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 547 CYS SG : rot -160:sc= 0 USER MOD Set 1.2: A 574 TYR OH : rot 180:sc= 0 USER MOD Set 1.3: A 604 HIS : no HD1:sc= -0.277 K(o=-0.28,f=-1.5) USER MOD Set 2.1: A 581 MET CE :methyl -166:sc= -3.69 (180deg=-4.14!) USER MOD Set 2.2: A 595 HIS :FLIP no HD1:sc= -0.0208 F(o=-5.9,f=-3.7) 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 41:sc= 0.151 USER MOD Single : A 548 SER OG : rot 180:sc= 0.3 USER MOD Single : A 551 SER OG : rot 180:sc= 0 USER MOD Single : A 558 CYS SG : rot -92:sc= 0.915 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 93:sc= -1.61 USER MOD Single : A 564 TYR OH : rot 180:sc= 0 USER MOD Single : A 566 THR OG1 : rot 180:sc= -0.158 USER MOD Single : A 567 THR OG1 : rot 37:sc= -1.14 USER MOD Single : A 568 GLN : amide:sc= -0.208 X(o=-0.21,f=-0.089) USER MOD Single : A 571 THR OG1 : rot 180:sc= 0 USER MOD Single : A 572 THR OG1 : rot 180:sc= 0.262 USER MOD Single : A 575 GLN : amide:sc= -0.0452 K(o=-0.045,f=-0.76) USER MOD Single : A 578 HIS : no HD1:sc= 0 X(o=0,f=-0.0053) USER MOD Single : A 579 TYR OH : rot -26:sc= -3.91! USER MOD Single : A 580 SER OG : rot -79:sc= 1.31 USER MOD Single : A 586 SER OG : rot 180:sc= 0 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 606 GLN : amide:sc= 0 X(o=0,f=-0.02) USER MOD Single : A 608 HIS : no HD1:sc= 0 X(o=0,f=-0.035) USER MOD Single : A 611 SER OG : rot 30:sc= 0.089 USER MOD Single : A 612 SER OG : rot 180:sc= 0 USER MOD Single : A 614 SER OG : rot 180:sc= 0 USER MOD Single : A 615 HIS : no HD1:sc= -0.0183 X(o=-0.018,f=0) USER MOD Single : A 619 THR OG1 : rot 180:sc= 0 USER MOD Single : A 621 SER OG : rot 180:sc= 0 USER MOD Single : A 622 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 541 4.765 20.433 9.209 1.00 0.00 N ATOM 2 CA GLY A 541 5.155 21.380 8.128 1.00 0.00 C ATOM 3 C GLY A 541 5.579 20.669 6.858 1.00 0.00 C ATOM 4 O GLY A 541 4.744 20.125 6.135 1.00 0.00 O ATOM 0 HA2 GLY A 541 4.316 22.040 7.908 1.00 0.00 H new ATOM 0 HA3 GLY A 541 5.973 22.009 8.479 1.00 0.00 H new ATOM 9 N SER A 542 6.880 20.673 6.587 1.00 0.00 N ATOM 10 CA SER A 542 7.415 20.024 5.396 1.00 0.00 C ATOM 11 C SER A 542 8.897 19.706 5.567 1.00 0.00 C ATOM 12 O SER A 542 9.653 19.687 4.596 1.00 0.00 O ATOM 13 CB SER A 542 7.210 20.914 4.168 1.00 0.00 C ATOM 14 OG SER A 542 7.002 20.136 3.002 1.00 0.00 O ATOM 0 H SER A 542 7.583 21.119 7.176 1.00 0.00 H new ATOM 0 HA SER A 542 6.876 19.088 5.251 1.00 0.00 H new ATOM 0 HB2 SER A 542 6.354 21.569 4.329 1.00 0.00 H new ATOM 0 HB3 SER A 542 8.081 21.555 4.030 1.00 0.00 H new ATOM 0 HG SER A 542 6.872 20.728 2.232 1.00 0.00 H new ATOM 20 N TYR A 543 9.304 19.457 6.807 1.00 0.00 N ATOM 21 CA TYR A 543 10.697 19.140 7.103 1.00 0.00 C ATOM 22 C TYR A 543 10.953 17.636 6.999 1.00 0.00 C ATOM 23 O TYR A 543 11.873 17.204 6.305 1.00 0.00 O ATOM 24 CB TYR A 543 11.072 19.647 8.498 1.00 0.00 C ATOM 25 CG TYR A 543 11.715 21.015 8.491 1.00 0.00 C ATOM 26 CD1 TYR A 543 13.071 21.167 8.229 1.00 0.00 C ATOM 27 CD2 TYR A 543 10.965 22.157 8.746 1.00 0.00 C ATOM 28 CE1 TYR A 543 13.660 22.417 8.221 1.00 0.00 C ATOM 29 CE2 TYR A 543 11.547 23.410 8.740 1.00 0.00 C ATOM 30 CZ TYR A 543 12.895 23.535 8.477 1.00 0.00 C ATOM 31 OH TYR A 543 13.478 24.781 8.469 1.00 0.00 O ATOM 0 H TYR A 543 8.691 19.468 7.622 1.00 0.00 H new ATOM 0 HA TYR A 543 11.322 19.642 6.365 1.00 0.00 H new ATOM 0 HB2 TYR A 543 10.175 19.679 9.117 1.00 0.00 H new ATOM 0 HB3 TYR A 543 11.755 18.936 8.963 1.00 0.00 H new ATOM 0 HD1 TYR A 543 13.674 20.294 8.028 1.00 0.00 H new ATOM 0 HD2 TYR A 543 9.909 22.063 8.952 1.00 0.00 H new ATOM 0 HE1 TYR A 543 14.715 22.518 8.015 1.00 0.00 H new ATOM 0 HE2 TYR A 543 10.949 24.287 8.940 1.00 0.00 H new ATOM 0 HH TYR A 543 12.800 25.461 8.667 1.00 0.00 H new ATOM 41 N PRO A 544 10.136 16.813 7.684 1.00 0.00 N ATOM 42 CA PRO A 544 10.284 15.353 7.654 1.00 0.00 C ATOM 43 C PRO A 544 10.244 14.799 6.235 1.00 0.00 C ATOM 44 O PRO A 544 9.653 15.403 5.340 1.00 0.00 O ATOM 45 CB PRO A 544 9.078 14.849 8.454 1.00 0.00 C ATOM 46 CG PRO A 544 8.684 15.995 9.317 1.00 0.00 C ATOM 47 CD PRO A 544 9.009 17.236 8.533 1.00 0.00 C ATOM 0 HA PRO A 544 11.244 15.036 8.062 1.00 0.00 H new ATOM 0 HB2 PRO A 544 8.262 14.553 7.794 1.00 0.00 H new ATOM 0 HB3 PRO A 544 9.338 13.975 9.052 1.00 0.00 H new ATOM 0 HG2 PRO A 544 7.622 15.954 9.559 1.00 0.00 H new ATOM 0 HG3 PRO A 544 9.228 15.977 10.262 1.00 0.00 H new ATOM 0 HD2 PRO A 544 8.159 17.570 7.937 1.00 0.00 H new ATOM 0 HD3 PRO A 544 9.285 18.064 9.186 1.00 0.00 H new ATOM 55 N THR A 545 10.873 13.645 6.033 1.00 0.00 N ATOM 56 CA THR A 545 10.905 13.014 4.719 1.00 0.00 C ATOM 57 C THR A 545 11.016 11.498 4.839 1.00 0.00 C ATOM 58 O THR A 545 11.996 10.975 5.369 1.00 0.00 O ATOM 59 CB THR A 545 12.073 13.558 3.897 1.00 0.00 C ATOM 60 OG1 THR A 545 13.274 13.527 4.649 1.00 0.00 O ATOM 61 CG2 THR A 545 11.863 14.981 3.426 1.00 0.00 C ATOM 0 H THR A 545 11.366 13.129 6.762 1.00 0.00 H new ATOM 0 HA THR A 545 9.970 13.250 4.212 1.00 0.00 H new ATOM 0 HB THR A 545 12.137 12.909 3.023 1.00 0.00 H new ATOM 0 HG1 THR A 545 13.323 12.688 5.153 1.00 0.00 H new ATOM 0 HG21 THR A 545 12.729 15.305 2.849 1.00 0.00 H new ATOM 0 HG22 THR A 545 10.972 15.029 2.801 1.00 0.00 H new ATOM 0 HG23 THR A 545 11.737 15.635 4.289 1.00 0.00 H new ATOM 69 N ASP A 546 10.004 10.799 4.335 1.00 0.00 N ATOM 70 CA ASP A 546 9.982 9.341 4.375 1.00 0.00 C ATOM 71 C ASP A 546 9.040 8.789 3.313 1.00 0.00 C ATOM 72 O ASP A 546 8.215 9.518 2.763 1.00 0.00 O ATOM 73 CB ASP A 546 9.550 8.849 5.759 1.00 0.00 C ATOM 74 CG ASP A 546 10.720 8.369 6.596 1.00 0.00 C ATOM 75 OD1 ASP A 546 10.480 7.723 7.638 1.00 0.00 O ATOM 76 OD2 ASP A 546 11.878 8.639 6.210 1.00 0.00 O ATOM 0 H ASP A 546 9.187 11.220 3.893 1.00 0.00 H new ATOM 0 HA ASP A 546 10.991 8.981 4.171 1.00 0.00 H new ATOM 0 HB2 ASP A 546 9.038 9.655 6.284 1.00 0.00 H new ATOM 0 HB3 ASP A 546 8.832 8.037 5.645 1.00 0.00 H new ATOM 81 N CYS A 547 9.168 7.499 3.029 1.00 0.00 N ATOM 82 CA CYS A 547 8.324 6.855 2.031 1.00 0.00 C ATOM 83 C CYS A 547 6.857 6.902 2.451 1.00 0.00 C ATOM 84 O CYS A 547 6.461 6.297 3.447 1.00 0.00 O ATOM 85 CB CYS A 547 8.768 5.410 1.812 1.00 0.00 C ATOM 86 SG CYS A 547 10.422 5.245 1.101 1.00 0.00 S ATOM 0 H CYS A 547 9.846 6.880 3.474 1.00 0.00 H new ATOM 0 HA CYS A 547 8.429 7.399 1.092 1.00 0.00 H new ATOM 0 HB2 CYS A 547 8.741 4.884 2.766 1.00 0.00 H new ATOM 0 HB3 CYS A 547 8.051 4.917 1.156 1.00 0.00 H new ATOM 0 HG CYS A 547 10.550 4.066 0.569 1.00 0.00 H new ATOM 92 N SER A 548 6.062 7.633 1.683 1.00 0.00 N ATOM 93 CA SER A 548 4.637 7.779 1.957 1.00 0.00 C ATOM 94 C SER A 548 3.809 6.955 0.983 1.00 0.00 C ATOM 95 O SER A 548 4.249 6.673 -0.127 1.00 0.00 O ATOM 96 CB SER A 548 4.227 9.250 1.844 1.00 0.00 C ATOM 97 OG SER A 548 4.264 9.683 0.493 1.00 0.00 O ATOM 0 H SER A 548 6.382 8.139 0.857 1.00 0.00 H new ATOM 0 HA SER A 548 4.452 7.421 2.970 1.00 0.00 H new ATOM 0 HB2 SER A 548 3.223 9.384 2.246 1.00 0.00 H new ATOM 0 HB3 SER A 548 4.896 9.865 2.446 1.00 0.00 H new ATOM 0 HG SER A 548 3.997 10.625 0.444 1.00 0.00 H new ATOM 103 N ILE A 549 2.596 6.597 1.393 1.00 0.00 N ATOM 104 CA ILE A 549 1.700 5.836 0.530 1.00 0.00 C ATOM 105 C ILE A 549 1.356 6.661 -0.706 1.00 0.00 C ATOM 106 O ILE A 549 1.094 6.120 -1.780 1.00 0.00 O ATOM 107 CB ILE A 549 0.393 5.465 1.261 1.00 0.00 C ATOM 108 CG1 ILE A 549 0.697 4.745 2.577 1.00 0.00 C ATOM 109 CG2 ILE A 549 -0.498 4.610 0.368 1.00 0.00 C ATOM 110 CD1 ILE A 549 1.251 3.348 2.396 1.00 0.00 C ATOM 0 H ILE A 549 2.213 6.820 2.312 1.00 0.00 H new ATOM 0 HA ILE A 549 2.212 4.917 0.245 1.00 0.00 H new ATOM 0 HB ILE A 549 -0.143 6.385 1.494 1.00 0.00 H new ATOM 0 HG12 ILE A 549 1.412 5.338 3.148 1.00 0.00 H new ATOM 0 HG13 ILE A 549 -0.216 4.690 3.169 1.00 0.00 H new ATOM 0 HG21 ILE A 549 -1.415 4.359 0.902 1.00 0.00 H new ATOM 0 HG22 ILE A 549 -0.746 5.165 -0.537 1.00 0.00 H new ATOM 0 HG23 ILE A 549 0.028 3.694 0.100 1.00 0.00 H new ATOM 0 HD11 ILE A 549 1.441 2.903 3.373 1.00 0.00 H new ATOM 0 HD12 ILE A 549 0.529 2.738 1.853 1.00 0.00 H new ATOM 0 HD13 ILE A 549 2.182 3.396 1.832 1.00 0.00 H new ATOM 122 N VAL A 550 1.360 7.983 -0.535 1.00 0.00 N ATOM 123 CA VAL A 550 1.049 8.908 -1.618 1.00 0.00 C ATOM 124 C VAL A 550 2.090 8.823 -2.732 1.00 0.00 C ATOM 125 O VAL A 550 1.746 8.681 -3.905 1.00 0.00 O ATOM 126 CB VAL A 550 0.976 10.357 -1.088 1.00 0.00 C ATOM 127 CG1 VAL A 550 0.896 11.360 -2.228 1.00 0.00 C ATOM 128 CG2 VAL A 550 -0.209 10.517 -0.147 1.00 0.00 C ATOM 0 H VAL A 550 1.577 8.437 0.352 1.00 0.00 H new ATOM 0 HA VAL A 550 0.079 8.624 -2.026 1.00 0.00 H new ATOM 0 HB VAL A 550 1.892 10.560 -0.534 1.00 0.00 H new ATOM 0 HG11 VAL A 550 0.846 12.370 -1.821 1.00 0.00 H new ATOM 0 HG12 VAL A 550 1.781 11.266 -2.858 1.00 0.00 H new ATOM 0 HG13 VAL A 550 0.004 11.164 -2.823 1.00 0.00 H new ATOM 0 HG21 VAL A 550 -0.247 11.543 0.218 1.00 0.00 H new ATOM 0 HG22 VAL A 550 -1.131 10.287 -0.681 1.00 0.00 H new ATOM 0 HG23 VAL A 550 -0.098 9.835 0.696 1.00 0.00 H new ATOM 138 N SER A 551 3.365 8.897 -2.359 1.00 0.00 N ATOM 139 CA SER A 551 4.446 8.814 -3.337 1.00 0.00 C ATOM 140 C SER A 551 4.670 7.363 -3.744 1.00 0.00 C ATOM 141 O SER A 551 5.021 7.068 -4.887 1.00 0.00 O ATOM 142 CB SER A 551 5.735 9.403 -2.759 1.00 0.00 C ATOM 143 OG SER A 551 6.830 9.187 -3.632 1.00 0.00 O ATOM 0 H SER A 551 3.674 9.013 -1.394 1.00 0.00 H new ATOM 0 HA SER A 551 4.165 9.391 -4.218 1.00 0.00 H new ATOM 0 HB2 SER A 551 5.606 10.472 -2.590 1.00 0.00 H new ATOM 0 HB3 SER A 551 5.943 8.950 -1.790 1.00 0.00 H new ATOM 0 HG SER A 551 7.641 9.574 -3.241 1.00 0.00 H new ATOM 149 N PHE A 552 4.452 6.466 -2.792 1.00 0.00 N ATOM 150 CA PHE A 552 4.612 5.038 -3.015 1.00 0.00 C ATOM 151 C PHE A 552 3.595 4.540 -4.041 1.00 0.00 C ATOM 152 O PHE A 552 3.936 3.792 -4.957 1.00 0.00 O ATOM 153 CB PHE A 552 4.453 4.300 -1.681 1.00 0.00 C ATOM 154 CG PHE A 552 4.048 2.859 -1.801 1.00 0.00 C ATOM 155 CD1 PHE A 552 2.970 2.379 -1.080 1.00 0.00 C ATOM 156 CD2 PHE A 552 4.743 1.989 -2.626 1.00 0.00 C ATOM 157 CE1 PHE A 552 2.588 1.059 -1.176 1.00 0.00 C ATOM 158 CE2 PHE A 552 4.366 0.664 -2.728 1.00 0.00 C ATOM 159 CZ PHE A 552 3.286 0.197 -2.002 1.00 0.00 C ATOM 0 H PHE A 552 4.160 6.709 -1.845 1.00 0.00 H new ATOM 0 HA PHE A 552 5.607 4.840 -3.414 1.00 0.00 H new ATOM 0 HB2 PHE A 552 5.397 4.353 -1.138 1.00 0.00 H new ATOM 0 HB3 PHE A 552 3.709 4.823 -1.079 1.00 0.00 H new ATOM 0 HD1 PHE A 552 2.421 3.047 -0.434 1.00 0.00 H new ATOM 0 HD2 PHE A 552 5.587 2.350 -3.194 1.00 0.00 H new ATOM 0 HE1 PHE A 552 1.744 0.698 -0.607 1.00 0.00 H new ATOM 0 HE2 PHE A 552 4.914 -0.006 -3.374 1.00 0.00 H new ATOM 0 HZ PHE A 552 2.988 -0.838 -2.080 1.00 0.00 H new ATOM 169 N LEU A 553 2.345 4.966 -3.881 1.00 0.00 N ATOM 170 CA LEU A 553 1.280 4.571 -4.796 1.00 0.00 C ATOM 171 C LEU A 553 1.415 5.302 -6.126 1.00 0.00 C ATOM 172 O LEU A 553 1.233 4.713 -7.191 1.00 0.00 O ATOM 173 CB LEU A 553 -0.090 4.861 -4.180 1.00 0.00 C ATOM 174 CG LEU A 553 -0.599 3.803 -3.200 1.00 0.00 C ATOM 175 CD1 LEU A 553 -1.954 4.203 -2.637 1.00 0.00 C ATOM 176 CD2 LEU A 553 -0.682 2.445 -3.881 1.00 0.00 C ATOM 0 H LEU A 553 2.046 5.584 -3.127 1.00 0.00 H new ATOM 0 HA LEU A 553 1.367 3.499 -4.975 1.00 0.00 H new ATOM 0 HB2 LEU A 553 -0.043 5.820 -3.663 1.00 0.00 H new ATOM 0 HB3 LEU A 553 -0.817 4.968 -4.985 1.00 0.00 H new ATOM 0 HG LEU A 553 0.107 3.731 -2.373 1.00 0.00 H new ATOM 0 HD11 LEU A 553 -2.299 3.438 -1.942 1.00 0.00 H new ATOM 0 HD12 LEU A 553 -1.864 5.155 -2.113 1.00 0.00 H new ATOM 0 HD13 LEU A 553 -2.671 4.304 -3.452 1.00 0.00 H new ATOM 0 HD21 LEU A 553 -1.046 1.703 -3.170 1.00 0.00 H new ATOM 0 HD22 LEU A 553 -1.367 2.503 -4.727 1.00 0.00 H new ATOM 0 HD23 LEU A 553 0.307 2.154 -4.234 1.00 0.00 H new ATOM 188 N ALA A 554 1.737 6.591 -6.056 1.00 0.00 N ATOM 189 CA ALA A 554 1.899 7.404 -7.255 1.00 0.00 C ATOM 190 C ALA A 554 2.954 6.810 -8.179 1.00 0.00 C ATOM 191 O ALA A 554 2.806 6.828 -9.402 1.00 0.00 O ATOM 192 CB ALA A 554 2.266 8.832 -6.879 1.00 0.00 C ATOM 0 H ALA A 554 1.891 7.093 -5.182 1.00 0.00 H new ATOM 0 HA ALA A 554 0.949 7.415 -7.790 1.00 0.00 H new ATOM 0 HB1 ALA A 554 2.384 9.428 -7.784 1.00 0.00 H new ATOM 0 HB2 ALA A 554 1.476 9.261 -6.263 1.00 0.00 H new ATOM 0 HB3 ALA A 554 3.202 8.832 -6.320 1.00 0.00 H new ATOM 198 N ARG A 555 4.016 6.279 -7.585 1.00 0.00 N ATOM 199 CA ARG A 555 5.097 5.672 -8.353 1.00 0.00 C ATOM 200 C ARG A 555 4.604 4.435 -9.098 1.00 0.00 C ATOM 201 O ARG A 555 5.148 4.070 -10.142 1.00 0.00 O ATOM 202 CB ARG A 555 6.258 5.298 -7.429 1.00 0.00 C ATOM 203 CG ARG A 555 7.626 5.492 -8.061 1.00 0.00 C ATOM 204 CD ARG A 555 8.743 5.092 -7.110 1.00 0.00 C ATOM 205 NE ARG A 555 9.734 4.237 -7.759 1.00 0.00 N ATOM 206 CZ ARG A 555 9.555 2.937 -7.988 1.00 0.00 C ATOM 207 NH1 ARG A 555 8.427 2.341 -7.621 1.00 0.00 N ATOM 208 NH2 ARG A 555 10.507 2.232 -8.584 1.00 0.00 N ATOM 0 H ARG A 555 4.152 6.256 -6.574 1.00 0.00 H new ATOM 0 HA ARG A 555 5.445 6.400 -9.085 1.00 0.00 H new ATOM 0 HB2 ARG A 555 6.198 5.899 -6.522 1.00 0.00 H new ATOM 0 HB3 ARG A 555 6.151 4.256 -7.128 1.00 0.00 H new ATOM 0 HG2 ARG A 555 7.694 4.899 -8.973 1.00 0.00 H new ATOM 0 HG3 ARG A 555 7.749 6.536 -8.350 1.00 0.00 H new ATOM 0 HD2 ARG A 555 9.232 5.988 -6.728 1.00 0.00 H new ATOM 0 HD3 ARG A 555 8.319 4.569 -6.252 1.00 0.00 H new ATOM 0 HE ARG A 555 10.614 4.660 -8.054 1.00 0.00 H new ATOM 0 HH11 ARG A 555 7.692 2.879 -7.161 1.00 0.00 H new ATOM 0 HH12 ARG A 555 8.295 1.345 -7.799 1.00 0.00 H new ATOM 0 HH21 ARG A 555 11.376 2.685 -8.867 1.00 0.00 H new ATOM 0 HH22 ARG A 555 10.370 1.237 -8.760 1.00 0.00 H new ATOM 222 N LEU A 556 3.572 3.794 -8.557 1.00 0.00 N ATOM 223 CA LEU A 556 3.006 2.598 -9.171 1.00 0.00 C ATOM 224 C LEU A 556 1.747 2.931 -9.969 1.00 0.00 C ATOM 225 O LEU A 556 1.316 2.149 -10.816 1.00 0.00 O ATOM 226 CB LEU A 556 2.680 1.557 -8.098 1.00 0.00 C ATOM 227 CG LEU A 556 3.801 1.288 -7.094 1.00 0.00 C ATOM 228 CD1 LEU A 556 3.226 0.832 -5.762 1.00 0.00 C ATOM 229 CD2 LEU A 556 4.767 0.250 -7.643 1.00 0.00 C ATOM 0 H LEU A 556 3.111 4.083 -7.694 1.00 0.00 H new ATOM 0 HA LEU A 556 3.748 2.189 -9.857 1.00 0.00 H new ATOM 0 HB2 LEU A 556 1.795 1.885 -7.552 1.00 0.00 H new ATOM 0 HB3 LEU A 556 2.421 0.619 -8.590 1.00 0.00 H new ATOM 0 HG LEU A 556 4.349 2.216 -6.931 1.00 0.00 H new ATOM 0 HD11 LEU A 556 4.038 0.645 -5.060 1.00 0.00 H new ATOM 0 HD12 LEU A 556 2.573 1.608 -5.363 1.00 0.00 H new ATOM 0 HD13 LEU A 556 2.654 -0.084 -5.907 1.00 0.00 H new ATOM 0 HD21 LEU A 556 5.559 0.070 -6.916 1.00 0.00 H new ATOM 0 HD22 LEU A 556 4.232 -0.680 -7.834 1.00 0.00 H new ATOM 0 HD23 LEU A 556 5.204 0.615 -8.573 1.00 0.00 H new ATOM 241 N GLY A 557 1.161 4.092 -9.696 1.00 0.00 N ATOM 242 CA GLY A 557 -0.041 4.499 -10.398 1.00 0.00 C ATOM 243 C GLY A 557 -1.302 3.955 -9.756 1.00 0.00 C ATOM 244 O GLY A 557 -2.145 3.364 -10.430 1.00 0.00 O ATOM 0 H GLY A 557 1.498 4.758 -9.001 1.00 0.00 H new ATOM 0 HA2 GLY A 557 -0.091 5.588 -10.424 1.00 0.00 H new ATOM 0 HA3 GLY A 557 0.013 4.157 -11.432 1.00 0.00 H new ATOM 248 N CYS A 558 -1.431 4.152 -8.447 1.00 0.00 N ATOM 249 CA CYS A 558 -2.598 3.676 -7.714 1.00 0.00 C ATOM 250 C CYS A 558 -2.908 4.589 -6.531 1.00 0.00 C ATOM 251 O CYS A 558 -3.241 4.121 -5.442 1.00 0.00 O ATOM 252 CB CYS A 558 -2.369 2.245 -7.224 1.00 0.00 C ATOM 253 SG CYS A 558 -2.434 0.998 -8.533 1.00 0.00 S ATOM 0 H CYS A 558 -0.742 4.638 -7.873 1.00 0.00 H new ATOM 0 HA CYS A 558 -3.452 3.688 -8.391 1.00 0.00 H new ATOM 0 HB2 CYS A 558 -1.397 2.191 -6.734 1.00 0.00 H new ATOM 0 HB3 CYS A 558 -3.120 2.006 -6.471 1.00 0.00 H new ATOM 0 HG CYS A 558 -3.644 0.533 -8.630 1.00 0.00 H new ATOM 259 N SER A 559 -2.798 5.895 -6.755 1.00 0.00 N ATOM 260 CA SER A 559 -3.067 6.875 -5.710 1.00 0.00 C ATOM 261 C SER A 559 -4.512 6.781 -5.229 1.00 0.00 C ATOM 262 O SER A 559 -4.813 7.085 -4.075 1.00 0.00 O ATOM 263 CB SER A 559 -2.781 8.288 -6.223 1.00 0.00 C ATOM 264 OG SER A 559 -1.509 8.357 -6.845 1.00 0.00 O ATOM 0 H SER A 559 -2.524 6.298 -7.651 1.00 0.00 H new ATOM 0 HA SER A 559 -2.409 6.659 -4.868 1.00 0.00 H new ATOM 0 HB2 SER A 559 -3.553 8.584 -6.933 1.00 0.00 H new ATOM 0 HB3 SER A 559 -2.823 8.995 -5.394 1.00 0.00 H new ATOM 0 HG SER A 559 -1.351 9.269 -7.166 1.00 0.00 H new ATOM 270 N SER A 560 -5.401 6.357 -6.120 1.00 0.00 N ATOM 271 CA SER A 560 -6.815 6.222 -5.785 1.00 0.00 C ATOM 272 C SER A 560 -7.019 5.211 -4.659 1.00 0.00 C ATOM 273 O SER A 560 -8.010 5.271 -3.932 1.00 0.00 O ATOM 274 CB SER A 560 -7.613 5.796 -7.018 1.00 0.00 C ATOM 275 OG SER A 560 -7.468 4.408 -7.265 1.00 0.00 O ATOM 0 H SER A 560 -5.169 6.101 -7.080 1.00 0.00 H new ATOM 0 HA SER A 560 -7.174 7.193 -5.443 1.00 0.00 H new ATOM 0 HB2 SER A 560 -8.667 6.035 -6.873 1.00 0.00 H new ATOM 0 HB3 SER A 560 -7.275 6.360 -7.887 1.00 0.00 H new ATOM 0 HG SER A 560 -7.989 4.161 -8.057 1.00 0.00 H new ATOM 281 N CYS A 561 -6.078 4.281 -4.525 1.00 0.00 N ATOM 282 CA CYS A 561 -6.159 3.256 -3.490 1.00 0.00 C ATOM 283 C CYS A 561 -5.852 3.832 -2.109 1.00 0.00 C ATOM 284 O CYS A 561 -6.207 3.240 -1.090 1.00 0.00 O ATOM 285 CB CYS A 561 -5.191 2.112 -3.802 1.00 0.00 C ATOM 286 SG CYS A 561 -5.947 0.721 -4.678 1.00 0.00 S ATOM 0 H CYS A 561 -5.252 4.216 -5.119 1.00 0.00 H new ATOM 0 HA CYS A 561 -7.180 2.874 -3.479 1.00 0.00 H new ATOM 0 HB2 CYS A 561 -4.368 2.501 -4.402 1.00 0.00 H new ATOM 0 HB3 CYS A 561 -4.762 1.749 -2.868 1.00 0.00 H new ATOM 0 HG CYS A 561 -5.801 0.884 -5.959 1.00 0.00 H new ATOM 292 N LEU A 562 -5.185 4.984 -2.080 1.00 0.00 N ATOM 293 CA LEU A 562 -4.825 5.626 -0.819 1.00 0.00 C ATOM 294 C LEU A 562 -6.033 5.777 0.100 1.00 0.00 C ATOM 295 O LEU A 562 -5.916 5.630 1.317 1.00 0.00 O ATOM 296 CB LEU A 562 -4.194 6.994 -1.074 1.00 0.00 C ATOM 297 CG LEU A 562 -3.041 7.351 -0.132 1.00 0.00 C ATOM 298 CD1 LEU A 562 -1.707 7.225 -0.851 1.00 0.00 C ATOM 299 CD2 LEU A 562 -3.216 8.755 0.428 1.00 0.00 C ATOM 0 H LEU A 562 -4.884 5.490 -2.913 1.00 0.00 H new ATOM 0 HA LEU A 562 -4.099 4.982 -0.322 1.00 0.00 H new ATOM 0 HB2 LEU A 562 -3.830 7.025 -2.101 1.00 0.00 H new ATOM 0 HB3 LEU A 562 -4.967 7.758 -0.986 1.00 0.00 H new ATOM 0 HG LEU A 562 -3.052 6.649 0.702 1.00 0.00 H new ATOM 0 HD11 LEU A 562 -0.899 7.483 -0.166 1.00 0.00 H new ATOM 0 HD12 LEU A 562 -1.576 6.200 -1.198 1.00 0.00 H new ATOM 0 HD13 LEU A 562 -1.689 7.902 -1.705 1.00 0.00 H new ATOM 0 HD21 LEU A 562 -2.385 8.987 1.095 1.00 0.00 H new ATOM 0 HD22 LEU A 562 -3.236 9.474 -0.391 1.00 0.00 H new ATOM 0 HD23 LEU A 562 -4.153 8.811 0.982 1.00 0.00 H new ATOM 311 N ASP A 563 -7.193 6.068 -0.481 1.00 0.00 N ATOM 312 CA ASP A 563 -8.414 6.240 0.302 1.00 0.00 C ATOM 313 C ASP A 563 -8.645 5.041 1.216 1.00 0.00 C ATOM 314 O ASP A 563 -9.114 5.189 2.346 1.00 0.00 O ATOM 315 CB ASP A 563 -9.617 6.429 -0.623 1.00 0.00 C ATOM 316 CG ASP A 563 -9.750 7.857 -1.115 1.00 0.00 C ATOM 317 OD1 ASP A 563 -8.708 8.512 -1.327 1.00 0.00 O ATOM 318 OD2 ASP A 563 -10.897 8.321 -1.288 1.00 0.00 O ATOM 0 H ASP A 563 -7.314 6.189 -1.486 1.00 0.00 H new ATOM 0 HA ASP A 563 -8.297 7.130 0.920 1.00 0.00 H new ATOM 0 HB2 ASP A 563 -9.522 5.760 -1.479 1.00 0.00 H new ATOM 0 HB3 ASP A 563 -10.527 6.144 -0.094 1.00 0.00 H new ATOM 323 N TYR A 564 -8.307 3.856 0.722 1.00 0.00 N ATOM 324 CA TYR A 564 -8.471 2.636 1.489 1.00 0.00 C ATOM 325 C TYR A 564 -7.466 2.573 2.636 1.00 0.00 C ATOM 326 O TYR A 564 -7.767 2.049 3.708 1.00 0.00 O ATOM 327 CB TYR A 564 -8.295 1.423 0.576 1.00 0.00 C ATOM 328 CG TYR A 564 -9.139 1.481 -0.678 1.00 0.00 C ATOM 329 CD1 TYR A 564 -8.547 1.506 -1.935 1.00 0.00 C ATOM 330 CD2 TYR A 564 -10.525 1.509 -0.605 1.00 0.00 C ATOM 331 CE1 TYR A 564 -9.314 1.557 -3.083 1.00 0.00 C ATOM 332 CE2 TYR A 564 -11.299 1.560 -1.749 1.00 0.00 C ATOM 333 CZ TYR A 564 -10.689 1.584 -2.985 1.00 0.00 C ATOM 334 OH TYR A 564 -11.455 1.635 -4.127 1.00 0.00 O ATOM 0 H TYR A 564 -7.917 3.718 -0.210 1.00 0.00 H new ATOM 0 HA TYR A 564 -9.475 2.629 1.913 1.00 0.00 H new ATOM 0 HB2 TYR A 564 -7.245 1.340 0.294 1.00 0.00 H new ATOM 0 HB3 TYR A 564 -8.548 0.520 1.132 1.00 0.00 H new ATOM 0 HD1 TYR A 564 -7.470 1.485 -2.016 1.00 0.00 H new ATOM 0 HD2 TYR A 564 -11.006 1.491 0.362 1.00 0.00 H new ATOM 0 HE1 TYR A 564 -8.839 1.576 -4.053 1.00 0.00 H new ATOM 0 HE2 TYR A 564 -12.376 1.581 -1.675 1.00 0.00 H new ATOM 0 HH TYR A 564 -12.404 1.647 -3.884 1.00 0.00 H new ATOM 344 N PHE A 565 -6.270 3.110 2.404 1.00 0.00 N ATOM 345 CA PHE A 565 -5.227 3.112 3.424 1.00 0.00 C ATOM 346 C PHE A 565 -5.516 4.160 4.494 1.00 0.00 C ATOM 347 O PHE A 565 -5.466 3.875 5.691 1.00 0.00 O ATOM 348 CB PHE A 565 -3.863 3.379 2.786 1.00 0.00 C ATOM 349 CG PHE A 565 -3.365 2.244 1.936 1.00 0.00 C ATOM 350 CD1 PHE A 565 -3.166 0.988 2.482 1.00 0.00 C ATOM 351 CD2 PHE A 565 -3.097 2.435 0.590 1.00 0.00 C ATOM 352 CE1 PHE A 565 -2.709 -0.058 1.703 1.00 0.00 C ATOM 353 CE2 PHE A 565 -2.639 1.394 -0.195 1.00 0.00 C ATOM 354 CZ PHE A 565 -2.445 0.145 0.362 1.00 0.00 C ATOM 0 H PHE A 565 -6.001 3.547 1.523 1.00 0.00 H new ATOM 0 HA PHE A 565 -5.213 2.130 3.897 1.00 0.00 H new ATOM 0 HB2 PHE A 565 -3.927 4.279 2.175 1.00 0.00 H new ATOM 0 HB3 PHE A 565 -3.136 3.579 3.573 1.00 0.00 H new ATOM 0 HD1 PHE A 565 -3.370 0.823 3.530 1.00 0.00 H new ATOM 0 HD2 PHE A 565 -3.248 3.409 0.149 1.00 0.00 H new ATOM 0 HE1 PHE A 565 -2.558 -1.033 2.142 1.00 0.00 H new ATOM 0 HE2 PHE A 565 -2.433 1.557 -1.243 1.00 0.00 H new ATOM 0 HZ PHE A 565 -2.088 -0.671 -0.249 1.00 0.00 H new ATOM 364 N THR A 566 -5.827 5.372 4.053 1.00 0.00 N ATOM 365 CA THR A 566 -6.130 6.462 4.970 1.00 0.00 C ATOM 366 C THR A 566 -7.348 6.128 5.823 1.00 0.00 C ATOM 367 O THR A 566 -7.399 6.459 7.007 1.00 0.00 O ATOM 368 CB THR A 566 -6.376 7.757 4.193 1.00 0.00 C ATOM 369 OG1 THR A 566 -7.138 7.505 3.027 1.00 0.00 O ATOM 370 CG2 THR A 566 -5.100 8.449 3.766 1.00 0.00 C ATOM 0 H THR A 566 -5.876 5.625 3.066 1.00 0.00 H new ATOM 0 HA THR A 566 -5.273 6.600 5.629 1.00 0.00 H new ATOM 0 HB THR A 566 -6.912 8.410 4.882 1.00 0.00 H new ATOM 0 HG1 THR A 566 -7.286 8.345 2.545 1.00 0.00 H new ATOM 0 HG21 THR A 566 -5.345 9.360 3.220 1.00 0.00 H new ATOM 0 HG22 THR A 566 -4.511 8.702 4.647 1.00 0.00 H new ATOM 0 HG23 THR A 566 -4.523 7.784 3.122 1.00 0.00 H new ATOM 378 N THR A 567 -8.328 5.471 5.211 1.00 0.00 N ATOM 379 CA THR A 567 -9.549 5.091 5.911 1.00 0.00 C ATOM 380 C THR A 567 -9.243 4.244 7.147 1.00 0.00 C ATOM 381 O THR A 567 -10.061 4.157 8.061 1.00 0.00 O ATOM 382 CB THR A 567 -10.479 4.321 4.972 1.00 0.00 C ATOM 383 OG1 THR A 567 -9.734 3.513 4.079 1.00 0.00 O ATOM 384 CG2 THR A 567 -11.370 5.221 4.143 1.00 0.00 C ATOM 0 H THR A 567 -8.300 5.191 4.231 1.00 0.00 H new ATOM 0 HA THR A 567 -10.042 6.006 6.239 1.00 0.00 H new ATOM 0 HB THR A 567 -11.108 3.713 5.623 1.00 0.00 H new ATOM 0 HG1 THR A 567 -8.956 3.142 4.545 1.00 0.00 H new ATOM 0 HG21 THR A 567 -12.004 4.612 3.499 1.00 0.00 H new ATOM 0 HG22 THR A 567 -11.995 5.823 4.803 1.00 0.00 H new ATOM 0 HG23 THR A 567 -10.754 5.878 3.529 1.00 0.00 H new ATOM 392 N GLN A 568 -8.068 3.621 7.169 1.00 0.00 N ATOM 393 CA GLN A 568 -7.676 2.785 8.299 1.00 0.00 C ATOM 394 C GLN A 568 -6.617 3.469 9.162 1.00 0.00 C ATOM 395 O GLN A 568 -6.352 3.042 10.286 1.00 0.00 O ATOM 396 CB GLN A 568 -7.146 1.443 7.800 1.00 0.00 C ATOM 397 CG GLN A 568 -7.026 0.392 8.890 1.00 0.00 C ATOM 398 CD GLN A 568 -8.199 -0.569 8.907 1.00 0.00 C ATOM 399 OE1 GLN A 568 -8.051 -1.753 8.603 1.00 0.00 O ATOM 400 NE2 GLN A 568 -9.373 -0.062 9.263 1.00 0.00 N ATOM 0 H GLN A 568 -7.375 3.678 6.423 1.00 0.00 H new ATOM 0 HA GLN A 568 -8.561 2.623 8.914 1.00 0.00 H new ATOM 0 HB2 GLN A 568 -7.807 1.069 7.018 1.00 0.00 H new ATOM 0 HB3 GLN A 568 -6.167 1.595 7.345 1.00 0.00 H new ATOM 0 HG2 GLN A 568 -6.103 -0.170 8.747 1.00 0.00 H new ATOM 0 HG3 GLN A 568 -6.952 0.886 9.859 1.00 0.00 H new ATOM 0 HE21 GLN A 568 -9.449 0.925 9.507 1.00 0.00 H new ATOM 0 HE22 GLN A 568 -10.199 -0.660 9.293 1.00 0.00 H new ATOM 409 N GLY A 569 -6.019 4.534 8.638 1.00 0.00 N ATOM 410 CA GLY A 569 -5.005 5.257 9.387 1.00 0.00 C ATOM 411 C GLY A 569 -3.605 5.096 8.818 1.00 0.00 C ATOM 412 O GLY A 569 -2.640 5.600 9.393 1.00 0.00 O ATOM 0 H GLY A 569 -6.217 4.909 7.711 1.00 0.00 H new ATOM 0 HA2 GLY A 569 -5.263 6.316 9.404 1.00 0.00 H new ATOM 0 HA3 GLY A 569 -5.011 4.911 10.420 1.00 0.00 H new ATOM 416 N LEU A 570 -3.485 4.402 7.689 1.00 0.00 N ATOM 417 CA LEU A 570 -2.183 4.197 7.062 1.00 0.00 C ATOM 418 C LEU A 570 -1.916 5.269 6.010 1.00 0.00 C ATOM 419 O LEU A 570 -2.576 5.312 4.972 1.00 0.00 O ATOM 420 CB LEU A 570 -2.104 2.811 6.418 1.00 0.00 C ATOM 421 CG LEU A 570 -2.787 1.687 7.202 1.00 0.00 C ATOM 422 CD1 LEU A 570 -3.949 1.127 6.405 1.00 0.00 C ATOM 423 CD2 LEU A 570 -1.796 0.582 7.534 1.00 0.00 C ATOM 0 H LEU A 570 -4.267 3.975 7.193 1.00 0.00 H new ATOM 0 HA LEU A 570 -1.423 4.268 7.840 1.00 0.00 H new ATOM 0 HB2 LEU A 570 -2.551 2.863 5.425 1.00 0.00 H new ATOM 0 HB3 LEU A 570 -1.054 2.551 6.281 1.00 0.00 H new ATOM 0 HG LEU A 570 -3.165 2.100 8.137 1.00 0.00 H new ATOM 0 HD11 LEU A 570 -4.428 0.328 6.972 1.00 0.00 H new ATOM 0 HD12 LEU A 570 -4.673 1.919 6.212 1.00 0.00 H new ATOM 0 HD13 LEU A 570 -3.583 0.731 5.458 1.00 0.00 H new ATOM 0 HD21 LEU A 570 -2.303 -0.206 8.091 1.00 0.00 H new ATOM 0 HD22 LEU A 570 -1.388 0.169 6.611 1.00 0.00 H new ATOM 0 HD23 LEU A 570 -0.985 0.990 8.138 1.00 0.00 H new ATOM 435 N THR A 571 -0.947 6.135 6.286 1.00 0.00 N ATOM 436 CA THR A 571 -0.596 7.211 5.366 1.00 0.00 C ATOM 437 C THR A 571 0.820 7.035 4.820 1.00 0.00 C ATOM 438 O THR A 571 1.151 7.555 3.755 1.00 0.00 O ATOM 439 CB THR A 571 -0.720 8.566 6.064 1.00 0.00 C ATOM 440 OG1 THR A 571 -1.825 8.573 6.949 1.00 0.00 O ATOM 441 CG2 THR A 571 -0.893 9.722 5.103 1.00 0.00 C ATOM 0 H THR A 571 -0.390 6.113 7.140 1.00 0.00 H new ATOM 0 HA THR A 571 -1.291 7.173 4.527 1.00 0.00 H new ATOM 0 HB THR A 571 0.218 8.701 6.602 1.00 0.00 H new ATOM 0 HG1 THR A 571 -1.887 9.447 7.388 1.00 0.00 H new ATOM 0 HG21 THR A 571 -0.975 10.653 5.664 1.00 0.00 H new ATOM 0 HG22 THR A 571 -0.031 9.774 4.438 1.00 0.00 H new ATOM 0 HG23 THR A 571 -1.798 9.573 4.514 1.00 0.00 H new ATOM 449 N THR A 572 1.652 6.302 5.555 1.00 0.00 N ATOM 450 CA THR A 572 3.031 6.065 5.140 1.00 0.00 C ATOM 451 C THR A 572 3.227 4.621 4.696 1.00 0.00 C ATOM 452 O THR A 572 2.555 3.716 5.188 1.00 0.00 O ATOM 453 CB THR A 572 3.997 6.376 6.288 1.00 0.00 C ATOM 454 OG1 THR A 572 4.133 5.254 7.146 1.00 0.00 O ATOM 455 CG2 THR A 572 3.567 7.554 7.137 1.00 0.00 C ATOM 0 H THR A 572 1.396 5.863 6.439 1.00 0.00 H new ATOM 0 HA THR A 572 3.242 6.725 4.299 1.00 0.00 H new ATOM 0 HB THR A 572 4.943 6.625 5.807 1.00 0.00 H new ATOM 0 HG1 THR A 572 4.755 5.471 7.872 1.00 0.00 H new ATOM 0 HG21 THR A 572 4.297 7.717 7.930 1.00 0.00 H new ATOM 0 HG22 THR A 572 3.502 8.447 6.515 1.00 0.00 H new ATOM 0 HG23 THR A 572 2.592 7.348 7.578 1.00 0.00 H new ATOM 463 N ILE A 573 4.166 4.405 3.779 1.00 0.00 N ATOM 464 CA ILE A 573 4.452 3.061 3.302 1.00 0.00 C ATOM 465 C ILE A 573 4.967 2.209 4.453 1.00 0.00 C ATOM 466 O ILE A 573 4.645 1.026 4.565 1.00 0.00 O ATOM 467 CB ILE A 573 5.487 3.062 2.154 1.00 0.00 C ATOM 468 CG1 ILE A 573 5.391 1.759 1.356 1.00 0.00 C ATOM 469 CG2 ILE A 573 6.901 3.260 2.691 1.00 0.00 C ATOM 470 CD1 ILE A 573 6.434 1.636 0.266 1.00 0.00 C ATOM 0 H ILE A 573 4.736 5.138 3.356 1.00 0.00 H new ATOM 0 HA ILE A 573 3.524 2.644 2.911 1.00 0.00 H new ATOM 0 HB ILE A 573 5.262 3.897 1.491 1.00 0.00 H new ATOM 0 HG12 ILE A 573 5.491 0.916 2.040 1.00 0.00 H new ATOM 0 HG13 ILE A 573 4.400 1.690 0.908 1.00 0.00 H new ATOM 0 HG21 ILE A 573 7.609 3.257 1.862 1.00 0.00 H new ATOM 0 HG22 ILE A 573 6.961 4.214 3.215 1.00 0.00 H new ATOM 0 HG23 ILE A 573 7.145 2.451 3.380 1.00 0.00 H new ATOM 0 HD11 ILE A 573 6.304 0.688 -0.257 1.00 0.00 H new ATOM 0 HD12 ILE A 573 6.321 2.458 -0.440 1.00 0.00 H new ATOM 0 HD13 ILE A 573 7.429 1.673 0.709 1.00 0.00 H new ATOM 482 N TYR A 574 5.767 2.834 5.311 1.00 0.00 N ATOM 483 CA TYR A 574 6.333 2.154 6.469 1.00 0.00 C ATOM 484 C TYR A 574 5.232 1.526 7.318 1.00 0.00 C ATOM 485 O TYR A 574 5.390 0.422 7.841 1.00 0.00 O ATOM 486 CB TYR A 574 7.146 3.132 7.318 1.00 0.00 C ATOM 487 CG TYR A 574 8.432 3.584 6.664 1.00 0.00 C ATOM 488 CD1 TYR A 574 9.474 2.692 6.444 1.00 0.00 C ATOM 489 CD2 TYR A 574 8.605 4.905 6.269 1.00 0.00 C ATOM 490 CE1 TYR A 574 10.652 3.103 5.849 1.00 0.00 C ATOM 491 CE2 TYR A 574 9.779 5.323 5.673 1.00 0.00 C ATOM 492 CZ TYR A 574 10.799 4.419 5.465 1.00 0.00 C ATOM 493 OH TYR A 574 11.970 4.832 4.871 1.00 0.00 O ATOM 0 H TYR A 574 6.038 3.814 5.225 1.00 0.00 H new ATOM 0 HA TYR A 574 6.991 1.364 6.108 1.00 0.00 H new ATOM 0 HB2 TYR A 574 6.533 4.007 7.535 1.00 0.00 H new ATOM 0 HB3 TYR A 574 7.381 2.662 8.273 1.00 0.00 H new ATOM 0 HD1 TYR A 574 9.362 1.660 6.743 1.00 0.00 H new ATOM 0 HD2 TYR A 574 7.809 5.616 6.431 1.00 0.00 H new ATOM 0 HE1 TYR A 574 11.453 2.397 5.686 1.00 0.00 H new ATOM 0 HE2 TYR A 574 9.897 6.353 5.371 1.00 0.00 H new ATOM 0 HH TYR A 574 11.911 5.787 4.661 1.00 0.00 H new ATOM 503 N GLN A 575 4.116 2.237 7.451 1.00 0.00 N ATOM 504 CA GLN A 575 2.988 1.750 8.236 1.00 0.00 C ATOM 505 C GLN A 575 2.491 0.405 7.712 1.00 0.00 C ATOM 506 O GLN A 575 1.871 -0.365 8.446 1.00 0.00 O ATOM 507 CB GLN A 575 1.848 2.770 8.217 1.00 0.00 C ATOM 508 CG GLN A 575 1.997 3.870 9.256 1.00 0.00 C ATOM 509 CD GLN A 575 1.044 3.704 10.422 1.00 0.00 C ATOM 510 OE1 GLN A 575 -0.149 3.463 10.235 1.00 0.00 O ATOM 511 NE2 GLN A 575 1.566 3.833 11.637 1.00 0.00 N ATOM 0 H GLN A 575 3.969 3.152 7.025 1.00 0.00 H new ATOM 0 HA GLN A 575 3.329 1.613 9.262 1.00 0.00 H new ATOM 0 HB2 GLN A 575 1.793 3.222 7.227 1.00 0.00 H new ATOM 0 HB3 GLN A 575 0.904 2.251 8.383 1.00 0.00 H new ATOM 0 HG2 GLN A 575 3.022 3.877 9.627 1.00 0.00 H new ATOM 0 HG3 GLN A 575 1.822 4.837 8.784 1.00 0.00 H new ATOM 0 HE21 GLN A 575 2.560 4.033 11.746 1.00 0.00 H new ATOM 0 HE22 GLN A 575 0.973 3.732 12.460 1.00 0.00 H new ATOM 520 N ILE A 576 2.765 0.125 6.439 1.00 0.00 N ATOM 521 CA ILE A 576 2.340 -1.128 5.826 1.00 0.00 C ATOM 522 C ILE A 576 3.528 -1.919 5.280 1.00 0.00 C ATOM 523 O ILE A 576 3.354 -2.847 4.491 1.00 0.00 O ATOM 524 CB ILE A 576 1.323 -0.886 4.691 1.00 0.00 C ATOM 525 CG1 ILE A 576 1.986 -0.192 3.499 1.00 0.00 C ATOM 526 CG2 ILE A 576 0.149 -0.061 5.199 1.00 0.00 C ATOM 527 CD1 ILE A 576 1.063 -0.037 2.311 1.00 0.00 C ATOM 0 H ILE A 576 3.278 0.748 5.815 1.00 0.00 H new ATOM 0 HA ILE A 576 1.861 -1.711 6.612 1.00 0.00 H new ATOM 0 HB ILE A 576 0.952 -1.855 4.356 1.00 0.00 H new ATOM 0 HG12 ILE A 576 2.337 0.792 3.809 1.00 0.00 H new ATOM 0 HG13 ILE A 576 2.864 -0.763 3.197 1.00 0.00 H new ATOM 0 HG21 ILE A 576 -0.560 0.101 4.387 1.00 0.00 H new ATOM 0 HG22 ILE A 576 -0.346 -0.594 6.011 1.00 0.00 H new ATOM 0 HG23 ILE A 576 0.511 0.901 5.563 1.00 0.00 H new ATOM 0 HD11 ILE A 576 1.594 0.462 1.500 1.00 0.00 H new ATOM 0 HD12 ILE A 576 0.732 -1.020 1.977 1.00 0.00 H new ATOM 0 HD13 ILE A 576 0.197 0.559 2.599 1.00 0.00 H new ATOM 539 N GLU A 577 4.733 -1.547 5.700 1.00 0.00 N ATOM 540 CA GLU A 577 5.946 -2.224 5.249 1.00 0.00 C ATOM 541 C GLU A 577 5.830 -3.740 5.406 1.00 0.00 C ATOM 542 O GLU A 577 6.493 -4.498 4.697 1.00 0.00 O ATOM 543 CB GLU A 577 7.157 -1.714 6.031 1.00 0.00 C ATOM 544 CG GLU A 577 8.489 -2.173 5.461 1.00 0.00 C ATOM 545 CD GLU A 577 9.551 -2.346 6.529 1.00 0.00 C ATOM 546 OE1 GLU A 577 9.550 -1.560 7.500 1.00 0.00 O ATOM 547 OE2 GLU A 577 10.384 -3.266 6.394 1.00 0.00 O ATOM 0 H GLU A 577 4.897 -0.780 6.352 1.00 0.00 H new ATOM 0 HA GLU A 577 6.077 -2.001 4.190 1.00 0.00 H new ATOM 0 HB2 GLU A 577 7.135 -0.624 6.048 1.00 0.00 H new ATOM 0 HB3 GLU A 577 7.079 -2.050 7.065 1.00 0.00 H new ATOM 0 HG2 GLU A 577 8.349 -3.118 4.936 1.00 0.00 H new ATOM 0 HG3 GLU A 577 8.834 -1.447 4.724 1.00 0.00 H new ATOM 554 N HIS A 578 4.990 -4.178 6.340 1.00 0.00 N ATOM 555 CA HIS A 578 4.798 -5.603 6.586 1.00 0.00 C ATOM 556 C HIS A 578 3.352 -6.021 6.325 1.00 0.00 C ATOM 557 O HIS A 578 2.847 -6.956 6.947 1.00 0.00 O ATOM 558 CB HIS A 578 5.188 -5.946 8.026 1.00 0.00 C ATOM 559 CG HIS A 578 6.211 -7.034 8.126 1.00 0.00 C ATOM 560 ND1 HIS A 578 5.960 -8.250 8.728 1.00 0.00 N ATOM 561 CD2 HIS A 578 7.495 -7.086 7.698 1.00 0.00 C ATOM 562 CE1 HIS A 578 7.046 -9.001 8.665 1.00 0.00 C ATOM 563 NE2 HIS A 578 7.990 -8.319 8.045 1.00 0.00 N ATOM 0 H HIS A 578 4.433 -3.567 6.938 1.00 0.00 H new ATOM 0 HA HIS A 578 5.440 -6.152 5.897 1.00 0.00 H new ATOM 0 HB2 HIS A 578 5.574 -5.050 8.512 1.00 0.00 H new ATOM 0 HB3 HIS A 578 4.295 -6.247 8.574 1.00 0.00 H new ATOM 0 HD2 HIS A 578 8.030 -6.304 7.180 1.00 0.00 H new ATOM 0 HE1 HIS A 578 7.144 -10.003 9.055 1.00 0.00 H new ATOM 0 HE2 HIS A 578 8.935 -8.653 7.854 1.00 0.00 H new ATOM 572 N TYR A 579 2.691 -5.325 5.406 1.00 0.00 N ATOM 573 CA TYR A 579 1.304 -5.631 5.072 1.00 0.00 C ATOM 574 C TYR A 579 1.169 -6.880 4.214 1.00 0.00 C ATOM 575 O TYR A 579 1.949 -7.114 3.291 1.00 0.00 O ATOM 576 CB TYR A 579 0.634 -4.453 4.368 1.00 0.00 C ATOM 577 CG TYR A 579 -0.357 -3.729 5.241 1.00 0.00 C ATOM 578 CD1 TYR A 579 -0.057 -3.410 6.558 1.00 0.00 C ATOM 579 CD2 TYR A 579 -1.607 -3.383 4.749 1.00 0.00 C ATOM 580 CE1 TYR A 579 -0.978 -2.766 7.361 1.00 0.00 C ATOM 581 CE2 TYR A 579 -2.531 -2.738 5.541 1.00 0.00 C ATOM 582 CZ TYR A 579 -2.214 -2.432 6.847 1.00 0.00 C ATOM 583 OH TYR A 579 -3.136 -1.791 7.643 1.00 0.00 O ATOM 0 H TYR A 579 3.091 -4.548 4.881 1.00 0.00 H new ATOM 0 HA TYR A 579 0.800 -5.822 6.020 1.00 0.00 H new ATOM 0 HB2 TYR A 579 1.400 -3.751 4.039 1.00 0.00 H new ATOM 0 HB3 TYR A 579 0.126 -4.813 3.473 1.00 0.00 H new ATOM 0 HD1 TYR A 579 0.911 -3.669 6.961 1.00 0.00 H new ATOM 0 HD2 TYR A 579 -1.860 -3.624 3.727 1.00 0.00 H new ATOM 0 HE1 TYR A 579 -0.732 -2.525 8.385 1.00 0.00 H new ATOM 0 HE2 TYR A 579 -3.499 -2.473 5.141 1.00 0.00 H new ATOM 0 HH TYR A 579 -2.964 -2.008 8.583 1.00 0.00 H new ATOM 593 N SER A 580 0.145 -7.664 4.530 1.00 0.00 N ATOM 594 CA SER A 580 -0.155 -8.887 3.805 1.00 0.00 C ATOM 595 C SER A 580 -1.294 -8.646 2.826 1.00 0.00 C ATOM 596 O SER A 580 -1.914 -7.583 2.835 1.00 0.00 O ATOM 597 CB SER A 580 -0.561 -9.987 4.785 1.00 0.00 C ATOM 598 OG SER A 580 -1.893 -9.789 5.239 1.00 0.00 O ATOM 0 H SER A 580 -0.499 -7.467 5.296 1.00 0.00 H new ATOM 0 HA SER A 580 0.736 -9.196 3.258 1.00 0.00 H new ATOM 0 HB2 SER A 580 -0.477 -10.960 4.302 1.00 0.00 H new ATOM 0 HB3 SER A 580 0.121 -9.993 5.635 1.00 0.00 H new ATOM 0 HG SER A 580 -1.902 -9.101 5.937 1.00 0.00 H new ATOM 604 N MET A 581 -1.597 -9.644 2.008 1.00 0.00 N ATOM 605 CA MET A 581 -2.697 -9.526 1.065 1.00 0.00 C ATOM 606 C MET A 581 -4.009 -9.427 1.837 1.00 0.00 C ATOM 607 O MET A 581 -4.980 -8.829 1.369 1.00 0.00 O ATOM 608 CB MET A 581 -2.727 -10.727 0.116 1.00 0.00 C ATOM 609 CG MET A 581 -3.873 -10.685 -0.883 1.00 0.00 C ATOM 610 SD MET A 581 -3.309 -10.536 -2.589 1.00 0.00 S ATOM 611 CE MET A 581 -2.049 -9.272 -2.421 1.00 0.00 C ATOM 0 H MET A 581 -1.102 -10.535 1.979 1.00 0.00 H new ATOM 0 HA MET A 581 -2.559 -8.627 0.464 1.00 0.00 H new ATOM 0 HB2 MET A 581 -1.783 -10.773 -0.428 1.00 0.00 H new ATOM 0 HB3 MET A 581 -2.802 -11.642 0.704 1.00 0.00 H new ATOM 0 HG2 MET A 581 -4.471 -11.590 -0.781 1.00 0.00 H new ATOM 0 HG3 MET A 581 -4.525 -9.844 -0.646 1.00 0.00 H new ATOM 0 HE1 MET A 581 -1.782 -8.891 -3.407 1.00 0.00 H new ATOM 0 HE2 MET A 581 -2.432 -8.456 -1.808 1.00 0.00 H new ATOM 0 HE3 MET A 581 -1.166 -9.699 -1.946 1.00 0.00 H new ATOM 621 N ASP A 582 -4.019 -10.011 3.036 1.00 0.00 N ATOM 622 CA ASP A 582 -5.194 -9.989 3.896 1.00 0.00 C ATOM 623 C ASP A 582 -5.445 -8.581 4.427 1.00 0.00 C ATOM 624 O ASP A 582 -6.555 -8.067 4.327 1.00 0.00 O ATOM 625 CB ASP A 582 -5.019 -10.965 5.061 1.00 0.00 C ATOM 626 CG ASP A 582 -6.323 -11.632 5.455 1.00 0.00 C ATOM 627 OD1 ASP A 582 -7.075 -12.046 4.548 1.00 0.00 O ATOM 628 OD2 ASP A 582 -6.591 -11.739 6.670 1.00 0.00 O ATOM 0 H ASP A 582 -3.220 -10.507 3.432 1.00 0.00 H new ATOM 0 HA ASP A 582 -6.056 -10.297 3.305 1.00 0.00 H new ATOM 0 HB2 ASP A 582 -4.292 -11.729 4.786 1.00 0.00 H new ATOM 0 HB3 ASP A 582 -4.612 -10.432 5.920 1.00 0.00 H new ATOM 633 N ASP A 583 -4.406 -7.956 4.983 1.00 0.00 N ATOM 634 CA ASP A 583 -4.539 -6.599 5.512 1.00 0.00 C ATOM 635 C ASP A 583 -4.940 -5.638 4.399 1.00 0.00 C ATOM 636 O ASP A 583 -5.872 -4.845 4.546 1.00 0.00 O ATOM 637 CB ASP A 583 -3.227 -6.130 6.151 1.00 0.00 C ATOM 638 CG ASP A 583 -2.712 -7.102 7.194 1.00 0.00 C ATOM 639 OD1 ASP A 583 -3.406 -7.303 8.213 1.00 0.00 O ATOM 640 OD2 ASP A 583 -1.614 -7.662 6.994 1.00 0.00 O ATOM 0 H ASP A 583 -3.475 -8.362 5.078 1.00 0.00 H new ATOM 0 HA ASP A 583 -5.315 -6.609 6.278 1.00 0.00 H new ATOM 0 HB2 ASP A 583 -2.473 -6.002 5.374 1.00 0.00 H new ATOM 0 HB3 ASP A 583 -3.379 -5.154 6.612 1.00 0.00 H new ATOM 645 N LEU A 584 -4.223 -5.721 3.284 1.00 0.00 N ATOM 646 CA LEU A 584 -4.482 -4.870 2.130 1.00 0.00 C ATOM 647 C LEU A 584 -5.925 -5.059 1.648 1.00 0.00 C ATOM 648 O LEU A 584 -6.602 -4.105 1.235 1.00 0.00 O ATOM 649 CB LEU A 584 -3.486 -5.212 1.018 1.00 0.00 C ATOM 650 CG LEU A 584 -2.823 -4.007 0.352 1.00 0.00 C ATOM 651 CD1 LEU A 584 -1.841 -4.455 -0.723 1.00 0.00 C ATOM 652 CD2 LEU A 584 -3.876 -3.083 -0.229 1.00 0.00 C ATOM 0 H LEU A 584 -3.451 -6.375 3.155 1.00 0.00 H new ATOM 0 HA LEU A 584 -4.355 -3.824 2.409 1.00 0.00 H new ATOM 0 HB2 LEU A 584 -2.708 -5.853 1.432 1.00 0.00 H new ATOM 0 HB3 LEU A 584 -4.003 -5.792 0.253 1.00 0.00 H new ATOM 0 HG LEU A 584 -2.262 -3.458 1.109 1.00 0.00 H new ATOM 0 HD11 LEU A 584 -1.381 -3.580 -1.183 1.00 0.00 H new ATOM 0 HD12 LEU A 584 -1.067 -5.077 -0.273 1.00 0.00 H new ATOM 0 HD13 LEU A 584 -2.371 -5.029 -1.483 1.00 0.00 H new ATOM 0 HD21 LEU A 584 -3.390 -2.229 -0.700 1.00 0.00 H new ATOM 0 HD22 LEU A 584 -4.463 -3.622 -0.972 1.00 0.00 H new ATOM 0 HD23 LEU A 584 -4.532 -2.733 0.568 1.00 0.00 H new ATOM 664 N ALA A 585 -6.396 -6.301 1.726 1.00 0.00 N ATOM 665 CA ALA A 585 -7.757 -6.628 1.330 1.00 0.00 C ATOM 666 C ALA A 585 -8.742 -6.152 2.394 1.00 0.00 C ATOM 667 O ALA A 585 -9.876 -5.782 2.087 1.00 0.00 O ATOM 668 CB ALA A 585 -7.898 -8.126 1.103 1.00 0.00 C ATOM 0 H ALA A 585 -5.852 -7.096 2.061 1.00 0.00 H new ATOM 0 HA ALA A 585 -7.982 -6.117 0.394 1.00 0.00 H new ATOM 0 HB1 ALA A 585 -8.922 -8.354 0.807 1.00 0.00 H new ATOM 0 HB2 ALA A 585 -7.214 -8.441 0.315 1.00 0.00 H new ATOM 0 HB3 ALA A 585 -7.659 -8.658 2.024 1.00 0.00 H new ATOM 674 N SER A 586 -8.293 -6.160 3.648 1.00 0.00 N ATOM 675 CA SER A 586 -9.121 -5.724 4.765 1.00 0.00 C ATOM 676 C SER A 586 -9.515 -4.266 4.591 1.00 0.00 C ATOM 677 O SER A 586 -10.669 -3.893 4.801 1.00 0.00 O ATOM 678 CB SER A 586 -8.377 -5.913 6.089 1.00 0.00 C ATOM 679 OG SER A 586 -9.214 -5.615 7.193 1.00 0.00 O ATOM 0 H SER A 586 -7.357 -6.465 3.914 1.00 0.00 H new ATOM 0 HA SER A 586 -10.025 -6.333 4.783 1.00 0.00 H new ATOM 0 HB2 SER A 586 -8.021 -6.940 6.166 1.00 0.00 H new ATOM 0 HB3 SER A 586 -7.498 -5.269 6.111 1.00 0.00 H new ATOM 0 HG SER A 586 -8.715 -5.745 8.026 1.00 0.00 H new ATOM 685 N LEU A 587 -8.550 -3.449 4.183 1.00 0.00 N ATOM 686 CA LEU A 587 -8.807 -2.031 3.954 1.00 0.00 C ATOM 687 C LEU A 587 -9.789 -1.856 2.801 1.00 0.00 C ATOM 688 O LEU A 587 -10.367 -0.783 2.625 1.00 0.00 O ATOM 689 CB LEU A 587 -7.508 -1.279 3.644 1.00 0.00 C ATOM 690 CG LEU A 587 -6.250 -1.826 4.321 1.00 0.00 C ATOM 691 CD1 LEU A 587 -5.093 -0.860 4.142 1.00 0.00 C ATOM 692 CD2 LEU A 587 -6.505 -2.088 5.799 1.00 0.00 C ATOM 0 H LEU A 587 -7.589 -3.741 4.005 1.00 0.00 H new ATOM 0 HA LEU A 587 -9.238 -1.615 4.865 1.00 0.00 H new ATOM 0 HB2 LEU A 587 -7.352 -1.289 2.565 1.00 0.00 H new ATOM 0 HB3 LEU A 587 -7.633 -0.237 3.938 1.00 0.00 H new ATOM 0 HG LEU A 587 -5.988 -2.773 3.848 1.00 0.00 H new ATOM 0 HD11 LEU A 587 -4.205 -1.262 4.629 1.00 0.00 H new ATOM 0 HD12 LEU A 587 -4.894 -0.724 3.079 1.00 0.00 H new ATOM 0 HD13 LEU A 587 -5.348 0.101 4.589 1.00 0.00 H new ATOM 0 HD21 LEU A 587 -5.598 -2.477 6.261 1.00 0.00 H new ATOM 0 HD22 LEU A 587 -6.792 -1.158 6.289 1.00 0.00 H new ATOM 0 HD23 LEU A 587 -7.308 -2.817 5.906 1.00 0.00 H new ATOM 704 N LYS A 588 -9.975 -2.930 2.025 1.00 0.00 N ATOM 705 CA LYS A 588 -10.889 -2.939 0.886 1.00 0.00 C ATOM 706 C LYS A 588 -10.181 -2.561 -0.411 1.00 0.00 C ATOM 707 O LYS A 588 -10.821 -2.086 -1.349 1.00 0.00 O ATOM 708 CB LYS A 588 -12.078 -2.001 1.124 1.00 0.00 C ATOM 709 CG LYS A 588 -13.303 -2.346 0.294 1.00 0.00 C ATOM 710 CD LYS A 588 -14.440 -1.369 0.549 1.00 0.00 C ATOM 711 CE LYS A 588 -15.393 -1.884 1.617 1.00 0.00 C ATOM 712 NZ LYS A 588 -16.729 -2.221 1.052 1.00 0.00 N ATOM 0 H LYS A 588 -9.493 -3.817 2.173 1.00 0.00 H new ATOM 0 HA LYS A 588 -11.260 -3.959 0.786 1.00 0.00 H new ATOM 0 HB2 LYS A 588 -12.346 -2.029 2.180 1.00 0.00 H new ATOM 0 HB3 LYS A 588 -11.774 -0.979 0.899 1.00 0.00 H new ATOM 0 HG2 LYS A 588 -13.042 -2.335 -0.764 1.00 0.00 H new ATOM 0 HG3 LYS A 588 -13.631 -3.358 0.531 1.00 0.00 H new ATOM 0 HD2 LYS A 588 -14.031 -0.407 0.859 1.00 0.00 H new ATOM 0 HD3 LYS A 588 -14.989 -1.199 -0.377 1.00 0.00 H new ATOM 0 HE2 LYS A 588 -14.965 -2.768 2.090 1.00 0.00 H new ATOM 0 HE3 LYS A 588 -15.508 -1.130 2.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 588 -17.349 -2.568 1.811 1.00 0.00 H new ATOM 0 HZ2 LYS A 588 -17.149 -1.372 0.623 1.00 0.00 H new ATOM 0 HZ3 LYS A 588 -16.623 -2.959 0.327 1.00 0.00 H new ATOM 726 N ILE A 589 -8.866 -2.781 -0.481 1.00 0.00 N ATOM 727 CA ILE A 589 -8.134 -2.455 -1.698 1.00 0.00 C ATOM 728 C ILE A 589 -8.378 -3.523 -2.767 1.00 0.00 C ATOM 729 O ILE A 589 -8.244 -4.719 -2.506 1.00 0.00 O ATOM 730 CB ILE A 589 -6.621 -2.296 -1.431 1.00 0.00 C ATOM 731 CG1 ILE A 589 -6.352 -0.926 -0.805 1.00 0.00 C ATOM 732 CG2 ILE A 589 -5.817 -2.461 -2.717 1.00 0.00 C ATOM 733 CD1 ILE A 589 -5.896 -0.991 0.633 1.00 0.00 C ATOM 0 H ILE A 589 -8.301 -3.174 0.272 1.00 0.00 H new ATOM 0 HA ILE A 589 -8.506 -1.497 -2.061 1.00 0.00 H new ATOM 0 HB ILE A 589 -6.305 -3.077 -0.739 1.00 0.00 H new ATOM 0 HG12 ILE A 589 -5.593 -0.411 -1.394 1.00 0.00 H new ATOM 0 HG13 ILE A 589 -7.261 -0.327 -0.861 1.00 0.00 H new ATOM 0 HG21 ILE A 589 -4.755 -2.344 -2.500 1.00 0.00 H new ATOM 0 HG22 ILE A 589 -5.995 -3.453 -3.133 1.00 0.00 H new ATOM 0 HG23 ILE A 589 -6.125 -1.704 -3.438 1.00 0.00 H new ATOM 0 HD11 ILE A 589 -5.726 0.019 1.007 1.00 0.00 H new ATOM 0 HD12 ILE A 589 -6.663 -1.477 1.236 1.00 0.00 H new ATOM 0 HD13 ILE A 589 -4.970 -1.562 0.695 1.00 0.00 H new ATOM 745 N PRO A 590 -8.754 -3.101 -3.989 1.00 0.00 N ATOM 746 CA PRO A 590 -9.032 -4.023 -5.097 1.00 0.00 C ATOM 747 C PRO A 590 -7.901 -5.017 -5.337 1.00 0.00 C ATOM 748 O PRO A 590 -6.743 -4.749 -5.015 1.00 0.00 O ATOM 749 CB PRO A 590 -9.196 -3.089 -6.298 1.00 0.00 C ATOM 750 CG PRO A 590 -9.658 -1.804 -5.705 1.00 0.00 C ATOM 751 CD PRO A 590 -8.948 -1.693 -4.385 1.00 0.00 C ATOM 0 HA PRO A 590 -9.905 -4.645 -4.898 1.00 0.00 H new ATOM 0 HB2 PRO A 590 -8.256 -2.964 -6.836 1.00 0.00 H new ATOM 0 HB3 PRO A 590 -9.921 -3.481 -7.011 1.00 0.00 H new ATOM 0 HG2 PRO A 590 -9.415 -0.962 -6.354 1.00 0.00 H new ATOM 0 HG3 PRO A 590 -10.740 -1.800 -5.570 1.00 0.00 H new ATOM 0 HD2 PRO A 590 -7.998 -1.167 -4.481 1.00 0.00 H new ATOM 0 HD3 PRO A 590 -9.542 -1.147 -3.653 1.00 0.00 H new ATOM 759 N GLU A 591 -8.250 -6.169 -5.901 1.00 0.00 N ATOM 760 CA GLU A 591 -7.273 -7.214 -6.186 1.00 0.00 C ATOM 761 C GLU A 591 -6.304 -6.777 -7.281 1.00 0.00 C ATOM 762 O GLU A 591 -5.149 -7.203 -7.307 1.00 0.00 O ATOM 763 CB GLU A 591 -7.984 -8.503 -6.602 1.00 0.00 C ATOM 764 CG GLU A 591 -7.397 -9.754 -5.966 1.00 0.00 C ATOM 765 CD GLU A 591 -6.094 -10.179 -6.611 1.00 0.00 C ATOM 766 OE1 GLU A 591 -5.060 -9.530 -6.346 1.00 0.00 O ATOM 767 OE2 GLU A 591 -6.105 -11.162 -7.382 1.00 0.00 O ATOM 0 H GLU A 591 -9.206 -6.403 -6.170 1.00 0.00 H new ATOM 0 HA GLU A 591 -6.701 -7.397 -5.277 1.00 0.00 H new ATOM 0 HB2 GLU A 591 -9.038 -8.430 -6.334 1.00 0.00 H new ATOM 0 HB3 GLU A 591 -7.937 -8.600 -7.687 1.00 0.00 H new ATOM 0 HG2 GLU A 591 -7.230 -9.573 -4.904 1.00 0.00 H new ATOM 0 HG3 GLU A 591 -8.118 -10.568 -6.042 1.00 0.00 H new ATOM 774 N GLN A 592 -6.783 -5.930 -8.185 1.00 0.00 N ATOM 775 CA GLN A 592 -5.961 -5.440 -9.285 1.00 0.00 C ATOM 776 C GLN A 592 -4.893 -4.465 -8.793 1.00 0.00 C ATOM 777 O GLN A 592 -3.925 -4.186 -9.500 1.00 0.00 O ATOM 778 CB GLN A 592 -6.838 -4.762 -10.338 1.00 0.00 C ATOM 779 CG GLN A 592 -6.121 -4.506 -11.654 1.00 0.00 C ATOM 780 CD GLN A 592 -6.722 -3.350 -12.430 1.00 0.00 C ATOM 781 OE1 GLN A 592 -7.907 -3.361 -12.763 1.00 0.00 O ATOM 782 NE2 GLN A 592 -5.905 -2.345 -12.722 1.00 0.00 N ATOM 0 H GLN A 592 -7.737 -5.568 -8.178 1.00 0.00 H new ATOM 0 HA GLN A 592 -5.457 -6.297 -9.731 1.00 0.00 H new ATOM 0 HB2 GLN A 592 -7.713 -5.385 -10.526 1.00 0.00 H new ATOM 0 HB3 GLN A 592 -7.201 -3.814 -9.941 1.00 0.00 H new ATOM 0 HG2 GLN A 592 -5.069 -4.298 -11.456 1.00 0.00 H new ATOM 0 HG3 GLN A 592 -6.158 -5.408 -12.265 1.00 0.00 H new ATOM 0 HE21 GLN A 592 -4.930 -2.378 -12.426 1.00 0.00 H new ATOM 0 HE22 GLN A 592 -6.253 -1.540 -13.243 1.00 0.00 H new ATOM 791 N PHE A 593 -5.073 -3.944 -7.581 1.00 0.00 N ATOM 792 CA PHE A 593 -4.120 -2.997 -7.012 1.00 0.00 C ATOM 793 C PHE A 593 -3.411 -3.586 -5.796 1.00 0.00 C ATOM 794 O PHE A 593 -2.234 -3.314 -5.565 1.00 0.00 O ATOM 795 CB PHE A 593 -4.829 -1.700 -6.621 1.00 0.00 C ATOM 796 CG PHE A 593 -5.661 -1.114 -7.725 1.00 0.00 C ATOM 797 CD1 PHE A 593 -7.002 -0.838 -7.525 1.00 0.00 C ATOM 798 CD2 PHE A 593 -5.100 -0.839 -8.962 1.00 0.00 C ATOM 799 CE1 PHE A 593 -7.772 -0.298 -8.538 1.00 0.00 C ATOM 800 CE2 PHE A 593 -5.865 -0.299 -9.980 1.00 0.00 C ATOM 801 CZ PHE A 593 -7.203 -0.028 -9.767 1.00 0.00 C ATOM 0 H PHE A 593 -5.866 -4.161 -6.978 1.00 0.00 H new ATOM 0 HA PHE A 593 -3.370 -2.782 -7.774 1.00 0.00 H new ATOM 0 HB2 PHE A 593 -5.467 -1.890 -5.758 1.00 0.00 H new ATOM 0 HB3 PHE A 593 -4.084 -0.968 -6.311 1.00 0.00 H new ATOM 0 HD1 PHE A 593 -7.452 -1.047 -6.566 1.00 0.00 H new ATOM 0 HD2 PHE A 593 -4.054 -1.049 -9.133 1.00 0.00 H new ATOM 0 HE1 PHE A 593 -8.818 -0.087 -8.368 1.00 0.00 H new ATOM 0 HE2 PHE A 593 -5.417 -0.089 -10.940 1.00 0.00 H new ATOM 0 HZ PHE A 593 -7.803 0.394 -10.560 1.00 0.00 H new ATOM 811 N ARG A 594 -4.131 -4.389 -5.018 1.00 0.00 N ATOM 812 CA ARG A 594 -3.558 -5.005 -3.824 1.00 0.00 C ATOM 813 C ARG A 594 -2.289 -5.787 -4.161 1.00 0.00 C ATOM 814 O ARG A 594 -1.310 -5.751 -3.415 1.00 0.00 O ATOM 815 CB ARG A 594 -4.587 -5.920 -3.147 1.00 0.00 C ATOM 816 CG ARG A 594 -4.631 -7.334 -3.712 1.00 0.00 C ATOM 817 CD ARG A 594 -5.640 -8.200 -2.972 1.00 0.00 C ATOM 818 NE ARG A 594 -6.984 -7.625 -2.997 1.00 0.00 N ATOM 819 CZ ARG A 594 -8.068 -8.258 -2.552 1.00 0.00 C ATOM 820 NH1 ARG A 594 -7.972 -9.481 -2.048 1.00 0.00 N ATOM 821 NH2 ARG A 594 -9.252 -7.664 -2.611 1.00 0.00 N ATOM 0 H ARG A 594 -5.107 -4.628 -5.191 1.00 0.00 H new ATOM 0 HA ARG A 594 -3.288 -4.208 -3.131 1.00 0.00 H new ATOM 0 HB2 ARG A 594 -4.364 -5.973 -2.081 1.00 0.00 H new ATOM 0 HB3 ARG A 594 -5.575 -5.471 -3.244 1.00 0.00 H new ATOM 0 HG2 ARG A 594 -4.890 -7.296 -4.770 1.00 0.00 H new ATOM 0 HG3 ARG A 594 -3.642 -7.786 -3.642 1.00 0.00 H new ATOM 0 HD2 ARG A 594 -5.663 -9.193 -3.421 1.00 0.00 H new ATOM 0 HD3 ARG A 594 -5.319 -8.325 -1.938 1.00 0.00 H new ATOM 0 HE ARG A 594 -7.098 -6.685 -3.377 1.00 0.00 H new ATOM 0 HH11 ARG A 594 -7.064 -9.943 -1.999 1.00 0.00 H new ATOM 0 HH12 ARG A 594 -8.806 -9.960 -1.709 1.00 0.00 H new ATOM 0 HH21 ARG A 594 -9.332 -6.723 -2.997 1.00 0.00 H new ATOM 0 HH22 ARG A 594 -10.083 -8.148 -2.270 1.00 0.00 H new ATOM 835 N HIS A 595 -2.315 -6.493 -5.287 1.00 0.00 N ATOM 836 CA HIS A 595 -1.167 -7.283 -5.718 1.00 0.00 C ATOM 837 C HIS A 595 0.019 -6.383 -6.046 1.00 0.00 C ATOM 838 O HIS A 595 1.131 -6.605 -5.564 1.00 0.00 O ATOM 839 CB HIS A 595 -1.535 -8.135 -6.934 1.00 0.00 C ATOM 840 CG HIS A 595 -1.161 -9.577 -6.789 1.00 0.00 C ATOM 841 ND1 HIS A 595 -1.261 -10.416 -5.730 1.00 0.00 N flip ATOM 842 CD2 HIS A 595 -0.611 -10.320 -7.813 1.00 0.00 C flip ATOM 843 CE1 HIS A 595 -0.774 -11.636 -6.131 1.00 0.00 C flip ATOM 844 NE2 HIS A 595 -0.390 -11.552 -7.391 1.00 0.00 N flip ATOM 0 H HIS A 595 -3.117 -6.534 -5.916 1.00 0.00 H new ATOM 0 HA HIS A 595 -0.881 -7.942 -4.899 1.00 0.00 H new ATOM 0 HB2 HIS A 595 -2.609 -8.062 -7.107 1.00 0.00 H new ATOM 0 HB3 HIS A 595 -1.042 -7.727 -7.816 1.00 0.00 H new ATOM 0 HD2 HIS A 595 -0.395 -9.952 -8.805 1.00 0.00 H new ATOM 0 HE1 HIS A 595 -0.715 -12.521 -5.515 1.00 0.00 H new ATOM 0 HE2 HIS A 595 0.010 -12.310 -7.945 1.00 0.00 H new ATOM 853 N ALA A 596 -0.224 -5.360 -6.860 1.00 0.00 N ATOM 854 CA ALA A 596 0.827 -4.424 -7.241 1.00 0.00 C ATOM 855 C ALA A 596 1.388 -3.723 -6.012 1.00 0.00 C ATOM 856 O ALA A 596 2.600 -3.702 -5.788 1.00 0.00 O ATOM 857 CB ALA A 596 0.294 -3.406 -8.238 1.00 0.00 C ATOM 0 H ALA A 596 -1.137 -5.159 -7.267 1.00 0.00 H new ATOM 0 HA ALA A 596 1.633 -4.984 -7.715 1.00 0.00 H new ATOM 0 HB1 ALA A 596 1.090 -2.714 -8.513 1.00 0.00 H new ATOM 0 HB2 ALA A 596 -0.062 -3.922 -9.130 1.00 0.00 H new ATOM 0 HB3 ALA A 596 -0.529 -2.851 -7.787 1.00 0.00 H new ATOM 863 N ILE A 597 0.492 -3.160 -5.213 1.00 0.00 N ATOM 864 CA ILE A 597 0.881 -2.467 -3.993 1.00 0.00 C ATOM 865 C ILE A 597 1.631 -3.411 -3.063 1.00 0.00 C ATOM 866 O ILE A 597 2.703 -3.080 -2.556 1.00 0.00 O ATOM 867 CB ILE A 597 -0.348 -1.890 -3.259 1.00 0.00 C ATOM 868 CG1 ILE A 597 -1.145 -0.976 -4.192 1.00 0.00 C ATOM 869 CG2 ILE A 597 0.081 -1.131 -2.012 1.00 0.00 C ATOM 870 CD1 ILE A 597 -2.570 -0.745 -3.740 1.00 0.00 C ATOM 0 H ILE A 597 -0.513 -3.170 -5.389 1.00 0.00 H new ATOM 0 HA ILE A 597 1.534 -1.641 -4.277 1.00 0.00 H new ATOM 0 HB ILE A 597 -0.987 -2.719 -2.954 1.00 0.00 H new ATOM 0 HG12 ILE A 597 -0.636 -0.015 -4.268 1.00 0.00 H new ATOM 0 HG13 ILE A 597 -1.155 -1.411 -5.191 1.00 0.00 H new ATOM 0 HG21 ILE A 597 -0.799 -0.732 -1.508 1.00 0.00 H new ATOM 0 HG22 ILE A 597 0.609 -1.806 -1.339 1.00 0.00 H new ATOM 0 HG23 ILE A 597 0.741 -0.311 -2.294 1.00 0.00 H new ATOM 0 HD11 ILE A 597 -3.075 -0.088 -4.449 1.00 0.00 H new ATOM 0 HD12 ILE A 597 -3.095 -1.699 -3.692 1.00 0.00 H new ATOM 0 HD13 ILE A 597 -2.568 -0.281 -2.754 1.00 0.00 H new ATOM 882 N TRP A 598 1.065 -4.598 -2.854 1.00 0.00 N ATOM 883 CA TRP A 598 1.684 -5.602 -1.995 1.00 0.00 C ATOM 884 C TRP A 598 3.110 -5.890 -2.454 1.00 0.00 C ATOM 885 O TRP A 598 4.029 -5.990 -1.641 1.00 0.00 O ATOM 886 CB TRP A 598 0.864 -6.892 -2.007 1.00 0.00 C ATOM 887 CG TRP A 598 1.388 -7.937 -1.069 1.00 0.00 C ATOM 888 CD1 TRP A 598 1.749 -7.760 0.236 1.00 0.00 C ATOM 889 CD2 TRP A 598 1.612 -9.320 -1.364 1.00 0.00 C ATOM 890 NE1 TRP A 598 2.184 -8.948 0.770 1.00 0.00 N ATOM 891 CE2 TRP A 598 2.109 -9.922 -0.192 1.00 0.00 C ATOM 892 CE3 TRP A 598 1.440 -10.108 -2.505 1.00 0.00 C ATOM 893 CZ2 TRP A 598 2.436 -11.274 -0.130 1.00 0.00 C ATOM 894 CZ3 TRP A 598 1.765 -11.451 -2.442 1.00 0.00 C ATOM 895 CH2 TRP A 598 2.256 -12.022 -1.262 1.00 0.00 C ATOM 0 H TRP A 598 0.179 -4.887 -3.268 1.00 0.00 H new ATOM 0 HA TRP A 598 1.713 -5.211 -0.978 1.00 0.00 H new ATOM 0 HB2 TRP A 598 -0.168 -6.661 -1.742 1.00 0.00 H new ATOM 0 HB3 TRP A 598 0.851 -7.296 -3.019 1.00 0.00 H new ATOM 0 HD1 TRP A 598 1.700 -6.823 0.770 1.00 0.00 H new ATOM 0 HE1 TRP A 598 2.510 -9.084 1.727 1.00 0.00 H new ATOM 0 HE3 TRP A 598 1.060 -9.676 -3.419 1.00 0.00 H new ATOM 0 HZ2 TRP A 598 2.818 -11.716 0.778 1.00 0.00 H new ATOM 0 HZ3 TRP A 598 1.638 -12.070 -3.318 1.00 0.00 H new ATOM 0 HH2 TRP A 598 2.498 -13.074 -1.244 1.00 0.00 H new ATOM 906 N LYS A 599 3.287 -6.009 -3.766 1.00 0.00 N ATOM 907 CA LYS A 599 4.600 -6.273 -4.339 1.00 0.00 C ATOM 908 C LYS A 599 5.572 -5.160 -3.969 1.00 0.00 C ATOM 909 O LYS A 599 6.715 -5.417 -3.591 1.00 0.00 O ATOM 910 CB LYS A 599 4.503 -6.399 -5.861 1.00 0.00 C ATOM 911 CG LYS A 599 5.744 -6.998 -6.504 1.00 0.00 C ATOM 912 CD LYS A 599 5.401 -8.200 -7.370 1.00 0.00 C ATOM 913 CE LYS A 599 6.647 -8.825 -7.975 1.00 0.00 C ATOM 914 NZ LYS A 599 6.565 -10.312 -8.003 1.00 0.00 N ATOM 0 H LYS A 599 2.537 -5.927 -4.452 1.00 0.00 H new ATOM 0 HA LYS A 599 4.971 -7.214 -3.932 1.00 0.00 H new ATOM 0 HB2 LYS A 599 3.640 -7.017 -6.112 1.00 0.00 H new ATOM 0 HB3 LYS A 599 4.323 -5.412 -6.288 1.00 0.00 H new ATOM 0 HG2 LYS A 599 6.241 -6.241 -7.111 1.00 0.00 H new ATOM 0 HG3 LYS A 599 6.448 -7.297 -5.728 1.00 0.00 H new ATOM 0 HD2 LYS A 599 4.874 -8.943 -6.771 1.00 0.00 H new ATOM 0 HD3 LYS A 599 4.723 -7.894 -8.167 1.00 0.00 H new ATOM 0 HE2 LYS A 599 6.785 -8.450 -8.989 1.00 0.00 H new ATOM 0 HE3 LYS A 599 7.522 -8.520 -7.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 599 7.434 -10.700 -8.423 1.00 0.00 H new ATOM 0 HZ2 LYS A 599 6.458 -10.672 -7.033 1.00 0.00 H new ATOM 0 HZ3 LYS A 599 5.745 -10.604 -8.573 1.00 0.00 H new ATOM 928 N GLY A 600 5.103 -3.920 -4.071 1.00 0.00 N ATOM 929 CA GLY A 600 5.939 -2.782 -3.735 1.00 0.00 C ATOM 930 C GLY A 600 6.404 -2.820 -2.293 1.00 0.00 C ATOM 931 O GLY A 600 7.561 -2.519 -1.998 1.00 0.00 O ATOM 0 H GLY A 600 4.160 -3.683 -4.380 1.00 0.00 H new ATOM 0 HA2 GLY A 600 6.807 -2.763 -4.395 1.00 0.00 H new ATOM 0 HA3 GLY A 600 5.384 -1.861 -3.912 1.00 0.00 H new ATOM 935 N ILE A 601 5.501 -3.197 -1.391 1.00 0.00 N ATOM 936 CA ILE A 601 5.828 -3.279 0.028 1.00 0.00 C ATOM 937 C ILE A 601 6.871 -4.362 0.284 1.00 0.00 C ATOM 938 O ILE A 601 7.768 -4.194 1.110 1.00 0.00 O ATOM 939 CB ILE A 601 4.576 -3.576 0.882 1.00 0.00 C ATOM 940 CG1 ILE A 601 3.460 -2.581 0.560 1.00 0.00 C ATOM 941 CG2 ILE A 601 4.919 -3.531 2.364 1.00 0.00 C ATOM 942 CD1 ILE A 601 3.847 -1.138 0.802 1.00 0.00 C ATOM 0 H ILE A 601 4.539 -3.450 -1.618 1.00 0.00 H new ATOM 0 HA ILE A 601 6.231 -2.308 0.317 1.00 0.00 H new ATOM 0 HB ILE A 601 4.224 -4.579 0.640 1.00 0.00 H new ATOM 0 HG12 ILE A 601 3.168 -2.700 -0.483 1.00 0.00 H new ATOM 0 HG13 ILE A 601 2.585 -2.820 1.165 1.00 0.00 H new ATOM 0 HG21 ILE A 601 4.025 -3.743 2.951 1.00 0.00 H new ATOM 0 HG22 ILE A 601 5.682 -4.277 2.584 1.00 0.00 H new ATOM 0 HG23 ILE A 601 5.295 -2.541 2.620 1.00 0.00 H new ATOM 0 HD11 ILE A 601 3.007 -0.489 0.552 1.00 0.00 H new ATOM 0 HD12 ILE A 601 4.111 -1.003 1.851 1.00 0.00 H new ATOM 0 HD13 ILE A 601 4.702 -0.881 0.177 1.00 0.00 H new ATOM 954 N LEU A 602 6.744 -5.476 -0.430 1.00 0.00 N ATOM 955 CA LEU A 602 7.671 -6.591 -0.281 1.00 0.00 C ATOM 956 C LEU A 602 9.078 -6.197 -0.724 1.00 0.00 C ATOM 957 O LEU A 602 10.061 -6.512 -0.054 1.00 0.00 O ATOM 958 CB LEU A 602 7.186 -7.791 -1.095 1.00 0.00 C ATOM 959 CG LEU A 602 6.134 -8.659 -0.405 1.00 0.00 C ATOM 960 CD1 LEU A 602 5.261 -9.360 -1.434 1.00 0.00 C ATOM 961 CD2 LEU A 602 6.799 -9.674 0.512 1.00 0.00 C ATOM 0 H LEU A 602 6.007 -5.630 -1.118 1.00 0.00 H new ATOM 0 HA LEU A 602 7.707 -6.863 0.774 1.00 0.00 H new ATOM 0 HB2 LEU A 602 6.775 -7.429 -2.037 1.00 0.00 H new ATOM 0 HB3 LEU A 602 8.045 -8.415 -1.341 1.00 0.00 H new ATOM 0 HG LEU A 602 5.498 -8.013 0.200 1.00 0.00 H new ATOM 0 HD11 LEU A 602 4.518 -9.973 -0.924 1.00 0.00 H new ATOM 0 HD12 LEU A 602 4.756 -8.616 -2.050 1.00 0.00 H new ATOM 0 HD13 LEU A 602 5.882 -9.994 -2.067 1.00 0.00 H new ATOM 0 HD21 LEU A 602 6.035 -10.283 0.995 1.00 0.00 H new ATOM 0 HD22 LEU A 602 7.459 -10.315 -0.073 1.00 0.00 H new ATOM 0 HD23 LEU A 602 7.380 -9.152 1.272 1.00 0.00 H new ATOM 973 N ASP A 603 9.165 -5.510 -1.858 1.00 0.00 N ATOM 974 CA ASP A 603 10.452 -5.076 -2.391 1.00 0.00 C ATOM 975 C ASP A 603 11.177 -4.168 -1.402 1.00 0.00 C ATOM 976 O ASP A 603 12.406 -4.145 -1.353 1.00 0.00 O ATOM 977 CB ASP A 603 10.256 -4.346 -3.721 1.00 0.00 C ATOM 978 CG ASP A 603 11.353 -4.660 -4.720 1.00 0.00 C ATOM 979 OD1 ASP A 603 12.539 -4.618 -4.330 1.00 0.00 O ATOM 980 OD2 ASP A 603 11.026 -4.946 -5.891 1.00 0.00 O ATOM 0 H ASP A 603 8.361 -5.242 -2.425 1.00 0.00 H new ATOM 0 HA ASP A 603 11.064 -5.963 -2.556 1.00 0.00 H new ATOM 0 HB2 ASP A 603 9.291 -4.623 -4.146 1.00 0.00 H new ATOM 0 HB3 ASP A 603 10.228 -3.271 -3.542 1.00 0.00 H new ATOM 985 N HIS A 604 10.407 -3.420 -0.619 1.00 0.00 N ATOM 986 CA HIS A 604 10.977 -2.509 0.367 1.00 0.00 C ATOM 987 C HIS A 604 11.727 -3.274 1.453 1.00 0.00 C ATOM 988 O HIS A 604 12.734 -2.800 1.977 1.00 0.00 O ATOM 989 CB HIS A 604 9.876 -1.654 0.998 1.00 0.00 C ATOM 990 CG HIS A 604 10.393 -0.437 1.699 1.00 0.00 C ATOM 991 ND1 HIS A 604 10.698 0.738 1.043 1.00 0.00 N ATOM 992 CD2 HIS A 604 10.659 -0.214 3.009 1.00 0.00 C ATOM 993 CE1 HIS A 604 11.131 1.628 1.919 1.00 0.00 C ATOM 994 NE2 HIS A 604 11.116 1.076 3.118 1.00 0.00 N ATOM 0 H HIS A 604 9.387 -3.427 -0.648 1.00 0.00 H new ATOM 0 HA HIS A 604 11.686 -1.859 -0.146 1.00 0.00 H new ATOM 0 HB2 HIS A 604 9.176 -1.346 0.221 1.00 0.00 H new ATOM 0 HB3 HIS A 604 9.317 -2.263 1.708 1.00 0.00 H new ATOM 0 HD2 HIS A 604 10.535 -0.920 3.817 1.00 0.00 H new ATOM 0 HE1 HIS A 604 11.444 2.636 1.692 1.00 0.00 H new ATOM 0 HE2 HIS A 604 11.398 1.534 3.985 1.00 0.00 H new ATOM 1003 N ARG A 605 11.228 -4.460 1.789 1.00 0.00 N ATOM 1004 CA ARG A 605 11.852 -5.288 2.813 1.00 0.00 C ATOM 1005 C ARG A 605 13.287 -5.645 2.432 1.00 0.00 C ATOM 1006 O ARG A 605 14.135 -5.856 3.299 1.00 0.00 O ATOM 1007 CB ARG A 605 11.038 -6.564 3.034 1.00 0.00 C ATOM 1008 CG ARG A 605 9.968 -6.426 4.103 1.00 0.00 C ATOM 1009 CD ARG A 605 8.936 -7.538 4.007 1.00 0.00 C ATOM 1010 NE ARG A 605 7.733 -7.110 3.299 1.00 0.00 N ATOM 1011 CZ ARG A 605 6.593 -7.799 3.289 1.00 0.00 C ATOM 1012 NH1 ARG A 605 6.498 -8.947 3.948 1.00 0.00 N ATOM 1013 NH2 ARG A 605 5.546 -7.337 2.618 1.00 0.00 N ATOM 0 H ARG A 605 10.394 -4.868 1.367 1.00 0.00 H new ATOM 0 HA ARG A 605 11.876 -4.715 3.740 1.00 0.00 H new ATOM 0 HB2 ARG A 605 10.566 -6.851 2.094 1.00 0.00 H new ATOM 0 HB3 ARG A 605 11.714 -7.373 3.311 1.00 0.00 H new ATOM 0 HG2 ARG A 605 10.433 -6.444 5.089 1.00 0.00 H new ATOM 0 HG3 ARG A 605 9.474 -5.460 4.001 1.00 0.00 H new ATOM 0 HD2 ARG A 605 9.373 -8.394 3.494 1.00 0.00 H new ATOM 0 HD3 ARG A 605 8.667 -7.870 5.010 1.00 0.00 H new ATOM 0 HE ARG A 605 7.768 -6.232 2.782 1.00 0.00 H new ATOM 0 HH11 ARG A 605 7.300 -9.306 4.466 1.00 0.00 H new ATOM 0 HH12 ARG A 605 5.623 -9.470 3.937 1.00 0.00 H new ATOM 0 HH21 ARG A 605 5.614 -6.455 2.110 1.00 0.00 H new ATOM 0 HH22 ARG A 605 4.673 -7.864 2.610 1.00 0.00 H new ATOM 1027 N GLN A 606 13.550 -5.713 1.131 1.00 0.00 N ATOM 1028 CA GLN A 606 14.881 -6.047 0.637 1.00 0.00 C ATOM 1029 C GLN A 606 15.892 -4.965 1.008 1.00 0.00 C ATOM 1030 O GLN A 606 17.080 -5.243 1.170 1.00 0.00 O ATOM 1031 CB GLN A 606 14.850 -6.233 -0.882 1.00 0.00 C ATOM 1032 CG GLN A 606 13.962 -7.380 -1.336 1.00 0.00 C ATOM 1033 CD GLN A 606 14.203 -7.765 -2.783 1.00 0.00 C ATOM 1034 OE1 GLN A 606 13.507 -7.302 -3.685 1.00 0.00 O ATOM 1035 NE2 GLN A 606 15.195 -8.619 -3.010 1.00 0.00 N ATOM 0 H GLN A 606 12.859 -5.541 0.400 1.00 0.00 H new ATOM 0 HA GLN A 606 15.191 -6.981 1.107 1.00 0.00 H new ATOM 0 HB2 GLN A 606 14.502 -5.310 -1.346 1.00 0.00 H new ATOM 0 HB3 GLN A 606 15.865 -6.407 -1.239 1.00 0.00 H new ATOM 0 HG2 GLN A 606 14.139 -8.246 -0.699 1.00 0.00 H new ATOM 0 HG3 GLN A 606 12.917 -7.099 -1.208 1.00 0.00 H new ATOM 0 HE21 GLN A 606 15.747 -8.978 -2.231 1.00 0.00 H new ATOM 0 HE22 GLN A 606 15.405 -8.916 -3.963 1.00 0.00 H new ATOM 1044 N LEU A 607 15.414 -3.731 1.139 1.00 0.00 N ATOM 1045 CA LEU A 607 16.279 -2.608 1.490 1.00 0.00 C ATOM 1046 C LEU A 607 17.006 -2.867 2.806 1.00 0.00 C ATOM 1047 O LEU A 607 18.107 -2.360 3.028 1.00 0.00 O ATOM 1048 CB LEU A 607 15.461 -1.320 1.590 1.00 0.00 C ATOM 1049 CG LEU A 607 15.059 -0.702 0.251 1.00 0.00 C ATOM 1050 CD1 LEU A 607 13.700 -0.025 0.360 1.00 0.00 C ATOM 1051 CD2 LEU A 607 16.114 0.290 -0.216 1.00 0.00 C ATOM 0 H LEU A 607 14.433 -3.483 1.008 1.00 0.00 H new ATOM 0 HA LEU A 607 17.024 -2.498 0.702 1.00 0.00 H new ATOM 0 HB2 LEU A 607 14.557 -1.525 2.164 1.00 0.00 H new ATOM 0 HB3 LEU A 607 16.036 -0.585 2.154 1.00 0.00 H new ATOM 0 HG LEU A 607 14.986 -1.500 -0.488 1.00 0.00 H new ATOM 0 HD11 LEU A 607 13.431 0.409 -0.603 1.00 0.00 H new ATOM 0 HD12 LEU A 607 12.949 -0.761 0.649 1.00 0.00 H new ATOM 0 HD13 LEU A 607 13.745 0.762 1.113 1.00 0.00 H new ATOM 0 HD21 LEU A 607 15.812 0.720 -1.171 1.00 0.00 H new ATOM 0 HD22 LEU A 607 16.219 1.084 0.523 1.00 0.00 H new ATOM 0 HD23 LEU A 607 17.068 -0.223 -0.335 1.00 0.00 H new ATOM 1063 N HIS A 608 16.386 -3.656 3.677 1.00 0.00 N ATOM 1064 CA HIS A 608 16.976 -3.979 4.972 1.00 0.00 C ATOM 1065 C HIS A 608 18.126 -4.973 4.820 1.00 0.00 C ATOM 1066 O HIS A 608 18.970 -5.098 5.708 1.00 0.00 O ATOM 1067 CB HIS A 608 15.912 -4.551 5.911 1.00 0.00 C ATOM 1068 CG HIS A 608 15.366 -3.546 6.877 1.00 0.00 C ATOM 1069 ND1 HIS A 608 14.986 -2.274 6.506 1.00 0.00 N ATOM 1070 CD2 HIS A 608 15.138 -3.631 8.210 1.00 0.00 C ATOM 1071 CE1 HIS A 608 14.548 -1.619 7.567 1.00 0.00 C ATOM 1072 NE2 HIS A 608 14.630 -2.421 8.613 1.00 0.00 N ATOM 0 H HIS A 608 15.475 -4.084 3.510 1.00 0.00 H new ATOM 0 HA HIS A 608 17.374 -3.059 5.400 1.00 0.00 H new ATOM 0 HB2 HIS A 608 15.092 -4.954 5.316 1.00 0.00 H new ATOM 0 HB3 HIS A 608 16.341 -5.384 6.469 1.00 0.00 H new ATOM 0 HD2 HIS A 608 15.322 -4.490 8.838 1.00 0.00 H new ATOM 0 HE1 HIS A 608 14.185 -0.602 7.577 1.00 0.00 H new ATOM 0 HE2 HIS A 608 14.360 -2.180 9.567 1.00 0.00 H new ATOM 1081 N GLU A 609 18.157 -5.678 3.690 1.00 0.00 N ATOM 1082 CA GLU A 609 19.206 -6.658 3.430 1.00 0.00 C ATOM 1083 C GLU A 609 19.112 -7.828 4.404 1.00 0.00 C ATOM 1084 O GLU A 609 19.648 -7.771 5.511 1.00 0.00 O ATOM 1085 CB GLU A 609 20.587 -6.002 3.527 1.00 0.00 C ATOM 1086 CG GLU A 609 21.269 -5.818 2.182 1.00 0.00 C ATOM 1087 CD GLU A 609 22.747 -5.505 2.315 1.00 0.00 C ATOM 1088 OE1 GLU A 609 23.284 -4.790 1.443 1.00 0.00 O ATOM 1089 OE2 GLU A 609 23.367 -5.977 3.292 1.00 0.00 O ATOM 0 H GLU A 609 17.469 -5.588 2.943 1.00 0.00 H new ATOM 0 HA GLU A 609 19.067 -7.040 2.419 1.00 0.00 H new ATOM 0 HB2 GLU A 609 20.485 -5.030 4.009 1.00 0.00 H new ATOM 0 HB3 GLU A 609 21.225 -6.611 4.168 1.00 0.00 H new ATOM 0 HG2 GLU A 609 21.145 -6.724 1.589 1.00 0.00 H new ATOM 0 HG3 GLU A 609 20.778 -5.011 1.637 1.00 0.00 H new ATOM 1096 N PHE A 610 18.427 -8.886 3.985 1.00 0.00 N ATOM 1097 CA PHE A 610 18.261 -10.070 4.820 1.00 0.00 C ATOM 1098 C PHE A 610 19.525 -10.925 4.808 1.00 0.00 C ATOM 1099 O PHE A 610 20.469 -10.642 4.071 1.00 0.00 O ATOM 1100 CB PHE A 610 17.068 -10.897 4.339 1.00 0.00 C ATOM 1101 CG PHE A 610 17.083 -11.169 2.862 1.00 0.00 C ATOM 1102 CD1 PHE A 610 17.894 -12.161 2.336 1.00 0.00 C ATOM 1103 CD2 PHE A 610 16.286 -10.433 2.001 1.00 0.00 C ATOM 1104 CE1 PHE A 610 17.911 -12.414 0.976 1.00 0.00 C ATOM 1105 CE2 PHE A 610 16.298 -10.680 0.641 1.00 0.00 C ATOM 1106 CZ PHE A 610 17.112 -11.673 0.129 1.00 0.00 C ATOM 0 H PHE A 610 17.977 -8.948 3.072 1.00 0.00 H new ATOM 0 HA PHE A 610 18.076 -9.740 5.842 1.00 0.00 H new ATOM 0 HB2 PHE A 610 17.054 -11.846 4.875 1.00 0.00 H new ATOM 0 HB3 PHE A 610 16.147 -10.374 4.595 1.00 0.00 H new ATOM 0 HD1 PHE A 610 18.520 -12.744 2.995 1.00 0.00 H new ATOM 0 HD2 PHE A 610 15.648 -9.657 2.397 1.00 0.00 H new ATOM 0 HE1 PHE A 610 18.548 -13.190 0.578 1.00 0.00 H new ATOM 0 HE2 PHE A 610 15.673 -10.098 -0.020 1.00 0.00 H new ATOM 0 HZ PHE A 610 17.123 -11.869 -0.933 1.00 0.00 H new ATOM 1116 N SER A 611 19.533 -11.970 5.627 1.00 0.00 N ATOM 1117 CA SER A 611 20.680 -12.868 5.711 1.00 0.00 C ATOM 1118 C SER A 611 20.345 -14.234 5.126 1.00 0.00 C ATOM 1119 O SER A 611 19.308 -14.818 5.440 1.00 0.00 O ATOM 1120 CB SER A 611 21.130 -13.019 7.165 1.00 0.00 C ATOM 1121 OG SER A 611 20.076 -13.505 7.978 1.00 0.00 O ATOM 0 H SER A 611 18.758 -12.217 6.243 1.00 0.00 H new ATOM 0 HA SER A 611 21.493 -12.434 5.129 1.00 0.00 H new ATOM 0 HB2 SER A 611 21.978 -13.702 7.217 1.00 0.00 H new ATOM 0 HB3 SER A 611 21.472 -12.056 7.545 1.00 0.00 H new ATOM 0 HG SER A 611 19.487 -14.077 7.443 1.00 0.00 H new ATOM 1127 N SER A 612 21.229 -14.742 4.273 1.00 0.00 N ATOM 1128 CA SER A 612 21.027 -16.041 3.644 1.00 0.00 C ATOM 1129 C SER A 612 22.215 -16.964 3.908 1.00 0.00 C ATOM 1130 O SER A 612 23.365 -16.525 3.894 1.00 0.00 O ATOM 1131 CB SER A 612 20.822 -15.874 2.137 1.00 0.00 C ATOM 1132 OG SER A 612 19.449 -15.712 1.824 1.00 0.00 O ATOM 0 H SER A 612 22.093 -14.273 4.002 1.00 0.00 H new ATOM 0 HA SER A 612 20.135 -16.493 4.078 1.00 0.00 H new ATOM 0 HB2 SER A 612 21.383 -15.009 1.784 1.00 0.00 H new ATOM 0 HB3 SER A 612 21.217 -16.745 1.614 1.00 0.00 H new ATOM 0 HG SER A 612 19.345 -15.606 0.855 1.00 0.00 H new ATOM 1138 N PRO A 613 21.954 -18.261 4.153 1.00 0.00 N ATOM 1139 CA PRO A 613 23.013 -19.241 4.420 1.00 0.00 C ATOM 1140 C PRO A 613 24.080 -19.251 3.330 1.00 0.00 C ATOM 1141 O PRO A 613 24.057 -18.425 2.418 1.00 0.00 O ATOM 1142 CB PRO A 613 22.268 -20.578 4.448 1.00 0.00 C ATOM 1143 CG PRO A 613 20.865 -20.224 4.802 1.00 0.00 C ATOM 1144 CD PRO A 613 20.613 -18.874 4.190 1.00 0.00 C ATOM 0 HA PRO A 613 23.548 -19.018 5.343 1.00 0.00 H new ATOM 0 HB2 PRO A 613 22.318 -21.079 3.481 1.00 0.00 H new ATOM 0 HB3 PRO A 613 22.702 -21.257 5.182 1.00 0.00 H new ATOM 0 HG2 PRO A 613 20.166 -20.965 4.415 1.00 0.00 H new ATOM 0 HG3 PRO A 613 20.731 -20.194 5.883 1.00 0.00 H new ATOM 0 HD2 PRO A 613 20.182 -18.959 3.192 1.00 0.00 H new ATOM 0 HD3 PRO A 613 19.918 -18.285 4.788 1.00 0.00 H new ATOM 1152 N SER A 614 25.013 -20.190 3.431 1.00 0.00 N ATOM 1153 CA SER A 614 26.089 -20.309 2.454 1.00 0.00 C ATOM 1154 C SER A 614 26.777 -21.666 2.563 1.00 0.00 C ATOM 1155 O SER A 614 27.975 -21.789 2.307 1.00 0.00 O ATOM 1156 CB SER A 614 27.110 -19.188 2.651 1.00 0.00 C ATOM 1157 OG SER A 614 27.874 -19.394 3.827 1.00 0.00 O ATOM 0 H SER A 614 25.046 -20.881 4.180 1.00 0.00 H new ATOM 0 HA SER A 614 25.653 -20.223 1.459 1.00 0.00 H new ATOM 0 HB2 SER A 614 27.773 -19.140 1.787 1.00 0.00 H new ATOM 0 HB3 SER A 614 26.595 -18.229 2.712 1.00 0.00 H new ATOM 0 HG SER A 614 28.520 -18.665 3.929 1.00 0.00 H new ATOM 1163 N HIS A 615 26.011 -22.682 2.946 1.00 0.00 N ATOM 1164 CA HIS A 615 26.546 -24.031 3.090 1.00 0.00 C ATOM 1165 C HIS A 615 25.594 -25.059 2.486 1.00 0.00 C ATOM 1166 O HIS A 615 24.379 -24.862 2.472 1.00 0.00 O ATOM 1167 CB HIS A 615 26.790 -24.350 4.566 1.00 0.00 C ATOM 1168 CG HIS A 615 25.604 -24.086 5.439 1.00 0.00 C ATOM 1169 ND1 HIS A 615 25.410 -22.894 6.106 1.00 0.00 N ATOM 1170 CD2 HIS A 615 24.543 -24.867 5.754 1.00 0.00 C ATOM 1171 CE1 HIS A 615 24.283 -22.954 6.792 1.00 0.00 C ATOM 1172 NE2 HIS A 615 23.738 -24.140 6.596 1.00 0.00 N ATOM 0 H HIS A 615 25.018 -22.597 3.162 1.00 0.00 H new ATOM 0 HA HIS A 615 27.494 -24.080 2.554 1.00 0.00 H new ATOM 0 HB2 HIS A 615 27.074 -25.398 4.661 1.00 0.00 H new ATOM 0 HB3 HIS A 615 27.633 -23.758 4.923 1.00 0.00 H new ATOM 0 HD2 HIS A 615 24.364 -25.874 5.407 1.00 0.00 H new ATOM 0 HE1 HIS A 615 23.876 -22.166 7.409 1.00 0.00 H new ATOM 0 HE2 HIS A 615 22.861 -24.464 7.004 1.00 0.00 H new ATOM 1181 N LEU A 616 26.156 -26.156 1.987 1.00 0.00 N ATOM 1182 CA LEU A 616 25.357 -27.215 1.381 1.00 0.00 C ATOM 1183 C LEU A 616 25.509 -28.521 2.155 1.00 0.00 C ATOM 1184 O LEU A 616 26.496 -29.239 1.993 1.00 0.00 O ATOM 1185 CB LEU A 616 25.769 -27.423 -0.078 1.00 0.00 C ATOM 1186 CG LEU A 616 24.668 -27.969 -0.989 1.00 0.00 C ATOM 1187 CD1 LEU A 616 23.704 -26.860 -1.383 1.00 0.00 C ATOM 1188 CD2 LEU A 616 25.274 -28.615 -2.225 1.00 0.00 C ATOM 0 H LEU A 616 27.160 -26.334 1.990 1.00 0.00 H new ATOM 0 HA LEU A 616 24.311 -26.912 1.416 1.00 0.00 H new ATOM 0 HB2 LEU A 616 26.115 -26.471 -0.481 1.00 0.00 H new ATOM 0 HB3 LEU A 616 26.616 -28.108 -0.106 1.00 0.00 H new ATOM 0 HG LEU A 616 24.111 -28.729 -0.441 1.00 0.00 H new ATOM 0 HD11 LEU A 616 22.927 -27.266 -2.031 1.00 0.00 H new ATOM 0 HD12 LEU A 616 23.246 -26.440 -0.487 1.00 0.00 H new ATOM 0 HD13 LEU A 616 24.247 -26.078 -1.914 1.00 0.00 H new ATOM 0 HD21 LEU A 616 24.478 -28.998 -2.863 1.00 0.00 H new ATOM 0 HD22 LEU A 616 25.855 -27.874 -2.775 1.00 0.00 H new ATOM 0 HD23 LEU A 616 25.925 -29.436 -1.924 1.00 0.00 H new ATOM 1200 N LEU A 617 24.525 -28.823 2.996 1.00 0.00 N ATOM 1201 CA LEU A 617 24.549 -30.042 3.795 1.00 0.00 C ATOM 1202 C LEU A 617 24.225 -31.260 2.937 1.00 0.00 C ATOM 1203 O LEU A 617 24.959 -32.248 2.941 1.00 0.00 O ATOM 1204 CB LEU A 617 23.555 -29.936 4.956 1.00 0.00 C ATOM 1205 CG LEU A 617 24.154 -30.174 6.343 1.00 0.00 C ATOM 1206 CD1 LEU A 617 24.693 -31.592 6.455 1.00 0.00 C ATOM 1207 CD2 LEU A 617 25.251 -29.160 6.630 1.00 0.00 C ATOM 0 H LEU A 617 23.701 -28.240 3.142 1.00 0.00 H new ATOM 0 HA LEU A 617 25.554 -30.164 4.199 1.00 0.00 H new ATOM 0 HB2 LEU A 617 23.102 -28.945 4.937 1.00 0.00 H new ATOM 0 HB3 LEU A 617 22.753 -30.656 4.795 1.00 0.00 H new ATOM 0 HG LEU A 617 23.366 -30.047 7.086 1.00 0.00 H new ATOM 0 HD11 LEU A 617 25.115 -31.743 7.448 1.00 0.00 H new ATOM 0 HD12 LEU A 617 23.883 -32.303 6.293 1.00 0.00 H new ATOM 0 HD13 LEU A 617 25.468 -31.747 5.704 1.00 0.00 H new ATOM 0 HD21 LEU A 617 25.666 -29.344 7.621 1.00 0.00 H new ATOM 0 HD22 LEU A 617 26.039 -29.255 5.883 1.00 0.00 H new ATOM 0 HD23 LEU A 617 24.835 -28.153 6.592 1.00 0.00 H new ATOM 1219 N ARG A 618 23.120 -31.183 2.200 1.00 0.00 N ATOM 1220 CA ARG A 618 22.700 -32.279 1.337 1.00 0.00 C ATOM 1221 C ARG A 618 22.449 -33.547 2.148 1.00 0.00 C ATOM 1222 O ARG A 618 23.386 -34.179 2.635 1.00 0.00 O ATOM 1223 CB ARG A 618 23.757 -32.546 0.263 1.00 0.00 C ATOM 1224 CG ARG A 618 23.581 -31.700 -0.987 1.00 0.00 C ATOM 1225 CD ARG A 618 24.628 -32.034 -2.037 1.00 0.00 C ATOM 1226 NE ARG A 618 24.102 -31.907 -3.394 1.00 0.00 N ATOM 1227 CZ ARG A 618 23.139 -32.680 -3.891 1.00 0.00 C ATOM 1228 NH1 ARG A 618 22.594 -33.635 -3.148 1.00 0.00 N ATOM 1229 NH2 ARG A 618 22.720 -32.498 -5.137 1.00 0.00 N ATOM 0 H ARG A 618 22.501 -30.373 2.184 1.00 0.00 H new ATOM 0 HA ARG A 618 21.767 -31.989 0.854 1.00 0.00 H new ATOM 0 HB2 ARG A 618 24.745 -32.358 0.683 1.00 0.00 H new ATOM 0 HB3 ARG A 618 23.724 -33.600 -0.014 1.00 0.00 H new ATOM 0 HG2 ARG A 618 22.585 -31.862 -1.400 1.00 0.00 H new ATOM 0 HG3 ARG A 618 23.650 -30.644 -0.726 1.00 0.00 H new ATOM 0 HD2 ARG A 618 25.486 -31.372 -1.917 1.00 0.00 H new ATOM 0 HD3 ARG A 618 24.986 -33.051 -1.881 1.00 0.00 H new ATOM 0 HE ARG A 618 24.496 -31.184 -3.996 1.00 0.00 H new ATOM 0 HH11 ARG A 618 22.913 -33.780 -2.190 1.00 0.00 H new ATOM 0 HH12 ARG A 618 21.856 -34.224 -3.535 1.00 0.00 H new ATOM 0 HH21 ARG A 618 23.136 -31.766 -5.713 1.00 0.00 H new ATOM 0 HH22 ARG A 618 21.982 -33.090 -5.519 1.00 0.00 H new ATOM 1243 N THR A 619 21.179 -33.911 2.289 1.00 0.00 N ATOM 1244 CA THR A 619 20.804 -35.102 3.042 1.00 0.00 C ATOM 1245 C THR A 619 20.361 -36.223 2.104 1.00 0.00 C ATOM 1246 O THR A 619 19.837 -35.967 1.020 1.00 0.00 O ATOM 1247 CB THR A 619 19.684 -34.774 4.029 1.00 0.00 C ATOM 1248 OG1 THR A 619 18.460 -34.562 3.346 1.00 0.00 O ATOM 1249 CG2 THR A 619 19.961 -33.544 4.864 1.00 0.00 C ATOM 0 H THR A 619 20.392 -33.398 1.892 1.00 0.00 H new ATOM 0 HA THR A 619 21.679 -35.442 3.596 1.00 0.00 H new ATOM 0 HB THR A 619 19.623 -35.637 4.692 1.00 0.00 H new ATOM 0 HG1 THR A 619 17.755 -34.355 3.995 1.00 0.00 H new ATOM 0 HG21 THR A 619 19.126 -33.369 5.542 1.00 0.00 H new ATOM 0 HG22 THR A 619 20.873 -33.694 5.442 1.00 0.00 H new ATOM 0 HG23 THR A 619 20.084 -32.681 4.210 1.00 0.00 H new ATOM 1257 N PRO A 620 20.567 -37.488 2.511 1.00 0.00 N ATOM 1258 CA PRO A 620 20.186 -38.650 1.701 1.00 0.00 C ATOM 1259 C PRO A 620 18.731 -38.588 1.250 1.00 0.00 C ATOM 1260 O PRO A 620 18.442 -38.550 0.054 1.00 0.00 O ATOM 1261 CB PRO A 620 20.403 -39.832 2.650 1.00 0.00 C ATOM 1262 CG PRO A 620 21.429 -39.358 3.618 1.00 0.00 C ATOM 1263 CD PRO A 620 21.187 -37.883 3.790 1.00 0.00 C ATOM 0 HA PRO A 620 20.767 -38.714 0.781 1.00 0.00 H new ATOM 0 HB2 PRO A 620 19.478 -40.107 3.157 1.00 0.00 H new ATOM 0 HB3 PRO A 620 20.746 -40.715 2.110 1.00 0.00 H new ATOM 0 HG2 PRO A 620 21.339 -39.882 4.570 1.00 0.00 H new ATOM 0 HG3 PRO A 620 22.435 -39.547 3.244 1.00 0.00 H new ATOM 0 HD2 PRO A 620 20.530 -37.679 4.635 1.00 0.00 H new ATOM 0 HD3 PRO A 620 22.116 -37.342 3.971 1.00 0.00 H new ATOM 1271 N SER A 621 17.817 -38.579 2.215 1.00 0.00 N ATOM 1272 CA SER A 621 16.391 -38.522 1.917 1.00 0.00 C ATOM 1273 C SER A 621 15.588 -38.156 3.161 1.00 0.00 C ATOM 1274 O SER A 621 14.681 -37.326 3.106 1.00 0.00 O ATOM 1275 CB SER A 621 15.911 -39.865 1.363 1.00 0.00 C ATOM 1276 OG SER A 621 14.767 -39.701 0.544 1.00 0.00 O ATOM 0 H SER A 621 18.039 -38.610 3.210 1.00 0.00 H new ATOM 0 HA SER A 621 16.233 -37.749 1.165 1.00 0.00 H new ATOM 0 HB2 SER A 621 16.711 -40.330 0.787 1.00 0.00 H new ATOM 0 HB3 SER A 621 15.678 -40.539 2.187 1.00 0.00 H new ATOM 0 HG SER A 621 14.482 -40.574 0.202 1.00 0.00 H new ATOM 1282 N SER A 622 15.931 -38.780 4.284 1.00 0.00 N ATOM 1283 CA SER A 622 15.242 -38.519 5.543 1.00 0.00 C ATOM 1284 C SER A 622 15.998 -37.485 6.372 1.00 0.00 C ATOM 1285 O SER A 622 15.351 -36.798 7.191 1.00 0.00 O ATOM 1286 CB SER A 622 15.087 -39.816 6.341 1.00 0.00 C ATOM 1287 OG SER A 622 14.263 -39.620 7.476 1.00 0.00 O ATOM 1288 OXT SER A 622 17.229 -37.371 6.195 1.00 0.00 O ATOM 0 H SER A 622 16.681 -39.469 4.348 1.00 0.00 H new ATOM 0 HA SER A 622 14.254 -38.121 5.313 1.00 0.00 H new ATOM 0 HB2 SER A 622 14.657 -40.589 5.704 1.00 0.00 H new ATOM 0 HB3 SER A 622 16.068 -40.172 6.657 1.00 0.00 H new ATOM 0 HG SER A 622 14.178 -40.463 7.968 1.00 0.00 H new TER 1294 SER A 622