG CYS A 561 -5.841 0.935 -4.876 1.00 0.00 S ATOM 0 H CYS A 561 -5.279 4.387 -5.260 1.00 0.00 H new ATOM 0 HA CYS A 561 -7.139 3.010 -3.595 1.00 0.00 H new ATOM 0 HB2 CYS A 561 -4.299 2.724 -4.483 1.00 0.00 H new ATOM 0 HB3 CYS A 561 -4.731 1.911 -2.992 1.00 0.00 H new ATOM 0 HG CYS A 561 -7.031 0.665 -4.429 1.00 0.00 H new ATOM 292 N LEU A 562 -5.196 5.165 -2.185 1.00 0.00 N ATOM 293 CA LEU A 562 -4.852 5.805 -0.919 1.00 0.00 C ATOM 294 C LEU A 562 -6.062 5.900 0.006 1.00 0.00 C ATOM 295 O LEU A 562 -5.942 5.714 1.215 1.00 0.00 O ATOM 296 CB LEU A 562 -4.270 7.199 -1.159 1.00 0.00 C ATOM 297 CG LEU A 562 -3.116 7.577 -0.228 1.00 0.00 C ATOM 298 CD1 LEU A 562 -1.784 7.429 -0.943 1.00 0.00 C ATOM 299 CD2 LEU A 562 -3.286 8.996 0.294 1.00 0.00 C ATOM 0 H LEU A 562 -4.910 5.686 -3.014 1.00 0.00 H new ATOM 0 HA LEU A 562 -4.099 5.184 -0.434 1.00 0.00 H new ATOM 0 HB2 LEU A 562 -3.922 7.261 -2.190 1.00 0.00 H new ATOM 0 HB3 LEU A 562 -5.066 7.935 -1.047 1.00 0.00 H new ATOM 0 HG LEU A 562 -3.129 6.897 0.623 1.00 0.00 H new ATOM 0 HD11 LEU A 562 -0.975 7.702 -0.265 1.00 0.00 H new ATOM 0 HD12 LEU A 562 -1.656 6.395 -1.263 1.00 0.00 H new ATOM 0 HD13 LEU A 562 -1.764 8.084 -1.814 1.00 0.00 H new ATOM 0 HD21 LEU A 562 -2.454 9.243 0.954 1.00 0.00 H new ATOM 0 HD22 LEU A 562 -3.303 9.692 -0.544 1.00 0.00 H new ATOM 0 HD23 LEU A 562 -4.222 9.070 0.847 1.00 0.00 H new ATOM 311 N ASP A 563 -7.227 6.187 -0.568 1.00 0.00 N ATOM 312 CA ASP A 563 -8.452 6.305 0.217 1.00 0.00 C ATOM 313 C ASP A 563 -8.661 5.070 1.087 1.00 0.00 C ATOM 314 O ASP A 563 -9.087 5.172 2.238 1.00 0.00 O ATOM 315 CB ASP A 563 -9.657 6.503 -0.705 1.00 0.00 C ATOM 316 CG ASP A 563 -9.742 7.915 -1.250 1.00 0.00 C ATOM 317 OD1 ASP A 563 -8.898 8.278 -2.097 1.00 0.00 O ATOM 318 OD2 ASP A 563 -10.654 8.659 -0.831 1.00 0.00 O ATOM 0 H ASP A 563 -7.349 6.341 -1.569 1.00 0.00 H new ATOM 0 HA ASP A 563 -8.355 7.174 0.868 1.00 0.00 H new ATOM 0 HB2 ASP A 563 -9.595 5.799 -1.535 1.00 0.00 H new ATOM 0 HB3 ASP A 563 -10.571 6.272 -0.158 1.00 0.00 H new ATOM 323 N TYR A 564 -8.348 3.906 0.531 1.00 0.00 N ATOM 324 CA TYR A 564 -8.490 2.652 1.251 1.00 0.00 C ATOM 325 C TYR A 564 -7.510 2.585 2.418 1.00 0.00 C ATOM 326 O TYR A 564 -7.815 2.019 3.468 1.00 0.00 O ATOM 327 CB TYR A 564 -8.249 1.482 0.300 1.00 0.00 C ATOM 328 CG TYR A 564 -9.105 1.525 -0.945 1.00 0.00 C ATOM 329 CD1 TYR A 564 -8.527 1.480 -2.207 1.00 0.00 C ATOM 330 CD2 TYR A 564 -10.488 1.607 -0.858 1.00 0.00 C ATOM 331 CE1 TYR A 564 -9.305 1.518 -3.349 1.00 0.00 C ATOM 332 CE2 TYR A 564 -11.273 1.645 -1.996 1.00 0.00 C ATOM 333 CZ TYR A 564 -10.676 1.600 -3.238 1.00 0.00 C ATOM 334 OH TYR A 564 -11.454 1.637 -4.372 1.00 0.00 O ATOM 0 H TYR A 564 -7.993 3.807 -0.420 1.00 0.00 H new ATOM 0 HA TYR A 564 -9.503 2.592 1.649 1.00 0.00 H new ATOM 0 HB2 TYR A 564 -7.199 1.473 0.008 1.00 0.00 H new ATOM 0 HB3 TYR A 564 -8.441 0.549 0.830 1.00 0.00 H new ATOM 0 HD1 TYR A 564 -7.453 1.414 -2.298 1.00 0.00 H new ATOM 0 HD2 TYR A 564 -10.958 1.642 0.114 1.00 0.00 H new ATOM 0 HE1 TYR A 564 -8.841 1.484 -4.323 1.00 0.00 H new ATOM 0 HE2 TYR A 564 -12.348 1.710 -1.912 1.00 0.00 H new ATOM 0 HH TYR A 564 -12.399 1.694 -4.119 1.00 0.00 H new ATOM 344 N PHE A 565 -6.330 3.166 2.224 1.00 0.00 N ATOM 345 CA PHE A 565 -5.302 3.172 3.259 1.00 0.00 C ATOM 346 C PHE A 565 -5.637 4.176 4.356 1.00 0.00 C ATOM 347 O PHE A 565 -5.575 3.860 5.545 1.00 0.00 O ATOM 348 CB PHE A 565 -3.942 3.505 2.646 1.00 0.00 C ATOM 349 CG PHE A 565 -3.386 2.397 1.799 1.00 0.00 C ATOM 350 CD1 PHE A 565 -3.111 2.603 0.459 1.00 0.00 C ATOM 351 CD2 PHE A 565 -3.144 1.149 2.344 1.00 0.00 C ATOM 352 CE1 PHE A 565 -2.602 1.584 -0.323 1.00 0.00 C ATOM 353 CE2 PHE A 565 -2.637 0.125 1.570 1.00 0.00 C ATOM 354 CZ PHE A 565 -2.365 0.343 0.233 1.00 0.00 C ATOM 0 H PHE A 565 -6.062 3.638 1.360 1.00 0.00 H new ATOM 0 HA PHE A 565 -5.262 2.178 3.704 1.00 0.00 H new ATOM 0 HB2 PHE A 565 -4.035 4.405 2.039 1.00 0.00 H new ATOM 0 HB3 PHE A 565 -3.236 3.731 3.445 1.00 0.00 H new ATOM 0 HD1 PHE A 565 -3.296 3.572 0.019 1.00 0.00 H new ATOM 0 HD2 PHE A 565 -3.354 0.974 3.389 1.00 0.00 H new ATOM 0 HE1 PHE A 565 -2.390 1.758 -1.368 1.00 0.00 H new ATOM 0 HE2 PHE A 565 -2.453 -0.845 2.008 1.00 0.00 H new ATOM 0 HZ PHE A 565 -1.968 -0.456 -0.376 1.00 0.00 H new ATOM 364 N THR A 566 -5.989 5.388 3.946 1.00 0.00 N ATOM 365 CA THR A 566 -6.333 6.446 4.890 1.00 0.00 C ATOM 366 C THR A 566 -7.507 6.034 5.771 1.00 0.00 C ATOM 367 O THR A 566 -7.543 6.349 6.961 1.00 0.00 O ATOM 368 CB THR A 566 -6.674 7.736 4.141 1.00 0.00 C ATOM 369 OG1 THR A 566 -7.472 7.462 3.001 1.00 0.00 O ATOM 370 CG2 THR A 566 -5.451 8.502 3.679 1.00 0.00 C ATOM 0 H THR A 566 -6.044 5.664 2.966 1.00 0.00 H new ATOM 0 HA THR A 566 -5.467 6.620 5.529 1.00 0.00 H new ATOM 0 HB THR A 566 -7.216 8.351 4.859 1.00 0.00 H new ATOM 0 HG1 THR A 566 -7.999 6.651 3.158 1.00 0.00 H new ATOM 0 HG21 THR A 566 -5.764 9.405 3.155 1.00 0.00 H new ATOM 0 HG22 THR A 566 -4.845 8.775 4.543 1.00 0.00 H new ATOM 0 HG23 THR A 566 -4.863 7.878 3.006 1.00 0.00 H new ATOM 378 N THR A 567 -8.467 5.331 5.180 1.00 0.00 N ATOM 379 CA THR A 567 -9.646 4.880 5.914 1.00 0.00 C ATOM 380 C THR A 567 -9.256 4.052 7.137 1.00 0.00 C ATOM 381 O THR A 567 -10.014 3.965 8.103 1.00 0.00 O ATOM 382 CB THR A 567 -10.563 4.061 5.002 1.00 0.00 C ATOM 383 OG1 THR A 567 -9.811 3.373 4.016 1.00 0.00 O ATOM 384 CG2 THR A 567 -11.604 4.900 4.290 1.00 0.00 C ATOM 0 H THR A 567 -8.453 5.061 4.196 1.00 0.00 H new ATOM 0 HA THR A 567 -10.181 5.766 6.257 1.00 0.00 H new ATOM 0 HB THR A 567 -11.075 3.361 5.662 1.00 0.00 H new ATOM 0 HG1 THR A 567 -9.015 2.978 4.428 1.00 0.00 H new ATOM 0 HG21 THR A 567 -12.220 4.258 3.660 1.00 0.00 H new ATOM 0 HG22 THR A 567 -12.234 5.399 5.026 1.00 0.00 H new ATOM 0 HG23 THR A 567 -11.108 5.647 3.671 1.00 0.00 H new ATOM 392 N GLN A 568 -8.074 3.443 7.092 1.00 0.00 N ATOM 393 CA GLN A 568 -7.598 2.624 8.203 1.00 0.00 C ATOM 394 C GLN A 568 -6.584 3.379 9.060 1.00 0.00 C ATOM 395 O GLN A 568 -6.265 2.960 10.173 1.00 0.00 O ATOM 396 CB GLN A 568 -6.953 1.343 7.677 1.00 0.00 C ATOM 397 CG GLN A 568 -7.684 0.726 6.497 1.00 0.00 C ATOM 398 CD GLN A 568 -8.988 0.064 6.899 1.00 0.00 C ATOM 399 OE1 GLN A 568 -10.070 0.534 6.546 1.00 0.00 O ATOM 400 NE2 GLN A 568 -8.892 -1.032 7.641 1.00 0.00 N ATOM 0 H GLN A 568 -7.431 3.501 6.302 1.00 0.00 H new ATOM 0 HA GLN A 568 -8.461 2.378 8.821 1.00 0.00 H new ATOM 0 HB2 GLN A 568 -5.926 1.559 7.383 1.00 0.00 H new ATOM 0 HB3 GLN A 568 -6.906 0.613 8.485 1.00 0.00 H new ATOM 0 HG2 GLN A 568 -7.887 1.499 5.756 1.00 0.00 H new ATOM 0 HG3 GLN A 568 -7.039 -0.012 6.020 1.00 0.00 H new ATOM 0 HE21 GLN A 568 -7.974 -1.387 7.911 1.00 0.00 H new ATOM 0 HE22 GLN A 568 -9.736 -1.520 7.942 1.00 0.00 H new ATOM 409 N GLY A 569 -6.081 4.492 8.538 1.00 0.00 N ATOM 410 CA GLY A 569 -5.113 5.284 9.273 1.00 0.00 C ATOM 411 C GLY A 569 -3.700 5.151 8.729 1.00 0.00 C ATOM 412 O GLY A 569 -2.762 5.715 9.292 1.00 0.00 O ATOM 0 H GLY A 569 -6.326 4.860 7.619 1.00 0.00 H new ATOM 0 HA2 GLY A 569 -5.411 6.332 9.242 1.00 0.00 H new ATOM 0 HA3 GLY A 569 -5.123 4.980 10.320 1.00 0.00 H new ATOM 416 N LEU A 570 -3.543 4.415 7.632 1.00 0.00 N ATOM 417 CA LEU A 570 -2.230 4.229 7.024 1.00 0.00 C ATOM 418 C LEU A 570 -1.925 5.365 6.053 1.00 0.00 C ATOM 419 O LEU A 570 -2.563 5.488 5.007 1.00 0.00 O ATOM 420 CB LEU A 570 -2.156 2.887 6.291 1.00 0.00 C ATOM 421 CG LEU A 570 -2.876 1.721 6.979 1.00 0.00 C ATOM 422 CD1 LEU A 570 -3.912 1.115 6.051 1.00 0.00 C ATOM 423 CD2 LEU A 570 -1.879 0.658 7.418 1.00 0.00 C ATOM 0 H LEU A 570 -4.305 3.940 7.148 1.00 0.00 H new ATOM 0 HA LEU A 570 -1.486 4.234 7.821 1.00 0.00 H new ATOM 0 HB2 LEU A 570 -2.577 3.014 5.293 1.00 0.00 H new ATOM 0 HB3 LEU A 570 -1.107 2.619 6.163 1.00 0.00 H new ATOM 0 HG LEU A 570 -3.382 2.108 7.864 1.00 0.00 H new ATOM 0 HD11 LEU A 570 -4.413 0.289 6.555 1.00 0.00 H new ATOM 0 HD12 LEU A 570 -4.646 1.874 5.780 1.00 0.00 H new ATOM 0 HD13 LEU A 570 -3.422 0.746 5.150 1.00 0.00 H new ATOM 0 HD21 LEU A 570 -2.410 -0.160 7.904 1.00 0.00 H new ATOM 0 HD22 LEU A 570 -1.345 0.278 6.547 1.00 0.00 H new ATOM 0 HD23 LEU A 570 -1.167 1.094 8.118 1.00 0.00 H new ATOM 435 N THR A 571 -0.951 6.198 6.407 1.00 0.00 N ATOM 436 CA THR A 571 -0.570 7.327 5.566 1.00 0.00 C ATOM 437 C THR A 571 0.833 7.142 4.993 1.00 0.00 C ATOM 438 O THR A 571 1.149 7.663 3.924 1.00 0.00 O ATOM 439 CB THR A 571 -0.636 8.629 6.365 1.00 0.00 C ATOM 440 OG1 THR A 571 0.316 8.621 7.415 1.00 0.00 O ATOM 441 CG2 THR A 571 -1.995 8.885 6.981 1.00 0.00 C ATOM 0 H THR A 571 -0.412 6.113 7.269 1.00 0.00 H new ATOM 0 HA THR A 571 -1.275 7.377 4.736 1.00 0.00 H new ATOM 0 HB THR A 571 -0.426 9.421 5.646 1.00 0.00 H new ATOM 0 HG1 THR A 571 0.573 7.697 7.616 1.00 0.00 H new ATOM 0 HG21 THR A 571 -1.973 9.824 7.534 1.00 0.00 H new ATOM 0 HG22 THR A 571 -2.746 8.945 6.193 1.00 0.00 H new ATOM 0 HG23 THR A 571 -2.246 8.070 7.660 1.00 0.00 H new ATOM 449 N THR A 572 1.672 6.402 5.711 1.00 0.00 N ATOM 450 CA THR A 572 3.040 6.157 5.268 1.00 0.00 C ATOM 451 C THR A 572 3.215 4.726 4.782 1.00 0.00 C ATOM 452 O THR A 572 2.548 3.810 5.265 1.00 0.00 O ATOM 453 CB THR A 572 4.029 6.419 6.406 1.00 0.00 C ATOM 454 OG1 THR A 572 4.084 5.306 7.285 1.00 0.00 O ATOM 455 CG2 THR A 572 3.695 7.643 7.230 1.00 0.00 C ATOM 0 H THR A 572 1.430 5.963 6.599 1.00 0.00 H new ATOM 0 HA THR A 572 3.240 6.839 4.442 1.00 0.00 H new ATOM 0 HB THR A 572 4.989 6.589 5.919 1.00 0.00 H new ATOM 0 HG1 THR A 572 4.722 5.490 8.006 1.00 0.00 H new ATOM 0 HG21 THR A 572 4.439 7.766 8.017 1.00 0.00 H new ATOM 0 HG22 THR A 572 3.696 8.525 6.589 1.00 0.00 H new ATOM 0 HG23 THR A 572 2.709 7.522 7.678 1.00 0.00 H new ATOM 463 N ILE A 573 4.136 4.535 3.844 1.00 0.00 N ATOM 464 CA ILE A 573 4.418 3.208 3.321 1.00 0.00 C ATOM 465 C ILE A 573 4.924 2.316 4.445 1.00 0.00 C ATOM 466 O ILE A 573 4.621 1.124 4.503 1.00 0.00 O ATOM 467 CB ILE A 573 5.468 3.260 2.189 1.00 0.00 C ATOM 468 CG1 ILE A 573 5.434 1.975 1.363 1.00 0.00 C ATOM 469 CG2 ILE A 573 6.864 3.492 2.751 1.00 0.00 C ATOM 470 CD1 ILE A 573 6.498 1.928 0.288 1.00 0.00 C ATOM 0 H ILE A 573 4.697 5.281 3.433 1.00 0.00 H new ATOM 0 HA ILE A 573 3.495 2.802 2.908 1.00 0.00 H new ATOM 0 HB ILE A 573 5.219 4.098 1.538 1.00 0.00 H new ATOM 0 HG12 ILE A 573 5.560 1.120 2.028 1.00 0.00 H new ATOM 0 HG13 ILE A 573 4.453 1.875 0.899 1.00 0.00 H new ATOM 0 HG21 ILE A 573 7.584 3.524 1.934 1.00 0.00 H new ATOM 0 HG22 ILE A 573 6.886 4.438 3.292 1.00 0.00 H new ATOM 0 HG23 ILE A 573 7.122 2.680 3.430 1.00 0.00 H new ATOM 0 HD11 ILE A 573 6.419 0.990 -0.262 1.00 0.00 H new ATOM 0 HD12 ILE A 573 6.359 2.763 -0.398 1.00 0.00 H new ATOM 0 HD13 ILE A 573 7.484 1.997 0.748 1.00 0.00 H new ATOM 482 N TYR A 574 5.699 2.921 5.342 1.00 0.00 N ATOM 483 CA TYR A 574 6.259 2.206 6.482 1.00 0.00 C ATOM 484 C TYR A 574 5.154 1.593 7.333 1.00 0.00 C ATOM 485 O TYR A 574 5.305 0.493 7.865 1.00 0.00 O ATOM 486 CB TYR A 574 7.110 3.147 7.334 1.00 0.00 C ATOM 487 CG TYR A 574 8.533 3.283 6.846 1.00 0.00 C ATOM 488 CD1 TYR A 574 8.958 4.436 6.197 1.00 0.00 C ATOM 489 CD2 TYR A 574 9.452 2.258 7.031 1.00 0.00 C ATOM 490 CE1 TYR A 574 10.259 4.562 5.748 1.00 0.00 C ATOM 491 CE2 TYR A 574 10.754 2.377 6.584 1.00 0.00 C ATOM 492 CZ TYR A 574 11.152 3.531 5.944 1.00 0.00 C ATOM 493 OH TYR A 574 12.447 3.653 5.498 1.00 0.00 O ATOM 0 H TYR A 574 5.953 3.908 5.299 1.00 0.00 H new ATOM 0 HA TYR A 574 6.890 1.403 6.101 1.00 0.00 H new ATOM 0 HB2 TYR A 574 6.644 4.132 7.348 1.00 0.00 H new ATOM 0 HB3 TYR A 574 7.120 2.784 8.362 1.00 0.00 H new ATOM 0 HD1 TYR A 574 8.261 5.246 6.041 1.00 0.00 H new ATOM 0 HD2 TYR A 574 9.144 1.353 7.533 1.00 0.00 H new ATOM 0 HE1 TYR A 574 10.574 5.465 5.246 1.00 0.00 H new ATOM 0 HE2 TYR A 574 11.456 1.570 6.735 1.00 0.00 H new ATOM 0 HH TYR A 574 12.946 2.838 5.716 1.00 0.00 H new ATOM 503 N GLN A 575 4.041 2.311 7.456 1.00 0.00 N ATOM 504 CA GLN A 575 2.911 1.831 8.242 1.00 0.00 C ATOM 505 C GLN A 575 2.420 0.480 7.724 1.00 0.00 C ATOM 506 O GLN A 575 1.771 -0.274 8.450 1.00 0.00 O ATOM 507 CB GLN A 575 1.771 2.852 8.208 1.00 0.00 C ATOM 508 CG GLN A 575 1.602 3.618 9.512 1.00 0.00 C ATOM 509 CD GLN A 575 1.803 5.111 9.343 1.00 0.00 C ATOM 510 OE1 GLN A 575 1.264 5.722 8.420 1.00 0.00 O ATOM 511 NE2 GLN A 575 2.583 5.708 10.237 1.00 0.00 N ATOM 0 H GLN A 575 3.899 3.223 7.023 1.00 0.00 H new ATOM 0 HA GLN A 575 3.244 1.703 9.272 1.00 0.00 H new ATOM 0 HB2 GLN A 575 1.953 3.561 7.400 1.00 0.00 H new ATOM 0 HB3 GLN A 575 0.839 2.337 7.975 1.00 0.00 H new ATOM 0 HG2 GLN A 575 0.605 3.433 9.911 1.00 0.00 H new ATOM 0 HG3 GLN A 575 2.314 3.240 10.246 1.00 0.00 H new ATOM 0 HE21 GLN A 575 3.010 5.163 10.986 1.00 0.00 H new ATOM 0 HE22 GLN A 575 2.755 6.711 10.174 1.00 0.00 H new ATOM 520 N ILE A 576 2.735 0.179 6.467 1.00 0.00 N ATOM 521 CA ILE A 576 2.329 -1.081 5.856 1.00 0.00 C ATOM 522 C ILE A 576 3.534 -1.859 5.324 1.00 0.00 C ATOM 523 O ILE A 576 3.384 -2.788 4.533 1.00 0.00 O ATOM 524 CB ILE A 576 1.320 -0.849 4.709 1.00 0.00 C ATOM 525 CG1 ILE A 576 2.000 -0.184 3.510 1.00 0.00 C ATOM 526 CG2 ILE A 576 0.153 -0.002 5.196 1.00 0.00 C ATOM 527 CD1 ILE A 576 1.068 0.034 2.339 1.00 0.00 C ATOM 0 H ILE A 576 3.271 0.792 5.852 1.00 0.00 H new ATOM 0 HA ILE A 576 1.848 -1.670 6.637 1.00 0.00 H new ATOM 0 HB ILE A 576 0.939 -1.818 4.388 1.00 0.00 H new ATOM 0 HG12 ILE A 576 2.412 0.776 3.821 1.00 0.00 H new ATOM 0 HG13 ILE A 576 2.839 -0.802 3.188 1.00 0.00 H new ATOM 0 HG21 ILE A 576 -0.550 0.154 4.378 1.00 0.00 H new ATOM 0 HG22 ILE A 576 -0.351 -0.514 6.015 1.00 0.00 H new ATOM 0 HG23 ILE A 576 0.524 0.962 5.544 1.00 0.00 H new ATOM 0 HD11 ILE A 576 1.613 0.509 1.523 1.00 0.00 H new ATOM 0 HD12 ILE A 576 0.675 -0.926 2.003 1.00 0.00 H new ATOM 0 HD13 ILE A 576 0.242 0.676 2.646 1.00 0.00 H new ATOM 539 N GLU A 577 4.731 -1.471 5.760 1.00 0.00 N ATOM 540 CA GLU A 577 5.959 -2.130 5.323 1.00 0.00 C ATOM 541 C GLU A 577 5.865 -3.646 5.482 1.00 0.00 C ATOM 542 O GLU A 577 6.490 -4.396 4.730 1.00 0.00 O ATOM 543 CB GLU A 577 7.154 -1.600 6.117 1.00 0.00 C ATOM 544 CG GLU A 577 8.494 -1.867 5.453 1.00 0.00 C ATOM 545 CD GLU A 577 9.538 -2.374 6.428 1.00 0.00 C ATOM 546 OE1 GLU A 577 10.456 -3.101 5.991 1.00 0.00 O ATOM 547 OE2 GLU A 577 9.439 -2.045 7.629 1.00 0.00 O ATOM 0 H GLU A 577 4.876 -0.703 6.416 1.00 0.00 H new ATOM 0 HA GLU A 577 6.098 -1.906 4.265 1.00 0.00 H new ATOM 0 HB2 GLU A 577 7.037 -0.526 6.260 1.00 0.00 H new ATOM 0 HB3 GLU A 577 7.152 -2.055 7.107 1.00 0.00 H new ATOM 0 HG2 GLU A 577 8.361 -2.599 4.656 1.00 0.00 H new ATOM 0 HG3 GLU A 577 8.853 -0.950 4.987 1.00 0.00 H new ATOM 554 N HIS A 578 5.089 -4.092 6.464 1.00 0.00 N ATOM 555 CA HIS A 578 4.926 -5.520 6.718 1.00 0.00 C ATOM 556 C HIS A 578 3.487 -5.968 6.470 1.00 0.00 C ATOM 557 O HIS A 578 3.035 -6.967 7.031 1.00 0.00 O ATOM 558 CB HIS A 578 5.331 -5.852 8.155 1.00 0.00 C ATOM 559 CG HIS A 578 6.783 -5.612 8.438 1.00 0.00 C ATOM 560 ND1 HIS A 578 7.697 -6.632 8.599 1.00 0.00 N ATOM 561 CD2 HIS A 578 7.478 -4.459 8.588 1.00 0.00 C ATOM 562 CE1 HIS A 578 8.891 -6.117 8.837 1.00 0.00 C ATOM 563 NE2 HIS A 578 8.784 -4.802 8.835 1.00 0.00 N ATOM 0 H HIS A 578 4.564 -3.488 7.096 1.00 0.00 H new ATOM 0 HA HIS A 578 5.575 -6.057 6.026 1.00 0.00 H new ATOM 0 HB2 HIS A 578 4.732 -5.253 8.841 1.00 0.00 H new ATOM 0 HB3 HIS A 578 5.098 -6.897 8.358 1.00 0.00 H new ATOM 0 HD2 HIS A 578 7.079 -3.457 8.525 1.00 0.00 H new ATOM 0 HE1 HIS A 578 9.799 -6.677 9.004 1.00 0.00 H new ATOM 0 HE2 HIS A 578 9.549 -4.146 8.992 1.00 0.00 H new ATOM 572 N TYR A 579 2.770 -5.226 5.631 1.00 0.00 N ATOM 573 CA TYR A 579 1.385 -5.555 5.319 1.00 0.00 C ATOM 574 C TYR A 579 1.271 -6.784 4.429 1.00 0.00 C ATOM 575 O TYR A 579 2.068 -6.990 3.514 1.00 0.00 O ATOM 576 CB TYR A 579 0.682 -4.373 4.653 1.00 0.00 C ATOM 577 CG TYR A 579 -0.297 -3.670 5.561 1.00 0.00 C ATOM 578 CD1 TYR A 579 -1.484 -3.155 5.059 1.00 0.00 C ATOM 579 CD2 TYR A 579 -0.046 -3.537 6.921 1.00 0.00 C ATOM 580 CE1 TYR A 579 -2.395 -2.529 5.884 1.00 0.00 C ATOM 581 CE2 TYR A 579 -0.951 -2.909 7.754 1.00 0.00 C ATOM 582 CZ TYR A 579 -2.125 -2.408 7.232 1.00 0.00 C ATOM 583 OH TYR A 579 -3.033 -1.787 8.059 1.00 0.00 O ATOM 0 H TYR A 579 3.125 -4.396 5.157 1.00 0.00 H new ATOM 0 HA TYR A 579 0.897 -5.780 6.267 1.00 0.00 H new ATOM 0 HB2 TYR A 579 1.431 -3.657 4.315 1.00 0.00 H new ATOM 0 HB3 TYR A 579 0.155 -4.726 3.766 1.00 0.00 H new ATOM 0 HD1 TYR A 579 -1.698 -3.246 4.004 1.00 0.00 H new ATOM 0 HD2 TYR A 579 0.871 -3.931 7.333 1.00 0.00 H new ATOM 0 HE1 TYR A 579 -3.315 -2.136 5.477 1.00 0.00 H new ATOM 0 HE2 TYR A 579 -0.740 -2.811 8.809 1.00 0.00 H new ATOM 0 HH TYR A 579 -2.664 -1.729 8.965 1.00 0.00 H new ATOM 593 N SER A 580 0.251 -7.585 4.707 1.00 0.00 N ATOM 594 CA SER A 580 -0.020 -8.794 3.945 1.00 0.00 C ATOM 595 C SER A 580 -1.140 -8.541 2.947 1.00 0.00 C ATOM 596 O SER A 580 -1.825 -7.521 3.021 1.00 0.00 O ATOM 597 CB SER A 580 -0.431 -9.925 4.888 1.00 0.00 C ATOM 598 OG SER A 580 -1.777 -9.762 5.314 1.00 0.00 O ATOM 0 H SER A 580 -0.410 -7.415 5.465 1.00 0.00 H new ATOM 0 HA SER A 580 0.885 -9.079 3.409 1.00 0.00 H new ATOM 0 HB2 SER A 580 -0.318 -10.885 4.383 1.00 0.00 H new ATOM 0 HB3 SER A 580 0.230 -9.941 5.754 1.00 0.00 H new ATOM 0 HG SER A 580 -1.811 -9.116 6.050 1.00 0.00 H new ATOM 604 N MET A 581 -1.350 -9.480 2.034 1.00 0.00 N ATOM 605 CA MET A 581 -2.421 -9.345 1.058 1.00 0.00 C ATOM 606 C MET A 581 -3.759 -9.271 1.785 1.00 0.00 C ATOM 607 O MET A 581 -4.702 -8.627 1.322 1.00 0.00 O ATOM 608 CB MET A 581 -2.411 -10.520 0.079 1.00 0.00 C ATOM 609 CG MET A 581 -1.059 -10.753 -0.576 1.00 0.00 C ATOM 610 SD MET A 581 -1.199 -11.225 -2.312 1.00 0.00 S ATOM 611 CE MET A 581 -0.767 -9.685 -3.118 1.00 0.00 C ATOM 0 H MET A 581 -0.799 -10.334 1.949 1.00 0.00 H new ATOM 0 HA MET A 581 -2.269 -8.430 0.486 1.00 0.00 H new ATOM 0 HB2 MET A 581 -2.711 -11.425 0.607 1.00 0.00 H new ATOM 0 HB3 MET A 581 -3.156 -10.342 -0.697 1.00 0.00 H new ATOM 0 HG2 MET A 581 -0.461 -9.845 -0.498 1.00 0.00 H new ATOM 0 HG3 MET A 581 -0.526 -11.534 -0.033 1.00 0.00 H new ATOM 0 HE1 MET A 581 -0.085 -9.886 -3.944 1.00 0.00 H new ATOM 0 HE2 MET A 581 -1.670 -9.208 -3.500 1.00 0.00 H new ATOM 0 HE3 MET A 581 -0.283 -9.022 -2.401 1.00 0.00 H new ATOM 621 N ASP A 582 -3.822 -9.924 2.946 1.00 0.00 N ATOM 622 CA ASP A 582 -5.026 -9.927 3.762 1.00 0.00 C ATOM 623 C ASP A 582 -5.294 -8.530 4.313 1.00 0.00 C ATOM 624 O ASP A 582 -6.381 -7.984 4.136 1.00 0.00 O ATOM 625 CB ASP A 582 -4.891 -10.931 4.910 1.00 0.00 C ATOM 626 CG ASP A 582 -6.026 -11.936 4.935 1.00 0.00 C ATOM 627 OD1 ASP A 582 -7.174 -11.528 5.215 1.00 0.00 O ATOM 628 OD2 ASP A 582 -5.770 -13.131 4.676 1.00 0.00 O ATOM 0 H ASP A 582 -3.047 -10.458 3.339 1.00 0.00 H new ATOM 0 HA ASP A 582 -5.868 -10.225 3.137 1.00 0.00 H new ATOM 0 HB2 ASP A 582 -3.943 -11.460 4.817 1.00 0.00 H new ATOM 0 HB3 ASP A 582 -4.864 -10.394 5.858 1.00 0.00 H new ATOM 633 N ASP A 583 -4.290 -7.948 4.971 1.00 0.00 N ATOM 634 CA ASP A 583 -4.433 -6.603 5.527 1.00 0.00 C ATOM 635 C ASP A 583 -4.814 -5.623 4.427 1.00 0.00 C ATOM 636 O ASP A 583 -5.770 -4.861 4.560 1.00 0.00 O ATOM 637 CB ASP A 583 -3.131 -6.146 6.196 1.00 0.00 C ATOM 638 CG ASP A 583 -2.666 -7.105 7.274 1.00 0.00 C ATOM 639 OD1 ASP A 583 -3.411 -7.300 8.257 1.00 0.00 O ATOM 640 OD2 ASP A 583 -1.557 -7.662 7.134 1.00 0.00 O ATOM 0 H ASP A 583 -3.380 -8.381 5.130 1.00 0.00 H new ATOM 0 HA ASP A 583 -5.220 -6.628 6.281 1.00 0.00 H new ATOM 0 HB2 ASP A 583 -2.352 -6.049 5.440 1.00 0.00 H new ATOM 0 HB3 ASP A 583 -3.277 -5.158 6.632 1.00 0.00 H new ATOM 645 N LEU A 584 -4.057 -5.661 3.336 1.00 0.00 N ATOM 646 CA LEU A 584 -4.296 -4.787 2.194 1.00 0.00 C ATOM 647 C LEU A 584 -5.734 -4.957 1.690 1.00 0.00 C ATOM 648 O LEU A 584 -6.391 -3.992 1.266 1.00 0.00 O ATOM 649 CB LEU A 584 -3.288 -5.115 1.088 1.00 0.00 C ATOM 650 CG LEU A 584 -2.609 -3.904 0.450 1.00 0.00 C ATOM 651 CD1 LEU A 584 -1.719 -4.327 -0.711 1.00 0.00 C ATOM 652 CD2 LEU A 584 -3.650 -2.899 -0.005 1.00 0.00 C ATOM 0 H LEU A 584 -3.266 -6.294 3.219 1.00 0.00 H new ATOM 0 HA LEU A 584 -4.166 -3.747 2.495 1.00 0.00 H new ATOM 0 HB2 LEU A 584 -2.519 -5.768 1.501 1.00 0.00 H new ATOM 0 HB3 LEU A 584 -3.799 -5.679 0.307 1.00 0.00 H new ATOM 0 HG LEU A 584 -1.974 -3.430 1.199 1.00 0.00 H new ATOM 0 HD11 LEU A 584 -1.248 -3.447 -1.148 1.00 0.00 H new ATOM 0 HD12 LEU A 584 -0.949 -5.009 -0.350 1.00 0.00 H new ATOM 0 HD13 LEU A 584 -2.322 -4.829 -1.468 1.00 0.00 H new ATOM 0 HD21 LEU A 584 -3.154 -2.041 -0.458 1.00 0.00 H new ATOM 0 HD22 LEU A 584 -4.310 -3.365 -0.737 1.00 0.00 H new ATOM 0 HD23 LEU A 584 -4.236 -2.568 0.853 1.00 0.00 H new ATOM 664 N ALA A 585 -6.225 -6.191 1.761 1.00 0.00 N ATOM 665 CA ALA A 585 -7.585 -6.495 1.340 1.00 0.00 C ATOM 666 C ALA A 585 -8.579 -5.995 2.382 1.00 0.00 C ATOM 667 O ALA A 585 -9.692 -5.588 2.051 1.00 0.00 O ATOM 668 CB ALA A 585 -7.751 -7.990 1.117 1.00 0.00 C ATOM 0 H ALA A 585 -5.700 -6.995 2.106 1.00 0.00 H new ATOM 0 HA ALA A 585 -7.782 -5.985 0.397 1.00 0.00 H new ATOM 0 HB1 ALA A 585 -8.773 -8.200 0.803 1.00 0.00 H new ATOM 0 HB2 ALA A 585 -7.058 -8.322 0.343 1.00 0.00 H new ATOM 0 HB3 ALA A 585 -7.540 -8.522 2.045 1.00 0.00 H new ATOM 674 N SER A 586 -8.158 -6.019 3.646 1.00 0.00 N ATOM 675 CA SER A 586 -9.000 -5.557 4.743 1.00 0.00 C ATOM 676 C SER A 586 -9.263 -4.064 4.608 1.00 0.00 C ATOM 677 O SER A 586 -10.346 -3.579 4.934 1.00 0.00 O ATOM 678 CB SER A 586 -8.336 -5.857 6.089 1.00 0.00 C ATOM 679 OG SER A 586 -7.403 -4.848 6.435 1.00 0.00 O ATOM 0 H SER A 586 -7.238 -6.354 3.933 1.00 0.00 H new ATOM 0 HA SER A 586 -9.951 -6.088 4.700 1.00 0.00 H new ATOM 0 HB2 SER A 586 -9.098 -5.933 6.865 1.00 0.00 H new ATOM 0 HB3 SER A 586 -7.832 -6.822 6.042 1.00 0.00 H new ATOM 0 HG SER A 586 -6.612 -4.923 5.861 1.00 0.00 H new ATOM 685 N LEU A 587 -8.267 -3.341 4.102 1.00 0.00 N ATOM 686 CA LEU A 587 -8.398 -1.900 3.898 1.00 0.00 C ATOM 687 C LEU A 587 -9.391 -1.616 2.776 1.00 0.00 C ATOM 688 O LEU A 587 -9.841 -0.483 2.610 1.00 0.00 O ATOM 689 CB LEU A 587 -7.046 -1.252 3.565 1.00 0.00 C ATOM 690 CG LEU A 587 -5.804 -2.051 3.960 1.00 0.00 C ATOM 691 CD1 LEU A 587 -4.544 -1.317 3.535 1.00 0.00 C ATOM 692 CD2 LEU A 587 -5.794 -2.310 5.460 1.00 0.00 C ATOM 0 H LEU A 587 -7.364 -3.727 3.827 1.00 0.00 H new ATOM 0 HA LEU A 587 -8.763 -1.467 4.829 1.00 0.00 H new ATOM 0 HB2 LEU A 587 -7.009 -1.068 2.491 1.00 0.00 H new ATOM 0 HB3 LEU A 587 -7.000 -0.280 4.057 1.00 0.00 H new ATOM 0 HG LEU A 587 -5.831 -3.012 3.446 1.00 0.00 H new ATOM 0 HD11 LEU A 587 -3.669 -1.899 3.824 1.00 0.00 H new ATOM 0 HD12 LEU A 587 -4.549 -1.182 2.453 1.00 0.00 H new ATOM 0 HD13 LEU A 587 -4.509 -0.343 4.023 1.00 0.00 H new ATOM 0 HD21 LEU A 587 -4.903 -2.880 5.725 1.00 0.00 H new ATOM 0 HD22 LEU A 587 -5.789 -1.359 5.993 1.00 0.00 H new ATOM 0 HD23 LEU A 587 -6.683 -2.876 5.737 1.00 0.00 H new ATOM 704 N LYS A 588 -9.726 -2.666 2.015 1.00 0.00 N ATOM 705 CA LYS A 588 -10.671 -2.577 0.904 1.00 0.00 C ATOM 706 C LYS A 588 -9.959 -2.439 -0.439 1.00 0.00 C ATOM 707 O LYS A 588 -10.581 -2.054 -1.430 1.00 0.00 O ATOM 708 CB LYS A 588 -11.649 -1.417 1.099 1.00 0.00 C ATOM 709 CG LYS A 588 -12.960 -1.592 0.349 1.00 0.00 C ATOM 710 CD LYS A 588 -13.126 -0.543 -0.740 1.00 0.00 C ATOM 711 CE LYS A 588 -14.402 -0.765 -1.537 1.00 0.00 C ATOM 712 NZ LYS A 588 -14.711 0.391 -2.424 1.00 0.00 N ATOM 0 H LYS A 588 -9.346 -3.602 2.156 1.00 0.00 H new ATOM 0 HA LYS A 588 -11.233 -3.511 0.895 1.00 0.00 H new ATOM 0 HB2 LYS A 588 -11.861 -1.306 2.163 1.00 0.00 H new ATOM 0 HB3 LYS A 588 -11.173 -0.493 0.771 1.00 0.00 H new ATOM 0 HG2 LYS A 588 -12.996 -2.587 -0.095 1.00 0.00 H new ATOM 0 HG3 LYS A 588 -13.792 -1.525 1.049 1.00 0.00 H new ATOM 0 HD2 LYS A 588 -13.144 0.450 -0.291 1.00 0.00 H new ATOM 0 HD3 LYS A 588 -12.267 -0.574 -1.410 1.00 0.00 H new ATOM 0 HE2 LYS A 588 -14.301 -1.668 -2.139 1.00 0.00 H new ATOM 0 HE3 LYS A 588 -15.234 -0.930 -0.852 1.00 0.00 H new ATOM 0 HZ1 LYS A 588 -15.588 0.200 -2.950 1.00 0.00 H new ATOM 0 HZ2 LYS A 588 -14.832 1.248 -1.848 1.00 0.00 H new ATOM 0 HZ3 LYS A 588 -13.929 0.533 -3.095 1.00 0.00 H new ATOM 726 N ILE A 589 -8.663 -2.762 -0.491 1.00 0.00 N ATOM 727 CA ILE A 589 -7.935 -2.666 -1.750 1.00 0.00 C ATOM 728 C ILE A 589 -8.161 -3.923 -2.594 1.00 0.00 C ATOM 729 O ILE A 589 -7.858 -5.034 -2.162 1.00 0.00 O ATOM 730 CB ILE A 589 -6.428 -2.435 -1.520 1.00 0.00 C ATOM 731 CG1 ILE A 589 -6.193 -0.994 -1.063 1.00 0.00 C ATOM 732 CG2 ILE A 589 -5.630 -2.727 -2.786 1.00 0.00 C ATOM 733 CD1 ILE A 589 -5.811 -0.874 0.393 1.00 0.00 C ATOM 0 H ILE A 589 -8.112 -3.084 0.305 1.00 0.00 H new ATOM 0 HA ILE A 589 -8.322 -1.802 -2.291 1.00 0.00 H new ATOM 0 HB ILE A 589 -6.086 -3.120 -0.744 1.00 0.00 H new ATOM 0 HG12 ILE A 589 -5.406 -0.552 -1.674 1.00 0.00 H new ATOM 0 HG13 ILE A 589 -7.098 -0.413 -1.241 1.00 0.00 H new ATOM 0 HG21 ILE A 589 -4.570 -2.556 -2.596 1.00 0.00 H new ATOM 0 HG22 ILE A 589 -5.783 -3.765 -3.081 1.00 0.00 H new ATOM 0 HG23 ILE A 589 -5.966 -2.069 -3.587 1.00 0.00 H new ATOM 0 HD11 ILE A 589 -5.661 0.176 0.644 1.00 0.00 H new ATOM 0 HD12 ILE A 589 -6.607 -1.285 1.013 1.00 0.00 H new ATOM 0 HD13 ILE A 589 -4.889 -1.426 0.574 1.00 0.00 H new ATOM 745 N PRO A 590 -8.715 -3.758 -3.810 1.00 0.00 N ATOM 746 CA PRO A 590 -9.001 -4.880 -4.714 1.00 0.00 C ATOM 747 C PRO A 590 -7.770 -5.726 -5.014 1.00 0.00 C ATOM 748 O PRO A 590 -6.637 -5.283 -4.828 1.00 0.00 O ATOM 749 CB PRO A 590 -9.505 -4.194 -5.988 1.00 0.00 C ATOM 750 CG PRO A 590 -10.013 -2.871 -5.529 1.00 0.00 C ATOM 751 CD PRO A 590 -9.118 -2.466 -4.393 1.00 0.00 C ATOM 0 HA PRO A 590 -9.716 -5.576 -4.276 1.00 0.00 H new ATOM 0 HB2 PRO A 590 -8.705 -4.079 -6.719 1.00 0.00 H new ATOM 0 HB3 PRO A 590 -10.292 -4.776 -6.466 1.00 0.00 H new ATOM 0 HG2 PRO A 590 -9.980 -2.138 -6.335 1.00 0.00 H new ATOM 0 HG3 PRO A 590 -11.051 -2.941 -5.204 1.00 0.00 H new ATOM 0 HD2 PRO A 590 -8.258 -1.895 -4.741 1.00 0.00 H new ATOM 0 HD3 PRO A 590 -9.642 -1.843 -3.669 1.00 0.00 H new ATOM 759 N GLU A 591 -8.004 -6.950 -5.480 1.00 0.00 N ATOM 760 CA GLU A 591 -6.919 -7.867 -5.808 1.00 0.00 C ATOM 761 C GLU A 591 -6.097 -7.346 -6.983 1.00 0.00 C ATOM 762 O GLU A 591 -4.897 -7.604 -7.078 1.00 0.00 O ATOM 763 CB GLU A 591 -7.480 -9.254 -6.135 1.00 0.00 C ATOM 764 CG GLU A 591 -6.909 -10.362 -5.265 1.00 0.00 C ATOM 765 CD GLU A 591 -5.876 -11.201 -5.991 1.00 0.00 C ATOM 766 OE1 GLU A 591 -4.896 -10.621 -6.506 1.00 0.00 O ATOM 767 OE2 GLU A 591 -6.044 -12.437 -6.044 1.00 0.00 O ATOM 0 H GLU A 591 -8.938 -7.329 -5.639 1.00 0.00 H new ATOM 0 HA GLU A 591 -6.265 -7.941 -4.940 1.00 0.00 H new ATOM 0 HB2 GLU A 591 -8.564 -9.235 -6.020 1.00 0.00 H new ATOM 0 HB3 GLU A 591 -7.275 -9.482 -7.181 1.00 0.00 H new ATOM 0 HG2 GLU A 591 -6.456 -9.923 -4.376 1.00 0.00 H new ATOM 0 HG3 GLU A 591 -7.720 -11.006 -4.925 1.00 0.00 H new ATOM 774 N GLN A 592 -6.752 -6.614 -7.879 1.00 0.00 N ATOM 775 CA GLN A 592 -6.083 -6.060 -9.050 1.00 0.00 C ATOM 776 C GLN A 592 -5.137 -4.924 -8.667 1.00 0.00 C ATOM 777 O GLN A 592 -4.265 -4.543 -9.449 1.00 0.00 O ATOM 778 CB GLN A 592 -7.117 -5.558 -10.061 1.00 0.00 C ATOM 779 CG GLN A 592 -6.727 -5.815 -11.507 1.00 0.00 C ATOM 780 CD GLN A 592 -7.859 -6.415 -12.320 1.00 0.00 C ATOM 781 OE1 GLN A 592 -7.781 -7.560 -12.763 1.00 0.00 O ATOM 782 NE2 GLN A 592 -8.920 -5.641 -12.518 1.00 0.00 N ATOM 0 H GLN A 592 -7.745 -6.391 -7.816 1.00 0.00 H new ATOM 0 HA GLN A 592 -5.491 -6.856 -9.502 1.00 0.00 H new ATOM 0 HB2 GLN A 592 -8.074 -6.040 -9.860 1.00 0.00 H new ATOM 0 HB3 GLN A 592 -7.263 -4.487 -9.917 1.00 0.00 H new ATOM 0 HG2 GLN A 592 -6.412 -4.878 -11.966 1.00 0.00 H new ATOM 0 HG3 GLN A 592 -5.869 -6.487 -11.534 1.00 0.00 H new ATOM 0 HE21 GLN A 592 -8.942 -4.697 -12.132 1.00 0.00 H new ATOM 0 HE22 GLN A 592 -9.713 -5.990 -13.056 1.00 0.00 H new ATOM 791 N PHE A 593 -5.312 -4.381 -7.464 1.00 0.00 N ATOM 792 CA PHE A 593 -4.471 -3.287 -6.993 1.00 0.00 C ATOM 793 C PHE A 593 -3.607 -3.722 -5.812 1.00 0.00 C ATOM 794 O PHE A 593 -2.476 -3.262 -5.659 1.00 0.00 O ATOM 795 CB PHE A 593 -5.334 -2.089 -6.592 1.00 0.00 C ATOM 796 CG PHE A 593 -6.176 -1.552 -7.714 1.00 0.00 C ATOM 797 CD1 PHE A 593 -5.590 -0.897 -8.785 1.00 0.00 C ATOM 798 CD2 PHE A 593 -7.554 -1.702 -7.697 1.00 0.00 C ATOM 799 CE1 PHE A 593 -6.363 -0.401 -9.819 1.00 0.00 C ATOM 800 CE2 PHE A 593 -8.332 -1.209 -8.727 1.00 0.00 C ATOM 801 CZ PHE A 593 -7.735 -0.557 -9.790 1.00 0.00 C ATOM 0 H PHE A 593 -6.027 -4.681 -6.801 1.00 0.00 H new ATOM 0 HA PHE A 593 -3.811 -2.998 -7.811 1.00 0.00 H new ATOM 0 HB2 PHE A 593 -5.985 -2.380 -5.768 1.00 0.00 H new ATOM 0 HB3 PHE A 593 -4.687 -1.294 -6.221 1.00 0.00 H new ATOM 0 HD1 PHE A 593 -4.518 -0.772 -8.813 1.00 0.00 H new ATOM 0 HD2 PHE A 593 -8.025 -2.210 -6.869 1.00 0.00 H new ATOM 0 HE1 PHE A 593 -5.894 0.108 -10.648 1.00 0.00 H new ATOM 0 HE2 PHE A 593 -9.405 -1.333 -8.702 1.00 0.00 H new ATOM 0 HZ PHE A 593 -8.341 -0.170 -10.596 1.00 0.00 H new ATOM 811 N ARG A 594 -4.147 -4.603 -4.976 1.00 0.00 N ATOM 812 CA ARG A 594 -3.420 -5.087 -3.808 1.00 0.00 C ATOM 813 C ARG A 594 -2.138 -5.806 -4.221 1.00 0.00 C ATOM 814 O ARG A 594 -1.136 -5.758 -3.512 1.00 0.00 O ATOM 815 CB ARG A 594 -4.308 -6.016 -2.966 1.00 0.00 C ATOM 816 CG ARG A 594 -4.217 -7.486 -3.350 1.00 0.00 C ATOM 817 CD ARG A 594 -5.136 -8.345 -2.495 1.00 0.00 C ATOM 818 NE ARG A 594 -6.538 -7.954 -2.632 1.00 0.00 N ATOM 819 CZ ARG A 594 -7.560 -8.710 -2.234 1.00 0.00 C ATOM 820 NH1 ARG A 594 -7.341 -9.896 -1.679 1.00 0.00 N ATOM 821 NH2 ARG A 594 -8.804 -8.279 -2.394 1.00 0.00 N ATOM 0 H ARG A 594 -5.082 -4.995 -5.085 1.00 0.00 H new ATOM 0 HA ARG A 594 -3.145 -4.224 -3.201 1.00 0.00 H new ATOM 0 HB2 ARG A 594 -4.034 -5.909 -1.917 1.00 0.00 H new ATOM 0 HB3 ARG A 594 -5.344 -5.692 -3.059 1.00 0.00 H new ATOM 0 HG2 ARG A 594 -4.480 -7.605 -4.401 1.00 0.00 H new ATOM 0 HG3 ARG A 594 -3.189 -7.829 -3.238 1.00 0.00 H new ATOM 0 HD2 ARG A 594 -5.022 -9.391 -2.779 1.00 0.00 H new ATOM 0 HD3 ARG A 594 -4.838 -8.265 -1.450 1.00 0.00 H new ATOM 0 HE ARG A 594 -6.746 -7.050 -3.057 1.00 0.00 H new ATOM 0 HH11 ARG A 594 -6.386 -10.233 -1.555 1.00 0.00 H new ATOM 0 HH12 ARG A 594 -8.128 -10.470 -1.376 1.00 0.00 H new ATOM 0 HH21 ARG A 594 -8.978 -7.369 -2.822 1.00 0.00 H new ATOM 0 HH22 ARG A 594 -9.587 -8.857 -2.090 1.00 0.00 H new ATOM 835 N HIS A 595 -2.179 -6.475 -5.368 1.00 0.00 N ATOM 836 CA HIS A 595 -1.018 -7.204 -5.865 1.00 0.00 C ATOM 837 C HIS A 595 0.132 -6.249 -6.172 1.00 0.00 C ATOM 838 O HIS A 595 1.262 -6.462 -5.730 1.00 0.00 O ATOM 839 CB HIS A 595 -1.389 -8.003 -7.115 1.00 0.00 C ATOM 840 CG HIS A 595 -1.498 -9.477 -6.871 1.00 0.00 C ATOM 841 ND1 HIS A 595 -1.011 -10.423 -7.748 1.00 0.00 N ATOM 842 CD2 HIS A 595 -2.041 -10.166 -5.840 1.00 0.00 C ATOM 843 CE1 HIS A 595 -1.252 -11.631 -7.267 1.00 0.00 C ATOM 844 NE2 HIS A 595 -1.875 -11.502 -6.111 1.00 0.00 N ATOM 0 H HIS A 595 -3.001 -6.528 -5.970 1.00 0.00 H new ATOM 0 HA HIS A 595 -0.691 -7.895 -5.088 1.00 0.00 H new ATOM 0 HB2 HIS A 595 -2.339 -7.636 -7.503 1.00 0.00 H new ATOM 0 HB3 HIS A 595 -0.640 -7.825 -7.886 1.00 0.00 H new ATOM 0 HD2 HIS A 595 -2.516 -9.744 -4.967 1.00 0.00 H new ATOM 0 HE1 HIS A 595 -0.984 -12.564 -7.740 1.00 0.00 H new ATOM 0 HE2 HIS A 595 -2.183 -12.270 -5.515 1.00 0.00 H new ATOM 853 N ALA A 596 -0.162 -5.195 -6.926 1.00 0.00 N ATOM 854 CA ALA A 596 0.850 -4.209 -7.283 1.00 0.00 C ATOM 855 C ALA A 596 1.393 -3.522 -6.038 1.00 0.00 C ATOM 856 O ALA A 596 2.606 -3.434 -5.837 1.00 0.00 O ATOM 857 CB ALA A 596 0.274 -3.183 -8.249 1.00 0.00 C ATOM 0 H ALA A 596 -1.091 -5.002 -7.301 1.00 0.00 H new ATOM 0 HA ALA A 596 1.674 -4.725 -7.776 1.00 0.00 H new ATOM 0 HB1 ALA A 596 1.042 -2.454 -8.506 1.00 0.00 H new ATOM 0 HB2 ALA A 596 -0.066 -3.686 -9.154 1.00 0.00 H new ATOM 0 HB3 ALA A 596 -0.567 -2.673 -7.779 1.00 0.00 H new ATOM 863 N ILE A 597 0.482 -3.046 -5.200 1.00 0.00 N ATOM 864 CA ILE A 597 0.856 -2.373 -3.964 1.00 0.00 C ATOM 865 C ILE A 597 1.671 -3.305 -3.073 1.00 0.00 C ATOM 866 O ILE A 597 2.721 -2.926 -2.558 1.00 0.00 O ATOM 867 CB ILE A 597 -0.388 -1.882 -3.195 1.00 0.00 C ATOM 868 CG1 ILE A 597 -1.252 -0.996 -4.095 1.00 0.00 C ATOM 869 CG2 ILE A 597 0.020 -1.126 -1.939 1.00 0.00 C ATOM 870 CD1 ILE A 597 -2.664 -0.806 -3.582 1.00 0.00 C ATOM 0 H ILE A 597 -0.524 -3.114 -5.355 1.00 0.00 H new ATOM 0 HA ILE A 597 1.462 -1.508 -4.232 1.00 0.00 H new ATOM 0 HB ILE A 597 -0.973 -2.751 -2.895 1.00 0.00 H new ATOM 0 HG12 ILE A 597 -0.776 -0.020 -4.195 1.00 0.00 H new ATOM 0 HG13 ILE A 597 -1.292 -1.435 -5.092 1.00 0.00 H new ATOM 0 HG21 ILE A 597 -0.872 -0.788 -1.412 1.00 0.00 H new ATOM 0 HG22 ILE A 597 0.598 -1.784 -1.290 1.00 0.00 H new ATOM 0 HG23 ILE A 597 0.627 -0.263 -2.214 1.00 0.00 H new ATOM 0 HD11 ILE A 597 -3.218 -0.167 -4.270 1.00 0.00 H new ATOM 0 HD12 ILE A 597 -3.158 -1.775 -3.508 1.00 0.00 H new ATOM 0 HD13 ILE A 597 -2.634 -0.339 -2.598 1.00 0.00 H new ATOM 882 N TRP A 598 1.184 -4.532 -2.907 1.00 0.00 N ATOM 883 CA TRP A 598 1.871 -5.525 -2.089 1.00 0.00 C ATOM 884 C TRP A 598 3.284 -5.759 -2.610 1.00 0.00 C ATOM 885 O TRP A 598 4.227 -5.907 -1.834 1.00 0.00 O ATOM 886 CB TRP A 598 1.093 -6.842 -2.082 1.00 0.00 C ATOM 887 CG TRP A 598 1.565 -7.805 -1.035 1.00 0.00 C ATOM 888 CD1 TRP A 598 1.579 -7.605 0.315 1.00 0.00 C ATOM 889 CD2 TRP A 598 2.092 -9.119 -1.252 1.00 0.00 C ATOM 890 NE1 TRP A 598 2.083 -8.714 0.950 1.00 0.00 N ATOM 891 CE2 TRP A 598 2.405 -9.657 0.011 1.00 0.00 C ATOM 892 CE3 TRP A 598 2.329 -9.893 -2.392 1.00 0.00 C ATOM 893 CZ2 TRP A 598 2.943 -10.933 0.164 1.00 0.00 C ATOM 894 CZ3 TRP A 598 2.863 -11.160 -2.237 1.00 0.00 C ATOM 895 CH2 TRP A 598 3.164 -11.669 -0.968 1.00 0.00 C ATOM 0 H TRP A 598 0.316 -4.862 -3.329 1.00 0.00 H new ATOM 0 HA TRP A 598 1.931 -5.146 -1.069 1.00 0.00 H new ATOM 0 HB2 TRP A 598 0.036 -6.630 -1.921 1.00 0.00 H new ATOM 0 HB3 TRP A 598 1.178 -7.311 -3.062 1.00 0.00 H new ATOM 0 HD1 TRP A 598 1.243 -6.707 0.811 1.00 0.00 H new ATOM 0 HE1 TRP A 598 2.199 -8.818 1.958 1.00 0.00 H new ATOM 0 HE3 TRP A 598 2.100 -9.509 -3.375 1.00 0.00 H new ATOM 0 HZ2 TRP A 598 3.177 -11.327 1.142 1.00 0.00 H new ATOM 0 HZ3 TRP A 598 3.051 -11.767 -3.110 1.00 0.00 H new ATOM 0 HH2 TRP A 598 3.579 -12.662 -0.881 1.00 0.00 H new ATOM 906 N LYS A 599 3.422 -5.787 -3.932 1.00 0.00 N ATOM 907 CA LYS A 599 4.720 -5.995 -4.560 1.00 0.00 C ATOM 908 C LYS A 599 5.687 -4.886 -4.161 1.00 0.00 C ATOM 909 O LYS A 599 6.828 -5.149 -3.782 1.00 0.00 O ATOM 910 CB LYS A 599 4.574 -6.044 -6.083 1.00 0.00 C ATOM 911 CG LYS A 599 5.257 -7.245 -6.721 1.00 0.00 C ATOM 912 CD LYS A 599 4.264 -8.123 -7.468 1.00 0.00 C ATOM 913 CE LYS A 599 4.926 -8.843 -8.632 1.00 0.00 C ATOM 914 NZ LYS A 599 5.983 -9.787 -8.173 1.00 0.00 N ATOM 0 H LYS A 599 2.650 -5.668 -4.588 1.00 0.00 H new ATOM 0 HA LYS A 599 5.121 -6.949 -4.216 1.00 0.00 H new ATOM 0 HB2 LYS A 599 3.514 -6.061 -6.338 1.00 0.00 H new ATOM 0 HB3 LYS A 599 4.990 -5.131 -6.509 1.00 0.00 H new ATOM 0 HG2 LYS A 599 6.029 -6.902 -7.409 1.00 0.00 H new ATOM 0 HG3 LYS A 599 5.755 -7.833 -5.950 1.00 0.00 H new ATOM 0 HD2 LYS A 599 3.835 -8.854 -6.783 1.00 0.00 H new ATOM 0 HD3 LYS A 599 3.441 -7.511 -7.837 1.00 0.00 H new ATOM 0 HE2 LYS A 599 4.171 -9.390 -9.197 1.00 0.00 H new ATOM 0 HE3 LYS A 599 5.363 -8.111 -9.310 1.00 0.00 H new ATOM 0 HZ1 LYS A 599 6.363 -10.307 -8.990 1.00 0.00 H new ATOM 0 HZ2 LYS A 599 6.750 -9.254 -7.715 1.00 0.00 H new ATOM 0 HZ3 LYS A 599 5.576 -10.460 -7.493 1.00 0.00 H new ATOM 928 N GLY A 600 5.218 -3.645 -4.244 1.00 0.00 N ATOM 929 CA GLY A 600 6.052 -2.514 -3.882 1.00 0.00 C ATOM 930 C GLY A 600 6.509 -2.577 -2.437 1.00 0.00 C ATOM 931 O GLY A 600 7.666 -2.287 -2.131 1.00 0.00 O ATOM 0 H GLY A 600 4.277 -3.403 -4.555 1.00 0.00 H new ATOM 0 HA2 GLY A 600 6.924 -2.484 -4.536 1.00 0.00 H new ATOM 0 HA3 GLY A 600 5.498 -1.590 -4.046 1.00 0.00 H new ATOM 935 N ILE A 601 5.598 -2.959 -1.547 1.00 0.00 N ATOM 936 CA ILE A 601 5.912 -3.063 -0.126 1.00 0.00 C ATOM 937 C ILE A 601 6.924 -4.178 0.129 1.00 0.00 C ATOM 938 O ILE A 601 7.788 -4.059 0.998 1.00 0.00 O ATOM 939 CB ILE A 601 4.644 -3.331 0.712 1.00 0.00 C ATOM 940 CG1 ILE A 601 3.580 -2.269 0.420 1.00 0.00 C ATOM 941 CG2 ILE A 601 4.978 -3.358 2.198 1.00 0.00 C ATOM 942 CD1 ILE A 601 3.956 -0.884 0.898 1.00 0.00 C ATOM 0 H ILE A 601 4.636 -3.202 -1.785 1.00 0.00 H new ATOM 0 HA ILE A 601 6.341 -2.108 0.177 1.00 0.00 H new ATOM 0 HB ILE A 601 4.246 -4.307 0.434 1.00 0.00 H new ATOM 0 HG12 ILE A 601 3.398 -2.236 -0.654 1.00 0.00 H new ATOM 0 HG13 ILE A 601 2.644 -2.565 0.893 1.00 0.00 H new ATOM 0 HG21 ILE A 601 4.071 -3.548 2.771 1.00 0.00 H new ATOM 0 HG22 ILE A 601 5.703 -4.148 2.394 1.00 0.00 H new ATOM 0 HG23 ILE A 601 5.399 -2.397 2.494 1.00 0.00 H new ATOM 0 HD11 ILE A 601 3.155 -0.186 0.656 1.00 0.00 H new ATOM 0 HD12 ILE A 601 4.110 -0.901 1.977 1.00 0.00 H new ATOM 0 HD13 ILE A 601 4.875 -0.566 0.405 1.00 0.00 H new ATOM 954 N LEU A 602 6.807 -5.261 -0.633 1.00 0.00 N ATOM 955 CA LEU A 602 7.708 -6.398 -0.488 1.00 0.00 C ATOM 956 C LEU A 602 9.135 -6.019 -0.876 1.00 0.00 C ATOM 957 O LEU A 602 10.088 -6.356 -0.174 1.00 0.00 O ATOM 958 CB LEU A 602 7.226 -7.565 -1.352 1.00 0.00 C ATOM 959 CG LEU A 602 6.142 -8.437 -0.715 1.00 0.00 C ATOM 960 CD1 LEU A 602 5.576 -9.413 -1.735 1.00 0.00 C ATOM 961 CD2 LEU A 602 6.699 -9.184 0.488 1.00 0.00 C ATOM 0 H LEU A 602 6.097 -5.375 -1.357 1.00 0.00 H new ATOM 0 HA LEU A 602 7.706 -6.701 0.559 1.00 0.00 H new ATOM 0 HB2 LEU A 602 6.845 -7.168 -2.293 1.00 0.00 H new ATOM 0 HB3 LEU A 602 8.082 -8.195 -1.595 1.00 0.00 H new ATOM 0 HG LEU A 602 5.334 -7.790 -0.374 1.00 0.00 H new ATOM 0 HD11 LEU A 602 4.806 -10.025 -1.265 1.00 0.00 H new ATOM 0 HD12 LEU A 602 5.141 -8.859 -2.567 1.00 0.00 H new ATOM 0 HD13 LEU A 602 6.375 -10.056 -2.106 1.00 0.00 H new ATOM 0 HD21 LEU A 602 5.915 -9.799 0.929 1.00 0.00 H new ATOM 0 HD22 LEU A 602 7.525 -9.821 0.170 1.00 0.00 H new ATOM 0 HD23 LEU A 602 7.057 -8.468 1.227 1.00 0.00 H new ATOM 973 N ASP A 603 9.272 -5.321 -1.997 1.00 0.00 N ATOM 974 CA ASP A 603 10.583 -4.899 -2.480 1.00 0.00 C ATOM 975 C ASP A 603 11.294 -4.031 -1.446 1.00 0.00 C ATOM 976 O ASP A 603 12.513 -4.105 -1.291 1.00 0.00 O ATOM 977 CB ASP A 603 10.442 -4.133 -3.796 1.00 0.00 C ATOM 978 CG ASP A 603 11.546 -4.465 -4.780 1.00 0.00 C ATOM 979 OD1 ASP A 603 12.393 -3.586 -5.042 1.00 0.00 O ATOM 980 OD2 ASP A 603 11.565 -5.606 -5.288 1.00 0.00 O ATOM 0 H ASP A 603 8.492 -5.035 -2.589 1.00 0.00 H new ATOM 0 HA ASP A 603 11.183 -5.793 -2.649 1.00 0.00 H new ATOM 0 HB2 ASP A 603 9.477 -4.364 -4.246 1.00 0.00 H new ATOM 0 HB3 ASP A 603 10.451 -3.062 -3.592 1.00 0.00 H new ATOM 985 N HIS A 604 10.524 -3.208 -0.741 1.00 0.00 N ATOM 986 CA HIS A 604 11.082 -2.325 0.277 1.00 0.00 C ATOM 987 C HIS A 604 11.605 -3.124 1.466 1.00 0.00 C ATOM 988 O HIS A 604 12.649 -2.800 2.033 1.00 0.00 O ATOM 989 CB HIS A 604 10.025 -1.323 0.747 1.00 0.00 C ATOM 990 CG HIS A 604 10.599 -0.144 1.470 1.00 0.00 C ATOM 991 ND1 HIS A 604 11.566 0.676 0.925 1.00 0.00 N ATOM 992 CD2 HIS A 604 10.340 0.352 2.703 1.00 0.00 C ATOM 993 CE1 HIS A 604 11.875 1.624 1.791 1.00 0.00 C ATOM 994 NE2 HIS A 604 11.144 1.451 2.877 1.00 0.00 N ATOM 0 H HIS A 604 9.513 -3.134 -0.856 1.00 0.00 H new ATOM 0 HA HIS A 604 11.917 -1.783 -0.167 1.00 0.00 H new ATOM 0 HB2 HIS A 604 9.461 -0.970 -0.116 1.00 0.00 H new ATOM 0 HB3 HIS A 604 9.319 -1.833 1.403 1.00 0.00 H new ATOM 0 HD2 HIS A 604 9.633 -0.043 3.417 1.00 0.00 H new ATOM 0 HE1 HIS A 604 12.602 2.408 1.637 1.00 0.00 H new ATOM 0 HE2 HIS A 604 11.172 2.039 3.710 1.00 0.00 H new ATOM 1003 N ARG A 605 10.875 -4.170 1.839 1.00 0.00 N ATOM 1004 CA ARG A 605 11.267 -5.015 2.962 1.00 0.00 C ATOM 1005 C ARG A 605 12.528 -5.807 2.633 1.00 0.00 C ATOM 1006 O ARG A 605 13.347 -6.080 3.511 1.00 0.00 O ATOM 1007 CB ARG A 605 10.128 -5.970 3.330 1.00 0.00 C ATOM 1008 CG ARG A 605 9.388 -5.573 4.597 1.00 0.00 C ATOM 1009 CD ARG A 605 8.271 -6.552 4.919 1.00 0.00 C ATOM 1010 NE ARG A 605 8.777 -7.901 5.163 1.00 0.00 N ATOM 1011 CZ ARG A 605 8.012 -8.924 5.539 1.00 0.00 C ATOM 1012 NH1 ARG A 605 6.708 -8.755 5.715 1.00 0.00 N ATOM 1013 NH2 ARG A 605 8.554 -10.117 5.740 1.00 0.00 N ATOM 0 H ARG A 605 10.009 -4.453 1.380 1.00 0.00 H new ATOM 0 HA ARG A 605 11.479 -4.370 3.815 1.00 0.00 H new ATOM 0 HB2 ARG A 605 9.419 -6.013 2.503 1.00 0.00 H new ATOM 0 HB3 ARG A 605 10.533 -6.974 3.455 1.00 0.00 H new ATOM 0 HG2 ARG A 605 10.089 -5.531 5.431 1.00 0.00 H new ATOM 0 HG3 ARG A 605 8.973 -4.572 4.479 1.00 0.00 H new ATOM 0 HD2 ARG A 605 7.727 -6.205 5.797 1.00 0.00 H new ATOM 0 HD3 ARG A 605 7.560 -6.576 4.093 1.00 0.00 H new ATOM 0 HE ARG A 605 9.775 -8.069 5.038 1.00 0.00 H new ATOM 0 HH11 ARG A 605 6.287 -7.838 5.562 1.00 0.00 H new ATOM 0 HH12 ARG A 605 6.126 -9.542 6.003 1.00 0.00 H new ATOM 0 HH21 ARG A 605 9.556 -10.251 5.607 1.00 0.00 H new ATOM 0 HH22 ARG A 605 7.969 -10.901 6.028 1.00 0.00 H new ATOM 1027 N GLN A 606 12.679 -6.174 1.365 1.00 0.00 N ATOM 1028 CA GLN A 606 13.840 -6.936 0.922 1.00 0.00 C ATOM 1029 C GLN A 606 15.086 -6.058 0.883 1.00 0.00 C ATOM 1030 O GLN A 606 16.201 -6.533 1.100 1.00 0.00 O ATOM 1031 CB GLN A 606 13.583 -7.540 -0.460 1.00 0.00 C ATOM 1032 CG GLN A 606 12.960 -8.925 -0.412 1.00 0.00 C ATOM 1033 CD GLN A 606 12.717 -9.502 -1.793 1.00 0.00 C ATOM 1034 OE1 GLN A 606 11.595 -9.474 -2.300 1.00 0.00 O ATOM 1035 NE2 GLN A 606 13.768 -10.028 -2.409 1.00 0.00 N ATOM 0 H GLN A 606 12.011 -5.956 0.626 1.00 0.00 H new ATOM 0 HA GLN A 606 14.009 -7.741 1.637 1.00 0.00 H new ATOM 0 HB2 GLN A 606 12.927 -6.875 -1.022 1.00 0.00 H new ATOM 0 HB3 GLN A 606 14.525 -7.593 -1.005 1.00 0.00 H new ATOM 0 HG2 GLN A 606 13.613 -9.594 0.148 1.00 0.00 H new ATOM 0 HG3 GLN A 606 12.015 -8.876 0.129 1.00 0.00 H new ATOM 0 HE21 GLN A 606 14.679 -10.030 -1.951 1.00 0.00 H new ATOM 0 HE22 GLN A 606 13.664 -10.431 -3.340 1.00 0.00 H new ATOM 1044 N LEU A 607 14.891 -4.773 0.604 1.00 0.00 N ATOM 1045 CA LEU A 607 16.000 -3.828 0.537 1.00 0.00 C ATOM 1046 C LEU A 607 16.620 -3.615 1.915 1.00 0.00 C ATOM 1047 O LEU A 607 17.834 -3.460 2.042 1.00 0.00 O ATOM 1048 CB LEU A 607 15.524 -2.490 -0.035 1.00 0.00 C ATOM 1049 CG LEU A 607 15.684 -2.341 -1.548 1.00 0.00 C ATOM 1050 CD1 LEU A 607 14.629 -1.396 -2.105 1.00 0.00 C ATOM 1051 CD2 LEU A 607 17.081 -1.843 -1.889 1.00 0.00 C ATOM 0 H LEU A 607 13.975 -4.362 0.421 1.00 0.00 H new ATOM 0 HA LEU A 607 16.761 -4.246 -0.122 1.00 0.00 H new ATOM 0 HB2 LEU A 607 14.472 -2.357 0.219 1.00 0.00 H new ATOM 0 HB3 LEU A 607 16.074 -1.686 0.454 1.00 0.00 H new ATOM 0 HG LEU A 607 15.546 -3.320 -2.008 1.00 0.00 H new ATOM 0 HD11 LEU A 607 14.758 -1.302 -3.183 1.00 0.00 H new ATOM 0 HD12 LEU A 607 13.636 -1.792 -1.892 1.00 0.00 H new ATOM 0 HD13 LEU A 607 14.736 -0.416 -1.640 1.00 0.00 H new ATOM 0 HD21 LEU A 607 17.178 -1.743 -2.970 1.00 0.00 H new ATOM 0 HD22 LEU A 607 17.247 -0.874 -1.418 1.00 0.00 H new ATOM 0 HD23 LEU A 607 17.821 -2.555 -1.523 1.00 0.00 H new ATOM 1063 N HIS A 608 15.778 -3.609 2.943 1.00 0.00 N ATOM 1064 CA HIS A 608 16.243 -3.414 4.311 1.00 0.00 C ATOM 1065 C HIS A 608 16.695 -4.735 4.926 1.00 0.00 C ATOM 1066 O HIS A 608 17.717 -4.795 5.609 1.00 0.00 O ATOM 1067 CB HIS A 608 15.137 -2.793 5.165 1.00 0.00 C ATOM 1068 CG HIS A 608 15.639 -2.158 6.425 1.00 0.00 C ATOM 1069 ND1 HIS A 608 16.979 -2.039 6.726 1.00 0.00 N ATOM 1070 CD2 HIS A 608 14.971 -1.605 7.466 1.00 0.00 C ATOM 1071 CE1 HIS A 608 17.116 -1.441 7.896 1.00 0.00 C ATOM 1072 NE2 HIS A 608 15.912 -1.168 8.365 1.00 0.00 N ATOM 0 H HIS A 608 14.770 -3.737 2.855 1.00 0.00 H new ATOM 0 HA HIS A 608 17.096 -2.736 4.284 1.00 0.00 H new ATOM 0 HB2 HIS A 608 14.611 -2.043 4.574 1.00 0.00 H new ATOM 0 HB3 HIS A 608 14.410 -3.564 5.421 1.00 0.00 H new ATOM 0 HD2 HIS A 608 13.899 -1.523 7.569 1.00 0.00 H new ATOM 0 HE1 HIS A 608 18.052 -1.214 8.385 1.00 0.00 H new ATOM 0 HE2 HIS A 608 15.713 -0.707 9.253 1.00 0.00 H new ATOM 1081 N GLU A 609 15.925 -5.790 4.680 1.00 0.00 N ATOM 1082 CA GLU A 609 16.247 -7.110 5.210 1.00 0.00 C ATOM 1083 C GLU A 609 17.056 -7.920 4.201 1.00 0.00 C ATOM 1084 O GLU A 609 16.494 -8.595 3.339 1.00 0.00 O ATOM 1085 CB GLU A 609 14.967 -7.863 5.576 1.00 0.00 C ATOM 1086 CG GLU A 609 15.177 -8.956 6.611 1.00 0.00 C ATOM 1087 CD GLU A 609 14.129 -10.048 6.526 1.00 0.00 C ATOM 1088 OE1 GLU A 609 14.418 -11.102 5.921 1.00 0.00 O ATOM 1089 OE2 GLU A 609 13.020 -9.849 7.065 1.00 0.00 O ATOM 0 H GLU A 609 15.075 -5.757 4.118 1.00 0.00 H new ATOM 0 HA GLU A 609 16.850 -6.975 6.108 1.00 0.00 H new ATOM 0 HB2 GLU A 609 14.233 -7.152 5.955 1.00 0.00 H new ATOM 0 HB3 GLU A 609 14.545 -8.305 4.673 1.00 0.00 H new ATOM 0 HG2 GLU A 609 16.166 -9.395 6.475 1.00 0.00 H new ATOM 0 HG3 GLU A 609 15.158 -8.516 7.608 1.00 0.00 H new ATOM 1096 N PHE A 610 18.378 -7.849 4.316 1.00 0.00 N ATOM 1097 CA PHE A 610 19.263 -8.576 3.415 1.00 0.00 C ATOM 1098 C PHE A 610 20.723 -8.382 3.813 1.00 0.00 C ATOM 1099 O PHE A 610 21.401 -7.485 3.312 1.00 0.00 O ATOM 1100 CB PHE A 610 19.049 -8.113 1.972 1.00 0.00 C ATOM 1101 CG PHE A 610 18.988 -9.242 0.983 1.00 0.00 C ATOM 1102 CD1 PHE A 610 20.073 -9.529 0.170 1.00 0.00 C ATOM 1103 CD2 PHE A 610 17.845 -10.017 0.866 1.00 0.00 C ATOM 1104 CE1 PHE A 610 20.019 -10.566 -0.740 1.00 0.00 C ATOM 1105 CE2 PHE A 610 17.785 -11.056 -0.044 1.00 0.00 C ATOM 1106 CZ PHE A 610 18.874 -11.330 -0.848 1.00 0.00 C ATOM 0 H PHE A 610 18.860 -7.295 5.024 1.00 0.00 H new ATOM 0 HA PHE A 610 19.023 -9.637 3.488 1.00 0.00 H new ATOM 0 HB2 PHE A 610 18.123 -7.541 1.916 1.00 0.00 H new ATOM 0 HB3 PHE A 610 19.858 -7.438 1.692 1.00 0.00 H new ATOM 0 HD1 PHE A 610 20.971 -8.935 0.249 1.00 0.00 H new ATOM 0 HD2 PHE A 610 16.991 -9.807 1.493 1.00 0.00 H new ATOM 0 HE1 PHE A 610 20.872 -10.779 -1.367 1.00 0.00 H new ATOM 0 HE2 PHE A 610 16.888 -11.652 -0.126 1.00 0.00 H new ATOM 0 HZ PHE A 610 18.830 -12.141 -1.560 1.00 0.00 H new ATOM 1116 N SER A 611 21.202 -9.231 4.718 1.00 0.00 N ATOM 1117 CA SER A 611 22.581 -9.152 5.184 1.00 0.00 C ATOM 1118 C SER A 611 23.545 -9.661 4.118 1.00 0.00 C ATOM 1119 O SER A 611 24.646 -9.134 3.959 1.00 0.00 O ATOM 1120 CB SER A 611 22.753 -9.961 6.471 1.00 0.00 C ATOM 1121 OG SER A 611 21.805 -11.013 6.544 1.00 0.00 O ATOM 0 H SER A 611 20.655 -9.980 5.142 1.00 0.00 H new ATOM 0 HA SER A 611 22.811 -8.106 5.387 1.00 0.00 H new ATOM 0 HB2 SER A 611 23.761 -10.373 6.513 1.00 0.00 H new ATOM 0 HB3 SER A 611 22.640 -9.305 7.334 1.00 0.00 H new ATOM 0 HG SER A 611 21.937 -11.516 7.375 1.00 0.00 H new ATOM 1127 N SER A 612 23.125 -10.689 3.389 1.00 0.00 N ATOM 1128 CA SER A 612 23.951 -11.270 2.336 1.00 0.00 C ATOM 1129 C SER A 612 25.258 -11.813 2.907 1.00 0.00 C ATOM 1130 O SER A 612 25.612 -11.526 4.051 1.00 0.00 O ATOM 1131 CB SER A 612 24.246 -10.227 1.257 1.00 0.00 C ATOM 1132 OG SER A 612 23.197 -9.278 1.163 1.00 0.00 O ATOM 0 H SER A 612 22.217 -11.138 3.508 1.00 0.00 H new ATOM 0 HA SER A 612 23.399 -12.097 1.890 1.00 0.00 H new ATOM 0 HB2 SER A 612 25.182 -9.717 1.486 1.00 0.00 H new ATOM 0 HB3 SER A 612 24.380 -10.722 0.295 1.00 0.00 H new ATOM 0 HG SER A 612 22.354 -9.740 0.974 1.00 0.00 H new ATOM 1138 N PRO A 613 25.997 -12.607 2.114 1.00 0.00 N ATOM 1139 CA PRO A 613 27.272 -13.190 2.546 1.00 0.00 C ATOM 1140 C PRO A 613 28.232 -12.140 3.094 1.00 0.00 C ATOM 1141 O PRO A 613 27.999 -10.938 2.956 1.00 0.00 O ATOM 1142 CB PRO A 613 27.833 -13.812 1.266 1.00 0.00 C ATOM 1143 CG PRO A 613 26.636 -14.089 0.423 1.00 0.00 C ATOM 1144 CD PRO A 613 25.649 -12.998 0.734 1.00 0.00 C ATOM 0 HA PRO A 613 27.138 -13.905 3.358 1.00 0.00 H new ATOM 0 HB2 PRO A 613 28.522 -13.132 0.764 1.00 0.00 H new ATOM 0 HB3 PRO A 613 28.387 -14.726 1.480 1.00 0.00 H new ATOM 0 HG2 PRO A 613 26.896 -14.090 -0.636 1.00 0.00 H new ATOM 0 HG3 PRO A 613 26.218 -15.070 0.649 1.00 0.00 H new ATOM 0 HD2 PRO A 613 25.744 -12.161 0.043 1.00 0.00 H new ATOM 0 HD3 PRO A 613 24.621 -13.354 0.664 1.00 0.00 H new ATOM 1152 N SER A 614 29.314 -12.600 3.715 1.00 0.00 N ATOM 1153 CA SER A 614 30.310 -11.699 4.282 1.00 0.00 C ATOM 1154 C SER A 614 31.271 -11.203 3.206 1.00 0.00 C ATOM 1155 O SER A 614 32.464 -11.506 3.235 1.00 0.00 O ATOM 1156 CB SER A 614 31.087 -12.403 5.396 1.00 0.00 C ATOM 1157 OG SER A 614 30.451 -12.231 6.651 1.00 0.00 O ATOM 0 H SER A 614 29.523 -13.591 3.838 1.00 0.00 H new ATOM 0 HA SER A 614 29.790 -10.837 4.701 1.00 0.00 H new ATOM 0 HB2 SER A 614 31.170 -13.466 5.170 1.00 0.00 H new ATOM 0 HB3 SER A 614 32.101 -12.007 5.442 1.00 0.00 H new ATOM 0 HG SER A 614 30.967 -12.692 7.345 1.00 0.00 H new ATOM 1163 N HIS A 615 30.743 -10.437 2.256 1.00 0.00 N ATOM 1164 CA HIS A 615 31.552 -9.898 1.170 1.00 0.00 C ATOM 1165 C HIS A 615 31.018 -8.544 0.715 1.00 0.00 C ATOM 1166 O HIS A 615 31.776 -7.587 0.557 1.00 0.00 O ATOM 1167 CB HIS A 615 31.577 -10.875 -0.008 1.00 0.00 C ATOM 1168 CG HIS A 615 32.817 -11.711 -0.065 1.00 0.00 C ATOM 1169 ND1 HIS A 615 32.794 -13.082 -0.223 1.00 0.00 N ATOM 1170 CD2 HIS A 615 34.124 -11.366 0.017 1.00 0.00 C ATOM 1171 CE1 HIS A 615 34.032 -13.542 -0.236 1.00 0.00 C ATOM 1172 NE2 HIS A 615 34.858 -12.521 -0.092 1.00 0.00 N ATOM 0 H HIS A 615 29.758 -10.176 2.217 1.00 0.00 H new ATOM 0 HA HIS A 615 32.568 -9.761 1.539 1.00 0.00 H new ATOM 0 HB2 HIS A 615 30.709 -11.531 0.056 1.00 0.00 H new ATOM 0 HB3 HIS A 615 31.484 -10.313 -0.937 1.00 0.00 H new ATOM 0 HD2 HIS A 615 34.516 -10.368 0.144 1.00 0.00 H new ATOM 0 HE1 HIS A 615 34.320 -14.577 -0.346 1.00 0.00 H new ATOM 0 HE2 HIS A 615 35.876 -12.581 -0.066 1.00 0.00 H new ATOM 1181 N LEU A 616 29.708 -8.470 0.506 1.00 0.00 N ATOM 1182 CA LEU A 616 29.072 -7.232 0.069 1.00 0.00 C ATOM 1183 C LEU A 616 28.540 -6.444 1.262 1.00 0.00 C ATOM 1184 O LEU A 616 28.682 -5.223 1.326 1.00 0.00 O ATOM 1185 CB LEU A 616 27.933 -7.535 -0.906 1.00 0.00 C ATOM 1186 CG LEU A 616 28.300 -8.469 -2.061 1.00 0.00 C ATOM 1187 CD1 LEU A 616 28.271 -9.918 -1.603 1.00 0.00 C ATOM 1188 CD2 LEU A 616 27.357 -8.259 -3.235 1.00 0.00 C ATOM 0 H LEU A 616 29.066 -9.252 0.632 1.00 0.00 H new ATOM 0 HA LEU A 616 29.823 -6.626 -0.438 1.00 0.00 H new ATOM 0 HB2 LEU A 616 27.107 -7.978 -0.349 1.00 0.00 H new ATOM 0 HB3 LEU A 616 27.570 -6.594 -1.321 1.00 0.00 H new ATOM 0 HG LEU A 616 29.313 -8.233 -2.388 1.00 0.00 H new ATOM 0 HD11 LEU A 616 28.534 -10.569 -2.437 1.00 0.00 H new ATOM 0 HD12 LEU A 616 28.987 -10.058 -0.793 1.00 0.00 H new ATOM 0 HD13 LEU A 616 27.271 -10.168 -1.250 1.00 0.00 H new ATOM 0 HD21 LEU A 616 27.632 -8.931 -4.048 1.00 0.00 H new ATOM 0 HD22 LEU A 616 26.334 -8.468 -2.922 1.00 0.00 H new ATOM 0 HD23 LEU A 616 27.428 -7.227 -3.578 1.00 0.00 H new ATOM 1200 N LEU A 617 27.926 -7.150 2.206 1.00 0.00 N ATOM 1201 CA LEU A 617 27.373 -6.517 3.397 1.00 0.00 C ATOM 1202 C LEU A 617 27.893 -7.192 4.663 1.00 0.00 C ATOM 1203 O LEU A 617 27.859 -8.417 4.785 1.00 0.00 O ATOM 1204 CB LEU A 617 25.842 -6.571 3.365 1.00 0.00 C ATOM 1205 CG LEU A 617 25.162 -5.305 2.843 1.00 0.00 C ATOM 1206 CD1 LEU A 617 25.392 -4.144 3.798 1.00 0.00 C ATOM 1207 CD2 LEU A 617 25.670 -4.962 1.452 1.00 0.00 C ATOM 0 H LEU A 617 27.799 -8.161 2.169 1.00 0.00 H new ATOM 0 HA LEU A 617 27.692 -5.475 3.406 1.00 0.00 H new ATOM 0 HB2 LEU A 617 25.536 -7.412 2.743 1.00 0.00 H new ATOM 0 HB3 LEU A 617 25.479 -6.771 4.373 1.00 0.00 H new ATOM 0 HG LEU A 617 24.090 -5.491 2.780 1.00 0.00 H new ATOM 0 HD11 LEU A 617 24.901 -3.251 3.410 1.00 0.00 H new ATOM 0 HD12 LEU A 617 24.978 -4.390 4.776 1.00 0.00 H new ATOM 0 HD13 LEU A 617 26.462 -3.957 3.893 1.00 0.00 H new ATOM 0 HD21 LEU A 617 25.175 -4.058 1.096 1.00 0.00 H new ATOM 0 HD22 LEU A 617 26.747 -4.796 1.489 1.00 0.00 H new ATOM 0 HD23 LEU A 617 25.453 -5.786 0.772 1.00 0.00 H new ATOM 1219 N ARG A 618 28.373 -6.384 5.602 1.00 0.00 N ATOM 1220 CA ARG A 618 28.900 -6.902 6.861 1.00 0.00 C ATOM 1221 C ARG A 618 28.008 -6.501 8.031 1.00 0.00 C ATOM 1222 O ARG A 618 28.494 -6.105 9.089 1.00 0.00 O ATOM 1223 CB ARG A 618 30.324 -6.390 7.090 1.00 0.00 C ATOM 1224 CG ARG A 618 31.336 -6.941 6.098 1.00 0.00 C ATOM 1225 CD ARG A 618 32.620 -6.128 6.103 1.00 0.00 C ATOM 1226 NE ARG A 618 33.191 -5.998 4.765 1.00 0.00 N ATOM 1227 CZ ARG A 618 32.749 -5.138 3.850 1.00 0.00 C ATOM 1228 NH1 ARG A 618 31.731 -4.332 4.124 1.00 0.00 N ATOM 1229 NH2 ARG A 618 33.326 -5.084 2.657 1.00 0.00 N ATOM 0 H ARG A 618 28.408 -5.368 5.516 1.00 0.00 H new ATOM 0 HA ARG A 618 28.918 -7.990 6.799 1.00 0.00 H new ATOM 0 HB2 ARG A 618 30.324 -5.302 7.029 1.00 0.00 H new ATOM 0 HB3 ARG A 618 30.638 -6.653 8.100 1.00 0.00 H new ATOM 0 HG2 ARG A 618 31.560 -7.979 6.344 1.00 0.00 H new ATOM 0 HG3 ARG A 618 30.905 -6.937 5.097 1.00 0.00 H new ATOM 0 HD2 ARG A 618 32.420 -5.137 6.509 1.00 0.00 H new ATOM 0 HD3 ARG A 618 33.347 -6.602 6.763 1.00 0.00 H new ATOM 0 HE ARG A 618 33.975 -6.602 4.517 1.00 0.00 H new ATOM 0 HH11 ARG A 618 31.283 -4.369 5.040 1.00 0.00 H new ATOM 0 HH12 ARG A 618 31.397 -3.675 3.419 1.00 0.00 H new ATOM 0 HH21 ARG A 618 34.108 -5.701 2.441 1.00 0.00 H new ATOM 0 HH22 ARG A 618 32.987 -4.425 1.956 1.00 0.00 H new ATOM 1243 N THR A 619 26.698 -6.607 7.832 1.00 0.00 N ATOM 1244 CA THR A 619 25.736 -6.256 8.870 1.00 0.00 C ATOM 1245 C THR A 619 25.122 -7.508 9.491 1.00 0.00 C ATOM 1246 O THR A 619 24.073 -7.978 9.052 1.00 0.00 O ATOM 1247 CB THR A 619 24.634 -5.366 8.293 1.00 0.00 C ATOM 1248 OG1 THR A 619 25.112 -4.633 7.180 1.00 0.00 O ATOM 1249 CG2 THR A 619 24.082 -4.372 9.293 1.00 0.00 C ATOM 0 H THR A 619 26.279 -6.933 6.961 1.00 0.00 H new ATOM 0 HA THR A 619 26.265 -5.708 9.650 1.00 0.00 H new ATOM 0 HB THR A 619 23.835 -6.048 8.003 1.00 0.00 H new ATOM 0 HG1 THR A 619 24.392 -4.071 6.824 1.00 0.00 H new ATOM 0 HG21 THR A 619 23.305 -3.773 8.819 1.00 0.00 H new ATOM 0 HG22 THR A 619 23.660 -4.908 10.143 1.00 0.00 H new ATOM 0 HG23 THR A 619 24.884 -3.719 9.638 1.00 0.00 H new ATOM 1257 N PRO A 620 25.772 -8.066 10.528 1.00 0.00 N ATOM 1258 CA PRO A 620 25.284 -9.270 11.209 1.00 0.00 C ATOM 1259 C PRO A 620 24.015 -9.007 12.013 1.00 0.00 C ATOM 1260 O PRO A 620 23.087 -9.815 12.009 1.00 0.00 O ATOM 1261 CB PRO A 620 26.438 -9.645 12.141 1.00 0.00 C ATOM 1262 CG PRO A 620 27.160 -8.366 12.384 1.00 0.00 C ATOM 1263 CD PRO A 620 27.030 -7.570 11.116 1.00 0.00 C ATOM 0 HA PRO A 620 25.016 -10.056 10.503 1.00 0.00 H new ATOM 0 HB2 PRO A 620 26.071 -10.075 13.073 1.00 0.00 H new ATOM 0 HB3 PRO A 620 27.091 -10.388 11.683 1.00 0.00 H new ATOM 0 HG2 PRO A 620 26.728 -7.828 13.228 1.00 0.00 H new ATOM 0 HG3 PRO A 620 28.207 -8.549 12.624 1.00 0.00 H new ATOM 0 HD2 PRO A 620 26.985 -6.500 11.317 1.00 0.00 H new ATOM 0 HD3 PRO A 620 27.877 -7.734 10.450 1.00 0.00 H new ATOM 1271 N SER A 621 23.981 -7.869 12.701 1.00 0.00 N ATOM 1272 CA SER A 621 22.825 -7.499 13.509 1.00 0.00 C ATOM 1273 C SER A 621 22.878 -6.022 13.889 1.00 0.00 C ATOM 1274 O SER A 621 21.967 -5.258 13.572 1.00 0.00 O ATOM 1275 CB SER A 621 22.763 -8.361 14.771 1.00 0.00 C ATOM 1276 OG SER A 621 23.807 -8.026 15.669 1.00 0.00 O ATOM 0 H SER A 621 24.740 -7.188 12.715 1.00 0.00 H new ATOM 0 HA SER A 621 21.927 -7.671 12.916 1.00 0.00 H new ATOM 0 HB2 SER A 621 21.799 -8.224 15.262 1.00 0.00 H new ATOM 0 HB3 SER A 621 22.836 -9.414 14.500 1.00 0.00 H new ATOM 0 HG SER A 621 23.744 -8.590 16.468 1.00 0.00 H new ATOM 1282 N SER A 622 23.949 -5.629 14.569 1.00 0.00 N ATOM 1283 CA SER A 622 24.121 -4.244 14.993 1.00 0.00 C ATOM 1284 C SER A 622 25.444 -3.680 14.485 1.00 0.00 C ATOM 1285 O SER A 622 25.415 -2.652 13.778 1.00 0.00 O ATOM 1286 CB SER A 622 24.061 -4.145 16.518 1.00 0.00 C ATOM 1287 OG SER A 622 24.304 -2.818 16.952 1.00 0.00 O ATOM 1288 OXT SER A 622 26.497 -4.272 14.801 1.00 0.00 O ATOM 0 H SER A 622 24.712 -6.250 14.839 1.00 0.00 H new ATOM 0 HA SER A 622 23.309 -3.655 14.566 1.00 0.00 H new ATOM 0 HB2 SER A 622 23.082 -4.472 16.869 1.00 0.00 H new ATOM 0 HB3 SER A 622 24.798 -4.816 16.959 1.00 0.00 H new ATOM 0 HG SER A 622 24.259 -2.780 17.930 1.00 0.00 H new TER 1294 SER A 622