USER MOD reduce.3.24.130724 H: found=0, std=0, add=635, rem=0, adj=29 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 564 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 588 LYS NZ :NH3+ 154:sc= 0.124 (180deg=0) USER MOD Set 2.1: A 581 MET CE :methyl -171:sc= -1.29 (180deg=-1.47) USER MOD Set 2.2: A 595 HIS :FLIP no HD1:sc= -0.0638 F(o=-4.1,f=-1.4) USER MOD Set 3.1: A 572 THR OG1 : rot 180:sc= 0.101 USER MOD Set 3.2: A 575 GLN : amide:sc= -0.0556 X(o=0.045,f=-0.014) 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= -0.522 USER MOD Single : A 547 CYS SG : rot 180:sc= -1.33 USER MOD Single : A 548 SER OG : rot -170:sc= 0.286 USER MOD Single : A 551 SER OG : rot 180:sc= 0 USER MOD Single : A 558 CYS SG : rot 7:sc= 0.179 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 -30:sc= -1.6 USER MOD Single : A 566 THR OG1 : rot 180:sc= -0.115 USER MOD Single : A 567 THR OG1 : rot 23:sc= 0.045 USER MOD Single : A 568 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 571 THR OG1 : rot 180:sc= 0 USER MOD Single : A 574 TYR OH : rot 180:sc= 0 USER MOD Single : A 578 HIS :FLIP no HD1:sc= -1.29 F(o=-2,f=-1.3) USER MOD Single : A 579 TYR OH : rot 165:sc= -4.71! USER MOD Single : A 580 SER OG : rot -84:sc= 1.2 USER MOD Single : A 586 SER OG : rot 180:sc= 0 USER MOD Single : A 592 GLN : amide:sc= -0.128 X(o=-0.13,f=-0.002) USER MOD Single : A 599 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 604 HIS : no HD1:sc= -0.0293 X(o=-0.029,f=-0.19) USER MOD Single : A 606 GLN : amide:sc= -0.0865 X(o=-0.087,f=0) USER MOD Single : A 608 HIS : no HD1:sc= -0.0784 X(o=-0.078,f=-0.4) USER MOD Single : A 611 SER OG : rot 10:sc= 0.998! USER MOD Single : A 612 SER OG : rot -61:sc= 0.153 USER MOD Single : A 614 SER OG : rot 180:sc= 0 USER MOD Single : A 615 HIS : no HD1:sc= -0.327 X(o=-0.33,f=-0.11) USER MOD Single : A 619 THR OG1 : rot 180:sc= -0.109 USER MOD Single : A 621 SER OG : rot 180:sc= 0 USER MOD Single : A 622 SER OG : rot 180:sc= 0.0218 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 541 2.891 5.954 14.077 1.00 0.00 N ATOM 2 CA GLY A 541 2.852 7.442 14.119 1.00 0.00 C ATOM 3 C GLY A 541 1.884 8.026 13.110 1.00 0.00 C ATOM 4 O GLY A 541 1.432 7.332 12.200 1.00 0.00 O ATOM 0 HA2 GLY A 541 2.568 7.767 15.120 1.00 0.00 H new ATOM 0 HA3 GLY A 541 3.851 7.834 13.928 1.00 0.00 H new ATOM 9 N SER A 542 1.565 9.306 13.271 1.00 0.00 N ATOM 10 CA SER A 542 0.643 9.982 12.366 1.00 0.00 C ATOM 11 C SER A 542 1.397 10.894 11.402 1.00 0.00 C ATOM 12 O SER A 542 1.033 11.015 10.233 1.00 0.00 O ATOM 13 CB SER A 542 -0.381 10.795 13.159 1.00 0.00 C ATOM 14 OG SER A 542 0.252 11.798 13.934 1.00 0.00 O ATOM 0 H SER A 542 1.931 9.895 14.019 1.00 0.00 H new ATOM 0 HA SER A 542 0.121 9.221 11.786 1.00 0.00 H new ATOM 0 HB2 SER A 542 -1.093 11.256 12.474 1.00 0.00 H new ATOM 0 HB3 SER A 542 -0.950 10.132 13.811 1.00 0.00 H new ATOM 0 HG SER A 542 -0.425 12.304 14.430 1.00 0.00 H new ATOM 20 N TYR A 543 2.449 11.534 11.903 1.00 0.00 N ATOM 21 CA TYR A 543 3.254 12.435 11.088 1.00 0.00 C ATOM 22 C TYR A 543 4.048 11.659 10.039 1.00 0.00 C ATOM 23 O TYR A 543 4.324 10.471 10.211 1.00 0.00 O ATOM 24 CB TYR A 543 4.207 13.241 11.972 1.00 0.00 C ATOM 25 CG TYR A 543 3.519 14.323 12.774 1.00 0.00 C ATOM 26 CD1 TYR A 543 3.707 14.422 14.146 1.00 0.00 C ATOM 27 CD2 TYR A 543 2.681 15.244 12.158 1.00 0.00 C ATOM 28 CE1 TYR A 543 3.079 15.408 14.883 1.00 0.00 C ATOM 29 CE2 TYR A 543 2.050 16.233 12.888 1.00 0.00 C ATOM 30 CZ TYR A 543 2.252 16.311 14.250 1.00 0.00 C ATOM 31 OH TYR A 543 1.624 17.294 14.979 1.00 0.00 O ATOM 0 H TYR A 543 2.763 11.445 12.869 1.00 0.00 H new ATOM 0 HA TYR A 543 2.579 13.119 10.574 1.00 0.00 H new ATOM 0 HB2 TYR A 543 4.717 12.562 12.656 1.00 0.00 H new ATOM 0 HB3 TYR A 543 4.973 13.697 11.345 1.00 0.00 H new ATOM 0 HD1 TYR A 543 4.355 13.717 14.646 1.00 0.00 H new ATOM 0 HD2 TYR A 543 2.520 15.186 11.092 1.00 0.00 H new ATOM 0 HE1 TYR A 543 3.235 15.471 15.950 1.00 0.00 H new ATOM 0 HE2 TYR A 543 1.402 16.942 12.394 1.00 0.00 H new ATOM 0 HH TYR A 543 1.079 17.847 14.381 1.00 0.00 H new ATOM 41 N PRO A 544 4.426 12.323 8.933 1.00 0.00 N ATOM 42 CA PRO A 544 5.191 11.689 7.853 1.00 0.00 C ATOM 43 C PRO A 544 6.626 11.377 8.264 1.00 0.00 C ATOM 44 O PRO A 544 7.185 12.028 9.147 1.00 0.00 O ATOM 45 CB PRO A 544 5.171 12.738 6.740 1.00 0.00 C ATOM 46 CG PRO A 544 4.993 14.037 7.446 1.00 0.00 C ATOM 47 CD PRO A 544 4.139 13.741 8.648 1.00 0.00 C ATOM 0 HA PRO A 544 4.764 10.730 7.561 1.00 0.00 H new ATOM 0 HB2 PRO A 544 6.097 12.723 6.166 1.00 0.00 H new ATOM 0 HB3 PRO A 544 4.358 12.555 6.038 1.00 0.00 H new ATOM 0 HG2 PRO A 544 5.955 14.454 7.744 1.00 0.00 H new ATOM 0 HG3 PRO A 544 4.514 14.771 6.798 1.00 0.00 H new ATOM 0 HD2 PRO A 544 4.398 14.380 9.492 1.00 0.00 H new ATOM 0 HD3 PRO A 544 3.082 13.902 8.439 1.00 0.00 H new ATOM 55 N THR A 545 7.217 10.377 7.618 1.00 0.00 N ATOM 56 CA THR A 545 8.589 9.977 7.916 1.00 0.00 C ATOM 57 C THR A 545 9.477 10.114 6.679 1.00 0.00 C ATOM 58 O THR A 545 10.127 11.141 6.485 1.00 0.00 O ATOM 59 CB THR A 545 8.626 8.538 8.454 1.00 0.00 C ATOM 60 OG1 THR A 545 9.851 7.906 8.124 1.00 0.00 O ATOM 61 CG2 THR A 545 7.506 7.661 7.931 1.00 0.00 C ATOM 0 H THR A 545 6.768 9.828 6.885 1.00 0.00 H new ATOM 0 HA THR A 545 8.978 10.643 8.687 1.00 0.00 H new ATOM 0 HB THR A 545 8.508 8.640 9.533 1.00 0.00 H new ATOM 0 HG1 THR A 545 9.853 6.992 8.478 1.00 0.00 H new ATOM 0 HG21 THR A 545 7.599 6.661 8.355 1.00 0.00 H new ATOM 0 HG22 THR A 545 6.545 8.089 8.217 1.00 0.00 H new ATOM 0 HG23 THR A 545 7.568 7.602 6.844 1.00 0.00 H new ATOM 69 N ASP A 546 9.501 9.078 5.848 1.00 0.00 N ATOM 70 CA ASP A 546 10.309 9.089 4.633 1.00 0.00 C ATOM 71 C ASP A 546 9.448 8.820 3.406 1.00 0.00 C ATOM 72 O ASP A 546 9.132 9.732 2.642 1.00 0.00 O ATOM 73 CB ASP A 546 11.427 8.046 4.730 1.00 0.00 C ATOM 74 CG ASP A 546 12.804 8.656 4.552 1.00 0.00 C ATOM 75 OD1 ASP A 546 13.436 8.398 3.506 1.00 0.00 O ATOM 76 OD2 ASP A 546 13.250 9.390 5.459 1.00 0.00 O ATOM 0 H ASP A 546 8.970 8.219 5.993 1.00 0.00 H new ATOM 0 HA ASP A 546 10.754 10.078 4.530 1.00 0.00 H new ATOM 0 HB2 ASP A 546 11.375 7.550 5.699 1.00 0.00 H new ATOM 0 HB3 ASP A 546 11.272 7.279 3.971 1.00 0.00 H new ATOM 81 N CYS A 547 9.070 7.561 3.226 1.00 0.00 N ATOM 82 CA CYS A 547 8.244 7.164 2.094 1.00 0.00 C ATOM 83 C CYS A 547 6.771 7.101 2.493 1.00 0.00 C ATOM 84 O CYS A 547 6.401 6.431 3.456 1.00 0.00 O ATOM 85 CB CYS A 547 8.712 5.818 1.543 1.00 0.00 C ATOM 86 SG CYS A 547 7.883 5.321 0.015 1.00 0.00 S ATOM 0 H CYS A 547 9.323 6.796 3.851 1.00 0.00 H new ATOM 0 HA CYS A 547 8.349 7.915 1.311 1.00 0.00 H new ATOM 0 HB2 CYS A 547 9.786 5.864 1.363 1.00 0.00 H new ATOM 0 HB3 CYS A 547 8.548 5.050 2.299 1.00 0.00 H new ATOM 0 HG CYS A 547 8.346 4.171 -0.376 1.00 0.00 H new ATOM 92 N SER A 548 5.944 7.819 1.745 1.00 0.00 N ATOM 93 CA SER A 548 4.509 7.874 2.003 1.00 0.00 C ATOM 94 C SER A 548 3.735 7.048 0.986 1.00 0.00 C ATOM 95 O SER A 548 4.226 6.778 -0.107 1.00 0.00 O ATOM 96 CB SER A 548 4.020 9.323 1.938 1.00 0.00 C ATOM 97 OG SER A 548 3.978 9.782 0.596 1.00 0.00 O ATOM 0 H SER A 548 6.245 8.377 0.946 1.00 0.00 H new ATOM 0 HA SER A 548 4.335 7.464 2.998 1.00 0.00 H new ATOM 0 HB2 SER A 548 3.028 9.397 2.383 1.00 0.00 H new ATOM 0 HB3 SER A 548 4.681 9.961 2.525 1.00 0.00 H new ATOM 0 HG SER A 548 3.817 10.749 0.586 1.00 0.00 H new ATOM 103 N ILE A 549 2.507 6.682 1.338 1.00 0.00 N ATOM 104 CA ILE A 549 1.655 5.923 0.433 1.00 0.00 C ATOM 105 C ILE A 549 1.327 6.774 -0.789 1.00 0.00 C ATOM 106 O ILE A 549 1.099 6.257 -1.882 1.00 0.00 O ATOM 107 CB ILE A 549 0.334 5.500 1.111 1.00 0.00 C ATOM 108 CG1 ILE A 549 0.610 4.805 2.448 1.00 0.00 C ATOM 109 CG2 ILE A 549 -0.473 4.597 0.187 1.00 0.00 C ATOM 110 CD1 ILE A 549 1.202 3.419 2.308 1.00 0.00 C ATOM 0 H ILE A 549 2.082 6.898 2.240 1.00 0.00 H new ATOM 0 HA ILE A 549 2.198 5.023 0.143 1.00 0.00 H new ATOM 0 HB ILE A 549 -0.253 6.396 1.312 1.00 0.00 H new ATOM 0 HG12 ILE A 549 1.291 5.423 3.034 1.00 0.00 H new ATOM 0 HG13 ILE A 549 -0.322 4.737 3.010 1.00 0.00 H new ATOM 0 HG21 ILE A 549 -1.401 4.308 0.680 1.00 0.00 H new ATOM 0 HG22 ILE A 549 -0.703 5.132 -0.734 1.00 0.00 H new ATOM 0 HG23 ILE A 549 0.107 3.704 -0.047 1.00 0.00 H new ATOM 0 HD11 ILE A 549 1.369 2.993 3.297 1.00 0.00 H new ATOM 0 HD12 ILE A 549 0.513 2.784 1.751 1.00 0.00 H new ATOM 0 HD13 ILE A 549 2.151 3.481 1.775 1.00 0.00 H new ATOM 122 N VAL A 550 1.308 8.091 -0.586 1.00 0.00 N ATOM 123 CA VAL A 550 1.013 9.038 -1.653 1.00 0.00 C ATOM 124 C VAL A 550 2.075 8.975 -2.747 1.00 0.00 C ATOM 125 O VAL A 550 1.754 8.857 -3.929 1.00 0.00 O ATOM 126 CB VAL A 550 0.925 10.475 -1.094 1.00 0.00 C ATOM 127 CG1 VAL A 550 0.935 11.507 -2.212 1.00 0.00 C ATOM 128 CG2 VAL A 550 -0.314 10.631 -0.226 1.00 0.00 C ATOM 0 H VAL A 550 1.496 8.526 0.317 1.00 0.00 H new ATOM 0 HA VAL A 550 0.050 8.764 -2.085 1.00 0.00 H new ATOM 0 HB VAL A 550 1.806 10.651 -0.477 1.00 0.00 H new ATOM 0 HG11 VAL A 550 0.872 12.508 -1.784 1.00 0.00 H new ATOM 0 HG12 VAL A 550 1.858 11.415 -2.784 1.00 0.00 H new ATOM 0 HG13 VAL A 550 0.082 11.339 -2.870 1.00 0.00 H new ATOM 0 HG21 VAL A 550 -0.362 11.649 0.160 1.00 0.00 H new ATOM 0 HG22 VAL A 550 -1.204 10.427 -0.822 1.00 0.00 H new ATOM 0 HG23 VAL A 550 -0.266 9.929 0.606 1.00 0.00 H new ATOM 138 N SER A 551 3.340 9.041 -2.345 1.00 0.00 N ATOM 139 CA SER A 551 4.442 8.977 -3.300 1.00 0.00 C ATOM 140 C SER A 551 4.673 7.534 -3.731 1.00 0.00 C ATOM 141 O SER A 551 4.999 7.258 -4.887 1.00 0.00 O ATOM 142 CB SER A 551 5.718 9.553 -2.683 1.00 0.00 C ATOM 143 OG SER A 551 6.799 9.491 -3.597 1.00 0.00 O ATOM 0 H SER A 551 3.627 9.138 -1.371 1.00 0.00 H new ATOM 0 HA SER A 551 4.181 9.572 -4.175 1.00 0.00 H new ATOM 0 HB2 SER A 551 5.547 10.588 -2.386 1.00 0.00 H new ATOM 0 HB3 SER A 551 5.970 9.000 -1.778 1.00 0.00 H new ATOM 0 HG SER A 551 7.602 9.866 -3.180 1.00 0.00 H new ATOM 149 N PHE A 552 4.488 6.623 -2.786 1.00 0.00 N ATOM 150 CA PHE A 552 4.660 5.198 -3.036 1.00 0.00 C ATOM 151 C PHE A 552 3.672 4.718 -4.097 1.00 0.00 C ATOM 152 O PHE A 552 4.045 4.008 -5.031 1.00 0.00 O ATOM 153 CB PHE A 552 4.472 4.428 -1.722 1.00 0.00 C ATOM 154 CG PHE A 552 4.049 2.997 -1.888 1.00 0.00 C ATOM 155 CD1 PHE A 552 2.944 2.518 -1.211 1.00 0.00 C ATOM 156 CD2 PHE A 552 4.753 2.138 -2.715 1.00 0.00 C ATOM 157 CE1 PHE A 552 2.543 1.206 -1.352 1.00 0.00 C ATOM 158 CE2 PHE A 552 4.358 0.822 -2.862 1.00 0.00 C ATOM 159 CZ PHE A 552 3.251 0.354 -2.179 1.00 0.00 C ATOM 0 H PHE A 552 4.216 6.849 -1.829 1.00 0.00 H new ATOM 0 HA PHE A 552 5.666 5.014 -3.414 1.00 0.00 H new ATOM 0 HB2 PHE A 552 5.408 4.453 -1.165 1.00 0.00 H new ATOM 0 HB3 PHE A 552 3.727 4.945 -1.117 1.00 0.00 H new ATOM 0 HD1 PHE A 552 2.387 3.179 -0.563 1.00 0.00 H new ATOM 0 HD2 PHE A 552 5.619 2.500 -3.250 1.00 0.00 H new ATOM 0 HE1 PHE A 552 1.677 0.845 -0.817 1.00 0.00 H new ATOM 0 HE2 PHE A 552 4.913 0.160 -3.510 1.00 0.00 H new ATOM 0 HZ PHE A 552 2.940 -0.674 -2.291 1.00 0.00 H new ATOM 169 N LEU A 553 2.412 5.115 -3.950 1.00 0.00 N ATOM 170 CA LEU A 553 1.372 4.730 -4.898 1.00 0.00 C ATOM 171 C LEU A 553 1.518 5.508 -6.200 1.00 0.00 C ATOM 172 O LEU A 553 1.354 4.954 -7.288 1.00 0.00 O ATOM 173 CB LEU A 553 -0.017 4.972 -4.302 1.00 0.00 C ATOM 174 CG LEU A 553 -0.521 3.876 -3.361 1.00 0.00 C ATOM 175 CD1 LEU A 553 -1.946 4.171 -2.911 1.00 0.00 C ATOM 176 CD2 LEU A 553 -0.444 2.516 -4.039 1.00 0.00 C ATOM 0 H LEU A 553 2.086 5.703 -3.183 1.00 0.00 H new ATOM 0 HA LEU A 553 1.485 3.666 -5.109 1.00 0.00 H new ATOM 0 HB2 LEU A 553 -0.002 5.917 -3.759 1.00 0.00 H new ATOM 0 HB3 LEU A 553 -0.731 5.085 -5.118 1.00 0.00 H new ATOM 0 HG LEU A 553 0.119 3.857 -2.479 1.00 0.00 H new ATOM 0 HD11 LEU A 553 -2.287 3.381 -2.242 1.00 0.00 H new ATOM 0 HD12 LEU A 553 -1.972 5.126 -2.387 1.00 0.00 H new ATOM 0 HD13 LEU A 553 -2.600 4.217 -3.782 1.00 0.00 H new ATOM 0 HD21 LEU A 553 -0.806 1.748 -3.356 1.00 0.00 H new ATOM 0 HD22 LEU A 553 -1.060 2.522 -4.938 1.00 0.00 H new ATOM 0 HD23 LEU A 553 0.590 2.302 -4.310 1.00 0.00 H new ATOM 188 N ALA A 554 1.828 6.796 -6.083 1.00 0.00 N ATOM 189 CA ALA A 554 1.999 7.651 -7.252 1.00 0.00 C ATOM 190 C ALA A 554 3.037 7.072 -8.206 1.00 0.00 C ATOM 191 O ALA A 554 2.882 7.140 -9.426 1.00 0.00 O ATOM 192 CB ALA A 554 2.395 9.057 -6.825 1.00 0.00 C ATOM 0 H ALA A 554 1.966 7.270 -5.190 1.00 0.00 H new ATOM 0 HA ALA A 554 1.046 7.700 -7.779 1.00 0.00 H new ATOM 0 HB1 ALA A 554 2.519 9.684 -7.708 1.00 0.00 H new ATOM 0 HB2 ALA A 554 1.616 9.477 -6.188 1.00 0.00 H new ATOM 0 HB3 ALA A 554 3.334 9.019 -6.272 1.00 0.00 H new ATOM 198 N ARG A 555 4.092 6.499 -7.641 1.00 0.00 N ATOM 199 CA ARG A 555 5.156 5.901 -8.438 1.00 0.00 C ATOM 200 C ARG A 555 4.647 4.676 -9.192 1.00 0.00 C ATOM 201 O ARG A 555 5.144 4.347 -10.269 1.00 0.00 O ATOM 202 CB ARG A 555 6.336 5.512 -7.545 1.00 0.00 C ATOM 203 CG ARG A 555 7.671 5.502 -8.271 1.00 0.00 C ATOM 204 CD ARG A 555 7.959 4.144 -8.890 1.00 0.00 C ATOM 205 NE ARG A 555 8.582 3.229 -7.936 1.00 0.00 N ATOM 206 CZ ARG A 555 9.870 3.270 -7.602 1.00 0.00 C ATOM 207 NH1 ARG A 555 10.674 4.177 -8.143 1.00 0.00 N ATOM 208 NH2 ARG A 555 10.355 2.402 -6.725 1.00 0.00 N ATOM 0 H ARG A 555 4.234 6.436 -6.633 1.00 0.00 H new ATOM 0 HA ARG A 555 5.490 6.641 -9.166 1.00 0.00 H new ATOM 0 HB2 ARG A 555 6.392 6.208 -6.708 1.00 0.00 H new ATOM 0 HB3 ARG A 555 6.153 4.523 -7.125 1.00 0.00 H new ATOM 0 HG2 ARG A 555 7.668 6.265 -9.050 1.00 0.00 H new ATOM 0 HG3 ARG A 555 8.467 5.761 -7.574 1.00 0.00 H new ATOM 0 HD2 ARG A 555 7.030 3.708 -9.257 1.00 0.00 H new ATOM 0 HD3 ARG A 555 8.614 4.270 -9.752 1.00 0.00 H new ATOM 0 HE ARG A 555 7.996 2.517 -7.500 1.00 0.00 H new ATOM 0 HH11 ARG A 555 10.306 4.847 -8.818 1.00 0.00 H new ATOM 0 HH12 ARG A 555 11.660 4.204 -7.884 1.00 0.00 H new ATOM 0 HH21 ARG A 555 9.741 1.703 -6.306 1.00 0.00 H new ATOM 0 HH22 ARG A 555 11.342 2.433 -6.469 1.00 0.00 H new ATOM 222 N LEU A 556 3.650 4.005 -8.620 1.00 0.00 N ATOM 223 CA LEU A 556 3.073 2.817 -9.240 1.00 0.00 C ATOM 224 C LEU A 556 1.833 3.167 -10.059 1.00 0.00 C ATOM 225 O LEU A 556 1.400 2.390 -10.909 1.00 0.00 O ATOM 226 CB LEU A 556 2.716 1.782 -8.171 1.00 0.00 C ATOM 227 CG LEU A 556 3.803 1.532 -7.124 1.00 0.00 C ATOM 228 CD1 LEU A 556 3.249 0.719 -5.964 1.00 0.00 C ATOM 229 CD2 LEU A 556 4.994 0.824 -7.752 1.00 0.00 C ATOM 0 H LEU A 556 3.226 4.264 -7.729 1.00 0.00 H new ATOM 0 HA LEU A 556 3.819 2.396 -9.914 1.00 0.00 H new ATOM 0 HB2 LEU A 556 1.809 2.107 -7.661 1.00 0.00 H new ATOM 0 HB3 LEU A 556 2.484 0.838 -8.664 1.00 0.00 H new ATOM 0 HG LEU A 556 4.139 2.495 -6.739 1.00 0.00 H new ATOM 0 HD11 LEU A 556 4.036 0.551 -5.229 1.00 0.00 H new ATOM 0 HD12 LEU A 556 2.427 1.263 -5.498 1.00 0.00 H new ATOM 0 HD13 LEU A 556 2.886 -0.240 -6.333 1.00 0.00 H new ATOM 0 HD21 LEU A 556 5.758 0.654 -6.993 1.00 0.00 H new ATOM 0 HD22 LEU A 556 4.673 -0.133 -8.164 1.00 0.00 H new ATOM 0 HD23 LEU A 556 5.406 1.443 -8.549 1.00 0.00 H new ATOM 241 N GLY A 557 1.261 4.341 -9.799 1.00 0.00 N ATOM 242 CA GLY A 557 0.078 4.765 -10.524 1.00 0.00 C ATOM 243 C GLY A 557 -1.202 4.224 -9.916 1.00 0.00 C ATOM 244 O GLY A 557 -2.078 3.737 -10.630 1.00 0.00 O ATOM 0 H GLY A 557 1.596 5.004 -9.100 1.00 0.00 H new ATOM 0 HA2 GLY A 557 0.037 5.854 -10.540 1.00 0.00 H new ATOM 0 HA3 GLY A 557 0.153 4.434 -11.560 1.00 0.00 H new ATOM 248 N CYS A 558 -1.311 4.312 -8.594 1.00 0.00 N ATOM 249 CA CYS A 558 -2.494 3.828 -7.892 1.00 0.00 C ATOM 250 C CYS A 558 -2.799 4.698 -6.675 1.00 0.00 C ATOM 251 O CYS A 558 -3.129 4.191 -5.603 1.00 0.00 O ATOM 252 CB CYS A 558 -2.296 2.374 -7.458 1.00 0.00 C ATOM 253 SG CYS A 558 -2.244 1.195 -8.828 1.00 0.00 S ATOM 0 H CYS A 558 -0.595 4.713 -7.988 1.00 0.00 H new ATOM 0 HA CYS A 558 -3.340 3.883 -8.577 1.00 0.00 H new ATOM 0 HB2 CYS A 558 -1.367 2.298 -6.892 1.00 0.00 H new ATOM 0 HB3 CYS A 558 -3.105 2.094 -6.783 1.00 0.00 H new ATOM 0 HG CYS A 558 -2.250 1.840 -9.956 1.00 0.00 H new ATOM 259 N SER A 559 -2.688 6.011 -6.851 1.00 0.00 N ATOM 260 CA SER A 559 -2.953 6.952 -5.768 1.00 0.00 C ATOM 261 C SER A 559 -4.401 6.852 -5.297 1.00 0.00 C ATOM 262 O SER A 559 -4.708 7.134 -4.139 1.00 0.00 O ATOM 263 CB SER A 559 -2.650 8.381 -6.222 1.00 0.00 C ATOM 264 OG SER A 559 -3.290 8.672 -7.453 1.00 0.00 O ATOM 0 H SER A 559 -2.417 6.447 -7.732 1.00 0.00 H new ATOM 0 HA SER A 559 -2.302 6.696 -4.932 1.00 0.00 H new ATOM 0 HB2 SER A 559 -2.982 9.086 -5.460 1.00 0.00 H new ATOM 0 HB3 SER A 559 -1.573 8.511 -6.329 1.00 0.00 H new ATOM 0 HG SER A 559 -3.082 9.592 -7.720 1.00 0.00 H new ATOM 270 N SER A 560 -5.288 6.450 -6.201 1.00 0.00 N ATOM 271 CA SER A 560 -6.703 6.315 -5.874 1.00 0.00 C ATOM 272 C SER A 560 -6.915 5.297 -4.756 1.00 0.00 C ATOM 273 O SER A 560 -7.926 5.334 -4.055 1.00 0.00 O ATOM 274 CB SER A 560 -7.495 5.898 -7.115 1.00 0.00 C ATOM 275 OG SER A 560 -8.829 6.371 -7.053 1.00 0.00 O ATOM 0 H SER A 560 -5.053 6.212 -7.165 1.00 0.00 H new ATOM 0 HA SER A 560 -7.062 7.284 -5.527 1.00 0.00 H new ATOM 0 HB2 SER A 560 -7.009 6.289 -8.009 1.00 0.00 H new ATOM 0 HB3 SER A 560 -7.495 4.811 -7.202 1.00 0.00 H new ATOM 0 HG SER A 560 -9.313 6.092 -7.858 1.00 0.00 H new ATOM 281 N CYS A 561 -5.959 4.385 -4.598 1.00 0.00 N ATOM 282 CA CYS A 561 -6.046 3.356 -3.567 1.00 0.00 C ATOM 283 C CYS A 561 -5.783 3.933 -2.178 1.00 0.00 C ATOM 284 O CYS A 561 -6.153 3.331 -1.169 1.00 0.00 O ATOM 285 CB CYS A 561 -5.052 2.231 -3.857 1.00 0.00 C ATOM 286 SG CYS A 561 -5.743 0.866 -4.821 1.00 0.00 S ATOM 0 H CYS A 561 -5.116 4.338 -5.171 1.00 0.00 H new ATOM 0 HA CYS A 561 -7.060 2.957 -3.583 1.00 0.00 H new ATOM 0 HB2 CYS A 561 -4.198 2.645 -4.393 1.00 0.00 H new ATOM 0 HB3 CYS A 561 -4.676 1.840 -2.912 1.00 0.00 H new ATOM 0 HG CYS A 561 -7.011 0.749 -4.561 1.00 0.00 H new ATOM 292 N LEU A 562 -5.138 5.095 -2.127 1.00 0.00 N ATOM 293 CA LEU A 562 -4.823 5.739 -0.854 1.00 0.00 C ATOM 294 C LEU A 562 -6.058 5.853 0.034 1.00 0.00 C ATOM 295 O LEU A 562 -5.974 5.677 1.249 1.00 0.00 O ATOM 296 CB LEU A 562 -4.222 7.125 -1.088 1.00 0.00 C ATOM 297 CG LEU A 562 -3.071 7.489 -0.147 1.00 0.00 C ATOM 298 CD1 LEU A 562 -1.736 7.327 -0.853 1.00 0.00 C ATOM 299 CD2 LEU A 562 -3.231 8.909 0.372 1.00 0.00 C ATOM 0 H LEU A 562 -4.824 5.609 -2.950 1.00 0.00 H new ATOM 0 HA LEU A 562 -4.092 5.113 -0.342 1.00 0.00 H new ATOM 0 HB2 LEU A 562 -3.865 7.183 -2.116 1.00 0.00 H new ATOM 0 HB3 LEU A 562 -5.010 7.871 -0.982 1.00 0.00 H new ATOM 0 HG LEU A 562 -3.096 6.809 0.705 1.00 0.00 H new ATOM 0 HD11 LEU A 562 -0.929 7.590 -0.169 1.00 0.00 H new ATOM 0 HD12 LEU A 562 -1.617 6.292 -1.174 1.00 0.00 H new ATOM 0 HD13 LEU A 562 -1.703 7.983 -1.723 1.00 0.00 H new ATOM 0 HD21 LEU A 562 -2.403 9.148 1.039 1.00 0.00 H new ATOM 0 HD22 LEU A 562 -3.234 9.605 -0.467 1.00 0.00 H new ATOM 0 HD23 LEU A 562 -4.171 8.994 0.917 1.00 0.00 H new ATOM 311 N ASP A 563 -7.203 6.142 -0.575 1.00 0.00 N ATOM 312 CA ASP A 563 -8.450 6.278 0.173 1.00 0.00 C ATOM 313 C ASP A 563 -8.693 5.051 1.046 1.00 0.00 C ATOM 314 O ASP A 563 -9.206 5.161 2.160 1.00 0.00 O ATOM 315 CB ASP A 563 -9.626 6.476 -0.786 1.00 0.00 C ATOM 316 CG ASP A 563 -9.905 7.940 -1.065 1.00 0.00 C ATOM 317 OD1 ASP A 563 -9.018 8.617 -1.624 1.00 0.00 O ATOM 318 OD2 ASP A 563 -11.012 8.408 -0.724 1.00 0.00 O ATOM 0 H ASP A 563 -7.295 6.286 -1.581 1.00 0.00 H new ATOM 0 HA ASP A 563 -8.366 7.153 0.818 1.00 0.00 H new ATOM 0 HB2 ASP A 563 -9.416 5.964 -1.725 1.00 0.00 H new ATOM 0 HB3 ASP A 563 -10.518 6.013 -0.363 1.00 0.00 H new ATOM 323 N TYR A 564 -8.315 3.886 0.534 1.00 0.00 N ATOM 324 CA TYR A 564 -8.483 2.641 1.262 1.00 0.00 C ATOM 325 C TYR A 564 -7.517 2.566 2.440 1.00 0.00 C ATOM 326 O TYR A 564 -7.844 2.007 3.487 1.00 0.00 O ATOM 327 CB TYR A 564 -8.254 1.459 0.323 1.00 0.00 C ATOM 328 CG TYR A 564 -9.100 1.504 -0.929 1.00 0.00 C ATOM 329 CD1 TYR A 564 -8.511 1.509 -2.188 1.00 0.00 C ATOM 330 CD2 TYR A 564 -10.486 1.539 -0.852 1.00 0.00 C ATOM 331 CE1 TYR A 564 -9.282 1.550 -3.335 1.00 0.00 C ATOM 332 CE2 TYR A 564 -11.262 1.580 -1.994 1.00 0.00 C ATOM 333 CZ TYR A 564 -10.656 1.585 -3.232 1.00 0.00 C ATOM 334 OH TYR A 564 -11.426 1.626 -4.372 1.00 0.00 O ATOM 0 H TYR A 564 -7.889 3.781 -0.387 1.00 0.00 H new ATOM 0 HA TYR A 564 -9.500 2.602 1.651 1.00 0.00 H new ATOM 0 HB2 TYR A 564 -7.202 1.431 0.039 1.00 0.00 H new ATOM 0 HB3 TYR A 564 -8.464 0.534 0.860 1.00 0.00 H new ATOM 0 HD1 TYR A 564 -7.435 1.480 -2.272 1.00 0.00 H new ATOM 0 HD2 TYR A 564 -10.965 1.534 0.116 1.00 0.00 H new ATOM 0 HE1 TYR A 564 -8.810 1.555 -4.306 1.00 0.00 H new ATOM 0 HE2 TYR A 564 -12.339 1.608 -1.917 1.00 0.00 H new ATOM 0 HH TYR A 564 -12.374 1.646 -4.126 1.00 0.00 H new ATOM 344 N PHE A 565 -6.325 3.130 2.263 1.00 0.00 N ATOM 345 CA PHE A 565 -5.316 3.123 3.316 1.00 0.00 C ATOM 346 C PHE A 565 -5.658 4.134 4.405 1.00 0.00 C ATOM 347 O PHE A 565 -5.644 3.814 5.593 1.00 0.00 O ATOM 348 CB PHE A 565 -3.940 3.438 2.724 1.00 0.00 C ATOM 349 CG PHE A 565 -3.373 2.319 1.899 1.00 0.00 C ATOM 350 CD1 PHE A 565 -3.122 1.082 2.466 1.00 0.00 C ATOM 351 CD2 PHE A 565 -3.095 2.505 0.555 1.00 0.00 C ATOM 352 CE1 PHE A 565 -2.603 0.049 1.708 1.00 0.00 C ATOM 353 CE2 PHE A 565 -2.576 1.476 -0.209 1.00 0.00 C ATOM 354 CZ PHE A 565 -2.330 0.246 0.369 1.00 0.00 C ATOM 0 H PHE A 565 -6.036 3.596 1.403 1.00 0.00 H new ATOM 0 HA PHE A 565 -5.296 2.130 3.765 1.00 0.00 H new ATOM 0 HB2 PHE A 565 -4.015 4.333 2.106 1.00 0.00 H new ATOM 0 HB3 PHE A 565 -3.248 3.668 3.535 1.00 0.00 H new ATOM 0 HD1 PHE A 565 -3.334 0.922 3.513 1.00 0.00 H new ATOM 0 HD2 PHE A 565 -3.286 3.465 0.098 1.00 0.00 H new ATOM 0 HE1 PHE A 565 -2.411 -0.912 2.163 1.00 0.00 H new ATOM 0 HE2 PHE A 565 -2.363 1.634 -1.256 1.00 0.00 H new ATOM 0 HZ PHE A 565 -1.925 -0.560 -0.225 1.00 0.00 H new ATOM 364 N THR A 566 -5.974 5.353 3.989 1.00 0.00 N ATOM 365 CA THR A 566 -6.324 6.413 4.927 1.00 0.00 C ATOM 366 C THR A 566 -7.551 6.029 5.746 1.00 0.00 C ATOM 367 O THR A 566 -7.605 6.269 6.952 1.00 0.00 O ATOM 368 CB THR A 566 -6.585 7.719 4.177 1.00 0.00 C ATOM 369 OG1 THR A 566 -7.427 7.497 3.060 1.00 0.00 O ATOM 370 CG2 THR A 566 -5.322 8.385 3.675 1.00 0.00 C ATOM 0 H THR A 566 -5.995 5.633 3.008 1.00 0.00 H new ATOM 0 HA THR A 566 -5.485 6.555 5.608 1.00 0.00 H new ATOM 0 HB THR A 566 -7.059 8.378 4.904 1.00 0.00 H new ATOM 0 HG1 THR A 566 -7.583 8.345 2.594 1.00 0.00 H new ATOM 0 HG21 THR A 566 -5.580 9.306 3.152 1.00 0.00 H new ATOM 0 HG22 THR A 566 -4.672 8.616 4.519 1.00 0.00 H new ATOM 0 HG23 THR A 566 -4.803 7.713 2.991 1.00 0.00 H new ATOM 378 N THR A 567 -8.534 5.434 5.080 1.00 0.00 N ATOM 379 CA THR A 567 -9.767 5.018 5.741 1.00 0.00 C ATOM 380 C THR A 567 -9.489 4.085 6.918 1.00 0.00 C ATOM 381 O THR A 567 -10.330 3.931 7.804 1.00 0.00 O ATOM 382 CB THR A 567 -10.700 4.329 4.743 1.00 0.00 C ATOM 383 OG1 THR A 567 -9.989 3.391 3.954 1.00 0.00 O ATOM 384 CG2 THR A 567 -11.391 5.295 3.804 1.00 0.00 C ATOM 0 H THR A 567 -8.502 5.228 4.081 1.00 0.00 H new ATOM 0 HA THR A 567 -10.249 5.916 6.128 1.00 0.00 H new ATOM 0 HB THR A 567 -11.458 3.835 5.351 1.00 0.00 H new ATOM 0 HG1 THR A 567 -9.173 3.119 4.425 1.00 0.00 H new ATOM 0 HG21 THR A 567 -12.037 4.741 3.123 1.00 0.00 H new ATOM 0 HG22 THR A 567 -11.991 5.998 4.382 1.00 0.00 H new ATOM 0 HG23 THR A 567 -10.643 5.842 3.230 1.00 0.00 H new ATOM 392 N GLN A 568 -8.314 3.459 6.928 1.00 0.00 N ATOM 393 CA GLN A 568 -7.958 2.542 8.007 1.00 0.00 C ATOM 394 C GLN A 568 -6.897 3.143 8.929 1.00 0.00 C ATOM 395 O GLN A 568 -6.662 2.637 10.026 1.00 0.00 O ATOM 396 CB GLN A 568 -7.452 1.224 7.426 1.00 0.00 C ATOM 397 CG GLN A 568 -7.253 0.134 8.469 1.00 0.00 C ATOM 398 CD GLN A 568 -8.279 -0.977 8.355 1.00 0.00 C ATOM 399 OE1 GLN A 568 -7.966 -2.083 7.916 1.00 0.00 O ATOM 400 NE2 GLN A 568 -9.512 -0.687 8.751 1.00 0.00 N ATOM 0 H GLN A 568 -7.599 3.568 6.209 1.00 0.00 H new ATOM 0 HA GLN A 568 -8.855 2.361 8.600 1.00 0.00 H new ATOM 0 HB2 GLN A 568 -8.160 0.872 6.676 1.00 0.00 H new ATOM 0 HB3 GLN A 568 -6.506 1.402 6.914 1.00 0.00 H new ATOM 0 HG2 GLN A 568 -6.253 -0.287 8.363 1.00 0.00 H new ATOM 0 HG3 GLN A 568 -7.309 0.574 9.465 1.00 0.00 H new ATOM 0 HE21 GLN A 568 -9.727 0.244 9.109 1.00 0.00 H new ATOM 0 HE22 GLN A 568 -10.245 -1.395 8.698 1.00 0.00 H new ATOM 409 N GLY A 569 -6.267 4.227 8.486 1.00 0.00 N ATOM 410 CA GLY A 569 -5.252 4.874 9.301 1.00 0.00 C ATOM 411 C GLY A 569 -3.839 4.643 8.795 1.00 0.00 C ATOM 412 O GLY A 569 -2.887 4.663 9.574 1.00 0.00 O ATOM 0 H GLY A 569 -6.439 4.668 7.582 1.00 0.00 H new ATOM 0 HA2 GLY A 569 -5.449 5.946 9.332 1.00 0.00 H new ATOM 0 HA3 GLY A 569 -5.329 4.507 10.324 1.00 0.00 H new ATOM 416 N LEU A 570 -3.698 4.433 7.491 1.00 0.00 N ATOM 417 CA LEU A 570 -2.384 4.209 6.893 1.00 0.00 C ATOM 418 C LEU A 570 -2.061 5.306 5.884 1.00 0.00 C ATOM 419 O LEU A 570 -2.694 5.402 4.833 1.00 0.00 O ATOM 420 CB LEU A 570 -2.332 2.840 6.211 1.00 0.00 C ATOM 421 CG LEU A 570 -2.886 1.679 7.039 1.00 0.00 C ATOM 422 CD1 LEU A 570 -4.123 1.109 6.375 1.00 0.00 C ATOM 423 CD2 LEU A 570 -1.835 0.593 7.215 1.00 0.00 C ATOM 0 H LEU A 570 -4.473 4.413 6.829 1.00 0.00 H new ATOM 0 HA LEU A 570 -1.639 4.234 7.688 1.00 0.00 H new ATOM 0 HB2 LEU A 570 -2.889 2.896 5.276 1.00 0.00 H new ATOM 0 HB3 LEU A 570 -1.296 2.620 5.953 1.00 0.00 H new ATOM 0 HG LEU A 570 -3.156 2.057 8.025 1.00 0.00 H new ATOM 0 HD11 LEU A 570 -4.509 0.283 6.973 1.00 0.00 H new ATOM 0 HD12 LEU A 570 -4.884 1.886 6.295 1.00 0.00 H new ATOM 0 HD13 LEU A 570 -3.867 0.747 5.379 1.00 0.00 H new ATOM 0 HD21 LEU A 570 -2.250 -0.223 7.807 1.00 0.00 H new ATOM 0 HD22 LEU A 570 -1.534 0.216 6.238 1.00 0.00 H new ATOM 0 HD23 LEU A 570 -0.966 1.007 7.727 1.00 0.00 H new ATOM 435 N THR A 571 -1.076 6.137 6.213 1.00 0.00 N ATOM 436 CA THR A 571 -0.678 7.234 5.334 1.00 0.00 C ATOM 437 C THR A 571 0.747 7.045 4.818 1.00 0.00 C ATOM 438 O THR A 571 1.086 7.510 3.729 1.00 0.00 O ATOM 439 CB THR A 571 -0.789 8.568 6.072 1.00 0.00 C ATOM 440 OG1 THR A 571 -0.539 8.398 7.456 1.00 0.00 O ATOM 441 CG2 THR A 571 -2.147 9.221 5.928 1.00 0.00 C ATOM 0 H THR A 571 -0.540 6.073 7.078 1.00 0.00 H new ATOM 0 HA THR A 571 -1.352 7.236 4.478 1.00 0.00 H new ATOM 0 HB THR A 571 -0.042 9.215 5.612 1.00 0.00 H new ATOM 0 HG1 THR A 571 -0.613 9.263 7.910 1.00 0.00 H new ATOM 0 HG21 THR A 571 -2.158 10.163 6.476 1.00 0.00 H new ATOM 0 HG22 THR A 571 -2.349 9.412 4.874 1.00 0.00 H new ATOM 0 HG23 THR A 571 -2.914 8.559 6.331 1.00 0.00 H new ATOM 449 N THR A 572 1.577 6.367 5.603 1.00 0.00 N ATOM 450 CA THR A 572 2.965 6.129 5.217 1.00 0.00 C ATOM 451 C THR A 572 3.161 4.706 4.712 1.00 0.00 C ATOM 452 O THR A 572 2.491 3.779 5.166 1.00 0.00 O ATOM 453 CB THR A 572 3.906 6.380 6.399 1.00 0.00 C ATOM 454 OG1 THR A 572 3.983 5.232 7.232 1.00 0.00 O ATOM 455 CG2 THR A 572 3.495 7.556 7.261 1.00 0.00 C ATOM 0 H THR A 572 1.315 5.974 6.507 1.00 0.00 H new ATOM 0 HA THR A 572 3.202 6.824 4.411 1.00 0.00 H new ATOM 0 HB THR A 572 4.874 6.608 5.952 1.00 0.00 H new ATOM 0 HG1 THR A 572 4.590 5.411 7.981 1.00 0.00 H new ATOM 0 HG21 THR A 572 4.207 7.674 8.078 1.00 0.00 H new ATOM 0 HG22 THR A 572 3.482 8.463 6.657 1.00 0.00 H new ATOM 0 HG23 THR A 572 2.500 7.378 7.669 1.00 0.00 H new ATOM 463 N ILE A 573 4.102 4.536 3.789 1.00 0.00 N ATOM 464 CA ILE A 573 4.400 3.219 3.249 1.00 0.00 C ATOM 465 C ILE A 573 4.925 2.318 4.357 1.00 0.00 C ATOM 466 O ILE A 573 4.594 1.135 4.431 1.00 0.00 O ATOM 467 CB ILE A 573 5.439 3.294 2.107 1.00 0.00 C ATOM 468 CG1 ILE A 573 5.338 2.064 1.207 1.00 0.00 C ATOM 469 CG2 ILE A 573 6.853 3.429 2.657 1.00 0.00 C ATOM 470 CD1 ILE A 573 6.377 2.042 0.107 1.00 0.00 C ATOM 0 H ILE A 573 4.668 5.291 3.402 1.00 0.00 H new ATOM 0 HA ILE A 573 3.477 2.808 2.839 1.00 0.00 H new ATOM 0 HB ILE A 573 5.219 4.182 1.514 1.00 0.00 H new ATOM 0 HG12 ILE A 573 5.445 1.166 1.816 1.00 0.00 H new ATOM 0 HG13 ILE A 573 4.344 2.030 0.760 1.00 0.00 H new ATOM 0 HG21 ILE A 573 7.562 3.479 1.830 1.00 0.00 H new ATOM 0 HG22 ILE A 573 6.926 4.338 3.254 1.00 0.00 H new ATOM 0 HG23 ILE A 573 7.085 2.566 3.281 1.00 0.00 H new ATOM 0 HD11 ILE A 573 6.250 1.143 -0.496 1.00 0.00 H new ATOM 0 HD12 ILE A 573 6.257 2.922 -0.525 1.00 0.00 H new ATOM 0 HD13 ILE A 573 7.374 2.045 0.548 1.00 0.00 H new ATOM 482 N TYR A 574 5.751 2.903 5.219 1.00 0.00 N ATOM 483 CA TYR A 574 6.334 2.173 6.338 1.00 0.00 C ATOM 484 C TYR A 574 5.249 1.539 7.201 1.00 0.00 C ATOM 485 O TYR A 574 5.428 0.445 7.734 1.00 0.00 O ATOM 486 CB TYR A 574 7.200 3.105 7.188 1.00 0.00 C ATOM 487 CG TYR A 574 8.564 3.370 6.596 1.00 0.00 C ATOM 488 CD1 TYR A 574 8.907 4.633 6.133 1.00 0.00 C ATOM 489 CD2 TYR A 574 9.508 2.355 6.499 1.00 0.00 C ATOM 490 CE1 TYR A 574 10.155 4.878 5.590 1.00 0.00 C ATOM 491 CE2 TYR A 574 10.757 2.593 5.957 1.00 0.00 C ATOM 492 CZ TYR A 574 11.075 3.855 5.504 1.00 0.00 C ATOM 493 OH TYR A 574 12.317 4.096 4.964 1.00 0.00 O ATOM 0 H TYR A 574 6.032 3.882 5.163 1.00 0.00 H new ATOM 0 HA TYR A 574 6.959 1.378 5.932 1.00 0.00 H new ATOM 0 HB2 TYR A 574 6.679 4.054 7.318 1.00 0.00 H new ATOM 0 HB3 TYR A 574 7.322 2.670 8.180 1.00 0.00 H new ATOM 0 HD1 TYR A 574 8.188 5.436 6.198 1.00 0.00 H new ATOM 0 HD2 TYR A 574 9.262 1.365 6.853 1.00 0.00 H new ATOM 0 HE1 TYR A 574 10.408 5.866 5.235 1.00 0.00 H new ATOM 0 HE2 TYR A 574 11.480 1.794 5.889 1.00 0.00 H new ATOM 0 HH TYR A 574 12.846 3.271 4.978 1.00 0.00 H new ATOM 503 N GLN A 575 4.123 2.234 7.336 1.00 0.00 N ATOM 504 CA GLN A 575 3.011 1.732 8.136 1.00 0.00 C ATOM 505 C GLN A 575 2.540 0.369 7.629 1.00 0.00 C ATOM 506 O GLN A 575 1.920 -0.396 8.368 1.00 0.00 O ATOM 507 CB GLN A 575 1.847 2.726 8.111 1.00 0.00 C ATOM 508 CG GLN A 575 1.307 3.065 9.491 1.00 0.00 C ATOM 509 CD GLN A 575 2.296 3.853 10.327 1.00 0.00 C ATOM 510 OE1 GLN A 575 3.019 3.290 11.149 1.00 0.00 O ATOM 511 NE2 GLN A 575 2.332 5.164 10.120 1.00 0.00 N ATOM 0 H GLN A 575 3.957 3.143 6.904 1.00 0.00 H new ATOM 0 HA GLN A 575 3.361 1.616 9.162 1.00 0.00 H new ATOM 0 HB2 GLN A 575 2.174 3.644 7.622 1.00 0.00 H new ATOM 0 HB3 GLN A 575 1.040 2.313 7.506 1.00 0.00 H new ATOM 0 HG2 GLN A 575 0.387 3.640 9.386 1.00 0.00 H new ATOM 0 HG3 GLN A 575 1.049 2.143 10.013 1.00 0.00 H new ATOM 0 HE21 GLN A 575 1.714 5.588 9.428 1.00 0.00 H new ATOM 0 HE22 GLN A 575 2.978 5.747 10.653 1.00 0.00 H new ATOM 520 N ILE A 576 2.836 0.072 6.367 1.00 0.00 N ATOM 521 CA ILE A 576 2.439 -1.198 5.769 1.00 0.00 C ATOM 522 C ILE A 576 3.643 -1.959 5.214 1.00 0.00 C ATOM 523 O ILE A 576 3.487 -2.896 4.434 1.00 0.00 O ATOM 524 CB ILE A 576 1.409 -0.990 4.641 1.00 0.00 C ATOM 525 CG1 ILE A 576 2.013 -0.165 3.504 1.00 0.00 C ATOM 526 CG2 ILE A 576 0.161 -0.317 5.186 1.00 0.00 C ATOM 527 CD1 ILE A 576 1.057 0.061 2.352 1.00 0.00 C ATOM 0 H ILE A 576 3.348 0.692 5.740 1.00 0.00 H new ATOM 0 HA ILE A 576 1.984 -1.788 6.565 1.00 0.00 H new ATOM 0 HB ILE A 576 1.131 -1.965 4.242 1.00 0.00 H new ATOM 0 HG12 ILE A 576 2.333 0.801 3.896 1.00 0.00 H new ATOM 0 HG13 ILE A 576 2.905 -0.670 3.133 1.00 0.00 H new ATOM 0 HG21 ILE A 576 -0.558 -0.176 4.379 1.00 0.00 H new ATOM 0 HG22 ILE A 576 -0.281 -0.943 5.961 1.00 0.00 H new ATOM 0 HG23 ILE A 576 0.426 0.652 5.610 1.00 0.00 H new ATOM 0 HD11 ILE A 576 1.550 0.653 1.581 1.00 0.00 H new ATOM 0 HD12 ILE A 576 0.756 -0.900 1.935 1.00 0.00 H new ATOM 0 HD13 ILE A 576 0.176 0.593 2.710 1.00 0.00 H new ATOM 539 N GLU A 577 4.843 -1.551 5.618 1.00 0.00 N ATOM 540 CA GLU A 577 6.069 -2.197 5.155 1.00 0.00 C ATOM 541 C GLU A 577 6.000 -3.713 5.331 1.00 0.00 C ATOM 542 O GLU A 577 6.658 -4.461 4.607 1.00 0.00 O ATOM 543 CB GLU A 577 7.277 -1.641 5.910 1.00 0.00 C ATOM 544 CG GLU A 577 8.611 -2.138 5.374 1.00 0.00 C ATOM 545 CD GLU A 577 9.744 -1.942 6.362 1.00 0.00 C ATOM 546 OE1 GLU A 577 10.583 -2.859 6.494 1.00 0.00 O ATOM 547 OE2 GLU A 577 9.794 -0.872 7.003 1.00 0.00 O ATOM 0 H GLU A 577 4.993 -0.777 6.265 1.00 0.00 H new ATOM 0 HA GLU A 577 6.177 -1.983 4.092 1.00 0.00 H new ATOM 0 HB2 GLU A 577 7.257 -0.552 5.859 1.00 0.00 H new ATOM 0 HB3 GLU A 577 7.194 -1.912 6.962 1.00 0.00 H new ATOM 0 HG2 GLU A 577 8.528 -3.196 5.127 1.00 0.00 H new ATOM 0 HG3 GLU A 577 8.845 -1.612 4.448 1.00 0.00 H new ATOM 554 N HIS A 578 5.204 -4.162 6.297 1.00 0.00 N ATOM 555 CA HIS A 578 5.056 -5.589 6.565 1.00 0.00 C ATOM 556 C HIS A 578 3.612 -6.042 6.364 1.00 0.00 C ATOM 557 O HIS A 578 3.164 -7.006 6.984 1.00 0.00 O ATOM 558 CB HIS A 578 5.508 -5.913 7.991 1.00 0.00 C ATOM 559 CG HIS A 578 6.784 -5.234 8.386 1.00 0.00 C ATOM 560 ND1 HIS A 578 7.082 -3.921 8.525 1.00 0.00 N flip ATOM 561 CD2 HIS A 578 7.939 -5.921 8.690 1.00 0.00 C flip ATOM 562 CE1 HIS A 578 8.398 -3.841 8.907 1.00 0.00 C flip ATOM 563 NE2 HIS A 578 8.893 -5.061 9.001 1.00 0.00 N flip ATOM 0 H HIS A 578 4.652 -3.559 6.907 1.00 0.00 H new ATOM 0 HA HIS A 578 5.686 -6.128 5.857 1.00 0.00 H new ATOM 0 HB2 HIS A 578 4.721 -5.622 8.687 1.00 0.00 H new ATOM 0 HB3 HIS A 578 5.636 -6.991 8.086 1.00 0.00 H new ATOM 0 HD2 HIS A 578 8.048 -6.995 8.676 1.00 0.00 H new ATOM 0 HE1 HIS A 578 8.941 -2.927 9.100 1.00 0.00 H new ATOM 0 HE2 HIS A 578 9.848 -5.299 9.268 1.00 0.00 H new ATOM 572 N TYR A 579 2.888 -5.339 5.498 1.00 0.00 N ATOM 573 CA TYR A 579 1.495 -5.670 5.223 1.00 0.00 C ATOM 574 C TYR A 579 1.351 -6.919 4.367 1.00 0.00 C ATOM 575 O TYR A 579 2.131 -7.156 3.445 1.00 0.00 O ATOM 576 CB TYR A 579 0.784 -4.502 4.541 1.00 0.00 C ATOM 577 CG TYR A 579 -0.177 -3.775 5.449 1.00 0.00 C ATOM 578 CD1 TYR A 579 -1.397 -3.323 4.968 1.00 0.00 C ATOM 579 CD2 TYR A 579 0.123 -3.559 6.787 1.00 0.00 C ATOM 580 CE1 TYR A 579 -2.294 -2.677 5.793 1.00 0.00 C ATOM 581 CE2 TYR A 579 -0.767 -2.910 7.620 1.00 0.00 C ATOM 582 CZ TYR A 579 -1.974 -2.473 7.120 1.00 0.00 C ATOM 583 OH TYR A 579 -2.867 -1.831 7.951 1.00 0.00 O ATOM 0 H TYR A 579 3.243 -4.538 4.976 1.00 0.00 H new ATOM 0 HA TYR A 579 1.030 -5.870 6.188 1.00 0.00 H new ATOM 0 HB2 TYR A 579 1.529 -3.797 4.173 1.00 0.00 H new ATOM 0 HB3 TYR A 579 0.241 -4.874 3.672 1.00 0.00 H new ATOM 0 HD1 TYR A 579 -1.649 -3.480 3.930 1.00 0.00 H new ATOM 0 HD2 TYR A 579 1.067 -3.904 7.183 1.00 0.00 H new ATOM 0 HE1 TYR A 579 -3.241 -2.333 5.403 1.00 0.00 H new ATOM 0 HE2 TYR A 579 -0.518 -2.746 8.658 1.00 0.00 H new ATOM 0 HH TYR A 579 -2.608 -1.977 8.885 1.00 0.00 H new ATOM 593 N SER A 580 0.323 -7.696 4.678 1.00 0.00 N ATOM 594 CA SER A 580 0.020 -8.915 3.946 1.00 0.00 C ATOM 595 C SER A 580 -1.113 -8.661 2.964 1.00 0.00 C ATOM 596 O SER A 580 -1.781 -7.629 3.035 1.00 0.00 O ATOM 597 CB SER A 580 -0.388 -10.023 4.918 1.00 0.00 C ATOM 598 OG SER A 580 -1.726 -9.839 5.359 1.00 0.00 O ATOM 0 H SER A 580 -0.322 -7.499 5.443 1.00 0.00 H new ATOM 0 HA SER A 580 0.910 -9.226 3.399 1.00 0.00 H new ATOM 0 HB2 SER A 580 -0.291 -10.994 4.432 1.00 0.00 H new ATOM 0 HB3 SER A 580 0.285 -10.027 5.775 1.00 0.00 H new ATOM 0 HG SER A 580 -1.739 -9.212 6.112 1.00 0.00 H new ATOM 604 N MET A 581 -1.350 -9.607 2.067 1.00 0.00 N ATOM 605 CA MET A 581 -2.434 -9.468 1.105 1.00 0.00 C ATOM 606 C MET A 581 -3.763 -9.373 1.849 1.00 0.00 C ATOM 607 O MET A 581 -4.702 -8.716 1.396 1.00 0.00 O ATOM 608 CB MET A 581 -2.449 -10.650 0.135 1.00 0.00 C ATOM 609 CG MET A 581 -3.581 -10.593 -0.877 1.00 0.00 C ATOM 610 SD MET A 581 -3.126 -11.304 -2.470 1.00 0.00 S ATOM 611 CE MET A 581 -3.751 -10.054 -3.590 1.00 0.00 C ATOM 0 H MET A 581 -0.813 -10.470 1.985 1.00 0.00 H new ATOM 0 HA MET A 581 -2.280 -8.558 0.525 1.00 0.00 H new ATOM 0 HB2 MET A 581 -1.498 -10.684 -0.397 1.00 0.00 H new ATOM 0 HB3 MET A 581 -2.529 -11.576 0.705 1.00 0.00 H new ATOM 0 HG2 MET A 581 -4.445 -11.125 -0.480 1.00 0.00 H new ATOM 0 HG3 MET A 581 -3.883 -9.556 -1.020 1.00 0.00 H new ATOM 0 HE1 MET A 581 -3.690 -10.421 -4.615 1.00 0.00 H new ATOM 0 HE2 MET A 581 -4.790 -9.832 -3.345 1.00 0.00 H new ATOM 0 HE3 MET A 581 -3.154 -9.147 -3.493 1.00 0.00 H new ATOM 621 N ASP A 582 -3.822 -10.026 3.010 1.00 0.00 N ATOM 622 CA ASP A 582 -5.018 -10.012 3.839 1.00 0.00 C ATOM 623 C ASP A 582 -5.264 -8.614 4.396 1.00 0.00 C ATOM 624 O ASP A 582 -6.356 -8.066 4.255 1.00 0.00 O ATOM 625 CB ASP A 582 -4.883 -11.017 4.986 1.00 0.00 C ATOM 626 CG ASP A 582 -6.191 -11.716 5.299 1.00 0.00 C ATOM 627 OD1 ASP A 582 -6.940 -12.029 4.349 1.00 0.00 O ATOM 628 OD2 ASP A 582 -6.468 -11.951 6.494 1.00 0.00 O ATOM 0 H ASP A 582 -3.051 -10.572 3.395 1.00 0.00 H new ATOM 0 HA ASP A 582 -5.869 -10.297 3.220 1.00 0.00 H new ATOM 0 HB2 ASP A 582 -4.130 -11.761 4.727 1.00 0.00 H new ATOM 0 HB3 ASP A 582 -4.528 -10.501 5.878 1.00 0.00 H new ATOM 633 N ASP A 583 -4.239 -8.035 5.020 1.00 0.00 N ATOM 634 CA ASP A 583 -4.357 -6.691 5.581 1.00 0.00 C ATOM 635 C ASP A 583 -4.747 -5.699 4.495 1.00 0.00 C ATOM 636 O ASP A 583 -5.654 -4.886 4.673 1.00 0.00 O ATOM 637 CB ASP A 583 -3.038 -6.252 6.227 1.00 0.00 C ATOM 638 CG ASP A 583 -2.556 -7.226 7.284 1.00 0.00 C ATOM 639 OD1 ASP A 583 -3.284 -7.432 8.277 1.00 0.00 O ATOM 640 OD2 ASP A 583 -1.451 -7.784 7.116 1.00 0.00 O ATOM 0 H ASP A 583 -3.326 -8.471 5.149 1.00 0.00 H new ATOM 0 HA ASP A 583 -5.133 -6.712 6.347 1.00 0.00 H new ATOM 0 HB2 ASP A 583 -2.275 -6.152 5.455 1.00 0.00 H new ATOM 0 HB3 ASP A 583 -3.168 -5.268 6.677 1.00 0.00 H new ATOM 645 N LEU A 584 -4.049 -5.777 3.367 1.00 0.00 N ATOM 646 CA LEU A 584 -4.304 -4.894 2.236 1.00 0.00 C ATOM 647 C LEU A 584 -5.749 -5.056 1.752 1.00 0.00 C ATOM 648 O LEU A 584 -6.406 -4.088 1.333 1.00 0.00 O ATOM 649 CB LEU A 584 -3.310 -5.209 1.114 1.00 0.00 C ATOM 650 CG LEU A 584 -2.644 -3.987 0.485 1.00 0.00 C ATOM 651 CD1 LEU A 584 -1.697 -4.397 -0.631 1.00 0.00 C ATOM 652 CD2 LEU A 584 -3.699 -3.025 -0.023 1.00 0.00 C ATOM 0 H LEU A 584 -3.297 -6.448 3.212 1.00 0.00 H new ATOM 0 HA LEU A 584 -4.169 -3.857 2.544 1.00 0.00 H new ATOM 0 HB2 LEU A 584 -2.534 -5.865 1.509 1.00 0.00 H new ATOM 0 HB3 LEU A 584 -3.830 -5.764 0.333 1.00 0.00 H new ATOM 0 HG LEU A 584 -2.053 -3.482 1.249 1.00 0.00 H new ATOM 0 HD11 LEU A 584 -1.236 -3.508 -1.062 1.00 0.00 H new ATOM 0 HD12 LEU A 584 -0.922 -5.049 -0.229 1.00 0.00 H new ATOM 0 HD13 LEU A 584 -2.253 -4.928 -1.403 1.00 0.00 H new ATOM 0 HD21 LEU A 584 -3.215 -2.157 -0.470 1.00 0.00 H new ATOM 0 HD22 LEU A 584 -4.315 -3.523 -0.772 1.00 0.00 H new ATOM 0 HD23 LEU A 584 -4.327 -2.703 0.807 1.00 0.00 H new ATOM 664 N ALA A 585 -6.246 -6.286 1.836 1.00 0.00 N ATOM 665 CA ALA A 585 -7.614 -6.585 1.440 1.00 0.00 C ATOM 666 C ALA A 585 -8.583 -6.075 2.500 1.00 0.00 C ATOM 667 O ALA A 585 -9.693 -5.643 2.188 1.00 0.00 O ATOM 668 CB ALA A 585 -7.792 -8.080 1.226 1.00 0.00 C ATOM 0 H ALA A 585 -5.720 -7.091 2.175 1.00 0.00 H new ATOM 0 HA ALA A 585 -7.827 -6.080 0.498 1.00 0.00 H new ATOM 0 HB1 ALA A 585 -8.821 -8.285 0.930 1.00 0.00 H new ATOM 0 HB2 ALA A 585 -7.115 -8.418 0.442 1.00 0.00 H new ATOM 0 HB3 ALA A 585 -7.568 -8.609 2.152 1.00 0.00 H new ATOM 674 N SER A 586 -8.145 -6.120 3.757 1.00 0.00 N ATOM 675 CA SER A 586 -8.959 -5.654 4.872 1.00 0.00 C ATOM 676 C SER A 586 -9.261 -4.171 4.718 1.00 0.00 C ATOM 677 O SER A 586 -10.385 -3.725 4.951 1.00 0.00 O ATOM 678 CB SER A 586 -8.244 -5.909 6.200 1.00 0.00 C ATOM 679 OG SER A 586 -9.164 -6.263 7.217 1.00 0.00 O ATOM 0 H SER A 586 -7.228 -6.476 4.027 1.00 0.00 H new ATOM 0 HA SER A 586 -9.898 -6.208 4.870 1.00 0.00 H new ATOM 0 HB2 SER A 586 -7.512 -6.707 6.075 1.00 0.00 H new ATOM 0 HB3 SER A 586 -7.695 -5.016 6.498 1.00 0.00 H new ATOM 0 HG SER A 586 -8.681 -6.422 8.054 1.00 0.00 H new ATOM 685 N LEU A 587 -8.251 -3.413 4.302 1.00 0.00 N ATOM 686 CA LEU A 587 -8.416 -1.977 4.090 1.00 0.00 C ATOM 687 C LEU A 587 -9.448 -1.728 2.995 1.00 0.00 C ATOM 688 O LEU A 587 -10.005 -0.635 2.894 1.00 0.00 O ATOM 689 CB LEU A 587 -7.091 -1.303 3.705 1.00 0.00 C ATOM 690 CG LEU A 587 -5.815 -2.066 4.067 1.00 0.00 C ATOM 691 CD1 LEU A 587 -4.590 -1.309 3.580 1.00 0.00 C ATOM 692 CD2 LEU A 587 -5.744 -2.301 5.569 1.00 0.00 C ATOM 0 H LEU A 587 -7.314 -3.766 4.106 1.00 0.00 H new ATOM 0 HA LEU A 587 -8.757 -1.543 5.030 1.00 0.00 H new ATOM 0 HB2 LEU A 587 -7.094 -1.131 2.629 1.00 0.00 H new ATOM 0 HB3 LEU A 587 -7.053 -0.324 4.184 1.00 0.00 H new ATOM 0 HG LEU A 587 -5.836 -3.037 3.571 1.00 0.00 H new ATOM 0 HD11 LEU A 587 -3.690 -1.864 3.845 1.00 0.00 H new ATOM 0 HD12 LEU A 587 -4.640 -1.194 2.497 1.00 0.00 H new ATOM 0 HD13 LEU A 587 -4.560 -0.325 4.048 1.00 0.00 H new ATOM 0 HD21 LEU A 587 -4.830 -2.845 5.809 1.00 0.00 H new ATOM 0 HD22 LEU A 587 -5.743 -1.342 6.088 1.00 0.00 H new ATOM 0 HD23 LEU A 587 -6.608 -2.884 5.887 1.00 0.00 H new ATOM 704 N LYS A 588 -9.695 -2.765 2.185 1.00 0.00 N ATOM 705 CA LYS A 588 -10.660 -2.711 1.090 1.00 0.00 C ATOM 706 C LYS A 588 -9.984 -2.459 -0.255 1.00 0.00 C ATOM 707 O LYS A 588 -10.640 -2.026 -1.202 1.00 0.00 O ATOM 708 CB LYS A 588 -11.729 -1.647 1.343 1.00 0.00 C ATOM 709 CG LYS A 588 -13.017 -1.877 0.570 1.00 0.00 C ATOM 710 CD LYS A 588 -13.256 -0.783 -0.459 1.00 0.00 C ATOM 711 CE LYS A 588 -14.119 -1.277 -1.609 1.00 0.00 C ATOM 712 NZ LYS A 588 -14.160 -0.301 -2.733 1.00 0.00 N ATOM 0 H LYS A 588 -9.227 -3.667 2.275 1.00 0.00 H new ATOM 0 HA LYS A 588 -11.140 -3.689 1.050 1.00 0.00 H new ATOM 0 HB2 LYS A 588 -11.956 -1.619 2.409 1.00 0.00 H new ATOM 0 HB3 LYS A 588 -11.326 -0.670 1.077 1.00 0.00 H new ATOM 0 HG2 LYS A 588 -12.974 -2.844 0.070 1.00 0.00 H new ATOM 0 HG3 LYS A 588 -13.857 -1.914 1.264 1.00 0.00 H new ATOM 0 HD2 LYS A 588 -13.739 0.069 0.020 1.00 0.00 H new ATOM 0 HD3 LYS A 588 -12.300 -0.431 -0.846 1.00 0.00 H new ATOM 0 HE2 LYS A 588 -13.732 -2.230 -1.970 1.00 0.00 H new ATOM 0 HE3 LYS A 588 -15.132 -1.460 -1.250 1.00 0.00 H new ATOM 0 HZ1 LYS A 588 -14.356 -0.804 -3.622 1.00 0.00 H new ATOM 0 HZ2 LYS A 588 -14.910 0.398 -2.558 1.00 0.00 H new ATOM 0 HZ3 LYS A 588 -13.243 0.185 -2.805 1.00 0.00 H new ATOM 726 N ILE A 589 -8.682 -2.739 -0.358 1.00 0.00 N ATOM 727 CA ILE A 589 -7.989 -2.534 -1.624 1.00 0.00 C ATOM 728 C ILE A 589 -8.267 -3.703 -2.574 1.00 0.00 C ATOM 729 O ILE A 589 -8.063 -4.862 -2.217 1.00 0.00 O ATOM 730 CB ILE A 589 -6.468 -2.344 -1.423 1.00 0.00 C ATOM 731 CG1 ILE A 589 -6.195 -0.951 -0.849 1.00 0.00 C ATOM 732 CG2 ILE A 589 -5.715 -2.530 -2.738 1.00 0.00 C ATOM 733 CD1 ILE A 589 -5.792 -0.957 0.607 1.00 0.00 C ATOM 0 H ILE A 589 -8.103 -3.099 0.400 1.00 0.00 H new ATOM 0 HA ILE A 589 -8.373 -1.616 -2.069 1.00 0.00 H new ATOM 0 HB ILE A 589 -6.113 -3.100 -0.722 1.00 0.00 H new ATOM 0 HG12 ILE A 589 -5.406 -0.477 -1.432 1.00 0.00 H new ATOM 0 HG13 ILE A 589 -7.089 -0.339 -0.966 1.00 0.00 H new ATOM 0 HG21 ILE A 589 -4.647 -2.391 -2.569 1.00 0.00 H new ATOM 0 HG22 ILE A 589 -5.894 -3.535 -3.121 1.00 0.00 H new ATOM 0 HG23 ILE A 589 -6.065 -1.797 -3.465 1.00 0.00 H new ATOM 0 HD11 ILE A 589 -5.616 0.066 0.940 1.00 0.00 H new ATOM 0 HD12 ILE A 589 -6.589 -1.401 1.203 1.00 0.00 H new ATOM 0 HD13 ILE A 589 -4.880 -1.541 0.730 1.00 0.00 H new ATOM 745 N PRO A 590 -8.755 -3.412 -3.796 1.00 0.00 N ATOM 746 CA PRO A 590 -9.076 -4.447 -4.790 1.00 0.00 C ATOM 747 C PRO A 590 -7.892 -5.356 -5.101 1.00 0.00 C ATOM 748 O PRO A 590 -6.738 -4.927 -5.067 1.00 0.00 O ATOM 749 CB PRO A 590 -9.473 -3.642 -6.030 1.00 0.00 C ATOM 750 CG PRO A 590 -9.909 -2.320 -5.502 1.00 0.00 C ATOM 751 CD PRO A 590 -9.046 -2.058 -4.300 1.00 0.00 C ATOM 0 HA PRO A 590 -9.856 -5.119 -4.432 1.00 0.00 H new ATOM 0 HB2 PRO A 590 -8.634 -3.536 -6.718 1.00 0.00 H new ATOM 0 HB3 PRO A 590 -10.276 -4.133 -6.580 1.00 0.00 H new ATOM 0 HG2 PRO A 590 -9.784 -1.538 -6.252 1.00 0.00 H new ATOM 0 HG3 PRO A 590 -10.965 -2.336 -5.230 1.00 0.00 H new ATOM 0 HD2 PRO A 590 -8.135 -1.523 -4.567 1.00 0.00 H new ATOM 0 HD3 PRO A 590 -9.564 -1.454 -3.556 1.00 0.00 H new ATOM 759 N GLU A 591 -8.192 -6.616 -5.406 1.00 0.00 N ATOM 760 CA GLU A 591 -7.164 -7.602 -5.728 1.00 0.00 C ATOM 761 C GLU A 591 -6.296 -7.139 -6.894 1.00 0.00 C ATOM 762 O GLU A 591 -5.135 -7.531 -7.009 1.00 0.00 O ATOM 763 CB GLU A 591 -7.812 -8.945 -6.068 1.00 0.00 C ATOM 764 CG GLU A 591 -8.700 -9.492 -4.962 1.00 0.00 C ATOM 765 CD GLU A 591 -9.709 -10.502 -5.470 1.00 0.00 C ATOM 766 OE1 GLU A 591 -9.717 -11.642 -4.960 1.00 0.00 O ATOM 767 OE2 GLU A 591 -10.492 -10.153 -6.379 1.00 0.00 O ATOM 0 H GLU A 591 -9.144 -6.980 -5.437 1.00 0.00 H new ATOM 0 HA GLU A 591 -6.525 -7.717 -4.852 1.00 0.00 H new ATOM 0 HB2 GLU A 591 -8.405 -8.833 -6.976 1.00 0.00 H new ATOM 0 HB3 GLU A 591 -7.029 -9.671 -6.286 1.00 0.00 H new ATOM 0 HG2 GLU A 591 -8.077 -9.959 -4.199 1.00 0.00 H new ATOM 0 HG3 GLU A 591 -9.227 -8.667 -4.483 1.00 0.00 H new ATOM 774 N GLN A 592 -6.868 -6.309 -7.759 1.00 0.00 N ATOM 775 CA GLN A 592 -6.147 -5.800 -8.922 1.00 0.00 C ATOM 776 C GLN A 592 -5.136 -4.724 -8.531 1.00 0.00 C ATOM 777 O GLN A 592 -4.249 -4.385 -9.315 1.00 0.00 O ATOM 778 CB GLN A 592 -7.131 -5.233 -9.945 1.00 0.00 C ATOM 779 CG GLN A 592 -8.334 -6.129 -10.196 1.00 0.00 C ATOM 780 CD GLN A 592 -8.324 -6.746 -11.582 1.00 0.00 C ATOM 781 OE1 GLN A 592 -8.380 -7.966 -11.732 1.00 0.00 O ATOM 782 NE2 GLN A 592 -8.252 -5.901 -12.604 1.00 0.00 N ATOM 0 H GLN A 592 -7.828 -5.974 -7.678 1.00 0.00 H new ATOM 0 HA GLN A 592 -5.601 -6.634 -9.362 1.00 0.00 H new ATOM 0 HB2 GLN A 592 -7.480 -4.259 -9.600 1.00 0.00 H new ATOM 0 HB3 GLN A 592 -6.608 -5.069 -10.887 1.00 0.00 H new ATOM 0 HG2 GLN A 592 -8.353 -6.923 -9.449 1.00 0.00 H new ATOM 0 HG3 GLN A 592 -9.248 -5.549 -10.067 1.00 0.00 H new ATOM 0 HE21 GLN A 592 -8.207 -4.896 -12.433 1.00 0.00 H new ATOM 0 HE22 GLN A 592 -8.241 -6.257 -13.560 1.00 0.00 H new ATOM 791 N PHE A 593 -5.275 -4.178 -7.325 1.00 0.00 N ATOM 792 CA PHE A 593 -4.370 -3.133 -6.859 1.00 0.00 C ATOM 793 C PHE A 593 -3.492 -3.613 -5.706 1.00 0.00 C ATOM 794 O PHE A 593 -2.282 -3.392 -5.707 1.00 0.00 O ATOM 795 CB PHE A 593 -5.166 -1.900 -6.430 1.00 0.00 C ATOM 796 CG PHE A 593 -5.928 -1.259 -7.555 1.00 0.00 C ATOM 797 CD1 PHE A 593 -5.259 -0.658 -8.609 1.00 0.00 C ATOM 798 CD2 PHE A 593 -7.312 -1.263 -7.559 1.00 0.00 C ATOM 799 CE1 PHE A 593 -5.958 -0.071 -9.646 1.00 0.00 C ATOM 800 CE2 PHE A 593 -8.018 -0.677 -8.594 1.00 0.00 C ATOM 801 CZ PHE A 593 -7.340 -0.080 -9.639 1.00 0.00 C ATOM 0 H PHE A 593 -6.001 -4.440 -6.658 1.00 0.00 H new ATOM 0 HA PHE A 593 -3.714 -2.873 -7.690 1.00 0.00 H new ATOM 0 HB2 PHE A 593 -5.865 -2.184 -5.643 1.00 0.00 H new ATOM 0 HB3 PHE A 593 -4.483 -1.167 -6.000 1.00 0.00 H new ATOM 0 HD1 PHE A 593 -4.179 -0.648 -8.620 1.00 0.00 H new ATOM 0 HD2 PHE A 593 -7.847 -1.729 -6.745 1.00 0.00 H new ATOM 0 HE1 PHE A 593 -5.425 0.395 -10.462 1.00 0.00 H new ATOM 0 HE2 PHE A 593 -9.098 -0.686 -8.585 1.00 0.00 H new ATOM 0 HZ PHE A 593 -7.888 0.379 -10.449 1.00 0.00 H new ATOM 811 N ARG A 594 -4.102 -4.262 -4.717 1.00 0.00 N ATOM 812 CA ARG A 594 -3.355 -4.755 -3.561 1.00 0.00 C ATOM 813 C ARG A 594 -2.199 -5.651 -3.990 1.00 0.00 C ATOM 814 O ARG A 594 -1.183 -5.728 -3.308 1.00 0.00 O ATOM 815 CB ARG A 594 -4.268 -5.521 -2.603 1.00 0.00 C ATOM 816 CG ARG A 594 -5.042 -6.644 -3.265 1.00 0.00 C ATOM 817 CD ARG A 594 -6.329 -6.951 -2.516 1.00 0.00 C ATOM 818 NE ARG A 594 -6.319 -8.295 -1.950 1.00 0.00 N ATOM 819 CZ ARG A 594 -7.419 -8.981 -1.642 1.00 0.00 C ATOM 820 NH1 ARG A 594 -8.620 -8.451 -1.841 1.00 0.00 N ATOM 821 NH2 ARG A 594 -7.317 -10.201 -1.133 1.00 0.00 N ATOM 0 H ARG A 594 -5.103 -4.458 -4.692 1.00 0.00 H new ATOM 0 HA ARG A 594 -2.950 -3.885 -3.045 1.00 0.00 H new ATOM 0 HB2 ARG A 594 -3.666 -5.935 -1.794 1.00 0.00 H new ATOM 0 HB3 ARG A 594 -4.973 -4.823 -2.151 1.00 0.00 H new ATOM 0 HG2 ARG A 594 -5.275 -6.369 -4.294 1.00 0.00 H new ATOM 0 HG3 ARG A 594 -4.422 -7.539 -3.307 1.00 0.00 H new ATOM 0 HD2 ARG A 594 -6.468 -6.222 -1.718 1.00 0.00 H new ATOM 0 HD3 ARG A 594 -7.177 -6.848 -3.193 1.00 0.00 H new ATOM 0 HE ARG A 594 -5.415 -8.737 -1.780 1.00 0.00 H new ATOM 0 HH11 ARG A 594 -8.705 -7.513 -2.232 1.00 0.00 H new ATOM 0 HH12 ARG A 594 -9.458 -8.982 -1.603 1.00 0.00 H new ATOM 0 HH21 ARG A 594 -6.397 -10.613 -0.978 1.00 0.00 H new ATOM 0 HH22 ARG A 594 -8.158 -10.727 -0.897 1.00 0.00 H new ATOM 835 N HIS A 595 -2.357 -6.327 -5.122 1.00 0.00 N ATOM 836 CA HIS A 595 -1.312 -7.212 -5.622 1.00 0.00 C ATOM 837 C HIS A 595 -0.075 -6.415 -6.020 1.00 0.00 C ATOM 838 O HIS A 595 1.040 -6.732 -5.603 1.00 0.00 O ATOM 839 CB HIS A 595 -1.824 -8.023 -6.814 1.00 0.00 C ATOM 840 CG HIS A 595 -1.379 -9.452 -6.797 1.00 0.00 C ATOM 841 ND1 HIS A 595 -1.290 -10.340 -5.779 1.00 0.00 N flip ATOM 842 CD2 HIS A 595 -0.959 -10.124 -7.926 1.00 0.00 C flip ATOM 843 CE1 HIS A 595 -0.822 -11.518 -6.305 1.00 0.00 C flip ATOM 844 NE2 HIS A 595 -0.631 -11.362 -7.602 1.00 0.00 N flip ATOM 0 H HIS A 595 -3.191 -6.280 -5.707 1.00 0.00 H new ATOM 0 HA HIS A 595 -1.037 -7.900 -4.822 1.00 0.00 H new ATOM 0 HB2 HIS A 595 -2.913 -7.990 -6.825 1.00 0.00 H new ATOM 0 HB3 HIS A 595 -1.481 -7.555 -7.737 1.00 0.00 H new ATOM 0 HD2 HIS A 595 -0.907 -9.704 -8.920 1.00 0.00 H new ATOM 0 HE1 HIS A 595 -0.640 -12.425 -5.748 1.00 0.00 H new ATOM 0 HE2 HIS A 595 -0.288 -12.076 -8.245 1.00 0.00 H new ATOM 853 N ALA A 596 -0.278 -5.373 -6.819 1.00 0.00 N ATOM 854 CA ALA A 596 0.824 -4.526 -7.258 1.00 0.00 C ATOM 855 C ALA A 596 1.402 -3.756 -6.080 1.00 0.00 C ATOM 856 O ALA A 596 2.618 -3.709 -5.884 1.00 0.00 O ATOM 857 CB ALA A 596 0.358 -3.568 -8.345 1.00 0.00 C ATOM 0 H ALA A 596 -1.193 -5.096 -7.175 1.00 0.00 H new ATOM 0 HA ALA A 596 1.606 -5.162 -7.672 1.00 0.00 H new ATOM 0 HB1 ALA A 596 1.193 -2.943 -8.661 1.00 0.00 H new ATOM 0 HB2 ALA A 596 -0.013 -4.137 -9.197 1.00 0.00 H new ATOM 0 HB3 ALA A 596 -0.441 -2.937 -7.956 1.00 0.00 H new ATOM 863 N ILE A 597 0.516 -3.165 -5.288 1.00 0.00 N ATOM 864 CA ILE A 597 0.924 -2.408 -4.116 1.00 0.00 C ATOM 865 C ILE A 597 1.689 -3.304 -3.147 1.00 0.00 C ATOM 866 O ILE A 597 2.741 -2.924 -2.633 1.00 0.00 O ATOM 867 CB ILE A 597 -0.291 -1.786 -3.396 1.00 0.00 C ATOM 868 CG1 ILE A 597 -1.111 -0.940 -4.374 1.00 0.00 C ATOM 869 CG2 ILE A 597 0.158 -0.941 -2.213 1.00 0.00 C ATOM 870 CD1 ILE A 597 -2.500 -0.613 -3.874 1.00 0.00 C ATOM 0 H ILE A 597 -0.492 -3.197 -5.439 1.00 0.00 H new ATOM 0 HA ILE A 597 1.573 -1.600 -4.455 1.00 0.00 H new ATOM 0 HB ILE A 597 -0.918 -2.594 -3.020 1.00 0.00 H new ATOM 0 HG12 ILE A 597 -0.577 -0.011 -4.573 1.00 0.00 H new ATOM 0 HG13 ILE A 597 -1.191 -1.471 -5.322 1.00 0.00 H new ATOM 0 HG21 ILE A 597 -0.715 -0.512 -1.720 1.00 0.00 H new ATOM 0 HG22 ILE A 597 0.704 -1.566 -1.506 1.00 0.00 H new ATOM 0 HG23 ILE A 597 0.807 -0.139 -2.564 1.00 0.00 H new ATOM 0 HD11 ILE A 597 -3.022 -0.012 -4.618 1.00 0.00 H new ATOM 0 HD12 ILE A 597 -3.052 -1.537 -3.702 1.00 0.00 H new ATOM 0 HD13 ILE A 597 -2.429 -0.054 -2.941 1.00 0.00 H new ATOM 882 N TRP A 598 1.160 -4.504 -2.917 1.00 0.00 N ATOM 883 CA TRP A 598 1.800 -5.465 -2.025 1.00 0.00 C ATOM 884 C TRP A 598 3.220 -5.754 -2.493 1.00 0.00 C ATOM 885 O TRP A 598 4.161 -5.755 -1.699 1.00 0.00 O ATOM 886 CB TRP A 598 0.995 -6.766 -1.969 1.00 0.00 C ATOM 887 CG TRP A 598 1.497 -7.731 -0.939 1.00 0.00 C ATOM 888 CD1 TRP A 598 1.929 -7.435 0.321 1.00 0.00 C ATOM 889 CD2 TRP A 598 1.619 -9.152 -1.083 1.00 0.00 C ATOM 890 NE1 TRP A 598 2.312 -8.584 0.972 1.00 0.00 N ATOM 891 CE2 TRP A 598 2.131 -9.651 0.131 1.00 0.00 C ATOM 892 CE3 TRP A 598 1.344 -10.050 -2.117 1.00 0.00 C ATOM 893 CZ2 TRP A 598 2.374 -11.006 0.335 1.00 0.00 C ATOM 894 CZ3 TRP A 598 1.585 -11.396 -1.913 1.00 0.00 C ATOM 895 CH2 TRP A 598 2.094 -11.863 -0.695 1.00 0.00 C ATOM 0 H TRP A 598 0.290 -4.833 -3.336 1.00 0.00 H new ATOM 0 HA TRP A 598 1.836 -5.033 -1.025 1.00 0.00 H new ATOM 0 HB2 TRP A 598 -0.048 -6.531 -1.758 1.00 0.00 H new ATOM 0 HB3 TRP A 598 1.022 -7.244 -2.948 1.00 0.00 H new ATOM 0 HD1 TRP A 598 1.965 -6.442 0.745 1.00 0.00 H new ATOM 0 HE1 TRP A 598 2.672 -8.634 1.925 1.00 0.00 H new ATOM 0 HE3 TRP A 598 0.950 -9.699 -3.059 1.00 0.00 H new ATOM 0 HZ2 TRP A 598 2.769 -11.368 1.272 1.00 0.00 H new ATOM 0 HZ3 TRP A 598 1.377 -12.099 -2.706 1.00 0.00 H new ATOM 0 HH2 TRP A 598 2.269 -12.921 -0.566 1.00 0.00 H new ATOM 906 N LYS A 599 3.370 -5.989 -3.795 1.00 0.00 N ATOM 907 CA LYS A 599 4.678 -6.266 -4.373 1.00 0.00 C ATOM 908 C LYS A 599 5.639 -5.123 -4.069 1.00 0.00 C ATOM 909 O LYS A 599 6.799 -5.348 -3.721 1.00 0.00 O ATOM 910 CB LYS A 599 4.562 -6.466 -5.886 1.00 0.00 C ATOM 911 CG LYS A 599 4.357 -7.917 -6.293 1.00 0.00 C ATOM 912 CD LYS A 599 5.293 -8.319 -7.422 1.00 0.00 C ATOM 913 CE LYS A 599 4.932 -9.684 -7.986 1.00 0.00 C ATOM 914 NZ LYS A 599 5.333 -10.788 -7.070 1.00 0.00 N ATOM 0 H LYS A 599 2.602 -5.993 -4.466 1.00 0.00 H new ATOM 0 HA LYS A 599 5.067 -7.182 -3.929 1.00 0.00 H new ATOM 0 HB2 LYS A 599 3.729 -5.871 -6.260 1.00 0.00 H new ATOM 0 HB3 LYS A 599 5.465 -6.087 -6.365 1.00 0.00 H new ATOM 0 HG2 LYS A 599 4.525 -8.564 -5.432 1.00 0.00 H new ATOM 0 HG3 LYS A 599 3.324 -8.065 -6.606 1.00 0.00 H new ATOM 0 HD2 LYS A 599 5.249 -7.573 -8.216 1.00 0.00 H new ATOM 0 HD3 LYS A 599 6.320 -8.335 -7.056 1.00 0.00 H new ATOM 0 HE2 LYS A 599 3.857 -9.731 -8.162 1.00 0.00 H new ATOM 0 HE3 LYS A 599 5.420 -9.818 -8.951 1.00 0.00 H new ATOM 0 HZ1 LYS A 599 5.069 -11.702 -7.491 1.00 0.00 H new ATOM 0 HZ2 LYS A 599 6.362 -10.759 -6.921 1.00 0.00 H new ATOM 0 HZ3 LYS A 599 4.848 -10.675 -6.157 1.00 0.00 H new ATOM 928 N GLY A 600 5.143 -3.896 -4.194 1.00 0.00 N ATOM 929 CA GLY A 600 5.965 -2.734 -3.918 1.00 0.00 C ATOM 930 C GLY A 600 6.451 -2.709 -2.483 1.00 0.00 C ATOM 931 O GLY A 600 7.610 -2.391 -2.217 1.00 0.00 O ATOM 0 H GLY A 600 4.187 -3.687 -4.481 1.00 0.00 H new ATOM 0 HA2 GLY A 600 6.822 -2.729 -4.591 1.00 0.00 H new ATOM 0 HA3 GLY A 600 5.393 -1.829 -4.123 1.00 0.00 H new ATOM 935 N ILE A 601 5.562 -3.053 -1.554 1.00 0.00 N ATOM 936 CA ILE A 601 5.907 -3.076 -0.137 1.00 0.00 C ATOM 937 C ILE A 601 6.942 -4.159 0.154 1.00 0.00 C ATOM 938 O ILE A 601 7.881 -3.946 0.920 1.00 0.00 O ATOM 939 CB ILE A 601 4.665 -3.321 0.746 1.00 0.00 C ATOM 940 CG1 ILE A 601 3.560 -2.315 0.411 1.00 0.00 C ATOM 941 CG2 ILE A 601 5.033 -3.237 2.221 1.00 0.00 C ATOM 942 CD1 ILE A 601 3.926 -0.883 0.733 1.00 0.00 C ATOM 0 H ILE A 601 4.599 -3.319 -1.758 1.00 0.00 H new ATOM 0 HA ILE A 601 6.324 -2.098 0.102 1.00 0.00 H new ATOM 0 HB ILE A 601 4.291 -4.324 0.541 1.00 0.00 H new ATOM 0 HG12 ILE A 601 3.321 -2.390 -0.650 1.00 0.00 H new ATOM 0 HG13 ILE A 601 2.658 -2.583 0.961 1.00 0.00 H new ATOM 0 HG21 ILE A 601 4.145 -3.412 2.828 1.00 0.00 H new ATOM 0 HG22 ILE A 601 5.785 -3.991 2.452 1.00 0.00 H new ATOM 0 HG23 ILE A 601 5.433 -2.247 2.440 1.00 0.00 H new ATOM 0 HD11 ILE A 601 3.096 -0.227 0.469 1.00 0.00 H new ATOM 0 HD12 ILE A 601 4.136 -0.792 1.799 1.00 0.00 H new ATOM 0 HD13 ILE A 601 4.810 -0.596 0.163 1.00 0.00 H new ATOM 954 N LEU A 602 6.759 -5.323 -0.462 1.00 0.00 N ATOM 955 CA LEU A 602 7.672 -6.443 -0.271 1.00 0.00 C ATOM 956 C LEU A 602 9.082 -6.085 -0.730 1.00 0.00 C ATOM 957 O LEU A 602 10.055 -6.307 -0.009 1.00 0.00 O ATOM 958 CB LEU A 602 7.170 -7.669 -1.036 1.00 0.00 C ATOM 959 CG LEU A 602 6.138 -8.519 -0.293 1.00 0.00 C ATOM 960 CD1 LEU A 602 5.361 -9.388 -1.270 1.00 0.00 C ATOM 961 CD2 LEU A 602 6.816 -9.377 0.765 1.00 0.00 C ATOM 0 H LEU A 602 5.985 -5.514 -1.098 1.00 0.00 H new ATOM 0 HA LEU A 602 7.707 -6.673 0.794 1.00 0.00 H new ATOM 0 HB2 LEU A 602 6.734 -7.337 -1.978 1.00 0.00 H new ATOM 0 HB3 LEU A 602 8.025 -8.298 -1.285 1.00 0.00 H new ATOM 0 HG LEU A 602 5.436 -7.851 0.206 1.00 0.00 H new ATOM 0 HD11 LEU A 602 4.631 -9.986 -0.724 1.00 0.00 H new ATOM 0 HD12 LEU A 602 4.844 -8.753 -1.990 1.00 0.00 H new ATOM 0 HD13 LEU A 602 6.050 -10.048 -1.797 1.00 0.00 H new ATOM 0 HD21 LEU A 602 6.067 -9.975 1.284 1.00 0.00 H new ATOM 0 HD22 LEU A 602 7.541 -10.037 0.288 1.00 0.00 H new ATOM 0 HD23 LEU A 602 7.327 -8.734 1.482 1.00 0.00 H new ATOM 973 N ASP A 603 9.185 -5.532 -1.934 1.00 0.00 N ATOM 974 CA ASP A 603 10.477 -5.144 -2.490 1.00 0.00 C ATOM 975 C ASP A 603 11.189 -4.151 -1.576 1.00 0.00 C ATOM 976 O ASP A 603 12.407 -4.212 -1.407 1.00 0.00 O ATOM 977 CB ASP A 603 10.295 -4.535 -3.881 1.00 0.00 C ATOM 978 CG ASP A 603 11.393 -4.947 -4.841 1.00 0.00 C ATOM 979 OD1 ASP A 603 11.118 -5.035 -6.056 1.00 0.00 O ATOM 980 OD2 ASP A 603 12.529 -5.183 -4.378 1.00 0.00 O ATOM 0 H ASP A 603 8.390 -5.342 -2.544 1.00 0.00 H new ATOM 0 HA ASP A 603 11.092 -6.040 -2.571 1.00 0.00 H new ATOM 0 HB2 ASP A 603 9.330 -4.841 -4.285 1.00 0.00 H new ATOM 0 HB3 ASP A 603 10.277 -3.448 -3.799 1.00 0.00 H new ATOM 985 N HIS A 604 10.422 -3.238 -0.991 1.00 0.00 N ATOM 986 CA HIS A 604 10.980 -2.232 -0.094 1.00 0.00 C ATOM 987 C HIS A 604 11.477 -2.872 1.198 1.00 0.00 C ATOM 988 O HIS A 604 12.443 -2.405 1.801 1.00 0.00 O ATOM 989 CB HIS A 604 9.932 -1.163 0.221 1.00 0.00 C ATOM 990 CG HIS A 604 10.522 0.166 0.577 1.00 0.00 C ATOM 991 ND1 HIS A 604 11.427 0.828 -0.226 1.00 0.00 N ATOM 992 CD2 HIS A 604 10.331 0.959 1.658 1.00 0.00 C ATOM 993 CE1 HIS A 604 11.767 1.970 0.345 1.00 0.00 C ATOM 994 NE2 HIS A 604 11.115 2.073 1.488 1.00 0.00 N ATOM 0 H HIS A 604 9.412 -3.173 -1.121 1.00 0.00 H new ATOM 0 HA HIS A 604 11.827 -1.763 -0.595 1.00 0.00 H new ATOM 0 HB2 HIS A 604 9.278 -1.042 -0.642 1.00 0.00 H new ATOM 0 HB3 HIS A 604 9.310 -1.508 1.047 1.00 0.00 H new ATOM 0 HD2 HIS A 604 9.683 0.753 2.497 1.00 0.00 H new ATOM 0 HE1 HIS A 604 12.460 2.695 -0.055 1.00 0.00 H new ATOM 0 HE2 HIS A 604 11.183 2.854 2.140 1.00 0.00 H new ATOM 1003 N ARG A 605 10.812 -3.942 1.618 1.00 0.00 N ATOM 1004 CA ARG A 605 11.186 -4.645 2.839 1.00 0.00 C ATOM 1005 C ARG A 605 12.439 -5.489 2.619 1.00 0.00 C ATOM 1006 O ARG A 605 13.238 -5.681 3.535 1.00 0.00 O ATOM 1007 CB ARG A 605 10.036 -5.533 3.316 1.00 0.00 C ATOM 1008 CG ARG A 605 10.141 -5.932 4.779 1.00 0.00 C ATOM 1009 CD ARG A 605 9.040 -6.904 5.172 1.00 0.00 C ATOM 1010 NE ARG A 605 9.486 -7.854 6.189 1.00 0.00 N ATOM 1011 CZ ARG A 605 8.659 -8.577 6.940 1.00 0.00 C ATOM 1012 NH1 ARG A 605 7.345 -8.463 6.792 1.00 0.00 N ATOM 1013 NH2 ARG A 605 9.148 -9.417 7.842 1.00 0.00 N ATOM 0 H ARG A 605 10.010 -4.342 1.130 1.00 0.00 H new ATOM 0 HA ARG A 605 11.401 -3.900 3.605 1.00 0.00 H new ATOM 0 HB2 ARG A 605 9.094 -5.009 3.158 1.00 0.00 H new ATOM 0 HB3 ARG A 605 10.006 -6.434 2.704 1.00 0.00 H new ATOM 0 HG2 ARG A 605 11.114 -6.388 4.964 1.00 0.00 H new ATOM 0 HG3 ARG A 605 10.082 -5.042 5.405 1.00 0.00 H new ATOM 0 HD2 ARG A 605 8.182 -6.347 5.548 1.00 0.00 H new ATOM 0 HD3 ARG A 605 8.705 -7.449 4.289 1.00 0.00 H new ATOM 0 HE ARG A 605 10.489 -7.970 6.331 1.00 0.00 H new ATOM 0 HH11 ARG A 605 6.964 -7.818 6.099 1.00 0.00 H new ATOM 0 HH12 ARG A 605 6.716 -9.020 7.371 1.00 0.00 H new ATOM 0 HH21 ARG A 605 10.157 -9.508 7.960 1.00 0.00 H new ATOM 0 HH22 ARG A 605 8.515 -9.972 8.418 1.00 0.00 H new ATOM 1027 N GLN A 606 12.601 -5.990 1.398 1.00 0.00 N ATOM 1028 CA GLN A 606 13.756 -6.813 1.059 1.00 0.00 C ATOM 1029 C GLN A 606 15.053 -6.034 1.245 1.00 0.00 C ATOM 1030 O GLN A 606 16.092 -6.608 1.576 1.00 0.00 O ATOM 1031 CB GLN A 606 13.648 -7.309 -0.384 1.00 0.00 C ATOM 1032 CG GLN A 606 12.414 -8.158 -0.645 1.00 0.00 C ATOM 1033 CD GLN A 606 12.732 -9.638 -0.730 1.00 0.00 C ATOM 1034 OE1 GLN A 606 12.514 -10.274 -1.761 1.00 0.00 O ATOM 1035 NE2 GLN A 606 13.249 -10.196 0.359 1.00 0.00 N ATOM 0 H GLN A 606 11.948 -5.841 0.629 1.00 0.00 H new ATOM 0 HA GLN A 606 13.770 -7.671 1.731 1.00 0.00 H new ATOM 0 HB2 GLN A 606 13.636 -6.450 -1.055 1.00 0.00 H new ATOM 0 HB3 GLN A 606 14.537 -7.891 -0.627 1.00 0.00 H new ATOM 0 HG2 GLN A 606 11.688 -7.991 0.151 1.00 0.00 H new ATOM 0 HG3 GLN A 606 11.947 -7.837 -1.576 1.00 0.00 H new ATOM 0 HE21 GLN A 606 13.413 -9.631 1.192 1.00 0.00 H new ATOM 0 HE22 GLN A 606 13.482 -11.189 0.362 1.00 0.00 H new ATOM 1044 N LEU A 607 14.988 -4.725 1.030 1.00 0.00 N ATOM 1045 CA LEU A 607 16.158 -3.866 1.174 1.00 0.00 C ATOM 1046 C LEU A 607 16.595 -3.781 2.633 1.00 0.00 C ATOM 1047 O LEU A 607 17.788 -3.751 2.933 1.00 0.00 O ATOM 1048 CB LEU A 607 15.858 -2.466 0.636 1.00 0.00 C ATOM 1049 CG LEU A 607 15.607 -2.391 -0.870 1.00 0.00 C ATOM 1050 CD1 LEU A 607 14.795 -1.152 -1.215 1.00 0.00 C ATOM 1051 CD2 LEU A 607 16.925 -2.396 -1.630 1.00 0.00 C ATOM 0 H LEU A 607 14.137 -4.235 0.755 1.00 0.00 H new ATOM 0 HA LEU A 607 16.972 -4.303 0.595 1.00 0.00 H new ATOM 0 HB2 LEU A 607 14.983 -2.074 1.155 1.00 0.00 H new ATOM 0 HB3 LEU A 607 16.694 -1.812 0.882 1.00 0.00 H new ATOM 0 HG LEU A 607 15.035 -3.269 -1.168 1.00 0.00 H new ATOM 0 HD11 LEU A 607 14.626 -1.116 -2.291 1.00 0.00 H new ATOM 0 HD12 LEU A 607 13.836 -1.190 -0.698 1.00 0.00 H new ATOM 0 HD13 LEU A 607 15.340 -0.261 -0.903 1.00 0.00 H new ATOM 0 HD21 LEU A 607 16.728 -2.342 -2.701 1.00 0.00 H new ATOM 0 HD22 LEU A 607 17.523 -1.536 -1.327 1.00 0.00 H new ATOM 0 HD23 LEU A 607 17.470 -3.313 -1.407 1.00 0.00 H new ATOM 1063 N HIS A 608 15.621 -3.742 3.536 1.00 0.00 N ATOM 1064 CA HIS A 608 15.905 -3.660 4.964 1.00 0.00 C ATOM 1065 C HIS A 608 16.145 -5.047 5.552 1.00 0.00 C ATOM 1066 O HIS A 608 17.051 -5.240 6.361 1.00 0.00 O ATOM 1067 CB HIS A 608 14.751 -2.975 5.697 1.00 0.00 C ATOM 1068 CG HIS A 608 15.121 -2.472 7.059 1.00 0.00 C ATOM 1069 ND1 HIS A 608 16.401 -2.549 7.567 1.00 0.00 N ATOM 1070 CD2 HIS A 608 14.370 -1.883 8.020 1.00 0.00 C ATOM 1071 CE1 HIS A 608 16.422 -2.028 8.781 1.00 0.00 C ATOM 1072 NE2 HIS A 608 15.203 -1.617 9.079 1.00 0.00 N ATOM 0 H HIS A 608 14.628 -3.766 3.304 1.00 0.00 H new ATOM 0 HA HIS A 608 16.811 -3.068 5.095 1.00 0.00 H new ATOM 0 HB2 HIS A 608 14.394 -2.140 5.095 1.00 0.00 H new ATOM 0 HB3 HIS A 608 13.923 -3.678 5.791 1.00 0.00 H new ATOM 0 HD2 HIS A 608 13.314 -1.664 7.964 1.00 0.00 H new ATOM 0 HE1 HIS A 608 17.289 -1.951 9.421 1.00 0.00 H new ATOM 0 HE2 HIS A 608 14.925 -1.174 9.954 1.00 0.00 H new ATOM 1081 N GLU A 609 15.326 -6.008 5.139 1.00 0.00 N ATOM 1082 CA GLU A 609 15.450 -7.378 5.625 1.00 0.00 C ATOM 1083 C GLU A 609 15.201 -8.379 4.501 1.00 0.00 C ATOM 1084 O GLU A 609 14.105 -8.443 3.944 1.00 0.00 O ATOM 1085 CB GLU A 609 14.467 -7.626 6.770 1.00 0.00 C ATOM 1086 CG GLU A 609 14.832 -6.896 8.053 1.00 0.00 C ATOM 1087 CD GLU A 609 15.094 -7.841 9.211 1.00 0.00 C ATOM 1088 OE1 GLU A 609 14.349 -7.774 10.211 1.00 0.00 O ATOM 1089 OE2 GLU A 609 16.041 -8.648 9.114 1.00 0.00 O ATOM 0 H GLU A 609 14.570 -5.864 4.470 1.00 0.00 H new ATOM 0 HA GLU A 609 16.467 -7.516 5.992 1.00 0.00 H new ATOM 0 HB2 GLU A 609 13.470 -7.316 6.456 1.00 0.00 H new ATOM 0 HB3 GLU A 609 14.419 -8.696 6.972 1.00 0.00 H new ATOM 0 HG2 GLU A 609 15.719 -6.286 7.879 1.00 0.00 H new ATOM 0 HG3 GLU A 609 14.024 -6.215 8.321 1.00 0.00 H new ATOM 1096 N PHE A 610 16.226 -9.158 4.172 1.00 0.00 N ATOM 1097 CA PHE A 610 16.119 -10.157 3.114 1.00 0.00 C ATOM 1098 C PHE A 610 16.549 -11.531 3.617 1.00 0.00 C ATOM 1099 O PHE A 610 17.577 -11.666 4.281 1.00 0.00 O ATOM 1100 CB PHE A 610 16.974 -9.750 1.912 1.00 0.00 C ATOM 1101 CG PHE A 610 18.440 -9.656 2.223 1.00 0.00 C ATOM 1102 CD1 PHE A 610 18.930 -8.624 3.006 1.00 0.00 C ATOM 1103 CD2 PHE A 610 19.327 -10.601 1.732 1.00 0.00 C ATOM 1104 CE1 PHE A 610 20.280 -8.535 3.294 1.00 0.00 C ATOM 1105 CE2 PHE A 610 20.677 -10.517 2.016 1.00 0.00 C ATOM 1106 CZ PHE A 610 21.154 -9.483 2.798 1.00 0.00 C ATOM 0 H PHE A 610 17.140 -9.117 4.622 1.00 0.00 H new ATOM 0 HA PHE A 610 15.075 -10.214 2.806 1.00 0.00 H new ATOM 0 HB2 PHE A 610 16.827 -10.473 1.110 1.00 0.00 H new ATOM 0 HB3 PHE A 610 16.627 -8.786 1.540 1.00 0.00 H new ATOM 0 HD1 PHE A 610 18.251 -7.881 3.396 1.00 0.00 H new ATOM 0 HD2 PHE A 610 18.959 -11.412 1.121 1.00 0.00 H new ATOM 0 HE1 PHE A 610 20.650 -7.726 3.906 1.00 0.00 H new ATOM 0 HE2 PHE A 610 21.358 -11.259 1.627 1.00 0.00 H new ATOM 0 HZ PHE A 610 22.209 -9.416 3.021 1.00 0.00 H new ATOM 1116 N SER A 611 15.757 -12.548 3.295 1.00 0.00 N ATOM 1117 CA SER A 611 16.057 -13.912 3.713 1.00 0.00 C ATOM 1118 C SER A 611 17.173 -14.509 2.862 1.00 0.00 C ATOM 1119 O SER A 611 16.991 -14.763 1.671 1.00 0.00 O ATOM 1120 CB SER A 611 14.804 -14.785 3.617 1.00 0.00 C ATOM 1121 OG SER A 611 14.514 -15.113 2.269 1.00 0.00 O ATOM 0 H SER A 611 14.903 -12.453 2.746 1.00 0.00 H new ATOM 0 HA SER A 611 16.392 -13.882 4.750 1.00 0.00 H new ATOM 0 HB2 SER A 611 14.948 -15.698 4.194 1.00 0.00 H new ATOM 0 HB3 SER A 611 13.956 -14.260 4.057 1.00 0.00 H new ATOM 0 HG SER A 611 15.261 -14.837 1.697 1.00 0.00 H new ATOM 1127 N SER A 612 18.328 -14.731 3.481 1.00 0.00 N ATOM 1128 CA SER A 612 19.473 -15.298 2.778 1.00 0.00 C ATOM 1129 C SER A 612 19.443 -16.824 2.831 1.00 0.00 C ATOM 1130 O SER A 612 19.097 -17.409 3.858 1.00 0.00 O ATOM 1131 CB SER A 612 20.779 -14.781 3.387 1.00 0.00 C ATOM 1132 OG SER A 612 20.798 -13.365 3.423 1.00 0.00 O ATOM 0 H SER A 612 18.496 -14.527 4.466 1.00 0.00 H new ATOM 0 HA SER A 612 19.418 -14.987 1.735 1.00 0.00 H new ATOM 0 HB2 SER A 612 20.895 -15.175 4.397 1.00 0.00 H new ATOM 0 HB3 SER A 612 21.625 -15.145 2.804 1.00 0.00 H new ATOM 0 HG SER A 612 20.737 -13.014 2.510 1.00 0.00 H new ATOM 1138 N PRO A 613 19.807 -17.493 1.722 1.00 0.00 N ATOM 1139 CA PRO A 613 19.817 -18.957 1.653 1.00 0.00 C ATOM 1140 C PRO A 613 20.995 -19.565 2.407 1.00 0.00 C ATOM 1141 O PRO A 613 20.839 -20.545 3.137 1.00 0.00 O ATOM 1142 CB PRO A 613 19.940 -19.235 0.156 1.00 0.00 C ATOM 1143 CG PRO A 613 20.665 -18.052 -0.387 1.00 0.00 C ATOM 1144 CD PRO A 613 20.234 -16.877 0.450 1.00 0.00 C ATOM 0 HA PRO A 613 18.931 -19.395 2.112 1.00 0.00 H new ATOM 0 HB2 PRO A 613 20.489 -20.157 -0.032 1.00 0.00 H new ATOM 0 HB3 PRO A 613 18.960 -19.347 -0.308 1.00 0.00 H new ATOM 0 HG2 PRO A 613 21.744 -18.196 -0.330 1.00 0.00 H new ATOM 0 HG3 PRO A 613 20.420 -17.893 -1.437 1.00 0.00 H new ATOM 0 HD2 PRO A 613 21.051 -16.171 0.601 1.00 0.00 H new ATOM 0 HD3 PRO A 613 19.420 -16.326 -0.022 1.00 0.00 H new ATOM 1152 N SER A 614 22.173 -18.978 2.226 1.00 0.00 N ATOM 1153 CA SER A 614 23.378 -19.463 2.890 1.00 0.00 C ATOM 1154 C SER A 614 24.147 -18.312 3.532 1.00 0.00 C ATOM 1155 O SER A 614 23.958 -17.149 3.174 1.00 0.00 O ATOM 1156 CB SER A 614 24.275 -20.196 1.891 1.00 0.00 C ATOM 1157 OG SER A 614 23.796 -21.506 1.642 1.00 0.00 O ATOM 0 H SER A 614 22.319 -18.166 1.626 1.00 0.00 H new ATOM 0 HA SER A 614 23.076 -20.157 3.675 1.00 0.00 H new ATOM 0 HB2 SER A 614 24.317 -19.637 0.956 1.00 0.00 H new ATOM 0 HB3 SER A 614 25.293 -20.245 2.279 1.00 0.00 H new ATOM 0 HG SER A 614 24.385 -21.953 0.999 1.00 0.00 H new ATOM 1163 N HIS A 615 25.016 -18.645 4.481 1.00 0.00 N ATOM 1164 CA HIS A 615 25.815 -17.640 5.174 1.00 0.00 C ATOM 1165 C HIS A 615 27.303 -17.967 5.073 1.00 0.00 C ATOM 1166 O HIS A 615 27.996 -18.077 6.086 1.00 0.00 O ATOM 1167 CB HIS A 615 25.394 -17.548 6.642 1.00 0.00 C ATOM 1168 CG HIS A 615 24.340 -16.516 6.900 1.00 0.00 C ATOM 1169 ND1 HIS A 615 23.137 -16.484 6.228 1.00 0.00 N ATOM 1170 CD2 HIS A 615 24.315 -15.473 7.764 1.00 0.00 C ATOM 1171 CE1 HIS A 615 22.416 -15.467 6.666 1.00 0.00 C ATOM 1172 NE2 HIS A 615 23.108 -14.838 7.598 1.00 0.00 N ATOM 0 H HIS A 615 25.185 -19.603 4.788 1.00 0.00 H new ATOM 0 HA HIS A 615 25.641 -16.676 4.696 1.00 0.00 H new ATOM 0 HB2 HIS A 615 25.025 -18.521 6.967 1.00 0.00 H new ATOM 0 HB3 HIS A 615 26.270 -17.320 7.249 1.00 0.00 H new ATOM 0 HD2 HIS A 615 25.097 -15.193 8.454 1.00 0.00 H new ATOM 0 HE1 HIS A 615 21.429 -15.196 6.321 1.00 0.00 H new ATOM 0 HE2 HIS A 615 22.797 -14.014 8.112 1.00 0.00 H new ATOM 1181 N LEU A 616 27.787 -18.120 3.846 1.00 0.00 N ATOM 1182 CA LEU A 616 29.192 -18.433 3.612 1.00 0.00 C ATOM 1183 C LEU A 616 29.571 -19.757 4.273 1.00 0.00 C ATOM 1184 O LEU A 616 28.705 -20.509 4.721 1.00 0.00 O ATOM 1185 CB LEU A 616 30.083 -17.306 4.142 1.00 0.00 C ATOM 1186 CG LEU A 616 30.870 -16.546 3.070 1.00 0.00 C ATOM 1187 CD1 LEU A 616 30.168 -15.246 2.714 1.00 0.00 C ATOM 1188 CD2 LEU A 616 32.291 -16.275 3.544 1.00 0.00 C ATOM 0 H LEU A 616 27.227 -18.032 2.998 1.00 0.00 H new ATOM 0 HA LEU A 616 29.345 -18.529 2.537 1.00 0.00 H new ATOM 0 HB2 LEU A 616 29.460 -16.596 4.686 1.00 0.00 H new ATOM 0 HB3 LEU A 616 30.788 -17.727 4.859 1.00 0.00 H new ATOM 0 HG LEU A 616 30.919 -17.165 2.174 1.00 0.00 H new ATOM 0 HD11 LEU A 616 30.742 -14.720 1.951 1.00 0.00 H new ATOM 0 HD12 LEU A 616 29.171 -15.464 2.332 1.00 0.00 H new ATOM 0 HD13 LEU A 616 30.088 -14.621 3.603 1.00 0.00 H new ATOM 0 HD21 LEU A 616 32.836 -15.734 2.770 1.00 0.00 H new ATOM 0 HD22 LEU A 616 32.263 -15.676 4.454 1.00 0.00 H new ATOM 0 HD23 LEU A 616 32.793 -17.221 3.748 1.00 0.00 H new ATOM 1200 N LEU A 617 30.869 -20.034 4.330 1.00 0.00 N ATOM 1201 CA LEU A 617 31.363 -21.265 4.935 1.00 0.00 C ATOM 1202 C LEU A 617 32.502 -20.975 5.908 1.00 0.00 C ATOM 1203 O LEU A 617 33.259 -20.021 5.727 1.00 0.00 O ATOM 1204 CB LEU A 617 31.838 -22.234 3.852 1.00 0.00 C ATOM 1205 CG LEU A 617 32.820 -21.644 2.840 1.00 0.00 C ATOM 1206 CD1 LEU A 617 33.751 -22.723 2.307 1.00 0.00 C ATOM 1207 CD2 LEU A 617 32.071 -20.974 1.699 1.00 0.00 C ATOM 0 H LEU A 617 31.598 -19.422 3.964 1.00 0.00 H new ATOM 0 HA LEU A 617 30.543 -21.722 5.489 1.00 0.00 H new ATOM 0 HB2 LEU A 617 32.308 -23.091 4.334 1.00 0.00 H new ATOM 0 HB3 LEU A 617 30.967 -22.609 3.314 1.00 0.00 H new ATOM 0 HG LEU A 617 33.423 -20.890 3.346 1.00 0.00 H new ATOM 0 HD11 LEU A 617 34.443 -22.284 1.588 1.00 0.00 H new ATOM 0 HD12 LEU A 617 34.314 -23.158 3.133 1.00 0.00 H new ATOM 0 HD13 LEU A 617 33.164 -23.501 1.818 1.00 0.00 H new ATOM 0 HD21 LEU A 617 32.786 -20.560 0.988 1.00 0.00 H new ATOM 0 HD22 LEU A 617 31.443 -21.709 1.195 1.00 0.00 H new ATOM 0 HD23 LEU A 617 31.447 -20.173 2.094 1.00 0.00 H new ATOM 1219 N ARG A 618 32.616 -21.805 6.941 1.00 0.00 N ATOM 1220 CA ARG A 618 33.663 -21.638 7.943 1.00 0.00 C ATOM 1221 C ARG A 618 33.911 -22.943 8.692 1.00 0.00 C ATOM 1222 O ARG A 618 34.974 -23.551 8.564 1.00 0.00 O ATOM 1223 CB ARG A 618 33.282 -20.532 8.929 1.00 0.00 C ATOM 1224 CG ARG A 618 34.480 -19.809 9.524 1.00 0.00 C ATOM 1225 CD ARG A 618 34.714 -18.467 8.849 1.00 0.00 C ATOM 1226 NE ARG A 618 35.782 -18.535 7.853 1.00 0.00 N ATOM 1227 CZ ARG A 618 36.307 -17.467 7.256 1.00 0.00 C ATOM 1228 NH1 ARG A 618 35.867 -16.250 7.550 1.00 0.00 N ATOM 1229 NH2 ARG A 618 37.275 -17.616 6.362 1.00 0.00 N ATOM 0 H ARG A 618 31.997 -22.599 7.106 1.00 0.00 H new ATOM 0 HA ARG A 618 34.582 -21.355 7.430 1.00 0.00 H new ATOM 0 HB2 ARG A 618 32.646 -19.807 8.421 1.00 0.00 H new ATOM 0 HB3 ARG A 618 32.691 -20.964 9.736 1.00 0.00 H new ATOM 0 HG2 ARG A 618 34.321 -19.657 10.592 1.00 0.00 H new ATOM 0 HG3 ARG A 618 35.370 -20.430 9.419 1.00 0.00 H new ATOM 0 HD2 ARG A 618 33.792 -18.136 8.370 1.00 0.00 H new ATOM 0 HD3 ARG A 618 34.968 -17.721 9.602 1.00 0.00 H new ATOM 0 HE ARG A 618 36.146 -19.454 7.601 1.00 0.00 H new ATOM 0 HH11 ARG A 618 35.123 -16.129 8.237 1.00 0.00 H new ATOM 0 HH12 ARG A 618 36.273 -15.436 7.089 1.00 0.00 H new ATOM 0 HH21 ARG A 618 37.617 -18.549 6.132 1.00 0.00 H new ATOM 0 HH22 ARG A 618 37.677 -16.798 5.905 1.00 0.00 H new ATOM 1243 N THR A 619 32.925 -23.366 9.476 1.00 0.00 N ATOM 1244 CA THR A 619 33.036 -24.600 10.246 1.00 0.00 C ATOM 1245 C THR A 619 32.804 -25.822 9.359 1.00 0.00 C ATOM 1246 O THR A 619 33.690 -26.663 9.205 1.00 0.00 O ATOM 1247 CB THR A 619 32.039 -24.596 11.409 1.00 0.00 C ATOM 1248 OG1 THR A 619 31.222 -23.439 11.370 1.00 0.00 O ATOM 1249 CG2 THR A 619 32.706 -24.641 12.767 1.00 0.00 C ATOM 0 H THR A 619 32.040 -22.873 9.595 1.00 0.00 H new ATOM 0 HA THR A 619 34.048 -24.656 10.648 1.00 0.00 H new ATOM 0 HB THR A 619 31.445 -25.501 11.282 1.00 0.00 H new ATOM 0 HG1 THR A 619 30.592 -23.458 12.120 1.00 0.00 H new ATOM 0 HG21 THR A 619 31.944 -24.636 13.547 1.00 0.00 H new ATOM 0 HG22 THR A 619 33.303 -25.549 12.849 1.00 0.00 H new ATOM 0 HG23 THR A 619 33.351 -23.771 12.884 1.00 0.00 H new ATOM 1257 N PRO A 620 31.605 -25.937 8.761 1.00 0.00 N ATOM 1258 CA PRO A 620 31.265 -27.064 7.887 1.00 0.00 C ATOM 1259 C PRO A 620 31.937 -26.963 6.522 1.00 0.00 C ATOM 1260 O PRO A 620 32.074 -25.874 5.965 1.00 0.00 O ATOM 1261 CB PRO A 620 29.748 -26.950 7.747 1.00 0.00 C ATOM 1262 CG PRO A 620 29.463 -25.498 7.916 1.00 0.00 C ATOM 1263 CD PRO A 620 30.488 -24.980 8.888 1.00 0.00 C ATOM 0 HA PRO A 620 31.601 -28.017 8.296 1.00 0.00 H new ATOM 0 HB2 PRO A 620 29.412 -27.309 6.775 1.00 0.00 H new ATOM 0 HB3 PRO A 620 29.234 -27.545 8.502 1.00 0.00 H new ATOM 0 HG2 PRO A 620 29.531 -24.974 6.962 1.00 0.00 H new ATOM 0 HG3 PRO A 620 28.453 -25.341 8.295 1.00 0.00 H new ATOM 0 HD2 PRO A 620 30.799 -23.966 8.639 1.00 0.00 H new ATOM 0 HD3 PRO A 620 30.098 -24.953 9.905 1.00 0.00 H new ATOM 1271 N SER A 621 32.355 -28.106 5.989 1.00 0.00 N ATOM 1272 CA SER A 621 33.013 -28.148 4.688 1.00 0.00 C ATOM 1273 C SER A 621 32.297 -29.109 3.747 1.00 0.00 C ATOM 1274 O SER A 621 31.937 -30.221 4.134 1.00 0.00 O ATOM 1275 CB SER A 621 34.476 -28.567 4.847 1.00 0.00 C ATOM 1276 OG SER A 621 34.578 -29.902 5.310 1.00 0.00 O ATOM 0 H SER A 621 32.250 -29.016 6.438 1.00 0.00 H new ATOM 0 HA SER A 621 32.973 -27.148 4.256 1.00 0.00 H new ATOM 0 HB2 SER A 621 34.991 -28.470 3.891 1.00 0.00 H new ATOM 0 HB3 SER A 621 34.975 -27.897 5.547 1.00 0.00 H new ATOM 0 HG SER A 621 35.523 -30.145 5.401 1.00 0.00 H new ATOM 1282 N SER A 622 32.092 -28.675 2.508 1.00 0.00 N ATOM 1283 CA SER A 622 31.417 -29.497 1.511 1.00 0.00 C ATOM 1284 C SER A 622 32.430 -30.236 0.641 1.00 0.00 C ATOM 1285 O SER A 622 33.613 -29.836 0.641 1.00 0.00 O ATOM 1286 CB SER A 622 30.510 -28.633 0.635 1.00 0.00 C ATOM 1287 OG SER A 622 31.163 -27.435 0.249 1.00 0.00 O ATOM 1288 OXT SER A 622 32.030 -31.208 -0.034 1.00 0.00 O ATOM 0 H SER A 622 32.384 -27.758 2.170 1.00 0.00 H new ATOM 0 HA SER A 622 30.808 -30.233 2.035 1.00 0.00 H new ATOM 0 HB2 SER A 622 30.216 -29.193 -0.253 1.00 0.00 H new ATOM 0 HB3 SER A 622 29.596 -28.394 1.178 1.00 0.00 H new ATOM 0 HG SER A 622 30.562 -26.901 -0.312 1.00 0.00 H new TER 1294 SER A 622