USER MOD reduce.3.24.130724 H: found=0, std=0, add=1048, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1049 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 Single : A 502 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 504 THR OG1 : rot 133:sc= 0.577 USER MOD Single : A 506 MET CE :methyl -146:sc= -0.116 (180deg=-0.6) USER MOD Single : A 510 LYS NZ :NH3+ 178:sc= 1.3 (180deg=1.27) USER MOD Single : A 513 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 516 SER OG : rot 11:sc= -0.723! USER MOD Single : A 517 MET CE :methyl -160:sc= -1.81 (180deg=-3.32) USER MOD Single : A 523 GLN : amide:sc= -0.472 X(o=-0.47,f=-0.17) USER MOD Single : A 524 SER OG : rot 71:sc= 1.19 USER MOD Single : A 528 THR OG1 : rot 180:sc= 0 USER MOD Single : A 530 THR OG1 : rot 180:sc= 0 USER MOD Single : A 532 ASN : amide:sc= -0.176 X(o=-0.18,f=-0.18) USER MOD Single : A 537 TYR OH : rot 180:sc= 0 USER MOD Single : A 538 THR OG1 : rot 104:sc= 1.59 USER MOD Single : A 543 THR OG1 : rot 180:sc= -0.781 USER MOD Single : A 544 ASN :FLIP amide:sc= -0.0155 F(o=-1.4!,f=-0.015) USER MOD Single : A 556 SER OG : rot 94:sc= 1.2 USER MOD Single : A 563 LYS NZ :NH3+ -158:sc= 0.852 (180deg=0.53) USER MOD Single : A 567 ASN : amide:sc= 0 X(o=0,f=-0.43) USER MOD Single : A 570 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0368) USER MOD Single : A 571 TYR OH : rot -20:sc= 0.0244 USER MOD Single : A 572 HIS :FLIP no HD1:sc= -3.64! C(o=-7.6!,f=-3.6!) USER MOD Single : A 580 SER OG : rot -61:sc= 1 USER MOD Single : A 590 LYS NZ :NH3+ -167:sc= -0.0439 (180deg=-0.243) USER MOD Single : A 591 SER OG : rot -66:sc= 0.373 USER MOD Single : A 593 GLN : amide:sc= -0.394 K(o=-0.39,f=-1.2) USER MOD Single : A 596 LYS NZ :NH3+ -164:sc= 0.136 (180deg=-0.0855) USER MOD Single : A 600 SER OG : rot 180:sc= -0.858 USER MOD Single : A 602 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 603 ASN : amide:sc=-0.00453 X(o=-0.0045,f=-0.063) USER MOD Single : A 604 ASN :FLIP amide:sc= -0.0624 F(o=-1,f=-0.062) USER MOD Single : A 607 SER OG : rot 180:sc= 0 USER MOD Single : A 609 ASN : amide:sc= -9.42! C(o=-9.4!,f=-14!) USER MOD Single : A 610 LYS NZ :NH3+ 173:sc= 0.675 (180deg=0.546) USER MOD Single : A 619 MET CE :methyl 153:sc= -0.286 (180deg=-1.3) USER MOD Single : A 621 THR OG1 : rot -33:sc= 0.0626 USER MOD Single : A 622 ASN : amide:sc= -5.03! C(o=-5!,f=-15!) USER MOD Single : A 626 HIS : no HD1:sc= -0.559 K(o=-0.56,f=-7.5!) USER MOD Single : A 629 THR OG1 : rot 180:sc= 0.00486 USER MOD Single : A 630 ASN : amide:sc= -4.98! C(o=-5!,f=-5.2!) USER MOD Single : A 633 GLN : amide:sc= -0.504 K(o=-0.5,f=-1.7) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 500 -2.293 -14.738 12.296 1.00 0.00 N ATOM 2 CA ALA A 500 -1.150 -13.920 12.760 1.00 0.00 C ATOM 3 C ALA A 500 -0.478 -13.210 11.590 1.00 0.00 C ATOM 4 O ALA A 500 0.527 -12.523 11.766 1.00 0.00 O ATOM 5 CB ALA A 500 -0.139 -14.780 13.514 1.00 0.00 C ATOM 0 HA ALA A 500 -1.535 -13.163 13.443 1.00 0.00 H new ATOM 0 HB1 ALA A 500 0.692 -14.158 13.846 1.00 0.00 H new ATOM 0 HB2 ALA A 500 -0.621 -15.233 14.380 1.00 0.00 H new ATOM 0 HB3 ALA A 500 0.235 -15.564 12.855 1.00 0.00 H new ATOM 13 N GLY A 501 -1.036 -13.369 10.394 1.00 0.00 N ATOM 14 CA GLY A 501 -0.467 -12.726 9.227 1.00 0.00 C ATOM 15 C GLY A 501 0.312 -13.689 8.356 1.00 0.00 C ATOM 16 O GLY A 501 1.061 -13.269 7.475 1.00 0.00 O ATOM 0 H GLY A 501 -1.869 -13.930 10.214 1.00 0.00 H new ATOM 0 HA2 GLY A 501 -1.266 -12.275 8.639 1.00 0.00 H new ATOM 0 HA3 GLY A 501 0.190 -11.917 9.546 1.00 0.00 H new ATOM 20 N MET A 502 0.144 -14.981 8.609 1.00 0.00 N ATOM 21 CA MET A 502 0.808 -16.006 7.819 1.00 0.00 C ATOM 22 C MET A 502 0.074 -16.210 6.504 1.00 0.00 C ATOM 23 O MET A 502 -0.918 -16.937 6.435 1.00 0.00 O ATOM 24 CB MET A 502 0.885 -17.318 8.603 1.00 0.00 C ATOM 25 CG MET A 502 1.514 -18.469 7.823 1.00 0.00 C ATOM 26 SD MET A 502 1.654 -19.982 8.798 1.00 0.00 S ATOM 27 CE MET A 502 2.319 -21.125 7.582 1.00 0.00 C ATOM 0 H MET A 502 -0.448 -15.343 9.357 1.00 0.00 H new ATOM 0 HA MET A 502 1.825 -15.678 7.602 1.00 0.00 H new ATOM 0 HB2 MET A 502 1.460 -17.152 9.514 1.00 0.00 H new ATOM 0 HB3 MET A 502 -0.121 -17.606 8.909 1.00 0.00 H new ATOM 0 HG2 MET A 502 0.916 -18.669 6.934 1.00 0.00 H new ATOM 0 HG3 MET A 502 2.505 -18.171 7.480 1.00 0.00 H new ATOM 0 HE1 MET A 502 2.459 -22.104 8.041 1.00 0.00 H new ATOM 0 HE2 MET A 502 1.625 -21.212 6.746 1.00 0.00 H new ATOM 0 HE3 MET A 502 3.278 -20.754 7.220 1.00 0.00 H new ATOM 37 N GLY A 503 0.565 -15.550 5.472 1.00 0.00 N ATOM 38 CA GLY A 503 -0.082 -15.589 4.185 1.00 0.00 C ATOM 39 C GLY A 503 0.585 -14.670 3.198 1.00 0.00 C ATOM 40 O GLY A 503 1.800 -14.461 3.240 1.00 0.00 O ATOM 0 H GLY A 503 1.411 -14.981 5.505 1.00 0.00 H new ATOM 0 HA2 GLY A 503 -0.066 -16.609 3.801 1.00 0.00 H new ATOM 0 HA3 GLY A 503 -1.129 -15.306 4.295 1.00 0.00 H new ATOM 44 N THR A 504 -0.212 -14.108 2.314 1.00 0.00 N ATOM 45 CA THR A 504 0.288 -13.187 1.321 1.00 0.00 C ATOM 46 C THR A 504 0.201 -11.756 1.834 1.00 0.00 C ATOM 47 O THR A 504 -0.087 -11.526 3.006 1.00 0.00 O ATOM 48 CB THR A 504 -0.517 -13.294 0.015 1.00 0.00 C ATOM 49 OG1 THR A 504 -1.898 -13.001 0.268 1.00 0.00 O ATOM 50 CG2 THR A 504 -0.397 -14.681 -0.597 1.00 0.00 C ATOM 0 H THR A 504 -1.217 -14.276 2.265 1.00 0.00 H new ATOM 0 HA THR A 504 1.328 -13.448 1.124 1.00 0.00 H new ATOM 0 HB THR A 504 -0.109 -12.571 -0.691 1.00 0.00 H new ATOM 0 HG1 THR A 504 -2.226 -12.366 -0.403 1.00 0.00 H new ATOM 0 HG21 THR A 504 -0.977 -14.723 -1.519 1.00 0.00 H new ATOM 0 HG22 THR A 504 0.649 -14.892 -0.817 1.00 0.00 H new ATOM 0 HG23 THR A 504 -0.777 -15.423 0.106 1.00 0.00 H new ATOM 58 N VAL A 505 0.480 -10.810 0.948 1.00 0.00 N ATOM 59 CA VAL A 505 0.265 -9.398 1.194 1.00 0.00 C ATOM 60 C VAL A 505 -1.140 -9.120 1.732 1.00 0.00 C ATOM 61 O VAL A 505 -1.353 -8.164 2.459 1.00 0.00 O ATOM 62 CB VAL A 505 0.468 -8.594 -0.097 1.00 0.00 C ATOM 63 CG1 VAL A 505 1.937 -8.441 -0.442 1.00 0.00 C ATOM 64 CG2 VAL A 505 -0.270 -9.234 -1.253 1.00 0.00 C ATOM 0 H VAL A 505 0.868 -11.009 0.026 1.00 0.00 H new ATOM 0 HA VAL A 505 0.992 -9.092 1.946 1.00 0.00 H new ATOM 0 HB VAL A 505 0.058 -7.599 0.079 1.00 0.00 H new ATOM 0 HG11 VAL A 505 2.037 -7.866 -1.363 1.00 0.00 H new ATOM 0 HG12 VAL A 505 2.449 -7.921 0.368 1.00 0.00 H new ATOM 0 HG13 VAL A 505 2.383 -9.426 -0.580 1.00 0.00 H new ATOM 0 HG21 VAL A 505 -0.111 -8.646 -2.157 1.00 0.00 H new ATOM 0 HG22 VAL A 505 0.104 -10.246 -1.408 1.00 0.00 H new ATOM 0 HG23 VAL A 505 -1.336 -9.272 -1.028 1.00 0.00 H new ATOM 74 N MET A 506 -2.100 -9.946 1.349 1.00 0.00 N ATOM 75 CA MET A 506 -3.435 -9.870 1.920 1.00 0.00 C ATOM 76 C MET A 506 -3.423 -10.278 3.391 1.00 0.00 C ATOM 77 O MET A 506 -3.938 -9.556 4.244 1.00 0.00 O ATOM 78 CB MET A 506 -4.400 -10.777 1.152 1.00 0.00 C ATOM 79 CG MET A 506 -4.854 -10.221 -0.185 1.00 0.00 C ATOM 80 SD MET A 506 -5.704 -8.639 -0.040 1.00 0.00 S ATOM 81 CE MET A 506 -7.102 -9.091 0.987 1.00 0.00 C ATOM 0 H MET A 506 -1.980 -10.676 0.646 1.00 0.00 H new ATOM 0 HA MET A 506 -3.770 -8.836 1.842 1.00 0.00 H new ATOM 0 HB2 MET A 506 -3.919 -11.741 0.986 1.00 0.00 H new ATOM 0 HB3 MET A 506 -5.277 -10.961 1.772 1.00 0.00 H new ATOM 0 HG2 MET A 506 -3.988 -10.103 -0.836 1.00 0.00 H new ATOM 0 HG3 MET A 506 -5.517 -10.941 -0.665 1.00 0.00 H new ATOM 0 HE1 MET A 506 -7.971 -8.500 0.699 1.00 0.00 H new ATOM 0 HE2 MET A 506 -7.323 -10.150 0.855 1.00 0.00 H new ATOM 0 HE3 MET A 506 -6.863 -8.898 2.033 1.00 0.00 H new ATOM 91 N ASP A 507 -2.824 -11.430 3.692 1.00 0.00 N ATOM 92 CA ASP A 507 -2.868 -11.968 5.045 1.00 0.00 C ATOM 93 C ASP A 507 -1.987 -11.158 5.987 1.00 0.00 C ATOM 94 O ASP A 507 -2.275 -11.057 7.177 1.00 0.00 O ATOM 95 CB ASP A 507 -2.432 -13.428 5.058 1.00 0.00 C ATOM 96 CG ASP A 507 -3.195 -14.245 6.080 1.00 0.00 C ATOM 97 OD1 ASP A 507 -2.843 -14.200 7.271 1.00 0.00 O1- ATOM 98 OD2 ASP A 507 -4.164 -14.932 5.687 1.00 0.00 O ATOM 0 H ASP A 507 -2.308 -12.001 3.023 1.00 0.00 H new ATOM 0 HA ASP A 507 -3.899 -11.902 5.393 1.00 0.00 H new ATOM 0 HB2 ASP A 507 -2.580 -13.858 4.068 1.00 0.00 H new ATOM 0 HB3 ASP A 507 -1.365 -13.485 5.274 1.00 0.00 H new ATOM 103 N VAL A 508 -0.917 -10.570 5.448 1.00 0.00 N ATOM 104 CA VAL A 508 -0.033 -9.717 6.251 1.00 0.00 C ATOM 105 C VAL A 508 -0.811 -8.566 6.866 1.00 0.00 C ATOM 106 O VAL A 508 -0.557 -8.149 7.996 1.00 0.00 O ATOM 107 CB VAL A 508 1.166 -9.194 5.433 1.00 0.00 C ATOM 108 CG1 VAL A 508 0.759 -8.134 4.462 1.00 0.00 C ATOM 109 CG2 VAL A 508 2.278 -8.695 6.341 1.00 0.00 C ATOM 0 H VAL A 508 -0.642 -10.666 4.470 1.00 0.00 H new ATOM 0 HA VAL A 508 0.370 -10.333 7.055 1.00 0.00 H new ATOM 0 HB VAL A 508 1.549 -10.036 4.857 1.00 0.00 H new ATOM 0 HG11 VAL A 508 1.633 -7.794 3.907 1.00 0.00 H new ATOM 0 HG12 VAL A 508 0.024 -8.540 3.767 1.00 0.00 H new ATOM 0 HG13 VAL A 508 0.323 -7.294 5.002 1.00 0.00 H new ATOM 0 HG21 VAL A 508 3.108 -8.333 5.734 1.00 0.00 H new ATOM 0 HG22 VAL A 508 1.903 -7.883 6.964 1.00 0.00 H new ATOM 0 HG23 VAL A 508 2.622 -9.511 6.977 1.00 0.00 H new ATOM 119 N LEU A 509 -1.779 -8.090 6.121 1.00 0.00 N ATOM 120 CA LEU A 509 -2.658 -7.017 6.583 1.00 0.00 C ATOM 121 C LEU A 509 -3.762 -7.574 7.470 1.00 0.00 C ATOM 122 O LEU A 509 -4.194 -6.937 8.430 1.00 0.00 O ATOM 123 CB LEU A 509 -3.273 -6.297 5.387 1.00 0.00 C ATOM 124 CG LEU A 509 -2.322 -6.113 4.210 1.00 0.00 C ATOM 125 CD1 LEU A 509 -2.955 -5.268 3.120 1.00 0.00 C ATOM 126 CD2 LEU A 509 -0.997 -5.535 4.682 1.00 0.00 C ATOM 0 H LEU A 509 -1.988 -8.426 5.181 1.00 0.00 H new ATOM 0 HA LEU A 509 -2.065 -6.311 7.164 1.00 0.00 H new ATOM 0 HB2 LEU A 509 -4.146 -6.856 5.050 1.00 0.00 H new ATOM 0 HB3 LEU A 509 -3.627 -5.318 5.710 1.00 0.00 H new ATOM 0 HG LEU A 509 -2.119 -7.091 3.774 1.00 0.00 H new ATOM 0 HD11 LEU A 509 -2.253 -5.154 2.294 1.00 0.00 H new ATOM 0 HD12 LEU A 509 -3.861 -5.756 2.761 1.00 0.00 H new ATOM 0 HD13 LEU A 509 -3.206 -4.286 3.521 1.00 0.00 H new ATOM 0 HD21 LEU A 509 -0.330 -5.410 3.829 1.00 0.00 H new ATOM 0 HD22 LEU A 509 -1.169 -4.567 5.153 1.00 0.00 H new ATOM 0 HD23 LEU A 509 -0.541 -6.213 5.403 1.00 0.00 H new ATOM 138 N LYS A 510 -4.192 -8.785 7.140 1.00 0.00 N ATOM 139 CA LYS A 510 -5.286 -9.457 7.831 1.00 0.00 C ATOM 140 C LYS A 510 -4.901 -9.780 9.275 1.00 0.00 C ATOM 141 O LYS A 510 -5.763 -9.915 10.147 1.00 0.00 O ATOM 142 CB LYS A 510 -5.630 -10.753 7.084 1.00 0.00 C ATOM 143 CG LYS A 510 -6.841 -11.496 7.624 1.00 0.00 C ATOM 144 CD LYS A 510 -6.876 -12.931 7.122 1.00 0.00 C ATOM 145 CE LYS A 510 -6.852 -13.000 5.606 1.00 0.00 C ATOM 146 NZ LYS A 510 -6.704 -14.396 5.123 1.00 0.00 N1+ ATOM 0 H LYS A 510 -3.789 -9.333 6.380 1.00 0.00 H new ATOM 0 HA LYS A 510 -6.152 -8.795 7.849 1.00 0.00 H new ATOM 0 HB2 LYS A 510 -5.805 -10.516 6.035 1.00 0.00 H new ATOM 0 HB3 LYS A 510 -4.767 -11.418 7.121 1.00 0.00 H new ATOM 0 HG2 LYS A 510 -6.818 -11.490 8.714 1.00 0.00 H new ATOM 0 HG3 LYS A 510 -7.752 -10.980 7.321 1.00 0.00 H new ATOM 0 HD2 LYS A 510 -6.023 -13.477 7.524 1.00 0.00 H new ATOM 0 HD3 LYS A 510 -7.774 -13.424 7.494 1.00 0.00 H new ATOM 0 HE2 LYS A 510 -7.772 -12.572 5.207 1.00 0.00 H new ATOM 0 HE3 LYS A 510 -6.029 -12.394 5.227 1.00 0.00 H new ATOM 0 HZ1 LYS A 510 -6.726 -14.408 4.083 1.00 0.00 H new ATOM 0 HZ2 LYS A 510 -5.798 -14.784 5.455 1.00 0.00 H new ATOM 0 HZ3 LYS A 510 -7.485 -14.976 5.492 1.00 0.00 H new ATOM 160 N GLY A 511 -3.603 -9.904 9.518 1.00 0.00 N ATOM 161 CA GLY A 511 -3.129 -10.298 10.823 1.00 0.00 C ATOM 162 C GLY A 511 -2.596 -9.146 11.653 1.00 0.00 C ATOM 163 O GLY A 511 -2.126 -9.359 12.773 1.00 0.00 O ATOM 0 H GLY A 511 -2.870 -9.737 8.829 1.00 0.00 H new ATOM 0 HA2 GLY A 511 -3.943 -10.778 11.365 1.00 0.00 H new ATOM 0 HA3 GLY A 511 -2.342 -11.043 10.704 1.00 0.00 H new ATOM 167 N ASP A 512 -2.656 -7.929 11.124 1.00 0.00 N ATOM 168 CA ASP A 512 -2.134 -6.775 11.855 1.00 0.00 C ATOM 169 C ASP A 512 -3.257 -5.842 12.295 1.00 0.00 C ATOM 170 O ASP A 512 -4.221 -5.619 11.559 1.00 0.00 O ATOM 171 CB ASP A 512 -1.117 -6.002 11.013 1.00 0.00 C ATOM 172 CG ASP A 512 -0.305 -5.037 11.856 1.00 0.00 C ATOM 173 OD1 ASP A 512 -0.754 -3.887 12.044 1.00 0.00 O1- ATOM 174 OD2 ASP A 512 0.775 -5.437 12.350 1.00 0.00 O ATOM 0 H ASP A 512 -3.053 -7.715 10.209 1.00 0.00 H new ATOM 0 HA ASP A 512 -1.633 -7.158 12.744 1.00 0.00 H new ATOM 0 HB2 ASP A 512 -0.447 -6.704 10.517 1.00 0.00 H new ATOM 0 HB3 ASP A 512 -1.637 -5.451 10.230 1.00 0.00 H new ATOM 179 N ASN A 513 -3.119 -5.287 13.495 1.00 0.00 N ATOM 180 CA ASN A 513 -4.143 -4.416 14.070 1.00 0.00 C ATOM 181 C ASN A 513 -4.142 -3.032 13.430 1.00 0.00 C ATOM 182 O ASN A 513 -5.158 -2.342 13.434 1.00 0.00 O ATOM 183 CB ASN A 513 -3.958 -4.270 15.585 1.00 0.00 C ATOM 184 CG ASN A 513 -4.324 -5.527 16.348 1.00 0.00 C ATOM 185 OD1 ASN A 513 -3.484 -6.390 16.595 1.00 0.00 O ATOM 186 ND2 ASN A 513 -5.584 -5.632 16.738 1.00 0.00 N ATOM 0 H ASN A 513 -2.304 -5.425 14.092 1.00 0.00 H new ATOM 0 HA ASN A 513 -5.102 -4.891 13.866 1.00 0.00 H new ATOM 0 HB2 ASN A 513 -2.920 -4.012 15.796 1.00 0.00 H new ATOM 0 HB3 ASN A 513 -4.571 -3.443 15.943 1.00 0.00 H new ATOM 0 HD21 ASN A 513 -5.889 -6.451 17.264 1.00 0.00 H new ATOM 0 HD22 ASN A 513 -6.251 -4.894 16.513 1.00 0.00 H new ATOM 193 N ARG A 514 -3.014 -2.627 12.865 1.00 0.00 N ATOM 194 CA ARG A 514 -2.895 -1.289 12.302 1.00 0.00 C ATOM 195 C ARG A 514 -3.375 -1.276 10.858 1.00 0.00 C ATOM 196 O ARG A 514 -3.629 -0.219 10.283 1.00 0.00 O ATOM 197 CB ARG A 514 -1.449 -0.796 12.394 1.00 0.00 C ATOM 198 CG ARG A 514 -0.931 -0.773 13.822 1.00 0.00 C ATOM 199 CD ARG A 514 0.499 -0.270 13.909 1.00 0.00 C ATOM 200 NE ARG A 514 1.023 -0.398 15.269 1.00 0.00 N ATOM 201 CZ ARG A 514 2.200 0.072 15.675 1.00 0.00 C ATOM 202 NH1 ARG A 514 2.985 0.750 14.843 1.00 0.00 N1+ ATOM 203 NH2 ARG A 514 2.589 -0.139 16.921 1.00 0.00 N ATOM 0 H ARG A 514 -2.174 -3.200 12.784 1.00 0.00 H new ATOM 0 HA ARG A 514 -3.525 -0.613 12.880 1.00 0.00 H new ATOM 0 HB2 ARG A 514 -0.810 -1.440 11.790 1.00 0.00 H new ATOM 0 HB3 ARG A 514 -1.383 0.206 11.971 1.00 0.00 H new ATOM 0 HG2 ARG A 514 -1.575 -0.137 14.429 1.00 0.00 H new ATOM 0 HG3 ARG A 514 -0.987 -1.777 14.242 1.00 0.00 H new ATOM 0 HD2 ARG A 514 1.128 -0.833 13.220 1.00 0.00 H new ATOM 0 HD3 ARG A 514 0.540 0.774 13.597 1.00 0.00 H new ATOM 0 HE ARG A 514 0.445 -0.882 15.955 1.00 0.00 H new ATOM 0 HH11 ARG A 514 2.687 0.915 13.881 1.00 0.00 H new ATOM 0 HH12 ARG A 514 3.885 1.105 15.166 1.00 0.00 H new ATOM 0 HH21 ARG A 514 1.989 -0.658 17.562 1.00 0.00 H new ATOM 0 HH22 ARG A 514 3.489 0.217 17.241 1.00 0.00 H new ATOM 217 N PHE A 515 -3.501 -2.460 10.276 1.00 0.00 N ATOM 218 CA PHE A 515 -4.007 -2.594 8.926 1.00 0.00 C ATOM 219 C PHE A 515 -5.396 -3.218 8.926 1.00 0.00 C ATOM 220 O PHE A 515 -5.943 -3.529 7.873 1.00 0.00 O ATOM 221 CB PHE A 515 -3.066 -3.459 8.094 1.00 0.00 C ATOM 222 CG PHE A 515 -1.673 -2.914 7.977 1.00 0.00 C ATOM 223 CD1 PHE A 515 -1.456 -1.581 7.670 1.00 0.00 C ATOM 224 CD2 PHE A 515 -0.577 -3.738 8.184 1.00 0.00 C ATOM 225 CE1 PHE A 515 -0.175 -1.081 7.566 1.00 0.00 C ATOM 226 CE2 PHE A 515 0.708 -3.243 8.080 1.00 0.00 C ATOM 227 CZ PHE A 515 0.909 -1.912 7.773 1.00 0.00 C ATOM 0 H PHE A 515 -3.257 -3.343 10.724 1.00 0.00 H new ATOM 0 HA PHE A 515 -4.068 -1.597 8.490 1.00 0.00 H new ATOM 0 HB2 PHE A 515 -3.019 -4.454 8.536 1.00 0.00 H new ATOM 0 HB3 PHE A 515 -3.485 -3.574 7.094 1.00 0.00 H new ATOM 0 HD1 PHE A 515 -2.300 -0.926 7.510 1.00 0.00 H new ATOM 0 HD2 PHE A 515 -0.730 -4.779 8.429 1.00 0.00 H new ATOM 0 HE1 PHE A 515 -0.019 -0.040 7.323 1.00 0.00 H new ATOM 0 HE2 PHE A 515 1.554 -3.896 8.238 1.00 0.00 H new ATOM 0 HZ PHE A 515 1.913 -1.521 7.695 1.00 0.00 H new ATOM 237 N SER A 516 -5.973 -3.375 10.113 1.00 0.00 N ATOM 238 CA SER A 516 -7.244 -4.074 10.263 1.00 0.00 C ATOM 239 C SER A 516 -8.358 -3.449 9.421 1.00 0.00 C ATOM 240 O SER A 516 -9.089 -4.160 8.732 1.00 0.00 O ATOM 241 CB SER A 516 -7.655 -4.118 11.734 1.00 0.00 C ATOM 242 OG SER A 516 -6.718 -4.855 12.500 1.00 0.00 O ATOM 0 H SER A 516 -5.579 -3.027 10.987 1.00 0.00 H new ATOM 0 HA SER A 516 -7.096 -5.090 9.897 1.00 0.00 H new ATOM 0 HB2 SER A 516 -7.732 -3.103 12.125 1.00 0.00 H new ATOM 0 HB3 SER A 516 -8.642 -4.571 11.826 1.00 0.00 H new ATOM 0 HG SER A 516 -5.917 -5.026 11.961 1.00 0.00 H new ATOM 248 N MET A 517 -8.485 -2.124 9.449 1.00 0.00 N ATOM 249 CA MET A 517 -9.562 -1.468 8.714 1.00 0.00 C ATOM 250 C MET A 517 -9.239 -1.436 7.220 1.00 0.00 C ATOM 251 O MET A 517 -10.135 -1.351 6.379 1.00 0.00 O ATOM 252 CB MET A 517 -9.790 -0.049 9.229 1.00 0.00 C ATOM 253 CG MET A 517 -11.206 0.454 8.984 1.00 0.00 C ATOM 254 SD MET A 517 -11.248 2.191 8.519 1.00 0.00 S ATOM 255 CE MET A 517 -10.455 2.088 6.918 1.00 0.00 C ATOM 0 H MET A 517 -7.868 -1.494 9.962 1.00 0.00 H new ATOM 0 HA MET A 517 -10.476 -2.041 8.870 1.00 0.00 H new ATOM 0 HB2 MET A 517 -9.580 -0.019 10.298 1.00 0.00 H new ATOM 0 HB3 MET A 517 -9.083 0.625 8.746 1.00 0.00 H new ATOM 0 HG2 MET A 517 -11.668 -0.141 8.197 1.00 0.00 H new ATOM 0 HG3 MET A 517 -11.801 0.308 9.885 1.00 0.00 H new ATOM 0 HE1 MET A 517 -10.075 3.070 6.636 1.00 0.00 H new ATOM 0 HE2 MET A 517 -9.628 1.379 6.966 1.00 0.00 H new ATOM 0 HE3 MET A 517 -11.178 1.752 6.175 1.00 0.00 H new ATOM 265 N LEU A 518 -7.945 -1.510 6.910 1.00 0.00 N ATOM 266 CA LEU A 518 -7.460 -1.575 5.533 1.00 0.00 C ATOM 267 C LEU A 518 -8.012 -2.809 4.847 1.00 0.00 C ATOM 268 O LEU A 518 -8.498 -2.745 3.716 1.00 0.00 O ATOM 269 CB LEU A 518 -5.929 -1.610 5.541 1.00 0.00 C ATOM 270 CG LEU A 518 -5.236 -1.859 4.198 1.00 0.00 C ATOM 271 CD1 LEU A 518 -5.599 -0.799 3.173 1.00 0.00 C ATOM 272 CD2 LEU A 518 -3.730 -1.913 4.397 1.00 0.00 C ATOM 0 H LEU A 518 -7.202 -1.527 7.609 1.00 0.00 H new ATOM 0 HA LEU A 518 -7.797 -0.696 4.984 1.00 0.00 H new ATOM 0 HB2 LEU A 518 -5.570 -0.660 5.938 1.00 0.00 H new ATOM 0 HB3 LEU A 518 -5.611 -2.387 6.236 1.00 0.00 H new ATOM 0 HG LEU A 518 -5.584 -2.817 3.812 1.00 0.00 H new ATOM 0 HD11 LEU A 518 -5.088 -1.011 2.234 1.00 0.00 H new ATOM 0 HD12 LEU A 518 -6.677 -0.805 3.009 1.00 0.00 H new ATOM 0 HD13 LEU A 518 -5.294 0.181 3.539 1.00 0.00 H new ATOM 0 HD21 LEU A 518 -3.242 -2.090 3.438 1.00 0.00 H new ATOM 0 HD22 LEU A 518 -3.383 -0.966 4.811 1.00 0.00 H new ATOM 0 HD23 LEU A 518 -3.483 -2.722 5.085 1.00 0.00 H new ATOM 284 N VAL A 519 -7.948 -3.919 5.563 1.00 0.00 N ATOM 285 CA VAL A 519 -8.466 -5.200 5.072 1.00 0.00 C ATOM 286 C VAL A 519 -9.913 -5.056 4.629 1.00 0.00 C ATOM 287 O VAL A 519 -10.296 -5.507 3.554 1.00 0.00 O ATOM 288 CB VAL A 519 -8.406 -6.303 6.150 1.00 0.00 C ATOM 289 CG1 VAL A 519 -8.614 -7.676 5.528 1.00 0.00 C ATOM 290 CG2 VAL A 519 -7.097 -6.242 6.913 1.00 0.00 C ATOM 0 H VAL A 519 -7.539 -3.966 6.496 1.00 0.00 H new ATOM 0 HA VAL A 519 -7.833 -5.487 4.233 1.00 0.00 H new ATOM 0 HB VAL A 519 -9.215 -6.130 6.860 1.00 0.00 H new ATOM 0 HG11 VAL A 519 -8.568 -8.438 6.306 1.00 0.00 H new ATOM 0 HG12 VAL A 519 -9.589 -7.711 5.042 1.00 0.00 H new ATOM 0 HG13 VAL A 519 -7.834 -7.863 4.790 1.00 0.00 H new ATOM 0 HG21 VAL A 519 -7.078 -7.029 7.667 1.00 0.00 H new ATOM 0 HG22 VAL A 519 -6.266 -6.382 6.222 1.00 0.00 H new ATOM 0 HG23 VAL A 519 -7.004 -5.271 7.400 1.00 0.00 H new ATOM 300 N ALA A 520 -10.705 -4.407 5.469 1.00 0.00 N ATOM 301 CA ALA A 520 -12.125 -4.197 5.194 1.00 0.00 C ATOM 302 C ALA A 520 -12.339 -3.359 3.928 1.00 0.00 C ATOM 303 O ALA A 520 -13.325 -3.551 3.215 1.00 0.00 O ATOM 304 CB ALA A 520 -12.790 -3.538 6.392 1.00 0.00 C ATOM 0 H ALA A 520 -10.388 -4.012 6.355 1.00 0.00 H new ATOM 0 HA ALA A 520 -12.584 -5.170 5.019 1.00 0.00 H new ATOM 0 HB1 ALA A 520 -13.848 -3.384 6.181 1.00 0.00 H new ATOM 0 HB2 ALA A 520 -12.684 -4.180 7.266 1.00 0.00 H new ATOM 0 HB3 ALA A 520 -12.315 -2.577 6.588 1.00 0.00 H new ATOM 310 N ALA A 521 -11.423 -2.436 3.644 1.00 0.00 N ATOM 311 CA ALA A 521 -11.508 -1.642 2.422 1.00 0.00 C ATOM 312 C ALA A 521 -11.176 -2.508 1.217 1.00 0.00 C ATOM 313 O ALA A 521 -11.907 -2.526 0.230 1.00 0.00 O ATOM 314 CB ALA A 521 -10.578 -0.441 2.486 1.00 0.00 C ATOM 0 H ALA A 521 -10.621 -2.221 4.237 1.00 0.00 H new ATOM 0 HA ALA A 521 -12.528 -1.271 2.322 1.00 0.00 H new ATOM 0 HB1 ALA A 521 -10.661 0.133 1.563 1.00 0.00 H new ATOM 0 HB2 ALA A 521 -10.855 0.189 3.331 1.00 0.00 H new ATOM 0 HB3 ALA A 521 -9.550 -0.783 2.609 1.00 0.00 H new ATOM 320 N ILE A 522 -10.075 -3.241 1.323 1.00 0.00 N ATOM 321 CA ILE A 522 -9.665 -4.187 0.289 1.00 0.00 C ATOM 322 C ILE A 522 -10.779 -5.195 0.034 1.00 0.00 C ATOM 323 O ILE A 522 -11.046 -5.589 -1.103 1.00 0.00 O ATOM 324 CB ILE A 522 -8.394 -4.942 0.718 1.00 0.00 C ATOM 325 CG1 ILE A 522 -7.307 -3.949 1.124 1.00 0.00 C ATOM 326 CG2 ILE A 522 -7.901 -5.841 -0.407 1.00 0.00 C ATOM 327 CD1 ILE A 522 -6.165 -4.576 1.887 1.00 0.00 C ATOM 0 H ILE A 522 -9.443 -3.198 2.123 1.00 0.00 H new ATOM 0 HA ILE A 522 -9.458 -3.626 -0.623 1.00 0.00 H new ATOM 0 HB ILE A 522 -8.634 -5.570 1.576 1.00 0.00 H new ATOM 0 HG12 ILE A 522 -6.913 -3.469 0.228 1.00 0.00 H new ATOM 0 HG13 ILE A 522 -7.754 -3.165 1.736 1.00 0.00 H new ATOM 0 HG21 ILE A 522 -7.002 -6.367 -0.085 1.00 0.00 H new ATOM 0 HG22 ILE A 522 -8.675 -6.566 -0.659 1.00 0.00 H new ATOM 0 HG23 ILE A 522 -7.673 -5.235 -1.284 1.00 0.00 H new ATOM 0 HD11 ILE A 522 -5.433 -3.810 2.141 1.00 0.00 H new ATOM 0 HD12 ILE A 522 -6.545 -5.032 2.801 1.00 0.00 H new ATOM 0 HD13 ILE A 522 -5.692 -5.340 1.270 1.00 0.00 H new ATOM 339 N GLN A 523 -11.421 -5.596 1.119 1.00 0.00 N ATOM 340 CA GLN A 523 -12.553 -6.483 1.092 1.00 0.00 C ATOM 341 C GLN A 523 -13.682 -5.894 0.271 1.00 0.00 C ATOM 342 O GLN A 523 -14.218 -6.533 -0.638 1.00 0.00 O ATOM 343 CB GLN A 523 -13.023 -6.671 2.519 1.00 0.00 C ATOM 344 CG GLN A 523 -14.169 -7.628 2.654 1.00 0.00 C ATOM 345 CD GLN A 523 -13.843 -9.012 2.124 1.00 0.00 C ATOM 346 OE1 GLN A 523 -13.424 -9.890 2.876 1.00 0.00 O ATOM 347 NE2 GLN A 523 -13.982 -9.199 0.814 1.00 0.00 N ATOM 0 H GLN A 523 -11.157 -5.303 2.060 1.00 0.00 H new ATOM 0 HA GLN A 523 -12.264 -7.432 0.640 1.00 0.00 H new ATOM 0 HB2 GLN A 523 -12.189 -7.029 3.123 1.00 0.00 H new ATOM 0 HB3 GLN A 523 -13.319 -5.704 2.925 1.00 0.00 H new ATOM 0 HG2 GLN A 523 -14.452 -7.703 3.704 1.00 0.00 H new ATOM 0 HG3 GLN A 523 -15.032 -7.233 2.118 1.00 0.00 H new ATOM 0 HE21 GLN A 523 -14.333 -8.444 0.225 1.00 0.00 H new ATOM 0 HE22 GLN A 523 -13.737 -10.098 0.398 1.00 0.00 H new ATOM 356 N SER A 524 -14.043 -4.676 0.626 1.00 0.00 N ATOM 357 CA SER A 524 -15.093 -3.941 -0.067 1.00 0.00 C ATOM 358 C SER A 524 -14.747 -3.761 -1.544 1.00 0.00 C ATOM 359 O SER A 524 -15.633 -3.653 -2.391 1.00 0.00 O ATOM 360 CB SER A 524 -15.303 -2.578 0.596 1.00 0.00 C ATOM 361 OG SER A 524 -15.574 -2.723 1.981 1.00 0.00 O ATOM 0 H SER A 524 -13.620 -4.165 1.401 1.00 0.00 H new ATOM 0 HA SER A 524 -16.017 -4.516 -0.001 1.00 0.00 H new ATOM 0 HB2 SER A 524 -14.415 -1.962 0.458 1.00 0.00 H new ATOM 0 HB3 SER A 524 -16.130 -2.058 0.112 1.00 0.00 H new ATOM 0 HG SER A 524 -14.760 -3.010 2.445 1.00 0.00 H new ATOM 367 N ALA A 525 -13.456 -3.745 -1.844 1.00 0.00 N ATOM 368 CA ALA A 525 -12.986 -3.627 -3.214 1.00 0.00 C ATOM 369 C ALA A 525 -13.074 -4.967 -3.944 1.00 0.00 C ATOM 370 O ALA A 525 -13.239 -5.008 -5.164 1.00 0.00 O ATOM 371 CB ALA A 525 -11.558 -3.103 -3.229 1.00 0.00 C ATOM 0 H ALA A 525 -12.712 -3.813 -1.150 1.00 0.00 H new ATOM 0 HA ALA A 525 -13.629 -2.920 -3.739 1.00 0.00 H new ATOM 0 HB1 ALA A 525 -11.213 -3.017 -4.259 1.00 0.00 H new ATOM 0 HB2 ALA A 525 -11.525 -2.123 -2.752 1.00 0.00 H new ATOM 0 HB3 ALA A 525 -10.912 -3.793 -2.686 1.00 0.00 H new ATOM 377 N GLY A 526 -12.972 -6.064 -3.190 1.00 0.00 N ATOM 378 CA GLY A 526 -13.070 -7.390 -3.773 1.00 0.00 C ATOM 379 C GLY A 526 -11.940 -7.719 -4.734 1.00 0.00 C ATOM 380 O GLY A 526 -12.145 -8.451 -5.702 1.00 0.00 O ATOM 0 H GLY A 526 -12.823 -6.054 -2.181 1.00 0.00 H new ATOM 0 HA2 GLY A 526 -13.081 -8.129 -2.972 1.00 0.00 H new ATOM 0 HA3 GLY A 526 -14.020 -7.476 -4.300 1.00 0.00 H new ATOM 384 N LEU A 527 -10.746 -7.190 -4.478 1.00 0.00 N ATOM 385 CA LEU A 527 -9.595 -7.496 -5.321 1.00 0.00 C ATOM 386 C LEU A 527 -8.688 -8.511 -4.637 1.00 0.00 C ATOM 387 O LEU A 527 -7.496 -8.596 -4.933 1.00 0.00 O ATOM 388 CB LEU A 527 -8.823 -6.218 -5.705 1.00 0.00 C ATOM 389 CG LEU A 527 -8.420 -5.262 -4.564 1.00 0.00 C ATOM 390 CD1 LEU A 527 -7.206 -5.781 -3.806 1.00 0.00 C ATOM 391 CD2 LEU A 527 -8.138 -3.869 -5.118 1.00 0.00 C ATOM 0 H LEU A 527 -10.552 -6.555 -3.704 1.00 0.00 H new ATOM 0 HA LEU A 527 -9.961 -7.939 -6.247 1.00 0.00 H new ATOM 0 HB2 LEU A 527 -7.916 -6.518 -6.230 1.00 0.00 H new ATOM 0 HB3 LEU A 527 -9.431 -5.658 -6.415 1.00 0.00 H new ATOM 0 HG LEU A 527 -9.254 -5.207 -3.864 1.00 0.00 H new ATOM 0 HD11 LEU A 527 -6.949 -5.083 -3.009 1.00 0.00 H new ATOM 0 HD12 LEU A 527 -7.435 -6.756 -3.375 1.00 0.00 H new ATOM 0 HD13 LEU A 527 -6.363 -5.876 -4.490 1.00 0.00 H new ATOM 0 HD21 LEU A 527 -7.855 -3.204 -4.302 1.00 0.00 H new ATOM 0 HD22 LEU A 527 -7.325 -3.923 -5.842 1.00 0.00 H new ATOM 0 HD23 LEU A 527 -9.033 -3.484 -5.606 1.00 0.00 H new ATOM 403 N THR A 528 -9.279 -9.290 -3.739 1.00 0.00 N ATOM 404 CA THR A 528 -8.560 -10.302 -2.978 1.00 0.00 C ATOM 405 C THR A 528 -7.651 -11.149 -3.858 1.00 0.00 C ATOM 406 O THR A 528 -6.459 -11.239 -3.596 1.00 0.00 O ATOM 407 CB THR A 528 -9.548 -11.215 -2.234 1.00 0.00 C ATOM 408 OG1 THR A 528 -10.405 -10.414 -1.413 1.00 0.00 O ATOM 409 CG2 THR A 528 -8.821 -12.245 -1.374 1.00 0.00 C ATOM 0 H THR A 528 -10.273 -9.237 -3.518 1.00 0.00 H new ATOM 0 HA THR A 528 -7.933 -9.773 -2.261 1.00 0.00 H new ATOM 0 HB THR A 528 -10.138 -11.757 -2.974 1.00 0.00 H new ATOM 0 HG1 THR A 528 -11.038 -10.993 -0.938 1.00 0.00 H new ATOM 0 HG21 THR A 528 -9.551 -12.873 -0.863 1.00 0.00 H new ATOM 0 HG22 THR A 528 -8.188 -12.867 -2.008 1.00 0.00 H new ATOM 0 HG23 THR A 528 -8.204 -11.732 -0.636 1.00 0.00 H new ATOM 417 N GLU A 529 -8.202 -11.726 -4.921 1.00 0.00 N ATOM 418 CA GLU A 529 -7.451 -12.651 -5.768 1.00 0.00 C ATOM 419 C GLU A 529 -6.174 -12.006 -6.312 1.00 0.00 C ATOM 420 O GLU A 529 -5.188 -12.695 -6.564 1.00 0.00 O ATOM 421 CB GLU A 529 -8.322 -13.151 -6.922 1.00 0.00 C ATOM 422 CG GLU A 529 -7.657 -14.228 -7.771 1.00 0.00 C ATOM 423 CD GLU A 529 -7.410 -15.518 -7.012 1.00 0.00 C ATOM 424 OE1 GLU A 529 -6.496 -15.555 -6.163 1.00 0.00 O ATOM 425 OE2 GLU A 529 -8.114 -16.512 -7.277 1.00 0.00 O1- ATOM 0 H GLU A 529 -9.165 -11.571 -5.218 1.00 0.00 H new ATOM 0 HA GLU A 529 -7.161 -13.500 -5.149 1.00 0.00 H new ATOM 0 HB2 GLU A 529 -9.255 -13.544 -6.517 1.00 0.00 H new ATOM 0 HB3 GLU A 529 -8.583 -12.307 -7.561 1.00 0.00 H new ATOM 0 HG2 GLU A 529 -8.284 -14.438 -8.637 1.00 0.00 H new ATOM 0 HG3 GLU A 529 -6.708 -13.849 -8.149 1.00 0.00 H new ATOM 432 N THR A 530 -6.181 -10.686 -6.473 1.00 0.00 N ATOM 433 CA THR A 530 -5.000 -9.978 -6.937 1.00 0.00 C ATOM 434 C THR A 530 -3.829 -10.189 -5.974 1.00 0.00 C ATOM 435 O THR A 530 -2.746 -10.608 -6.382 1.00 0.00 O ATOM 436 CB THR A 530 -5.270 -8.467 -7.087 1.00 0.00 C ATOM 437 OG1 THR A 530 -6.393 -8.247 -7.950 1.00 0.00 O ATOM 438 CG2 THR A 530 -4.054 -7.751 -7.651 1.00 0.00 C ATOM 0 H THR A 530 -6.989 -10.091 -6.289 1.00 0.00 H new ATOM 0 HA THR A 530 -4.744 -10.385 -7.915 1.00 0.00 H new ATOM 0 HB THR A 530 -5.487 -8.066 -6.097 1.00 0.00 H new ATOM 0 HG1 THR A 530 -6.556 -7.284 -8.036 1.00 0.00 H new ATOM 0 HG21 THR A 530 -4.270 -6.687 -7.747 1.00 0.00 H new ATOM 0 HG22 THR A 530 -3.206 -7.890 -6.980 1.00 0.00 H new ATOM 0 HG23 THR A 530 -3.812 -8.162 -8.631 1.00 0.00 H new ATOM 446 N LEU A 531 -4.063 -9.923 -4.692 1.00 0.00 N ATOM 447 CA LEU A 531 -3.005 -10.001 -3.692 1.00 0.00 C ATOM 448 C LEU A 531 -2.995 -11.345 -2.961 1.00 0.00 C ATOM 449 O LEU A 531 -2.087 -11.625 -2.181 1.00 0.00 O ATOM 450 CB LEU A 531 -3.153 -8.873 -2.675 1.00 0.00 C ATOM 451 CG LEU A 531 -2.814 -7.472 -3.175 1.00 0.00 C ATOM 452 CD1 LEU A 531 -2.840 -6.504 -2.003 1.00 0.00 C ATOM 453 CD2 LEU A 531 -1.453 -7.452 -3.860 1.00 0.00 C ATOM 0 H LEU A 531 -4.974 -9.652 -4.323 1.00 0.00 H new ATOM 0 HA LEU A 531 -2.059 -9.902 -4.223 1.00 0.00 H new ATOM 0 HB2 LEU A 531 -4.181 -8.869 -2.314 1.00 0.00 H new ATOM 0 HB3 LEU A 531 -2.515 -9.096 -1.820 1.00 0.00 H new ATOM 0 HG LEU A 531 -3.557 -7.167 -3.912 1.00 0.00 H new ATOM 0 HD11 LEU A 531 -2.598 -5.501 -2.354 1.00 0.00 H new ATOM 0 HD12 LEU A 531 -3.834 -6.502 -1.555 1.00 0.00 H new ATOM 0 HD13 LEU A 531 -2.107 -6.814 -1.259 1.00 0.00 H new ATOM 0 HD21 LEU A 531 -1.235 -6.442 -4.207 1.00 0.00 H new ATOM 0 HD22 LEU A 531 -0.685 -7.766 -3.153 1.00 0.00 H new ATOM 0 HD23 LEU A 531 -1.464 -8.134 -4.711 1.00 0.00 H new ATOM 465 N ASN A 532 -4.008 -12.162 -3.189 1.00 0.00 N ATOM 466 CA ASN A 532 -4.127 -13.444 -2.503 1.00 0.00 C ATOM 467 C ASN A 532 -3.490 -14.552 -3.333 1.00 0.00 C ATOM 468 O ASN A 532 -3.292 -15.675 -2.869 1.00 0.00 O ATOM 469 CB ASN A 532 -5.608 -13.714 -2.211 1.00 0.00 C ATOM 470 CG ASN A 532 -5.937 -15.136 -1.892 1.00 0.00 C ATOM 471 OD1 ASN A 532 -5.775 -15.598 -0.763 1.00 0.00 O ATOM 472 ND2 ASN A 532 -6.442 -15.821 -2.878 1.00 0.00 N ATOM 0 H ASN A 532 -4.764 -11.963 -3.845 1.00 0.00 H new ATOM 0 HA ASN A 532 -3.591 -13.416 -1.555 1.00 0.00 H new ATOM 0 HB2 ASN A 532 -5.918 -13.088 -1.374 1.00 0.00 H new ATOM 0 HB3 ASN A 532 -6.196 -13.405 -3.075 1.00 0.00 H new ATOM 0 HD21 ASN A 532 -6.725 -16.790 -2.733 1.00 0.00 H new ATOM 0 HD22 ASN A 532 -6.554 -15.388 -3.795 1.00 0.00 H new ATOM 479 N ARG A 533 -3.138 -14.217 -4.559 1.00 0.00 N ATOM 480 CA ARG A 533 -2.468 -15.154 -5.438 1.00 0.00 C ATOM 481 C ARG A 533 -0.955 -14.956 -5.330 1.00 0.00 C ATOM 482 O ARG A 533 -0.494 -13.892 -4.912 1.00 0.00 O ATOM 483 CB ARG A 533 -2.949 -14.951 -6.882 1.00 0.00 C ATOM 484 CG ARG A 533 -2.538 -16.064 -7.828 1.00 0.00 C ATOM 485 CD ARG A 533 -3.089 -17.412 -7.377 1.00 0.00 C ATOM 486 NE ARG A 533 -4.547 -17.485 -7.464 1.00 0.00 N ATOM 487 CZ ARG A 533 -5.218 -18.612 -7.709 1.00 0.00 C ATOM 488 NH1 ARG A 533 -4.570 -19.772 -7.771 1.00 0.00 N1+ ATOM 489 NH2 ARG A 533 -6.541 -18.586 -7.844 1.00 0.00 N ATOM 0 H ARG A 533 -3.306 -13.299 -4.970 1.00 0.00 H new ATOM 0 HA ARG A 533 -2.708 -16.175 -5.142 1.00 0.00 H new ATOM 0 HB2 ARG A 533 -4.036 -14.868 -6.884 1.00 0.00 H new ATOM 0 HB3 ARG A 533 -2.556 -14.006 -7.256 1.00 0.00 H new ATOM 0 HG2 ARG A 533 -2.897 -15.840 -8.832 1.00 0.00 H new ATOM 0 HG3 ARG A 533 -1.450 -16.114 -7.882 1.00 0.00 H new ATOM 0 HD2 ARG A 533 -2.653 -18.201 -7.990 1.00 0.00 H new ATOM 0 HD3 ARG A 533 -2.781 -17.600 -6.348 1.00 0.00 H new ATOM 0 HE ARG A 533 -5.081 -16.626 -7.330 1.00 0.00 H new ATOM 0 HH11 ARG A 533 -3.560 -19.800 -7.631 1.00 0.00 H new ATOM 0 HH12 ARG A 533 -5.083 -20.633 -7.958 1.00 0.00 H new ATOM 0 HH21 ARG A 533 -7.045 -17.703 -7.760 1.00 0.00 H new ATOM 0 HH22 ARG A 533 -7.052 -19.449 -8.031 1.00 0.00 H new ATOM 503 N GLU A 534 -0.187 -15.980 -5.686 1.00 0.00 N ATOM 504 CA GLU A 534 1.263 -15.914 -5.581 1.00 0.00 C ATOM 505 C GLU A 534 1.852 -15.096 -6.726 1.00 0.00 C ATOM 506 O GLU A 534 1.298 -15.053 -7.827 1.00 0.00 O ATOM 507 CB GLU A 534 1.871 -17.321 -5.575 1.00 0.00 C ATOM 508 CG GLU A 534 3.387 -17.323 -5.461 1.00 0.00 C ATOM 509 CD GLU A 534 3.983 -18.710 -5.526 1.00 0.00 C ATOM 510 OE1 GLU A 534 4.061 -19.275 -6.636 1.00 0.00 O1- ATOM 511 OE2 GLU A 534 4.384 -19.240 -4.468 1.00 0.00 O ATOM 0 H GLU A 534 -0.545 -16.863 -6.049 1.00 0.00 H new ATOM 0 HA GLU A 534 1.509 -15.423 -4.639 1.00 0.00 H new ATOM 0 HB2 GLU A 534 1.451 -17.887 -4.744 1.00 0.00 H new ATOM 0 HB3 GLU A 534 1.582 -17.838 -6.490 1.00 0.00 H new ATOM 0 HG2 GLU A 534 3.807 -16.715 -6.263 1.00 0.00 H new ATOM 0 HG3 GLU A 534 3.676 -16.853 -4.521 1.00 0.00 H new ATOM 518 N GLY A 535 2.974 -14.451 -6.448 1.00 0.00 N ATOM 519 CA GLY A 535 3.655 -13.649 -7.437 1.00 0.00 C ATOM 520 C GLY A 535 4.668 -12.743 -6.781 1.00 0.00 C ATOM 521 O GLY A 535 5.262 -13.109 -5.766 1.00 0.00 O ATOM 0 H GLY A 535 3.431 -14.472 -5.536 1.00 0.00 H new ATOM 0 HA2 GLY A 535 4.152 -14.297 -8.159 1.00 0.00 H new ATOM 0 HA3 GLY A 535 2.930 -13.052 -7.991 1.00 0.00 H new ATOM 525 N VAL A 536 4.861 -11.564 -7.346 1.00 0.00 N ATOM 526 CA VAL A 536 5.750 -10.578 -6.759 1.00 0.00 C ATOM 527 C VAL A 536 5.030 -9.237 -6.653 1.00 0.00 C ATOM 528 O VAL A 536 4.470 -8.752 -7.632 1.00 0.00 O ATOM 529 CB VAL A 536 7.053 -10.420 -7.585 1.00 0.00 C ATOM 530 CG1 VAL A 536 7.916 -11.672 -7.477 1.00 0.00 C ATOM 531 CG2 VAL A 536 6.745 -10.124 -9.047 1.00 0.00 C ATOM 0 H VAL A 536 4.413 -11.266 -8.212 1.00 0.00 H new ATOM 0 HA VAL A 536 6.030 -10.924 -5.764 1.00 0.00 H new ATOM 0 HB VAL A 536 7.605 -9.576 -7.172 1.00 0.00 H new ATOM 0 HG11 VAL A 536 8.825 -11.539 -8.064 1.00 0.00 H new ATOM 0 HG12 VAL A 536 8.180 -11.843 -6.433 1.00 0.00 H new ATOM 0 HG13 VAL A 536 7.361 -12.530 -7.856 1.00 0.00 H new ATOM 0 HG21 VAL A 536 7.678 -10.018 -9.601 1.00 0.00 H new ATOM 0 HG22 VAL A 536 6.163 -10.943 -9.469 1.00 0.00 H new ATOM 0 HG23 VAL A 536 6.174 -9.198 -9.118 1.00 0.00 H new ATOM 541 N TYR A 537 5.029 -8.652 -5.462 1.00 0.00 N ATOM 542 CA TYR A 537 4.338 -7.387 -5.232 1.00 0.00 C ATOM 543 C TYR A 537 5.032 -6.578 -4.145 1.00 0.00 C ATOM 544 O TYR A 537 5.671 -7.136 -3.252 1.00 0.00 O ATOM 545 CB TYR A 537 2.877 -7.630 -4.818 1.00 0.00 C ATOM 546 CG TYR A 537 2.039 -8.338 -5.861 1.00 0.00 C ATOM 547 CD1 TYR A 537 1.626 -7.678 -7.012 1.00 0.00 C ATOM 548 CD2 TYR A 537 1.674 -9.669 -5.700 1.00 0.00 C ATOM 549 CE1 TYR A 537 0.867 -8.321 -7.969 1.00 0.00 C ATOM 550 CE2 TYR A 537 0.917 -10.321 -6.655 1.00 0.00 C ATOM 551 CZ TYR A 537 0.519 -9.641 -7.790 1.00 0.00 C ATOM 552 OH TYR A 537 -0.225 -10.284 -8.754 1.00 0.00 O ATOM 0 H TYR A 537 5.498 -9.032 -4.640 1.00 0.00 H new ATOM 0 HA TYR A 537 4.362 -6.828 -6.168 1.00 0.00 H new ATOM 0 HB2 TYR A 537 2.866 -8.218 -3.900 1.00 0.00 H new ATOM 0 HB3 TYR A 537 2.413 -6.671 -4.588 1.00 0.00 H new ATOM 0 HD1 TYR A 537 1.903 -6.645 -7.160 1.00 0.00 H new ATOM 0 HD2 TYR A 537 1.987 -10.202 -4.815 1.00 0.00 H new ATOM 0 HE1 TYR A 537 0.548 -7.791 -8.854 1.00 0.00 H new ATOM 0 HE2 TYR A 537 0.638 -11.355 -6.515 1.00 0.00 H new ATOM 0 HH TYR A 537 -0.386 -11.211 -8.479 1.00 0.00 H new ATOM 562 N THR A 538 4.912 -5.266 -4.237 1.00 0.00 N ATOM 563 CA THR A 538 5.371 -4.374 -3.182 1.00 0.00 C ATOM 564 C THR A 538 4.219 -3.490 -2.738 1.00 0.00 C ATOM 565 O THR A 538 3.863 -2.533 -3.422 1.00 0.00 O ATOM 566 CB THR A 538 6.545 -3.491 -3.647 1.00 0.00 C ATOM 567 OG1 THR A 538 7.646 -4.314 -4.027 1.00 0.00 O ATOM 568 CG2 THR A 538 6.985 -2.530 -2.554 1.00 0.00 C ATOM 0 H THR A 538 4.497 -4.789 -5.038 1.00 0.00 H new ATOM 0 HA THR A 538 5.724 -4.987 -2.353 1.00 0.00 H new ATOM 0 HB THR A 538 6.206 -2.904 -4.501 1.00 0.00 H new ATOM 0 HG1 THR A 538 7.701 -4.356 -5.005 1.00 0.00 H new ATOM 0 HG21 THR A 538 7.815 -1.923 -2.916 1.00 0.00 H new ATOM 0 HG22 THR A 538 6.152 -1.882 -2.283 1.00 0.00 H new ATOM 0 HG23 THR A 538 7.304 -3.096 -1.679 1.00 0.00 H new ATOM 576 N VAL A 539 3.616 -3.829 -1.617 1.00 0.00 N ATOM 577 CA VAL A 539 2.443 -3.130 -1.157 1.00 0.00 C ATOM 578 C VAL A 539 2.807 -2.100 -0.103 1.00 0.00 C ATOM 579 O VAL A 539 3.225 -2.451 1.003 1.00 0.00 O ATOM 580 CB VAL A 539 1.412 -4.113 -0.580 1.00 0.00 C ATOM 581 CG1 VAL A 539 0.194 -3.371 -0.074 1.00 0.00 C ATOM 582 CG2 VAL A 539 1.017 -5.135 -1.630 1.00 0.00 C ATOM 0 H VAL A 539 3.923 -4.588 -1.009 1.00 0.00 H new ATOM 0 HA VAL A 539 2.005 -2.620 -2.015 1.00 0.00 H new ATOM 0 HB VAL A 539 1.865 -4.637 0.262 1.00 0.00 H new ATOM 0 HG11 VAL A 539 -0.524 -4.084 0.331 1.00 0.00 H new ATOM 0 HG12 VAL A 539 0.492 -2.673 0.708 1.00 0.00 H new ATOM 0 HG13 VAL A 539 -0.264 -2.821 -0.896 1.00 0.00 H new ATOM 0 HG21 VAL A 539 0.286 -5.826 -1.209 1.00 0.00 H new ATOM 0 HG22 VAL A 539 0.581 -4.625 -2.489 1.00 0.00 H new ATOM 0 HG23 VAL A 539 1.900 -5.690 -1.948 1.00 0.00 H new ATOM 592 N PHE A 540 2.672 -0.832 -0.451 1.00 0.00 N ATOM 593 CA PHE A 540 2.822 0.219 0.525 1.00 0.00 C ATOM 594 C PHE A 540 1.502 0.393 1.261 1.00 0.00 C ATOM 595 O PHE A 540 0.533 0.905 0.713 1.00 0.00 O ATOM 596 CB PHE A 540 3.290 1.506 -0.148 1.00 0.00 C ATOM 597 CG PHE A 540 4.750 1.469 -0.488 1.00 0.00 C ATOM 598 CD1 PHE A 540 5.699 1.767 0.473 1.00 0.00 C ATOM 599 CD2 PHE A 540 5.173 1.139 -1.764 1.00 0.00 C ATOM 600 CE1 PHE A 540 7.049 1.741 0.167 1.00 0.00 C ATOM 601 CE2 PHE A 540 6.519 1.106 -2.076 1.00 0.00 C ATOM 602 CZ PHE A 540 7.459 1.410 -1.109 1.00 0.00 C ATOM 0 H PHE A 540 2.460 -0.513 -1.396 1.00 0.00 H new ATOM 0 HA PHE A 540 3.587 -0.045 1.255 1.00 0.00 H new ATOM 0 HB2 PHE A 540 2.711 1.670 -1.057 1.00 0.00 H new ATOM 0 HB3 PHE A 540 3.094 2.351 0.512 1.00 0.00 H new ATOM 0 HD1 PHE A 540 5.383 2.023 1.474 1.00 0.00 H new ATOM 0 HD2 PHE A 540 4.443 0.905 -2.524 1.00 0.00 H new ATOM 0 HE1 PHE A 540 7.780 1.979 0.925 1.00 0.00 H new ATOM 0 HE2 PHE A 540 6.836 0.843 -3.074 1.00 0.00 H new ATOM 0 HZ PHE A 540 8.511 1.389 -1.351 1.00 0.00 H new ATOM 612 N ALA A 541 1.479 -0.063 2.503 1.00 0.00 N ATOM 613 CA ALA A 541 0.237 -0.229 3.243 1.00 0.00 C ATOM 614 C ALA A 541 -0.016 0.945 4.175 1.00 0.00 C ATOM 615 O ALA A 541 0.763 1.199 5.095 1.00 0.00 O ATOM 616 CB ALA A 541 0.273 -1.531 4.026 1.00 0.00 C ATOM 0 H ALA A 541 2.315 -0.327 3.025 1.00 0.00 H new ATOM 0 HA ALA A 541 -0.584 -0.263 2.527 1.00 0.00 H new ATOM 0 HB1 ALA A 541 -0.659 -1.650 4.578 1.00 0.00 H new ATOM 0 HB2 ALA A 541 0.396 -2.367 3.337 1.00 0.00 H new ATOM 0 HB3 ALA A 541 1.109 -1.512 4.726 1.00 0.00 H new ATOM 622 N PRO A 542 -1.108 1.681 3.934 1.00 0.00 N ATOM 623 CA PRO A 542 -1.492 2.818 4.760 1.00 0.00 C ATOM 624 C PRO A 542 -2.162 2.384 6.058 1.00 0.00 C ATOM 625 O PRO A 542 -3.018 1.494 6.065 1.00 0.00 O ATOM 626 CB PRO A 542 -2.479 3.575 3.874 1.00 0.00 C ATOM 627 CG PRO A 542 -3.102 2.523 3.023 1.00 0.00 C ATOM 628 CD PRO A 542 -2.054 1.457 2.827 1.00 0.00 C ATOM 0 HA PRO A 542 -0.633 3.413 5.069 1.00 0.00 H new ATOM 0 HB2 PRO A 542 -3.227 4.097 4.470 1.00 0.00 H new ATOM 0 HB3 PRO A 542 -1.973 4.327 3.268 1.00 0.00 H new ATOM 0 HG2 PRO A 542 -3.990 2.111 3.503 1.00 0.00 H new ATOM 0 HG3 PRO A 542 -3.420 2.936 2.066 1.00 0.00 H new ATOM 0 HD2 PRO A 542 -2.488 0.458 2.869 1.00 0.00 H new ATOM 0 HD3 PRO A 542 -1.564 1.552 1.858 1.00 0.00 H new ATOM 636 N THR A 543 -1.759 3.005 7.152 1.00 0.00 N ATOM 637 CA THR A 543 -2.317 2.693 8.452 1.00 0.00 C ATOM 638 C THR A 543 -3.684 3.350 8.640 1.00 0.00 C ATOM 639 O THR A 543 -4.206 3.997 7.730 1.00 0.00 O ATOM 640 CB THR A 543 -1.360 3.133 9.567 1.00 0.00 C ATOM 641 OG1 THR A 543 -1.074 4.531 9.445 1.00 0.00 O ATOM 642 CG2 THR A 543 -0.070 2.340 9.495 1.00 0.00 C ATOM 0 H THR A 543 -1.043 3.732 7.164 1.00 0.00 H new ATOM 0 HA THR A 543 -2.450 1.613 8.507 1.00 0.00 H new ATOM 0 HB THR A 543 -1.838 2.947 10.529 1.00 0.00 H new ATOM 0 HG1 THR A 543 -0.464 4.804 10.162 1.00 0.00 H new ATOM 0 HG21 THR A 543 0.600 2.662 10.292 1.00 0.00 H new ATOM 0 HG22 THR A 543 -0.288 1.279 9.612 1.00 0.00 H new ATOM 0 HG23 THR A 543 0.407 2.508 8.530 1.00 0.00 H new ATOM 650 N ASN A 544 -4.254 3.199 9.830 1.00 0.00 N ATOM 651 CA ASN A 544 -5.613 3.663 10.093 1.00 0.00 C ATOM 652 C ASN A 544 -5.668 5.181 10.205 1.00 0.00 C ATOM 653 O ASN A 544 -6.642 5.804 9.785 1.00 0.00 O ATOM 654 CB ASN A 544 -6.182 3.009 11.358 1.00 0.00 C ATOM 655 CG ASN A 544 -6.299 1.499 11.233 1.00 0.00 C ATOM 656 OD1 ASN A 544 -6.412 1.011 10.005 1.00 0.00 O flip ATOM 657 ND2 ASN A 544 -6.274 0.775 12.227 1.00 0.00 N flip ATOM 0 H ASN A 544 -3.797 2.759 10.629 1.00 0.00 H new ATOM 0 HA ASN A 544 -6.231 3.365 9.246 1.00 0.00 H new ATOM 0 HB2 ASN A 544 -5.543 3.251 12.207 1.00 0.00 H new ATOM 0 HB3 ASN A 544 -7.165 3.430 11.569 1.00 0.00 H new ATOM 0 HD21 ASN A 544 -6.186 1.187 13.156 1.00 0.00 H new ATOM 0 HD22 ASN A 544 -6.341 -0.237 12.122 1.00 0.00 H new ATOM 664 N GLU A 545 -4.616 5.777 10.748 1.00 0.00 N ATOM 665 CA GLU A 545 -4.516 7.228 10.817 1.00 0.00 C ATOM 666 C GLU A 545 -4.300 7.812 9.423 1.00 0.00 C ATOM 667 O GLU A 545 -4.525 8.994 9.190 1.00 0.00 O ATOM 668 CB GLU A 545 -3.404 7.684 11.773 1.00 0.00 C ATOM 669 CG GLU A 545 -2.077 6.960 11.595 1.00 0.00 C ATOM 670 CD GLU A 545 -2.029 5.642 12.340 1.00 0.00 C ATOM 671 OE1 GLU A 545 -2.498 4.629 11.787 1.00 0.00 O1- ATOM 672 OE2 GLU A 545 -1.532 5.623 13.480 1.00 0.00 O ATOM 0 H GLU A 545 -3.820 5.279 11.147 1.00 0.00 H new ATOM 0 HA GLU A 545 -5.458 7.603 11.217 1.00 0.00 H new ATOM 0 HB2 GLU A 545 -3.241 8.753 11.635 1.00 0.00 H new ATOM 0 HB3 GLU A 545 -3.745 7.543 12.799 1.00 0.00 H new ATOM 0 HG2 GLU A 545 -1.905 6.780 10.534 1.00 0.00 H new ATOM 0 HG3 GLU A 545 -1.268 7.601 11.945 1.00 0.00 H new ATOM 679 N ALA A 546 -3.858 6.979 8.493 1.00 0.00 N ATOM 680 CA ALA A 546 -3.694 7.411 7.113 1.00 0.00 C ATOM 681 C ALA A 546 -5.026 7.557 6.439 1.00 0.00 C ATOM 682 O ALA A 546 -5.221 8.431 5.593 1.00 0.00 O ATOM 683 CB ALA A 546 -2.820 6.440 6.345 1.00 0.00 C ATOM 0 H ALA A 546 -3.608 6.006 8.667 1.00 0.00 H new ATOM 0 HA ALA A 546 -3.203 8.384 7.122 1.00 0.00 H new ATOM 0 HB1 ALA A 546 -2.712 6.783 5.316 1.00 0.00 H new ATOM 0 HB2 ALA A 546 -1.838 6.385 6.815 1.00 0.00 H new ATOM 0 HB3 ALA A 546 -3.281 5.452 6.351 1.00 0.00 H new ATOM 689 N PHE A 547 -5.942 6.713 6.839 1.00 0.00 N ATOM 690 CA PHE A 547 -7.314 6.814 6.410 1.00 0.00 C ATOM 691 C PHE A 547 -7.924 8.088 6.979 1.00 0.00 C ATOM 692 O PHE A 547 -9.014 8.503 6.593 1.00 0.00 O ATOM 693 CB PHE A 547 -8.090 5.567 6.832 1.00 0.00 C ATOM 694 CG PHE A 547 -7.450 4.304 6.325 1.00 0.00 C ATOM 695 CD1 PHE A 547 -6.935 4.251 5.037 1.00 0.00 C ATOM 696 CD2 PHE A 547 -7.344 3.182 7.133 1.00 0.00 C ATOM 697 CE1 PHE A 547 -6.334 3.100 4.566 1.00 0.00 C ATOM 698 CE2 PHE A 547 -6.742 2.031 6.665 1.00 0.00 C ATOM 699 CZ PHE A 547 -6.237 1.991 5.380 1.00 0.00 C ATOM 0 H PHE A 547 -5.758 5.935 7.472 1.00 0.00 H new ATOM 0 HA PHE A 547 -7.364 6.871 5.323 1.00 0.00 H new ATOM 0 HB2 PHE A 547 -8.152 5.530 7.920 1.00 0.00 H new ATOM 0 HB3 PHE A 547 -9.111 5.632 6.456 1.00 0.00 H new ATOM 0 HD1 PHE A 547 -7.005 5.118 4.397 1.00 0.00 H new ATOM 0 HD2 PHE A 547 -7.736 3.209 8.139 1.00 0.00 H new ATOM 0 HE1 PHE A 547 -5.940 3.069 3.561 1.00 0.00 H new ATOM 0 HE2 PHE A 547 -6.666 1.163 7.303 1.00 0.00 H new ATOM 0 HZ PHE A 547 -5.766 1.091 5.013 1.00 0.00 H new ATOM 709 N ARG A 548 -7.214 8.691 7.933 1.00 0.00 N ATOM 710 CA ARG A 548 -7.687 9.909 8.582 1.00 0.00 C ATOM 711 C ARG A 548 -7.142 11.138 7.863 1.00 0.00 C ATOM 712 O ARG A 548 -7.611 12.253 8.075 1.00 0.00 O ATOM 713 CB ARG A 548 -7.265 9.936 10.055 1.00 0.00 C ATOM 714 CG ARG A 548 -7.822 8.790 10.888 1.00 0.00 C ATOM 715 CD ARG A 548 -9.311 8.944 11.167 1.00 0.00 C ATOM 716 NE ARG A 548 -10.128 8.798 9.964 1.00 0.00 N ATOM 717 CZ ARG A 548 -11.456 8.865 9.965 1.00 0.00 C ATOM 718 NH1 ARG A 548 -12.109 9.030 11.108 1.00 0.00 N1+ ATOM 719 NH2 ARG A 548 -12.135 8.750 8.827 1.00 0.00 N ATOM 0 H ARG A 548 -6.312 8.355 8.271 1.00 0.00 H new ATOM 0 HA ARG A 548 -8.776 9.922 8.531 1.00 0.00 H new ATOM 0 HB2 ARG A 548 -6.177 9.913 10.109 1.00 0.00 H new ATOM 0 HB3 ARG A 548 -7.587 10.880 10.496 1.00 0.00 H new ATOM 0 HG2 ARG A 548 -7.648 7.848 10.367 1.00 0.00 H new ATOM 0 HG3 ARG A 548 -7.282 8.736 11.833 1.00 0.00 H new ATOM 0 HD2 ARG A 548 -9.618 8.200 11.902 1.00 0.00 H new ATOM 0 HD3 ARG A 548 -9.494 9.923 11.609 1.00 0.00 H new ATOM 0 HE ARG A 548 -9.654 8.636 9.076 1.00 0.00 H new ATOM 0 HH11 ARG A 548 -11.592 9.105 11.984 1.00 0.00 H new ATOM 0 HH12 ARG A 548 -13.128 9.082 11.111 1.00 0.00 H new ATOM 0 HH21 ARG A 548 -11.637 8.610 7.948 1.00 0.00 H new ATOM 0 HH22 ARG A 548 -13.154 8.802 8.833 1.00 0.00 H new ATOM 733 N ALA A 549 -6.155 10.917 7.005 1.00 0.00 N ATOM 734 CA ALA A 549 -5.455 12.007 6.338 1.00 0.00 C ATOM 735 C ALA A 549 -6.082 12.345 4.987 1.00 0.00 C ATOM 736 O ALA A 549 -5.560 13.181 4.245 1.00 0.00 O ATOM 737 CB ALA A 549 -3.984 11.652 6.163 1.00 0.00 C ATOM 0 H ALA A 549 -5.819 9.987 6.753 1.00 0.00 H new ATOM 0 HA ALA A 549 -5.542 12.892 6.969 1.00 0.00 H new ATOM 0 HB1 ALA A 549 -3.469 12.472 5.664 1.00 0.00 H new ATOM 0 HB2 ALA A 549 -3.532 11.481 7.140 1.00 0.00 H new ATOM 0 HB3 ALA A 549 -3.897 10.748 5.560 1.00 0.00 H new ATOM 743 N LEU A 550 -7.190 11.693 4.665 1.00 0.00 N ATOM 744 CA LEU A 550 -7.872 11.934 3.403 1.00 0.00 C ATOM 745 C LEU A 550 -9.229 12.583 3.616 1.00 0.00 C ATOM 746 O LEU A 550 -9.931 12.276 4.580 1.00 0.00 O ATOM 747 CB LEU A 550 -8.044 10.628 2.631 1.00 0.00 C ATOM 748 CG LEU A 550 -6.748 10.029 2.098 1.00 0.00 C ATOM 749 CD1 LEU A 550 -7.037 8.755 1.335 1.00 0.00 C ATOM 750 CD2 LEU A 550 -6.018 11.025 1.208 1.00 0.00 C ATOM 0 H LEU A 550 -7.635 10.994 5.260 1.00 0.00 H new ATOM 0 HA LEU A 550 -7.253 12.619 2.824 1.00 0.00 H new ATOM 0 HB2 LEU A 550 -8.525 9.898 3.281 1.00 0.00 H new ATOM 0 HB3 LEU A 550 -8.719 10.803 1.793 1.00 0.00 H new ATOM 0 HG LEU A 550 -6.104 9.794 2.945 1.00 0.00 H new ATOM 0 HD11 LEU A 550 -6.103 8.336 0.959 1.00 0.00 H new ATOM 0 HD12 LEU A 550 -7.517 8.035 1.998 1.00 0.00 H new ATOM 0 HD13 LEU A 550 -7.699 8.975 0.498 1.00 0.00 H new ATOM 0 HD21 LEU A 550 -5.096 10.576 0.839 1.00 0.00 H new ATOM 0 HD22 LEU A 550 -6.654 11.293 0.364 1.00 0.00 H new ATOM 0 HD23 LEU A 550 -5.781 11.920 1.782 1.00 0.00 H new ATOM 762 N PRO A 551 -9.610 13.508 2.719 1.00 0.00 N ATOM 763 CA PRO A 551 -10.935 14.122 2.744 1.00 0.00 C ATOM 764 C PRO A 551 -12.033 13.070 2.609 1.00 0.00 C ATOM 765 O PRO A 551 -12.010 12.249 1.685 1.00 0.00 O ATOM 766 CB PRO A 551 -10.933 15.060 1.529 1.00 0.00 C ATOM 767 CG PRO A 551 -9.493 15.291 1.220 1.00 0.00 C ATOM 768 CD PRO A 551 -8.780 14.031 1.619 1.00 0.00 C ATOM 0 HA PRO A 551 -11.133 14.643 3.681 1.00 0.00 H new ATOM 0 HB2 PRO A 551 -11.451 14.609 0.682 1.00 0.00 H new ATOM 0 HB3 PRO A 551 -11.443 15.997 1.753 1.00 0.00 H new ATOM 0 HG2 PRO A 551 -9.350 15.502 0.160 1.00 0.00 H new ATOM 0 HG3 PRO A 551 -9.108 16.149 1.771 1.00 0.00 H new ATOM 0 HD2 PRO A 551 -8.717 13.325 0.791 1.00 0.00 H new ATOM 0 HD3 PRO A 551 -7.759 14.232 1.945 1.00 0.00 H new ATOM 776 N PRO A 552 -13.011 13.082 3.528 1.00 0.00 N ATOM 777 CA PRO A 552 -14.072 12.071 3.577 1.00 0.00 C ATOM 778 C PRO A 552 -14.821 11.914 2.256 1.00 0.00 C ATOM 779 O PRO A 552 -15.315 10.835 1.951 1.00 0.00 O ATOM 780 CB PRO A 552 -15.014 12.585 4.666 1.00 0.00 C ATOM 781 CG PRO A 552 -14.161 13.444 5.529 1.00 0.00 C ATOM 782 CD PRO A 552 -13.150 14.074 4.610 1.00 0.00 C ATOM 0 HA PRO A 552 -13.661 11.081 3.777 1.00 0.00 H new ATOM 0 HB2 PRO A 552 -15.842 13.151 4.239 1.00 0.00 H new ATOM 0 HB3 PRO A 552 -15.450 11.762 5.233 1.00 0.00 H new ATOM 0 HG2 PRO A 552 -14.757 14.204 6.035 1.00 0.00 H new ATOM 0 HG3 PRO A 552 -13.671 12.855 6.304 1.00 0.00 H new ATOM 0 HD2 PRO A 552 -13.495 15.036 4.232 1.00 0.00 H new ATOM 0 HD3 PRO A 552 -12.202 14.252 5.117 1.00 0.00 H new ATOM 790 N ARG A 553 -14.896 12.988 1.475 1.00 0.00 N ATOM 791 CA ARG A 553 -15.592 12.962 0.190 1.00 0.00 C ATOM 792 C ARG A 553 -14.991 11.920 -0.750 1.00 0.00 C ATOM 793 O ARG A 553 -15.700 11.048 -1.252 1.00 0.00 O ATOM 794 CB ARG A 553 -15.551 14.349 -0.461 1.00 0.00 C ATOM 795 CG ARG A 553 -16.208 14.416 -1.836 1.00 0.00 C ATOM 796 CD ARG A 553 -17.642 13.913 -1.803 1.00 0.00 C ATOM 797 NE ARG A 553 -18.468 14.646 -0.848 1.00 0.00 N ATOM 798 CZ ARG A 553 -19.792 14.518 -0.764 1.00 0.00 C ATOM 799 NH1 ARG A 553 -20.446 13.728 -1.606 1.00 0.00 N1+ ATOM 800 NH2 ARG A 553 -20.469 15.171 0.166 1.00 0.00 N ATOM 0 H ARG A 553 -14.482 13.890 1.710 1.00 0.00 H new ATOM 0 HA ARG A 553 -16.629 12.684 0.377 1.00 0.00 H new ATOM 0 HB2 ARG A 553 -16.044 15.062 0.200 1.00 0.00 H new ATOM 0 HB3 ARG A 553 -14.512 14.664 -0.552 1.00 0.00 H new ATOM 0 HG2 ARG A 553 -16.192 15.445 -2.196 1.00 0.00 H new ATOM 0 HG3 ARG A 553 -15.631 13.821 -2.544 1.00 0.00 H new ATOM 0 HD2 ARG A 553 -18.078 14.001 -2.798 1.00 0.00 H new ATOM 0 HD3 ARG A 553 -17.647 12.854 -1.545 1.00 0.00 H new ATOM 0 HE ARG A 553 -18.006 15.293 -0.209 1.00 0.00 H new ATOM 0 HH11 ARG A 553 -19.935 13.214 -2.324 1.00 0.00 H new ATOM 0 HH12 ARG A 553 -21.459 13.635 -1.536 1.00 0.00 H new ATOM 0 HH21 ARG A 553 -19.978 15.776 0.824 1.00 0.00 H new ATOM 0 HH22 ARG A 553 -21.482 15.069 0.225 1.00 0.00 H new ATOM 814 N GLU A 554 -13.683 12.001 -0.963 1.00 0.00 N ATOM 815 CA GLU A 554 -12.998 11.094 -1.878 1.00 0.00 C ATOM 816 C GLU A 554 -13.083 9.659 -1.375 1.00 0.00 C ATOM 817 O GLU A 554 -13.249 8.719 -2.150 1.00 0.00 O ATOM 818 CB GLU A 554 -11.528 11.497 -2.043 1.00 0.00 C ATOM 819 CG GLU A 554 -11.336 12.919 -2.552 1.00 0.00 C ATOM 820 CD GLU A 554 -12.110 13.201 -3.829 1.00 0.00 C ATOM 821 OE1 GLU A 554 -11.711 12.697 -4.897 1.00 0.00 O1- ATOM 822 OE2 GLU A 554 -13.120 13.932 -3.761 1.00 0.00 O ATOM 0 H GLU A 554 -13.074 12.686 -0.514 1.00 0.00 H new ATOM 0 HA GLU A 554 -13.492 11.160 -2.847 1.00 0.00 H new ATOM 0 HB2 GLU A 554 -11.022 11.393 -1.083 1.00 0.00 H new ATOM 0 HB3 GLU A 554 -11.046 10.805 -2.734 1.00 0.00 H new ATOM 0 HG2 GLU A 554 -11.651 13.621 -1.780 1.00 0.00 H new ATOM 0 HG3 GLU A 554 -10.275 13.095 -2.730 1.00 0.00 H new ATOM 829 N TRP A 555 -12.996 9.501 -0.066 1.00 0.00 N ATOM 830 CA TRP A 555 -13.010 8.181 0.544 1.00 0.00 C ATOM 831 C TRP A 555 -14.392 7.565 0.520 1.00 0.00 C ATOM 832 O TRP A 555 -14.549 6.367 0.287 1.00 0.00 O ATOM 833 CB TRP A 555 -12.508 8.264 1.968 1.00 0.00 C ATOM 834 CG TRP A 555 -11.316 7.400 2.167 1.00 0.00 C ATOM 835 CD1 TRP A 555 -10.063 7.619 1.683 1.00 0.00 C ATOM 836 CD2 TRP A 555 -11.259 6.157 2.870 1.00 0.00 C ATOM 837 NE1 TRP A 555 -9.238 6.586 2.041 1.00 0.00 N ATOM 838 CE2 TRP A 555 -9.944 5.690 2.765 1.00 0.00 C ATOM 839 CE3 TRP A 555 -12.189 5.390 3.578 1.00 0.00 C ATOM 840 CZ2 TRP A 555 -9.524 4.509 3.328 1.00 0.00 C ATOM 841 CZ3 TRP A 555 -11.763 4.205 4.146 1.00 0.00 C ATOM 842 CH2 TRP A 555 -10.438 3.781 4.010 1.00 0.00 C ATOM 0 H TRP A 555 -12.915 10.272 0.597 1.00 0.00 H new ATOM 0 HA TRP A 555 -12.350 7.540 -0.040 1.00 0.00 H new ATOM 0 HB2 TRP A 555 -12.256 9.297 2.208 1.00 0.00 H new ATOM 0 HB3 TRP A 555 -13.299 7.961 2.654 1.00 0.00 H new ATOM 0 HD1 TRP A 555 -9.764 8.479 1.103 1.00 0.00 H new ATOM 0 HE1 TRP A 555 -8.250 6.506 1.800 1.00 0.00 H new ATOM 0 HE3 TRP A 555 -13.214 5.715 3.678 1.00 0.00 H new ATOM 0 HZ2 TRP A 555 -8.502 4.174 3.230 1.00 0.00 H new ATOM 0 HZ3 TRP A 555 -12.462 3.599 4.702 1.00 0.00 H new ATOM 0 HH2 TRP A 555 -10.136 2.848 4.461 1.00 0.00 H new ATOM 853 N SER A 556 -15.388 8.388 0.777 1.00 0.00 N ATOM 854 CA SER A 556 -16.779 7.954 0.681 1.00 0.00 C ATOM 855 C SER A 556 -17.096 7.467 -0.735 1.00 0.00 C ATOM 856 O SER A 556 -18.034 6.695 -0.945 1.00 0.00 O ATOM 857 CB SER A 556 -17.724 9.086 1.084 1.00 0.00 C ATOM 858 OG SER A 556 -17.517 9.460 2.439 1.00 0.00 O ATOM 0 H SER A 556 -15.267 9.362 1.054 1.00 0.00 H new ATOM 0 HA SER A 556 -16.926 7.122 1.370 1.00 0.00 H new ATOM 0 HB2 SER A 556 -17.563 9.948 0.436 1.00 0.00 H new ATOM 0 HB3 SER A 556 -18.758 8.770 0.943 1.00 0.00 H new ATOM 0 HG SER A 556 -16.887 10.210 2.479 1.00 0.00 H new ATOM 864 N ARG A 557 -16.312 7.929 -1.701 1.00 0.00 N ATOM 865 CA ARG A 557 -16.406 7.437 -3.065 1.00 0.00 C ATOM 866 C ARG A 557 -15.817 6.033 -3.163 1.00 0.00 C ATOM 867 O ARG A 557 -16.418 5.141 -3.760 1.00 0.00 O ATOM 868 CB ARG A 557 -15.670 8.367 -4.029 1.00 0.00 C ATOM 869 CG ARG A 557 -16.289 9.744 -4.166 1.00 0.00 C ATOM 870 CD ARG A 557 -15.455 10.611 -5.090 1.00 0.00 C ATOM 871 NE ARG A 557 -15.217 9.959 -6.377 1.00 0.00 N ATOM 872 CZ ARG A 557 -14.511 10.499 -7.367 1.00 0.00 C ATOM 873 NH1 ARG A 557 -13.955 11.698 -7.228 1.00 0.00 N1+ ATOM 874 NH2 ARG A 557 -14.354 9.830 -8.499 1.00 0.00 N ATOM 0 H ARG A 557 -15.601 8.647 -1.561 1.00 0.00 H new ATOM 0 HA ARG A 557 -17.460 7.407 -3.341 1.00 0.00 H new ATOM 0 HB2 ARG A 557 -14.639 8.477 -3.692 1.00 0.00 H new ATOM 0 HB3 ARG A 557 -15.636 7.898 -5.012 1.00 0.00 H new ATOM 0 HG2 ARG A 557 -17.303 9.656 -4.556 1.00 0.00 H new ATOM 0 HG3 ARG A 557 -16.365 10.215 -3.186 1.00 0.00 H new ATOM 0 HD2 ARG A 557 -15.962 11.562 -5.252 1.00 0.00 H new ATOM 0 HD3 ARG A 557 -14.500 10.836 -4.614 1.00 0.00 H new ATOM 0 HE ARG A 557 -15.617 9.033 -6.525 1.00 0.00 H new ATOM 0 HH11 ARG A 557 -14.067 12.214 -6.355 1.00 0.00 H new ATOM 0 HH12 ARG A 557 -13.416 12.102 -7.994 1.00 0.00 H new ATOM 0 HH21 ARG A 557 -14.773 8.907 -8.608 1.00 0.00 H new ATOM 0 HH22 ARG A 557 -13.814 10.238 -9.262 1.00 0.00 H new ATOM 888 N LEU A 558 -14.652 5.842 -2.549 1.00 0.00 N ATOM 889 CA LEU A 558 -13.939 4.570 -2.627 1.00 0.00 C ATOM 890 C LEU A 558 -14.709 3.478 -1.890 1.00 0.00 C ATOM 891 O LEU A 558 -15.008 2.432 -2.450 1.00 0.00 O ATOM 892 CB LEU A 558 -12.527 4.704 -2.039 1.00 0.00 C ATOM 893 CG LEU A 558 -11.778 5.986 -2.408 1.00 0.00 C ATOM 894 CD1 LEU A 558 -10.471 6.069 -1.641 1.00 0.00 C ATOM 895 CD2 LEU A 558 -11.525 6.057 -3.905 1.00 0.00 C ATOM 0 H LEU A 558 -14.181 6.554 -1.991 1.00 0.00 H new ATOM 0 HA LEU A 558 -13.855 4.293 -3.678 1.00 0.00 H new ATOM 0 HB2 LEU A 558 -12.598 4.645 -0.953 1.00 0.00 H new ATOM 0 HB3 LEU A 558 -11.934 3.850 -2.366 1.00 0.00 H new ATOM 0 HG LEU A 558 -12.400 6.838 -2.132 1.00 0.00 H new ATOM 0 HD11 LEU A 558 -9.947 6.986 -1.912 1.00 0.00 H new ATOM 0 HD12 LEU A 558 -10.677 6.072 -0.571 1.00 0.00 H new ATOM 0 HD13 LEU A 558 -9.849 5.209 -1.888 1.00 0.00 H new ATOM 0 HD21 LEU A 558 -10.991 6.978 -4.141 1.00 0.00 H new ATOM 0 HD22 LEU A 558 -10.925 5.201 -4.214 1.00 0.00 H new ATOM 0 HD23 LEU A 558 -12.477 6.043 -4.436 1.00 0.00 H new ATOM 907 N LEU A 559 -15.046 3.729 -0.633 1.00 0.00 N ATOM 908 CA LEU A 559 -15.793 2.770 0.162 1.00 0.00 C ATOM 909 C LEU A 559 -17.209 2.569 -0.381 1.00 0.00 C ATOM 910 O LEU A 559 -17.891 1.605 -0.025 1.00 0.00 O ATOM 911 CB LEU A 559 -15.840 3.260 1.602 1.00 0.00 C ATOM 912 CG LEU A 559 -14.689 2.804 2.505 1.00 0.00 C ATOM 913 CD1 LEU A 559 -15.049 1.515 3.229 1.00 0.00 C ATOM 914 CD2 LEU A 559 -13.403 2.602 1.719 1.00 0.00 C ATOM 0 H LEU A 559 -14.812 4.592 -0.142 1.00 0.00 H new ATOM 0 HA LEU A 559 -15.291 1.804 0.112 1.00 0.00 H new ATOM 0 HB2 LEU A 559 -15.859 4.350 1.594 1.00 0.00 H new ATOM 0 HB3 LEU A 559 -16.778 2.928 2.047 1.00 0.00 H new ATOM 0 HG LEU A 559 -14.524 3.595 3.236 1.00 0.00 H new ATOM 0 HD11 LEU A 559 -14.217 1.210 3.864 1.00 0.00 H new ATOM 0 HD12 LEU A 559 -15.934 1.678 3.844 1.00 0.00 H new ATOM 0 HD13 LEU A 559 -15.254 0.732 2.498 1.00 0.00 H new ATOM 0 HD21 LEU A 559 -12.611 2.279 2.394 1.00 0.00 H new ATOM 0 HD22 LEU A 559 -13.560 1.842 0.954 1.00 0.00 H new ATOM 0 HD23 LEU A 559 -13.115 3.540 1.245 1.00 0.00 H new ATOM 926 N GLY A 560 -17.644 3.481 -1.237 1.00 0.00 N ATOM 927 CA GLY A 560 -18.958 3.373 -1.832 1.00 0.00 C ATOM 928 C GLY A 560 -18.949 2.559 -3.111 1.00 0.00 C ATOM 929 O GLY A 560 -19.944 1.915 -3.450 1.00 0.00 O ATOM 0 H GLY A 560 -17.107 4.297 -1.531 1.00 0.00 H new ATOM 0 HA2 GLY A 560 -19.641 2.914 -1.117 1.00 0.00 H new ATOM 0 HA3 GLY A 560 -19.341 4.371 -2.043 1.00 0.00 H new ATOM 933 N ASP A 561 -17.823 2.583 -3.818 1.00 0.00 N ATOM 934 CA ASP A 561 -17.691 1.886 -5.095 1.00 0.00 C ATOM 935 C ASP A 561 -16.414 1.048 -5.126 1.00 0.00 C ATOM 936 O ASP A 561 -15.316 1.570 -4.940 1.00 0.00 O ATOM 937 CB ASP A 561 -17.677 2.896 -6.238 1.00 0.00 C ATOM 938 CG ASP A 561 -17.593 2.234 -7.593 1.00 0.00 C ATOM 939 OD1 ASP A 561 -18.639 1.821 -8.128 1.00 0.00 O ATOM 940 OD2 ASP A 561 -16.478 2.129 -8.131 1.00 0.00 O1- ATOM 0 H ASP A 561 -16.982 3.081 -3.526 1.00 0.00 H new ATOM 0 HA ASP A 561 -18.544 1.218 -5.213 1.00 0.00 H new ATOM 0 HB2 ASP A 561 -18.579 3.506 -6.191 1.00 0.00 H new ATOM 0 HB3 ASP A 561 -16.829 3.570 -6.113 1.00 0.00 H new ATOM 945 N ALA A 562 -16.562 -0.241 -5.400 1.00 0.00 N ATOM 946 CA ALA A 562 -15.457 -1.189 -5.284 1.00 0.00 C ATOM 947 C ALA A 562 -14.321 -0.860 -6.236 1.00 0.00 C ATOM 948 O ALA A 562 -13.158 -0.833 -5.830 1.00 0.00 O ATOM 949 CB ALA A 562 -15.947 -2.609 -5.526 1.00 0.00 C ATOM 0 H ALA A 562 -17.441 -0.658 -5.706 1.00 0.00 H new ATOM 0 HA ALA A 562 -15.069 -1.110 -4.268 1.00 0.00 H new ATOM 0 HB1 ALA A 562 -15.111 -3.303 -5.436 1.00 0.00 H new ATOM 0 HB2 ALA A 562 -16.709 -2.861 -4.789 1.00 0.00 H new ATOM 0 HB3 ALA A 562 -16.372 -2.682 -6.527 1.00 0.00 H new ATOM 955 N LYS A 563 -14.645 -0.593 -7.494 1.00 0.00 N ATOM 956 CA LYS A 563 -13.612 -0.318 -8.474 1.00 0.00 C ATOM 957 C LYS A 563 -13.007 1.054 -8.220 1.00 0.00 C ATOM 958 O LYS A 563 -11.867 1.318 -8.598 1.00 0.00 O ATOM 959 CB LYS A 563 -14.146 -0.436 -9.909 1.00 0.00 C ATOM 960 CG LYS A 563 -15.098 0.672 -10.343 1.00 0.00 C ATOM 961 CD LYS A 563 -14.392 1.696 -11.220 1.00 0.00 C ATOM 962 CE LYS A 563 -14.280 3.064 -10.555 1.00 0.00 C ATOM 963 NZ LYS A 563 -15.596 3.589 -10.115 1.00 0.00 N1+ ATOM 0 H LYS A 563 -15.599 -0.562 -7.853 1.00 0.00 H new ATOM 0 HA LYS A 563 -12.830 -1.069 -8.366 1.00 0.00 H new ATOM 0 HB2 LYS A 563 -13.298 -0.453 -10.594 1.00 0.00 H new ATOM 0 HB3 LYS A 563 -14.658 -1.393 -10.011 1.00 0.00 H new ATOM 0 HG2 LYS A 563 -15.937 0.240 -10.888 1.00 0.00 H new ATOM 0 HG3 LYS A 563 -15.510 1.166 -9.463 1.00 0.00 H new ATOM 0 HD2 LYS A 563 -13.394 1.333 -11.464 1.00 0.00 H new ATOM 0 HD3 LYS A 563 -14.933 1.797 -12.161 1.00 0.00 H new ATOM 0 HE2 LYS A 563 -13.614 2.993 -9.695 1.00 0.00 H new ATOM 0 HE3 LYS A 563 -13.826 3.768 -11.253 1.00 0.00 H new ATOM 0 HZ1 LYS A 563 -15.543 4.623 -10.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 563 -16.321 3.342 -10.818 1.00 0.00 H new ATOM 0 HZ3 LYS A 563 -15.847 3.170 -9.197 1.00 0.00 H new ATOM 977 N GLU A 564 -13.779 1.927 -7.580 1.00 0.00 N ATOM 978 CA GLU A 564 -13.280 3.238 -7.190 1.00 0.00 C ATOM 979 C GLU A 564 -12.234 3.083 -6.093 1.00 0.00 C ATOM 980 O GLU A 564 -11.183 3.723 -6.124 1.00 0.00 O ATOM 981 CB GLU A 564 -14.426 4.129 -6.708 1.00 0.00 C ATOM 982 CG GLU A 564 -14.057 5.600 -6.598 1.00 0.00 C ATOM 983 CD GLU A 564 -13.915 6.270 -7.950 1.00 0.00 C ATOM 984 OE1 GLU A 564 -12.903 6.023 -8.640 1.00 0.00 O ATOM 985 OE2 GLU A 564 -14.812 7.050 -8.325 1.00 0.00 O1- ATOM 0 H GLU A 564 -14.750 1.750 -7.322 1.00 0.00 H new ATOM 0 HA GLU A 564 -12.822 3.713 -8.058 1.00 0.00 H new ATOM 0 HB2 GLU A 564 -15.267 4.026 -7.394 1.00 0.00 H new ATOM 0 HB3 GLU A 564 -14.764 3.775 -5.734 1.00 0.00 H new ATOM 0 HG2 GLU A 564 -14.820 6.119 -6.018 1.00 0.00 H new ATOM 0 HG3 GLU A 564 -13.120 5.695 -6.050 1.00 0.00 H new ATOM 992 N LEU A 565 -12.523 2.207 -5.139 1.00 0.00 N ATOM 993 CA LEU A 565 -11.618 1.902 -4.066 1.00 0.00 C ATOM 994 C LEU A 565 -10.383 1.221 -4.631 1.00 0.00 C ATOM 995 O LEU A 565 -9.247 1.628 -4.367 1.00 0.00 O ATOM 996 CB LEU A 565 -12.354 0.977 -3.105 1.00 0.00 C ATOM 997 CG LEU A 565 -11.897 1.008 -1.658 1.00 0.00 C ATOM 998 CD1 LEU A 565 -12.895 0.254 -0.812 1.00 0.00 C ATOM 999 CD2 LEU A 565 -10.518 0.400 -1.526 1.00 0.00 C ATOM 0 H LEU A 565 -13.402 1.690 -5.098 1.00 0.00 H new ATOM 0 HA LEU A 565 -11.297 2.803 -3.544 1.00 0.00 H new ATOM 0 HB2 LEU A 565 -13.414 1.227 -3.134 1.00 0.00 H new ATOM 0 HB3 LEU A 565 -12.257 -0.045 -3.472 1.00 0.00 H new ATOM 0 HG LEU A 565 -11.840 2.041 -1.315 1.00 0.00 H new ATOM 0 HD11 LEU A 565 -12.575 0.271 0.230 1.00 0.00 H new ATOM 0 HD12 LEU A 565 -13.874 0.725 -0.898 1.00 0.00 H new ATOM 0 HD13 LEU A 565 -12.957 -0.778 -1.156 1.00 0.00 H new ATOM 0 HD21 LEU A 565 -10.205 0.430 -0.482 1.00 0.00 H new ATOM 0 HD22 LEU A 565 -10.542 -0.635 -1.868 1.00 0.00 H new ATOM 0 HD23 LEU A 565 -9.811 0.966 -2.133 1.00 0.00 H new ATOM 1011 N ALA A 566 -10.635 0.189 -5.428 1.00 0.00 N ATOM 1012 CA ALA A 566 -9.582 -0.570 -6.086 1.00 0.00 C ATOM 1013 C ALA A 566 -8.664 0.333 -6.907 1.00 0.00 C ATOM 1014 O ALA A 566 -7.472 0.066 -7.024 1.00 0.00 O ATOM 1015 CB ALA A 566 -10.200 -1.638 -6.973 1.00 0.00 C ATOM 0 H ALA A 566 -11.577 -0.144 -5.635 1.00 0.00 H new ATOM 0 HA ALA A 566 -8.973 -1.042 -5.315 1.00 0.00 H new ATOM 0 HB1 ALA A 566 -9.409 -2.205 -7.465 1.00 0.00 H new ATOM 0 HB2 ALA A 566 -10.805 -2.311 -6.365 1.00 0.00 H new ATOM 0 HB3 ALA A 566 -10.830 -1.165 -7.727 1.00 0.00 H new ATOM 1021 N ASN A 567 -9.230 1.403 -7.453 1.00 0.00 N ATOM 1022 CA ASN A 567 -8.491 2.335 -8.306 1.00 0.00 C ATOM 1023 C ASN A 567 -7.216 2.831 -7.620 1.00 0.00 C ATOM 1024 O ASN A 567 -6.123 2.705 -8.167 1.00 0.00 O ATOM 1025 CB ASN A 567 -9.397 3.515 -8.684 1.00 0.00 C ATOM 1026 CG ASN A 567 -8.728 4.536 -9.589 1.00 0.00 C ATOM 1027 OD1 ASN A 567 -7.823 4.213 -10.361 1.00 0.00 O ATOM 1028 ND2 ASN A 567 -9.182 5.777 -9.506 1.00 0.00 N ATOM 0 H ASN A 567 -10.210 1.651 -7.320 1.00 0.00 H new ATOM 0 HA ASN A 567 -8.189 1.809 -9.211 1.00 0.00 H new ATOM 0 HB2 ASN A 567 -10.289 3.132 -9.181 1.00 0.00 H new ATOM 0 HB3 ASN A 567 -9.729 4.013 -7.773 1.00 0.00 H new ATOM 0 HD21 ASN A 567 -8.781 6.507 -10.094 1.00 0.00 H new ATOM 0 HD22 ASN A 567 -9.933 6.003 -8.854 1.00 0.00 H new ATOM 1035 N ILE A 568 -7.360 3.362 -6.414 1.00 0.00 N ATOM 1036 CA ILE A 568 -6.227 3.899 -5.668 1.00 0.00 C ATOM 1037 C ILE A 568 -5.492 2.776 -4.955 1.00 0.00 C ATOM 1038 O ILE A 568 -4.263 2.752 -4.919 1.00 0.00 O ATOM 1039 CB ILE A 568 -6.665 4.967 -4.631 1.00 0.00 C ATOM 1040 CG1 ILE A 568 -7.411 6.109 -5.335 1.00 0.00 C ATOM 1041 CG2 ILE A 568 -5.456 5.510 -3.867 1.00 0.00 C ATOM 1042 CD1 ILE A 568 -7.883 7.205 -4.402 1.00 0.00 C ATOM 0 H ILE A 568 -8.254 3.433 -5.928 1.00 0.00 H new ATOM 0 HA ILE A 568 -5.565 4.381 -6.388 1.00 0.00 H new ATOM 0 HB ILE A 568 -7.337 4.497 -3.913 1.00 0.00 H new ATOM 0 HG12 ILE A 568 -6.757 6.545 -6.090 1.00 0.00 H new ATOM 0 HG13 ILE A 568 -8.273 5.697 -5.860 1.00 0.00 H new ATOM 0 HG21 ILE A 568 -5.787 6.257 -3.146 1.00 0.00 H new ATOM 0 HG22 ILE A 568 -4.961 4.693 -3.342 1.00 0.00 H new ATOM 0 HG23 ILE A 568 -4.758 5.967 -4.568 1.00 0.00 H new ATOM 0 HD11 ILE A 568 -8.400 7.974 -4.976 1.00 0.00 H new ATOM 0 HD12 ILE A 568 -8.564 6.785 -3.662 1.00 0.00 H new ATOM 0 HD13 ILE A 568 -7.025 7.646 -3.896 1.00 0.00 H new ATOM 1054 N LEU A 569 -6.255 1.833 -4.412 1.00 0.00 N ATOM 1055 CA LEU A 569 -5.686 0.703 -3.682 1.00 0.00 C ATOM 1056 C LEU A 569 -4.673 -0.071 -4.538 1.00 0.00 C ATOM 1057 O LEU A 569 -3.658 -0.546 -4.031 1.00 0.00 O ATOM 1058 CB LEU A 569 -6.808 -0.229 -3.223 1.00 0.00 C ATOM 1059 CG LEU A 569 -6.408 -1.294 -2.200 1.00 0.00 C ATOM 1060 CD1 LEU A 569 -5.865 -0.649 -0.935 1.00 0.00 C ATOM 1061 CD2 LEU A 569 -7.601 -2.171 -1.864 1.00 0.00 C ATOM 0 H LEU A 569 -7.274 1.828 -4.464 1.00 0.00 H new ATOM 0 HA LEU A 569 -5.154 1.093 -2.814 1.00 0.00 H new ATOM 0 HB2 LEU A 569 -7.607 0.377 -2.796 1.00 0.00 H new ATOM 0 HB3 LEU A 569 -7.221 -0.730 -4.099 1.00 0.00 H new ATOM 0 HG LEU A 569 -5.623 -1.911 -2.638 1.00 0.00 H new ATOM 0 HD11 LEU A 569 -5.587 -1.425 -0.222 1.00 0.00 H new ATOM 0 HD12 LEU A 569 -4.988 -0.050 -1.180 1.00 0.00 H new ATOM 0 HD13 LEU A 569 -6.630 -0.009 -0.495 1.00 0.00 H new ATOM 0 HD21 LEU A 569 -7.304 -2.925 -1.135 1.00 0.00 H new ATOM 0 HD22 LEU A 569 -8.398 -1.556 -1.446 1.00 0.00 H new ATOM 0 HD23 LEU A 569 -7.958 -2.662 -2.769 1.00 0.00 H new ATOM 1073 N LYS A 570 -4.947 -0.185 -5.837 1.00 0.00 N ATOM 1074 CA LYS A 570 -4.036 -0.879 -6.757 1.00 0.00 C ATOM 1075 C LYS A 570 -2.723 -0.112 -6.947 1.00 0.00 C ATOM 1076 O LYS A 570 -1.705 -0.690 -7.319 1.00 0.00 O ATOM 1077 CB LYS A 570 -4.699 -1.095 -8.122 1.00 0.00 C ATOM 1078 CG LYS A 570 -5.793 -2.151 -8.126 1.00 0.00 C ATOM 1079 CD LYS A 570 -6.414 -2.283 -9.506 1.00 0.00 C ATOM 1080 CE LYS A 570 -7.576 -3.264 -9.514 1.00 0.00 C ATOM 1081 NZ LYS A 570 -7.142 -4.656 -9.211 1.00 0.00 N1+ ATOM 0 H LYS A 570 -5.787 0.191 -6.278 1.00 0.00 H new ATOM 0 HA LYS A 570 -3.809 -1.845 -6.306 1.00 0.00 H new ATOM 0 HB2 LYS A 570 -5.122 -0.149 -8.461 1.00 0.00 H new ATOM 0 HB3 LYS A 570 -3.933 -1.379 -8.844 1.00 0.00 H new ATOM 0 HG2 LYS A 570 -5.379 -3.110 -7.816 1.00 0.00 H new ATOM 0 HG3 LYS A 570 -6.562 -1.886 -7.400 1.00 0.00 H new ATOM 0 HD2 LYS A 570 -6.761 -1.306 -9.843 1.00 0.00 H new ATOM 0 HD3 LYS A 570 -5.655 -2.613 -10.215 1.00 0.00 H new ATOM 0 HE2 LYS A 570 -8.319 -2.950 -8.781 1.00 0.00 H new ATOM 0 HE3 LYS A 570 -8.061 -3.241 -10.490 1.00 0.00 H new ATOM 0 HZ1 LYS A 570 -7.951 -5.301 -9.311 1.00 0.00 H new ATOM 0 HZ2 LYS A 570 -6.391 -4.937 -9.873 1.00 0.00 H new ATOM 0 HZ3 LYS A 570 -6.780 -4.703 -8.237 1.00 0.00 H new ATOM 1095 N TYR A 571 -2.745 1.184 -6.691 1.00 0.00 N ATOM 1096 CA TYR A 571 -1.565 2.021 -6.889 1.00 0.00 C ATOM 1097 C TYR A 571 -0.599 1.883 -5.717 1.00 0.00 C ATOM 1098 O TYR A 571 0.577 2.206 -5.830 1.00 0.00 O ATOM 1099 CB TYR A 571 -1.999 3.475 -7.111 1.00 0.00 C ATOM 1100 CG TYR A 571 -0.903 4.522 -7.024 1.00 0.00 C ATOM 1101 CD1 TYR A 571 0.148 4.546 -7.935 1.00 0.00 C ATOM 1102 CD2 TYR A 571 -0.947 5.512 -6.050 1.00 0.00 C ATOM 1103 CE1 TYR A 571 1.127 5.522 -7.870 1.00 0.00 C ATOM 1104 CE2 TYR A 571 0.028 6.486 -5.976 1.00 0.00 C ATOM 1105 CZ TYR A 571 1.061 6.490 -6.888 1.00 0.00 C ATOM 1106 OH TYR A 571 2.029 7.467 -6.815 1.00 0.00 O ATOM 0 H TYR A 571 -3.564 1.684 -6.346 1.00 0.00 H new ATOM 0 HA TYR A 571 -1.029 1.688 -7.778 1.00 0.00 H new ATOM 0 HB2 TYR A 571 -2.465 3.547 -8.094 1.00 0.00 H new ATOM 0 HB3 TYR A 571 -2.766 3.720 -6.376 1.00 0.00 H new ATOM 0 HD1 TYR A 571 0.201 3.791 -8.705 1.00 0.00 H new ATOM 0 HD2 TYR A 571 -1.759 5.519 -5.338 1.00 0.00 H new ATOM 0 HE1 TYR A 571 1.938 5.526 -8.583 1.00 0.00 H new ATOM 0 HE2 TYR A 571 -0.018 7.242 -5.206 1.00 0.00 H new ATOM 0 HH TYR A 571 2.833 7.167 -7.289 1.00 0.00 H new ATOM 1116 N HIS A 572 -1.097 1.363 -4.608 1.00 0.00 N ATOM 1117 CA HIS A 572 -0.262 1.090 -3.444 1.00 0.00 C ATOM 1118 C HIS A 572 0.544 -0.186 -3.642 1.00 0.00 C ATOM 1119 O HIS A 572 1.434 -0.508 -2.855 1.00 0.00 O ATOM 1120 CB HIS A 572 -1.131 0.960 -2.195 1.00 0.00 C ATOM 1121 CG HIS A 572 -1.599 2.268 -1.659 1.00 0.00 C ATOM 1122 ND1 HIS A 572 -1.562 2.727 -0.392 1.00 0.00 N flip ATOM 1123 CD2 HIS A 572 -2.111 3.241 -2.477 1.00 0.00 C flip ATOM 1124 CE1 HIS A 572 -2.051 4.004 -0.416 1.00 0.00 C flip ATOM 1125 NE2 HIS A 572 -2.364 4.269 -1.697 1.00 0.00 N flip ATOM 0 H HIS A 572 -2.080 1.119 -4.486 1.00 0.00 H new ATOM 0 HA HIS A 572 0.430 1.923 -3.319 1.00 0.00 H new ATOM 0 HB2 HIS A 572 -1.997 0.341 -2.427 1.00 0.00 H new ATOM 0 HB3 HIS A 572 -0.566 0.440 -1.421 1.00 0.00 H new ATOM 0 HD2 HIS A 572 -2.273 3.177 -3.543 1.00 0.00 H new ATOM 0 HE1 HIS A 572 -2.164 4.669 0.428 1.00 0.00 H new ATOM 0 HE2 HIS A 572 -2.749 5.156 -2.022 1.00 0.00 H new ATOM 1133 N ILE A 573 0.227 -0.903 -4.704 1.00 0.00 N ATOM 1134 CA ILE A 573 0.831 -2.191 -4.970 1.00 0.00 C ATOM 1135 C ILE A 573 1.750 -2.121 -6.183 1.00 0.00 C ATOM 1136 O ILE A 573 1.300 -1.839 -7.294 1.00 0.00 O ATOM 1137 CB ILE A 573 -0.259 -3.245 -5.223 1.00 0.00 C ATOM 1138 CG1 ILE A 573 -1.259 -3.260 -4.061 1.00 0.00 C ATOM 1139 CG2 ILE A 573 0.371 -4.615 -5.422 1.00 0.00 C ATOM 1140 CD1 ILE A 573 -2.573 -3.929 -4.398 1.00 0.00 C ATOM 0 H ILE A 573 -0.455 -0.608 -5.403 1.00 0.00 H new ATOM 0 HA ILE A 573 1.419 -2.472 -4.096 1.00 0.00 H new ATOM 0 HB ILE A 573 -0.800 -2.987 -6.133 1.00 0.00 H new ATOM 0 HG12 ILE A 573 -0.808 -3.773 -3.212 1.00 0.00 H new ATOM 0 HG13 ILE A 573 -1.454 -2.234 -3.747 1.00 0.00 H new ATOM 0 HG21 ILE A 573 -0.411 -5.353 -5.600 1.00 0.00 H new ATOM 0 HG22 ILE A 573 1.044 -4.585 -6.279 1.00 0.00 H new ATOM 0 HG23 ILE A 573 0.933 -4.890 -4.529 1.00 0.00 H new ATOM 0 HD11 ILE A 573 -3.229 -3.901 -3.528 1.00 0.00 H new ATOM 0 HD12 ILE A 573 -3.047 -3.403 -5.227 1.00 0.00 H new ATOM 0 HD13 ILE A 573 -2.391 -4.965 -4.682 1.00 0.00 H new ATOM 1152 N GLY A 574 3.035 -2.360 -5.961 1.00 0.00 N ATOM 1153 CA GLY A 574 3.983 -2.423 -7.056 1.00 0.00 C ATOM 1154 C GLY A 574 3.925 -3.748 -7.789 1.00 0.00 C ATOM 1155 O GLY A 574 3.425 -4.738 -7.250 1.00 0.00 O ATOM 0 H GLY A 574 3.440 -2.512 -5.037 1.00 0.00 H new ATOM 0 HA2 GLY A 574 3.780 -1.613 -7.757 1.00 0.00 H new ATOM 0 HA3 GLY A 574 4.991 -2.267 -6.671 1.00 0.00 H new ATOM 1159 N ASP A 575 4.462 -3.771 -9.003 1.00 0.00 N ATOM 1160 CA ASP A 575 4.332 -4.930 -9.882 1.00 0.00 C ATOM 1161 C ASP A 575 5.349 -6.023 -9.553 1.00 0.00 C ATOM 1162 O ASP A 575 5.264 -7.130 -10.086 1.00 0.00 O ATOM 1163 CB ASP A 575 4.481 -4.504 -11.346 1.00 0.00 C ATOM 1164 CG ASP A 575 5.917 -4.199 -11.733 1.00 0.00 C ATOM 1165 OD1 ASP A 575 6.503 -3.249 -11.177 1.00 0.00 O ATOM 1166 OD2 ASP A 575 6.458 -4.897 -12.617 1.00 0.00 O1- ATOM 0 H ASP A 575 4.994 -2.998 -9.403 1.00 0.00 H new ATOM 0 HA ASP A 575 3.338 -5.347 -9.720 1.00 0.00 H new ATOM 0 HB2 ASP A 575 4.098 -5.296 -11.990 1.00 0.00 H new ATOM 0 HB3 ASP A 575 3.867 -3.622 -11.526 1.00 0.00 H new ATOM 1171 N GLU A 576 6.313 -5.710 -8.697 1.00 0.00 N ATOM 1172 CA GLU A 576 7.292 -6.688 -8.252 1.00 0.00 C ATOM 1173 C GLU A 576 7.875 -6.272 -6.926 1.00 0.00 C ATOM 1174 O GLU A 576 7.530 -5.214 -6.406 1.00 0.00 O ATOM 1175 CB GLU A 576 8.396 -6.878 -9.286 1.00 0.00 C ATOM 1176 CG GLU A 576 9.139 -5.606 -9.643 1.00 0.00 C ATOM 1177 CD GLU A 576 10.373 -5.890 -10.465 1.00 0.00 C ATOM 1178 OE1 GLU A 576 11.435 -6.163 -9.868 1.00 0.00 O1- ATOM 1179 OE2 GLU A 576 10.287 -5.854 -11.713 1.00 0.00 O ATOM 0 H GLU A 576 6.436 -4.780 -8.296 1.00 0.00 H new ATOM 0 HA GLU A 576 6.784 -7.645 -8.131 1.00 0.00 H new ATOM 0 HB2 GLU A 576 9.111 -7.609 -8.908 1.00 0.00 H new ATOM 0 HB3 GLU A 576 7.961 -7.298 -10.193 1.00 0.00 H new ATOM 0 HG2 GLU A 576 8.477 -4.942 -10.199 1.00 0.00 H new ATOM 0 HG3 GLU A 576 9.423 -5.082 -8.730 1.00 0.00 H new ATOM 1186 N ILE A 577 8.756 -7.099 -6.383 1.00 0.00 N ATOM 1187 CA ILE A 577 9.187 -6.929 -5.016 1.00 0.00 C ATOM 1188 C ILE A 577 10.413 -6.021 -4.905 1.00 0.00 C ATOM 1189 O ILE A 577 11.504 -6.365 -5.364 1.00 0.00 O ATOM 1190 CB ILE A 577 9.507 -8.284 -4.353 1.00 0.00 C ATOM 1191 CG1 ILE A 577 8.357 -9.269 -4.574 1.00 0.00 C ATOM 1192 CG2 ILE A 577 9.764 -8.093 -2.864 1.00 0.00 C ATOM 1193 CD1 ILE A 577 8.638 -10.656 -4.041 1.00 0.00 C ATOM 0 H ILE A 577 9.181 -7.888 -6.870 1.00 0.00 H new ATOM 0 HA ILE A 577 8.354 -6.457 -4.495 1.00 0.00 H new ATOM 0 HB ILE A 577 10.407 -8.694 -4.812 1.00 0.00 H new ATOM 0 HG12 ILE A 577 7.459 -8.880 -4.095 1.00 0.00 H new ATOM 0 HG13 ILE A 577 8.146 -9.335 -5.641 1.00 0.00 H new ATOM 0 HG21 ILE A 577 9.989 -9.057 -2.407 1.00 0.00 H new ATOM 0 HG22 ILE A 577 10.609 -7.419 -2.724 1.00 0.00 H new ATOM 0 HG23 ILE A 577 8.878 -7.666 -2.394 1.00 0.00 H new ATOM 0 HD11 ILE A 577 7.780 -11.300 -4.233 1.00 0.00 H new ATOM 0 HD12 ILE A 577 9.517 -11.066 -4.538 1.00 0.00 H new ATOM 0 HD13 ILE A 577 8.820 -10.603 -2.968 1.00 0.00 H new ATOM 1205 N LEU A 578 10.227 -4.870 -4.284 1.00 0.00 N ATOM 1206 CA LEU A 578 11.319 -3.951 -4.016 1.00 0.00 C ATOM 1207 C LEU A 578 11.531 -3.891 -2.507 1.00 0.00 C ATOM 1208 O LEU A 578 10.827 -3.179 -1.796 1.00 0.00 O ATOM 1209 CB LEU A 578 10.993 -2.561 -4.589 1.00 0.00 C ATOM 1210 CG LEU A 578 12.181 -1.605 -4.797 1.00 0.00 C ATOM 1211 CD1 LEU A 578 11.765 -0.442 -5.684 1.00 0.00 C ATOM 1212 CD2 LEU A 578 12.714 -1.078 -3.470 1.00 0.00 C ATOM 0 H LEU A 578 9.318 -4.547 -3.952 1.00 0.00 H new ATOM 0 HA LEU A 578 12.235 -4.295 -4.496 1.00 0.00 H new ATOM 0 HB2 LEU A 578 10.493 -2.697 -5.548 1.00 0.00 H new ATOM 0 HB3 LEU A 578 10.279 -2.077 -3.923 1.00 0.00 H new ATOM 0 HG LEU A 578 12.979 -2.167 -5.282 1.00 0.00 H new ATOM 0 HD11 LEU A 578 12.612 0.229 -5.825 1.00 0.00 H new ATOM 0 HD12 LEU A 578 11.437 -0.822 -6.652 1.00 0.00 H new ATOM 0 HD13 LEU A 578 10.947 0.101 -5.211 1.00 0.00 H new ATOM 0 HD21 LEU A 578 13.552 -0.406 -3.656 1.00 0.00 H new ATOM 0 HD22 LEU A 578 11.924 -0.537 -2.950 1.00 0.00 H new ATOM 0 HD23 LEU A 578 13.048 -1.913 -2.855 1.00 0.00 H new ATOM 1224 N VAL A 579 12.477 -4.679 -2.023 1.00 0.00 N ATOM 1225 CA VAL A 579 12.720 -4.782 -0.591 1.00 0.00 C ATOM 1226 C VAL A 579 13.560 -3.621 -0.075 1.00 0.00 C ATOM 1227 O VAL A 579 14.106 -2.838 -0.854 1.00 0.00 O ATOM 1228 CB VAL A 579 13.418 -6.107 -0.225 1.00 0.00 C ATOM 1229 CG1 VAL A 579 12.475 -7.280 -0.425 1.00 0.00 C ATOM 1230 CG2 VAL A 579 14.687 -6.292 -1.043 1.00 0.00 C ATOM 0 H VAL A 579 13.089 -5.257 -2.599 1.00 0.00 H new ATOM 0 HA VAL A 579 11.740 -4.751 -0.114 1.00 0.00 H new ATOM 0 HB VAL A 579 13.696 -6.067 0.828 1.00 0.00 H new ATOM 0 HG11 VAL A 579 12.986 -8.206 -0.162 1.00 0.00 H new ATOM 0 HG12 VAL A 579 11.599 -7.155 0.211 1.00 0.00 H new ATOM 0 HG13 VAL A 579 12.163 -7.322 -1.468 1.00 0.00 H new ATOM 0 HG21 VAL A 579 15.163 -7.233 -0.768 1.00 0.00 H new ATOM 0 HG22 VAL A 579 14.437 -6.308 -2.104 1.00 0.00 H new ATOM 0 HG23 VAL A 579 15.372 -5.468 -0.844 1.00 0.00 H new ATOM 1240 N SER A 580 13.648 -3.529 1.247 1.00 0.00 N ATOM 1241 CA SER A 580 14.434 -2.498 1.927 1.00 0.00 C ATOM 1242 C SER A 580 15.841 -2.354 1.338 1.00 0.00 C ATOM 1243 O SER A 580 16.324 -1.242 1.122 1.00 0.00 O ATOM 1244 CB SER A 580 14.527 -2.829 3.418 1.00 0.00 C ATOM 1245 OG SER A 580 15.007 -4.152 3.613 1.00 0.00 O ATOM 0 H SER A 580 13.174 -4.170 1.884 1.00 0.00 H new ATOM 0 HA SER A 580 13.924 -1.545 1.782 1.00 0.00 H new ATOM 0 HB2 SER A 580 15.192 -2.120 3.912 1.00 0.00 H new ATOM 0 HB3 SER A 580 13.546 -2.722 3.881 1.00 0.00 H new ATOM 0 HG SER A 580 14.385 -4.789 3.204 1.00 0.00 H new ATOM 1251 N GLY A 581 16.487 -3.484 1.064 1.00 0.00 N ATOM 1252 CA GLY A 581 17.848 -3.467 0.552 1.00 0.00 C ATOM 1253 C GLY A 581 17.938 -2.959 -0.874 1.00 0.00 C ATOM 1254 O GLY A 581 19.036 -2.777 -1.407 1.00 0.00 O ATOM 0 H GLY A 581 16.091 -4.416 1.188 1.00 0.00 H new ATOM 0 HA2 GLY A 581 18.465 -2.839 1.195 1.00 0.00 H new ATOM 0 HA3 GLY A 581 18.261 -4.475 0.600 1.00 0.00 H new ATOM 1258 N GLY A 582 16.786 -2.743 -1.492 1.00 0.00 N ATOM 1259 CA GLY A 582 16.745 -2.236 -2.845 1.00 0.00 C ATOM 1260 C GLY A 582 16.425 -0.756 -2.885 1.00 0.00 C ATOM 1261 O GLY A 582 16.481 -0.126 -3.942 1.00 0.00 O ATOM 0 H GLY A 582 15.871 -2.912 -1.074 1.00 0.00 H new ATOM 0 HA2 GLY A 582 17.706 -2.413 -3.328 1.00 0.00 H new ATOM 0 HA3 GLY A 582 15.996 -2.785 -3.416 1.00 0.00 H new ATOM 1265 N ILE A 583 16.084 -0.207 -1.728 1.00 0.00 N ATOM 1266 CA ILE A 583 15.737 1.200 -1.613 1.00 0.00 C ATOM 1267 C ILE A 583 17.000 2.058 -1.646 1.00 0.00 C ATOM 1268 O ILE A 583 17.770 2.091 -0.684 1.00 0.00 O ATOM 1269 CB ILE A 583 14.954 1.453 -0.300 1.00 0.00 C ATOM 1270 CG1 ILE A 583 13.751 0.506 -0.213 1.00 0.00 C ATOM 1271 CG2 ILE A 583 14.491 2.903 -0.190 1.00 0.00 C ATOM 1272 CD1 ILE A 583 13.035 0.552 1.120 1.00 0.00 C ATOM 0 H ILE A 583 16.040 -0.721 -0.848 1.00 0.00 H new ATOM 0 HA ILE A 583 15.104 1.474 -2.457 1.00 0.00 H new ATOM 0 HB ILE A 583 15.629 1.257 0.533 1.00 0.00 H new ATOM 0 HG12 ILE A 583 13.044 0.757 -1.004 1.00 0.00 H new ATOM 0 HG13 ILE A 583 14.088 -0.514 -0.399 1.00 0.00 H new ATOM 0 HG21 ILE A 583 13.946 3.041 0.744 1.00 0.00 H new ATOM 0 HG22 ILE A 583 15.358 3.564 -0.205 1.00 0.00 H new ATOM 0 HG23 ILE A 583 13.838 3.141 -1.030 1.00 0.00 H new ATOM 0 HD11 ILE A 583 12.196 -0.144 1.107 1.00 0.00 H new ATOM 0 HD12 ILE A 583 13.727 0.271 1.914 1.00 0.00 H new ATOM 0 HD13 ILE A 583 12.666 1.562 1.300 1.00 0.00 H new ATOM 1284 N GLY A 584 17.227 2.711 -2.776 1.00 0.00 N ATOM 1285 CA GLY A 584 18.393 3.561 -2.927 1.00 0.00 C ATOM 1286 C GLY A 584 18.041 5.031 -2.824 1.00 0.00 C ATOM 1287 O GLY A 584 17.069 5.387 -2.159 1.00 0.00 O ATOM 0 H GLY A 584 16.622 2.668 -3.596 1.00 0.00 H new ATOM 0 HA2 GLY A 584 19.127 3.309 -2.161 1.00 0.00 H new ATOM 0 HA3 GLY A 584 18.861 3.367 -3.892 1.00 0.00 H new ATOM 1291 N ALA A 585 18.829 5.883 -3.481 1.00 0.00 N ATOM 1292 CA ALA A 585 18.585 7.325 -3.477 1.00 0.00 C ATOM 1293 C ALA A 585 17.140 7.623 -3.851 1.00 0.00 C ATOM 1294 O ALA A 585 16.408 8.262 -3.095 1.00 0.00 O ATOM 1295 CB ALA A 585 19.535 8.023 -4.436 1.00 0.00 C ATOM 0 H ALA A 585 19.644 5.598 -4.024 1.00 0.00 H new ATOM 0 HA ALA A 585 18.765 7.704 -2.471 1.00 0.00 H new ATOM 0 HB1 ALA A 585 19.342 9.096 -4.423 1.00 0.00 H new ATOM 0 HB2 ALA A 585 20.564 7.836 -4.130 1.00 0.00 H new ATOM 0 HB3 ALA A 585 19.381 7.639 -5.444 1.00 0.00 H new ATOM 1301 N LEU A 586 16.740 7.140 -5.017 1.00 0.00 N ATOM 1302 CA LEU A 586 15.358 7.220 -5.452 1.00 0.00 C ATOM 1303 C LEU A 586 15.117 6.190 -6.547 1.00 0.00 C ATOM 1304 O LEU A 586 15.623 6.314 -7.666 1.00 0.00 O ATOM 1305 CB LEU A 586 15.010 8.636 -5.937 1.00 0.00 C ATOM 1306 CG LEU A 586 13.507 8.953 -6.021 1.00 0.00 C ATOM 1307 CD1 LEU A 586 13.285 10.456 -6.013 1.00 0.00 C ATOM 1308 CD2 LEU A 586 12.885 8.347 -7.272 1.00 0.00 C ATOM 0 H LEU A 586 17.362 6.684 -5.684 1.00 0.00 H new ATOM 0 HA LEU A 586 14.705 7.002 -4.607 1.00 0.00 H new ATOM 0 HB2 LEU A 586 15.479 9.357 -5.267 1.00 0.00 H new ATOM 0 HB3 LEU A 586 15.451 8.783 -6.923 1.00 0.00 H new ATOM 0 HG LEU A 586 13.023 8.512 -5.149 1.00 0.00 H new ATOM 0 HD11 LEU A 586 12.217 10.666 -6.073 1.00 0.00 H new ATOM 0 HD12 LEU A 586 13.687 10.878 -5.092 1.00 0.00 H new ATOM 0 HD13 LEU A 586 13.791 10.903 -6.868 1.00 0.00 H new ATOM 0 HD21 LEU A 586 11.822 8.588 -7.303 1.00 0.00 H new ATOM 0 HD22 LEU A 586 13.376 8.754 -8.156 1.00 0.00 H new ATOM 0 HD23 LEU A 586 13.011 7.264 -7.253 1.00 0.00 H new ATOM 1320 N VAL A 587 14.365 5.163 -6.207 1.00 0.00 N ATOM 1321 CA VAL A 587 14.060 4.097 -7.134 1.00 0.00 C ATOM 1322 C VAL A 587 12.567 4.057 -7.403 1.00 0.00 C ATOM 1323 O VAL A 587 11.758 3.978 -6.480 1.00 0.00 O ATOM 1324 CB VAL A 587 14.517 2.727 -6.599 1.00 0.00 C ATOM 1325 CG1 VAL A 587 14.155 1.616 -7.574 1.00 0.00 C ATOM 1326 CG2 VAL A 587 16.012 2.729 -6.328 1.00 0.00 C ATOM 0 H VAL A 587 13.950 5.046 -5.283 1.00 0.00 H new ATOM 0 HA VAL A 587 14.602 4.300 -8.058 1.00 0.00 H new ATOM 0 HB VAL A 587 13.996 2.540 -5.660 1.00 0.00 H new ATOM 0 HG11 VAL A 587 14.488 0.658 -7.174 1.00 0.00 H new ATOM 0 HG12 VAL A 587 13.074 1.594 -7.716 1.00 0.00 H new ATOM 0 HG13 VAL A 587 14.643 1.799 -8.531 1.00 0.00 H new ATOM 0 HG21 VAL A 587 16.315 1.752 -5.951 1.00 0.00 H new ATOM 0 HG22 VAL A 587 16.549 2.943 -7.252 1.00 0.00 H new ATOM 0 HG23 VAL A 587 16.246 3.493 -5.587 1.00 0.00 H new ATOM 1336 N ARG A 588 12.209 4.130 -8.665 1.00 0.00 N ATOM 1337 CA ARG A 588 10.812 4.115 -9.050 1.00 0.00 C ATOM 1338 C ARG A 588 10.384 2.723 -9.476 1.00 0.00 C ATOM 1339 O ARG A 588 11.015 2.090 -10.325 1.00 0.00 O ATOM 1340 CB ARG A 588 10.552 5.135 -10.155 1.00 0.00 C ATOM 1341 CG ARG A 588 10.585 6.571 -9.656 1.00 0.00 C ATOM 1342 CD ARG A 588 10.481 7.566 -10.796 1.00 0.00 C ATOM 1343 NE ARG A 588 11.675 7.560 -11.637 1.00 0.00 N ATOM 1344 CZ ARG A 588 11.896 8.423 -12.628 1.00 0.00 C ATOM 1345 NH1 ARG A 588 10.982 9.338 -12.930 1.00 0.00 N1+ ATOM 1346 NH2 ARG A 588 13.028 8.367 -13.317 1.00 0.00 N ATOM 0 H ARG A 588 12.864 4.200 -9.444 1.00 0.00 H new ATOM 0 HA ARG A 588 10.212 4.395 -8.184 1.00 0.00 H new ATOM 0 HB2 ARG A 588 11.299 5.011 -10.939 1.00 0.00 H new ATOM 0 HB3 ARG A 588 9.580 4.935 -10.606 1.00 0.00 H new ATOM 0 HG2 ARG A 588 9.764 6.732 -8.957 1.00 0.00 H new ATOM 0 HG3 ARG A 588 11.510 6.744 -9.106 1.00 0.00 H new ATOM 0 HD2 ARG A 588 9.608 7.331 -11.404 1.00 0.00 H new ATOM 0 HD3 ARG A 588 10.327 8.566 -10.391 1.00 0.00 H new ATOM 0 HE ARG A 588 12.385 6.850 -11.454 1.00 0.00 H new ATOM 0 HH11 ARG A 588 10.110 9.381 -12.403 1.00 0.00 H new ATOM 0 HH12 ARG A 588 11.152 9.998 -13.689 1.00 0.00 H new ATOM 0 HH21 ARG A 588 13.730 7.663 -13.088 1.00 0.00 H new ATOM 0 HH22 ARG A 588 13.197 9.028 -14.075 1.00 0.00 H new ATOM 1360 N LEU A 589 9.320 2.261 -8.856 1.00 0.00 N ATOM 1361 CA LEU A 589 8.774 0.945 -9.097 1.00 0.00 C ATOM 1362 C LEU A 589 7.385 1.101 -9.688 1.00 0.00 C ATOM 1363 O LEU A 589 6.661 2.012 -9.314 1.00 0.00 O ATOM 1364 CB LEU A 589 8.714 0.188 -7.768 1.00 0.00 C ATOM 1365 CG LEU A 589 7.904 -1.107 -7.763 1.00 0.00 C ATOM 1366 CD1 LEU A 589 8.620 -2.194 -8.539 1.00 0.00 C ATOM 1367 CD2 LEU A 589 7.636 -1.555 -6.336 1.00 0.00 C ATOM 0 H LEU A 589 8.803 2.798 -8.160 1.00 0.00 H new ATOM 0 HA LEU A 589 9.397 0.385 -9.794 1.00 0.00 H new ATOM 0 HB2 LEU A 589 9.733 -0.045 -7.461 1.00 0.00 H new ATOM 0 HB3 LEU A 589 8.298 0.855 -7.013 1.00 0.00 H new ATOM 0 HG LEU A 589 6.949 -0.917 -8.253 1.00 0.00 H new ATOM 0 HD11 LEU A 589 8.024 -3.106 -8.521 1.00 0.00 H new ATOM 0 HD12 LEU A 589 8.760 -1.872 -9.571 1.00 0.00 H new ATOM 0 HD13 LEU A 589 9.591 -2.386 -8.084 1.00 0.00 H new ATOM 0 HD21 LEU A 589 7.058 -2.479 -6.347 1.00 0.00 H new ATOM 0 HD22 LEU A 589 8.583 -1.726 -5.824 1.00 0.00 H new ATOM 0 HD23 LEU A 589 7.074 -0.782 -5.811 1.00 0.00 H new ATOM 1379 N LYS A 590 7.021 0.249 -10.620 1.00 0.00 N ATOM 1380 CA LYS A 590 5.701 0.318 -11.213 1.00 0.00 C ATOM 1381 C LYS A 590 4.644 -0.146 -10.229 1.00 0.00 C ATOM 1382 O LYS A 590 4.954 -0.800 -9.237 1.00 0.00 O ATOM 1383 CB LYS A 590 5.635 -0.538 -12.461 1.00 0.00 C ATOM 1384 CG LYS A 590 6.523 -0.057 -13.585 1.00 0.00 C ATOM 1385 CD LYS A 590 6.196 -0.784 -14.872 1.00 0.00 C ATOM 1386 CE LYS A 590 6.452 -2.283 -14.759 1.00 0.00 C ATOM 1387 NZ LYS A 590 7.855 -2.589 -14.367 1.00 0.00 N1+ ATOM 0 H LYS A 590 7.615 -0.496 -10.983 1.00 0.00 H new ATOM 0 HA LYS A 590 5.508 1.358 -11.478 1.00 0.00 H new ATOM 0 HB2 LYS A 590 5.914 -1.560 -12.203 1.00 0.00 H new ATOM 0 HB3 LYS A 590 4.604 -0.568 -12.814 1.00 0.00 H new ATOM 0 HG2 LYS A 590 6.393 1.016 -13.724 1.00 0.00 H new ATOM 0 HG3 LYS A 590 7.569 -0.220 -13.325 1.00 0.00 H new ATOM 0 HD2 LYS A 590 5.151 -0.613 -15.130 1.00 0.00 H new ATOM 0 HD3 LYS A 590 6.797 -0.373 -15.684 1.00 0.00 H new ATOM 0 HE2 LYS A 590 5.770 -2.711 -14.024 1.00 0.00 H new ATOM 0 HE3 LYS A 590 6.232 -2.760 -15.714 1.00 0.00 H new ATOM 0 HZ1 LYS A 590 8.044 -3.601 -14.515 1.00 0.00 H new ATOM 0 HZ2 LYS A 590 8.508 -2.026 -14.948 1.00 0.00 H new ATOM 0 HZ3 LYS A 590 7.994 -2.354 -13.363 1.00 0.00 H new ATOM 1401 N SER A 591 3.400 0.188 -10.513 1.00 0.00 N ATOM 1402 CA SER A 591 2.296 -0.212 -9.653 1.00 0.00 C ATOM 1403 C SER A 591 1.207 -0.890 -10.482 1.00 0.00 C ATOM 1404 O SER A 591 1.354 -1.058 -11.693 1.00 0.00 O ATOM 1405 CB SER A 591 1.710 1.008 -8.937 1.00 0.00 C ATOM 1406 OG SER A 591 1.045 1.843 -9.864 1.00 0.00 O ATOM 0 H SER A 591 3.126 0.734 -11.330 1.00 0.00 H new ATOM 0 HA SER A 591 2.673 -0.913 -8.909 1.00 0.00 H new ATOM 0 HB2 SER A 591 1.014 0.685 -8.162 1.00 0.00 H new ATOM 0 HB3 SER A 591 2.505 1.564 -8.440 1.00 0.00 H new ATOM 0 HG SER A 591 1.698 2.227 -10.485 1.00 0.00 H new ATOM 1412 N LEU A 592 0.110 -1.248 -9.832 1.00 0.00 N ATOM 1413 CA LEU A 592 -1.015 -1.889 -10.514 1.00 0.00 C ATOM 1414 C LEU A 592 -1.909 -0.861 -11.198 1.00 0.00 C ATOM 1415 O LEU A 592 -2.367 -1.083 -12.317 1.00 0.00 O ATOM 1416 CB LEU A 592 -1.856 -2.711 -9.538 1.00 0.00 C ATOM 1417 CG LEU A 592 -1.127 -3.836 -8.804 1.00 0.00 C ATOM 1418 CD1 LEU A 592 -2.113 -4.634 -7.967 1.00 0.00 C ATOM 1419 CD2 LEU A 592 -0.385 -4.738 -9.779 1.00 0.00 C ATOM 0 H LEU A 592 -0.030 -1.107 -8.831 1.00 0.00 H new ATOM 0 HA LEU A 592 -0.591 -2.551 -11.269 1.00 0.00 H new ATOM 0 HB2 LEU A 592 -2.279 -2.034 -8.795 1.00 0.00 H new ATOM 0 HB3 LEU A 592 -2.692 -3.145 -10.087 1.00 0.00 H new ATOM 0 HG LEU A 592 -0.385 -3.392 -8.141 1.00 0.00 H new ATOM 0 HD11 LEU A 592 -1.585 -5.434 -7.447 1.00 0.00 H new ATOM 0 HD12 LEU A 592 -2.586 -3.977 -7.237 1.00 0.00 H new ATOM 0 HD13 LEU A 592 -2.876 -5.064 -8.616 1.00 0.00 H new ATOM 0 HD21 LEU A 592 0.124 -5.529 -9.228 1.00 0.00 H new ATOM 0 HD22 LEU A 592 -1.095 -5.181 -10.477 1.00 0.00 H new ATOM 0 HD23 LEU A 592 0.349 -4.151 -10.332 1.00 0.00 H new ATOM 1431 N GLN A 593 -2.166 0.257 -10.512 1.00 0.00 N ATOM 1432 CA GLN A 593 -3.012 1.323 -11.064 1.00 0.00 C ATOM 1433 C GLN A 593 -2.420 1.845 -12.364 1.00 0.00 C ATOM 1434 O GLN A 593 -3.132 2.294 -13.262 1.00 0.00 O ATOM 1435 CB GLN A 593 -3.143 2.469 -10.063 1.00 0.00 C ATOM 1436 CG GLN A 593 -3.994 3.619 -10.570 1.00 0.00 C ATOM 1437 CD GLN A 593 -3.901 4.860 -9.701 1.00 0.00 C ATOM 1438 OE1 GLN A 593 -3.061 5.726 -9.930 1.00 0.00 O ATOM 1439 NE2 GLN A 593 -4.753 4.954 -8.694 1.00 0.00 N ATOM 0 H GLN A 593 -1.803 0.448 -9.578 1.00 0.00 H new ATOM 0 HA GLN A 593 -4.001 0.910 -11.262 1.00 0.00 H new ATOM 0 HB2 GLN A 593 -3.576 2.086 -9.139 1.00 0.00 H new ATOM 0 HB3 GLN A 593 -2.149 2.843 -9.818 1.00 0.00 H new ATOM 0 HG2 GLN A 593 -3.686 3.870 -11.585 1.00 0.00 H new ATOM 0 HG3 GLN A 593 -5.034 3.297 -10.623 1.00 0.00 H new ATOM 0 HE21 GLN A 593 -5.437 4.215 -8.534 1.00 0.00 H new ATOM 0 HE22 GLN A 593 -4.726 5.766 -8.077 1.00 0.00 H new ATOM 1448 N GLY A 594 -1.107 1.773 -12.454 1.00 0.00 N ATOM 1449 CA GLY A 594 -0.449 2.021 -13.718 1.00 0.00 C ATOM 1450 C GLY A 594 0.623 3.084 -13.645 1.00 0.00 C ATOM 1451 O GLY A 594 1.393 3.247 -14.590 1.00 0.00 O ATOM 0 H GLY A 594 -0.484 1.548 -11.679 1.00 0.00 H new ATOM 0 HA2 GLY A 594 -0.004 1.092 -14.075 1.00 0.00 H new ATOM 0 HA3 GLY A 594 -1.195 2.320 -14.454 1.00 0.00 H new ATOM 1455 N ASP A 595 0.689 3.813 -12.537 1.00 0.00 N ATOM 1456 CA ASP A 595 1.706 4.842 -12.396 1.00 0.00 C ATOM 1457 C ASP A 595 2.929 4.273 -11.674 1.00 0.00 C ATOM 1458 O ASP A 595 3.156 3.060 -11.683 1.00 0.00 O ATOM 1459 CB ASP A 595 1.152 6.065 -11.656 1.00 0.00 C ATOM 1460 CG ASP A 595 1.913 7.336 -12.003 1.00 0.00 C ATOM 1461 OD1 ASP A 595 1.603 7.952 -13.045 1.00 0.00 O1- ATOM 1462 OD2 ASP A 595 2.843 7.706 -11.251 1.00 0.00 O ATOM 0 H ASP A 595 0.062 3.713 -11.738 1.00 0.00 H new ATOM 0 HA ASP A 595 2.009 5.169 -13.391 1.00 0.00 H new ATOM 0 HB2 ASP A 595 0.099 6.194 -11.906 1.00 0.00 H new ATOM 0 HB3 ASP A 595 1.205 5.893 -10.581 1.00 0.00 H new ATOM 1467 N LYS A 596 3.706 5.143 -11.053 1.00 0.00 N ATOM 1468 CA LYS A 596 4.983 4.765 -10.470 1.00 0.00 C ATOM 1469 C LYS A 596 4.988 4.987 -8.958 1.00 0.00 C ATOM 1470 O LYS A 596 4.422 5.960 -8.461 1.00 0.00 O ATOM 1471 CB LYS A 596 6.086 5.612 -11.108 1.00 0.00 C ATOM 1472 CG LYS A 596 5.849 7.098 -10.900 1.00 0.00 C ATOM 1473 CD LYS A 596 6.734 7.975 -11.758 1.00 0.00 C ATOM 1474 CE LYS A 596 6.280 9.422 -11.657 1.00 0.00 C ATOM 1475 NZ LYS A 596 4.859 9.586 -12.069 1.00 0.00 N1+ ATOM 0 H LYS A 596 3.471 6.129 -10.938 1.00 0.00 H new ATOM 0 HA LYS A 596 5.153 3.705 -10.659 1.00 0.00 H new ATOM 0 HB2 LYS A 596 7.050 5.335 -10.681 1.00 0.00 H new ATOM 0 HB3 LYS A 596 6.137 5.398 -12.176 1.00 0.00 H new ATOM 0 HG2 LYS A 596 4.805 7.325 -11.117 1.00 0.00 H new ATOM 0 HG3 LYS A 596 6.017 7.341 -9.851 1.00 0.00 H new ATOM 0 HD2 LYS A 596 7.771 7.887 -11.435 1.00 0.00 H new ATOM 0 HD3 LYS A 596 6.694 7.643 -12.796 1.00 0.00 H new ATOM 0 HE2 LYS A 596 6.404 9.771 -10.632 1.00 0.00 H new ATOM 0 HE3 LYS A 596 6.915 10.047 -12.285 1.00 0.00 H new ATOM 0 HZ1 LYS A 596 4.663 10.592 -12.248 1.00 0.00 H new ATOM 0 HZ2 LYS A 596 4.684 9.039 -12.936 1.00 0.00 H new ATOM 0 HZ3 LYS A 596 4.236 9.242 -11.311 1.00 0.00 H new ATOM 1489 N LEU A 597 5.621 4.081 -8.239 1.00 0.00 N ATOM 1490 CA LEU A 597 5.885 4.271 -6.826 1.00 0.00 C ATOM 1491 C LEU A 597 7.255 4.913 -6.651 1.00 0.00 C ATOM 1492 O LEU A 597 8.280 4.336 -7.021 1.00 0.00 O ATOM 1493 CB LEU A 597 5.818 2.940 -6.075 1.00 0.00 C ATOM 1494 CG LEU A 597 4.442 2.267 -6.081 1.00 0.00 C ATOM 1495 CD1 LEU A 597 4.451 1.009 -5.229 1.00 0.00 C ATOM 1496 CD2 LEU A 597 3.380 3.232 -5.584 1.00 0.00 C ATOM 0 H LEU A 597 5.965 3.197 -8.615 1.00 0.00 H new ATOM 0 HA LEU A 597 5.122 4.928 -6.408 1.00 0.00 H new ATOM 0 HB2 LEU A 597 6.544 2.255 -6.513 1.00 0.00 H new ATOM 0 HB3 LEU A 597 6.121 3.107 -5.041 1.00 0.00 H new ATOM 0 HG LEU A 597 4.206 1.983 -7.107 1.00 0.00 H new ATOM 0 HD11 LEU A 597 3.463 0.549 -5.249 1.00 0.00 H new ATOM 0 HD12 LEU A 597 5.186 0.307 -5.624 1.00 0.00 H new ATOM 0 HD13 LEU A 597 4.710 1.267 -4.202 1.00 0.00 H new ATOM 0 HD21 LEU A 597 2.408 2.740 -5.594 1.00 0.00 H new ATOM 0 HD22 LEU A 597 3.619 3.543 -4.567 1.00 0.00 H new ATOM 0 HD23 LEU A 597 3.350 4.107 -6.234 1.00 0.00 H new ATOM 1508 N GLU A 598 7.263 6.110 -6.100 1.00 0.00 N ATOM 1509 CA GLU A 598 8.481 6.889 -5.973 1.00 0.00 C ATOM 1510 C GLU A 598 9.155 6.606 -4.632 1.00 0.00 C ATOM 1511 O GLU A 598 8.917 7.304 -3.651 1.00 0.00 O ATOM 1512 CB GLU A 598 8.139 8.371 -6.114 1.00 0.00 C ATOM 1513 CG GLU A 598 9.340 9.285 -6.248 1.00 0.00 C ATOM 1514 CD GLU A 598 8.925 10.715 -6.528 1.00 0.00 C ATOM 1515 OE1 GLU A 598 8.760 11.065 -7.714 1.00 0.00 O1- ATOM 1516 OE2 GLU A 598 8.737 11.488 -5.563 1.00 0.00 O ATOM 0 H GLU A 598 6.431 6.569 -5.729 1.00 0.00 H new ATOM 0 HA GLU A 598 9.182 6.609 -6.760 1.00 0.00 H new ATOM 0 HB2 GLU A 598 7.500 8.502 -6.987 1.00 0.00 H new ATOM 0 HB3 GLU A 598 7.558 8.681 -5.245 1.00 0.00 H new ATOM 0 HG2 GLU A 598 9.929 9.249 -5.331 1.00 0.00 H new ATOM 0 HG3 GLU A 598 9.982 8.928 -7.053 1.00 0.00 H new ATOM 1523 N VAL A 599 9.967 5.558 -4.595 1.00 0.00 N ATOM 1524 CA VAL A 599 10.611 5.123 -3.370 1.00 0.00 C ATOM 1525 C VAL A 599 11.991 5.748 -3.234 1.00 0.00 C ATOM 1526 O VAL A 599 12.799 5.678 -4.153 1.00 0.00 O ATOM 1527 CB VAL A 599 10.741 3.586 -3.327 1.00 0.00 C ATOM 1528 CG1 VAL A 599 11.286 3.122 -1.984 1.00 0.00 C ATOM 1529 CG2 VAL A 599 9.399 2.934 -3.616 1.00 0.00 C ATOM 0 H VAL A 599 10.195 4.990 -5.411 1.00 0.00 H new ATOM 0 HA VAL A 599 9.985 5.449 -2.539 1.00 0.00 H new ATOM 0 HB VAL A 599 11.448 3.282 -4.098 1.00 0.00 H new ATOM 0 HG11 VAL A 599 11.368 2.035 -1.980 1.00 0.00 H new ATOM 0 HG12 VAL A 599 12.270 3.560 -1.820 1.00 0.00 H new ATOM 0 HG13 VAL A 599 10.611 3.438 -1.189 1.00 0.00 H new ATOM 0 HG21 VAL A 599 9.506 1.850 -3.582 1.00 0.00 H new ATOM 0 HG22 VAL A 599 8.672 3.250 -2.868 1.00 0.00 H new ATOM 0 HG23 VAL A 599 9.054 3.234 -4.606 1.00 0.00 H new ATOM 1539 N SER A 600 12.266 6.355 -2.092 1.00 0.00 N ATOM 1540 CA SER A 600 13.540 7.017 -1.882 1.00 0.00 C ATOM 1541 C SER A 600 14.043 6.772 -0.469 1.00 0.00 C ATOM 1542 O SER A 600 13.251 6.593 0.450 1.00 0.00 O ATOM 1543 CB SER A 600 13.389 8.516 -2.150 1.00 0.00 C ATOM 1544 OG SER A 600 12.140 8.994 -1.672 1.00 0.00 O ATOM 0 H SER A 600 11.626 6.403 -1.299 1.00 0.00 H new ATOM 0 HA SER A 600 14.274 6.605 -2.575 1.00 0.00 H new ATOM 0 HB2 SER A 600 14.200 9.059 -1.666 1.00 0.00 H new ATOM 0 HB3 SER A 600 13.471 8.708 -3.220 1.00 0.00 H new ATOM 0 HG SER A 600 12.066 9.954 -1.853 1.00 0.00 H new ATOM 1550 N LEU A 601 15.354 6.730 -0.306 1.00 0.00 N ATOM 1551 CA LEU A 601 15.953 6.577 1.009 1.00 0.00 C ATOM 1552 C LEU A 601 16.822 7.783 1.315 1.00 0.00 C ATOM 1553 O LEU A 601 17.850 7.995 0.672 1.00 0.00 O ATOM 1554 CB LEU A 601 16.800 5.304 1.064 1.00 0.00 C ATOM 1555 CG LEU A 601 17.450 5.009 2.417 1.00 0.00 C ATOM 1556 CD1 LEU A 601 16.384 4.772 3.474 1.00 0.00 C ATOM 1557 CD2 LEU A 601 18.380 3.810 2.310 1.00 0.00 C ATOM 0 H LEU A 601 16.026 6.800 -1.070 1.00 0.00 H new ATOM 0 HA LEU A 601 15.159 6.501 1.752 1.00 0.00 H new ATOM 0 HB2 LEU A 601 16.171 4.457 0.789 1.00 0.00 H new ATOM 0 HB3 LEU A 601 17.584 5.376 0.311 1.00 0.00 H new ATOM 0 HG LEU A 601 18.043 5.874 2.715 1.00 0.00 H new ATOM 0 HD11 LEU A 601 16.861 4.563 4.432 1.00 0.00 H new ATOM 0 HD12 LEU A 601 15.759 5.660 3.566 1.00 0.00 H new ATOM 0 HD13 LEU A 601 15.766 3.922 3.184 1.00 0.00 H new ATOM 0 HD21 LEU A 601 18.834 3.614 3.281 1.00 0.00 H new ATOM 0 HD22 LEU A 601 17.812 2.936 1.992 1.00 0.00 H new ATOM 0 HD23 LEU A 601 19.162 4.020 1.580 1.00 0.00 H new ATOM 1569 N LYS A 602 16.412 8.575 2.289 1.00 0.00 N ATOM 1570 CA LYS A 602 17.178 9.748 2.669 1.00 0.00 C ATOM 1571 C LYS A 602 17.377 9.799 4.173 1.00 0.00 C ATOM 1572 O LYS A 602 16.430 10.018 4.931 1.00 0.00 O ATOM 1573 CB LYS A 602 16.516 11.036 2.169 1.00 0.00 C ATOM 1574 CG LYS A 602 16.566 11.205 0.658 1.00 0.00 C ATOM 1575 CD LYS A 602 16.300 12.644 0.254 1.00 0.00 C ATOM 1576 CE LYS A 602 16.581 12.873 -1.223 1.00 0.00 C ATOM 1577 NZ LYS A 602 16.702 14.322 -1.541 1.00 0.00 N1+ ATOM 0 H LYS A 602 15.559 8.429 2.828 1.00 0.00 H new ATOM 0 HA LYS A 602 18.156 9.670 2.194 1.00 0.00 H new ATOM 0 HB2 LYS A 602 15.475 11.048 2.492 1.00 0.00 H new ATOM 0 HB3 LYS A 602 17.005 11.890 2.637 1.00 0.00 H new ATOM 0 HG2 LYS A 602 17.543 10.896 0.288 1.00 0.00 H new ATOM 0 HG3 LYS A 602 15.828 10.552 0.192 1.00 0.00 H new ATOM 0 HD2 LYS A 602 15.262 12.897 0.471 1.00 0.00 H new ATOM 0 HD3 LYS A 602 16.922 13.311 0.851 1.00 0.00 H new ATOM 0 HE2 LYS A 602 17.502 12.361 -1.502 1.00 0.00 H new ATOM 0 HE3 LYS A 602 15.780 12.435 -1.818 1.00 0.00 H new ATOM 0 HZ1 LYS A 602 16.893 14.440 -2.556 1.00 0.00 H new ATOM 0 HZ2 LYS A 602 15.814 14.806 -1.298 1.00 0.00 H new ATOM 0 HZ3 LYS A 602 17.483 14.734 -0.991 1.00 0.00 H new ATOM 1591 N ASN A 603 18.623 9.586 4.583 1.00 0.00 N ATOM 1592 CA ASN A 603 19.011 9.593 5.992 1.00 0.00 C ATOM 1593 C ASN A 603 18.238 8.528 6.762 1.00 0.00 C ATOM 1594 O ASN A 603 17.574 8.812 7.760 1.00 0.00 O ATOM 1595 CB ASN A 603 18.804 10.978 6.613 1.00 0.00 C ATOM 1596 CG ASN A 603 19.565 11.142 7.916 1.00 0.00 C ATOM 1597 OD1 ASN A 603 19.027 10.926 9.000 1.00 0.00 O ATOM 1598 ND2 ASN A 603 20.834 11.504 7.815 1.00 0.00 N ATOM 0 H ASN A 603 19.397 9.403 3.945 1.00 0.00 H new ATOM 0 HA ASN A 603 20.073 9.358 6.055 1.00 0.00 H new ATOM 0 HB2 ASN A 603 19.127 11.743 5.907 1.00 0.00 H new ATOM 0 HB3 ASN A 603 17.741 11.139 6.792 1.00 0.00 H new ATOM 0 HD21 ASN A 603 21.402 11.613 8.655 1.00 0.00 H new ATOM 0 HD22 ASN A 603 21.244 11.674 6.897 1.00 0.00 H new ATOM 1605 N ASN A 604 18.308 7.302 6.243 1.00 0.00 N ATOM 1606 CA ASN A 604 17.692 6.121 6.864 1.00 0.00 C ATOM 1607 C ASN A 604 16.161 6.168 6.787 1.00 0.00 C ATOM 1608 O ASN A 604 15.484 5.209 7.157 1.00 0.00 O ATOM 1609 CB ASN A 604 18.144 5.974 8.326 1.00 0.00 C ATOM 1610 CG ASN A 604 17.996 4.553 8.845 1.00 0.00 C ATOM 1611 OD1 ASN A 604 18.351 3.574 8.021 1.00 0.00 O flip ATOM 1612 ND2 ASN A 604 17.612 4.336 9.995 1.00 0.00 N flip ATOM 0 H ASN A 604 18.797 7.095 5.372 1.00 0.00 H new ATOM 0 HA ASN A 604 18.028 5.251 6.300 1.00 0.00 H new ATOM 0 HB2 ASN A 604 19.186 6.281 8.413 1.00 0.00 H new ATOM 0 HB3 ASN A 604 17.560 6.648 8.952 1.00 0.00 H new ATOM 0 HD21 ASN A 604 17.347 5.114 10.600 1.00 0.00 H new ATOM 0 HD22 ASN A 604 17.559 3.379 10.343 1.00 0.00 H new ATOM 1619 N VAL A 605 15.616 7.274 6.298 1.00 0.00 N ATOM 1620 CA VAL A 605 14.176 7.425 6.177 1.00 0.00 C ATOM 1621 C VAL A 605 13.722 7.079 4.766 1.00 0.00 C ATOM 1622 O VAL A 605 14.165 7.690 3.791 1.00 0.00 O ATOM 1623 CB VAL A 605 13.720 8.861 6.516 1.00 0.00 C ATOM 1624 CG1 VAL A 605 12.206 8.987 6.431 1.00 0.00 C ATOM 1625 CG2 VAL A 605 14.213 9.275 7.893 1.00 0.00 C ATOM 0 H VAL A 605 16.153 8.080 5.979 1.00 0.00 H new ATOM 0 HA VAL A 605 13.721 6.740 6.892 1.00 0.00 H new ATOM 0 HB VAL A 605 14.159 9.533 5.779 1.00 0.00 H new ATOM 0 HG11 VAL A 605 11.912 10.008 6.674 1.00 0.00 H new ATOM 0 HG12 VAL A 605 11.877 8.746 5.420 1.00 0.00 H new ATOM 0 HG13 VAL A 605 11.743 8.298 7.137 1.00 0.00 H new ATOM 0 HG21 VAL A 605 13.879 10.290 8.109 1.00 0.00 H new ATOM 0 HG22 VAL A 605 13.812 8.594 8.643 1.00 0.00 H new ATOM 0 HG23 VAL A 605 15.302 9.239 7.916 1.00 0.00 H new ATOM 1635 N VAL A 606 12.848 6.091 4.663 1.00 0.00 N ATOM 1636 CA VAL A 606 12.307 5.680 3.380 1.00 0.00 C ATOM 1637 C VAL A 606 11.100 6.540 3.028 1.00 0.00 C ATOM 1638 O VAL A 606 10.307 6.896 3.896 1.00 0.00 O ATOM 1639 CB VAL A 606 11.886 4.194 3.389 1.00 0.00 C ATOM 1640 CG1 VAL A 606 11.418 3.758 2.010 1.00 0.00 C ATOM 1641 CG2 VAL A 606 13.025 3.309 3.868 1.00 0.00 C ATOM 0 H VAL A 606 12.497 5.557 5.458 1.00 0.00 H new ATOM 0 HA VAL A 606 13.091 5.810 2.634 1.00 0.00 H new ATOM 0 HB VAL A 606 11.054 4.086 4.085 1.00 0.00 H new ATOM 0 HG11 VAL A 606 11.126 2.708 2.040 1.00 0.00 H new ATOM 0 HG12 VAL A 606 10.564 4.363 1.707 1.00 0.00 H new ATOM 0 HG13 VAL A 606 12.228 3.889 1.293 1.00 0.00 H new ATOM 0 HG21 VAL A 606 12.703 2.268 3.865 1.00 0.00 H new ATOM 0 HG22 VAL A 606 13.881 3.426 3.203 1.00 0.00 H new ATOM 0 HG23 VAL A 606 13.309 3.598 4.880 1.00 0.00 H new ATOM 1651 N SER A 607 10.981 6.897 1.765 1.00 0.00 N ATOM 1652 CA SER A 607 9.841 7.655 1.296 1.00 0.00 C ATOM 1653 C SER A 607 9.269 7.034 0.035 1.00 0.00 C ATOM 1654 O SER A 607 10.005 6.518 -0.794 1.00 0.00 O ATOM 1655 CB SER A 607 10.242 9.110 1.057 1.00 0.00 C ATOM 1656 OG SER A 607 10.779 9.678 2.238 1.00 0.00 O ATOM 0 H SER A 607 11.665 6.672 1.042 1.00 0.00 H new ATOM 0 HA SER A 607 9.065 7.633 2.061 1.00 0.00 H new ATOM 0 HB2 SER A 607 10.977 9.163 0.254 1.00 0.00 H new ATOM 0 HB3 SER A 607 9.374 9.684 0.733 1.00 0.00 H new ATOM 0 HG SER A 607 11.032 10.609 2.067 1.00 0.00 H new ATOM 1662 N VAL A 608 7.953 7.053 -0.089 1.00 0.00 N ATOM 1663 CA VAL A 608 7.290 6.527 -1.261 1.00 0.00 C ATOM 1664 C VAL A 608 6.214 7.495 -1.730 1.00 0.00 C ATOM 1665 O VAL A 608 5.339 7.889 -0.959 1.00 0.00 O ATOM 1666 CB VAL A 608 6.672 5.139 -0.994 1.00 0.00 C ATOM 1667 CG1 VAL A 608 5.698 5.182 0.175 1.00 0.00 C ATOM 1668 CG2 VAL A 608 5.995 4.622 -2.249 1.00 0.00 C ATOM 0 H VAL A 608 7.321 7.431 0.617 1.00 0.00 H new ATOM 0 HA VAL A 608 8.041 6.411 -2.042 1.00 0.00 H new ATOM 0 HB VAL A 608 7.474 4.452 -0.722 1.00 0.00 H new ATOM 0 HG11 VAL A 608 5.280 4.188 0.337 1.00 0.00 H new ATOM 0 HG12 VAL A 608 6.222 5.506 1.074 1.00 0.00 H new ATOM 0 HG13 VAL A 608 4.893 5.882 -0.048 1.00 0.00 H new ATOM 0 HG21 VAL A 608 5.562 3.642 -2.051 1.00 0.00 H new ATOM 0 HG22 VAL A 608 5.207 5.313 -2.549 1.00 0.00 H new ATOM 0 HG23 VAL A 608 6.729 4.539 -3.051 1.00 0.00 H new ATOM 1678 N ASN A 609 6.312 7.910 -2.987 1.00 0.00 N ATOM 1679 CA ASN A 609 5.336 8.818 -3.585 1.00 0.00 C ATOM 1680 C ASN A 609 5.328 10.136 -2.818 1.00 0.00 C ATOM 1681 O ASN A 609 4.296 10.798 -2.700 1.00 0.00 O ATOM 1682 CB ASN A 609 3.940 8.183 -3.584 1.00 0.00 C ATOM 1683 CG ASN A 609 3.937 6.789 -4.161 1.00 0.00 C ATOM 1684 OD1 ASN A 609 4.742 6.456 -5.029 1.00 0.00 O ATOM 1685 ND2 ASN A 609 3.037 5.963 -3.665 1.00 0.00 N ATOM 0 H ASN A 609 7.063 7.630 -3.618 1.00 0.00 H new ATOM 0 HA ASN A 609 5.617 9.012 -4.620 1.00 0.00 H new ATOM 0 HB2 ASN A 609 3.560 8.150 -2.563 1.00 0.00 H new ATOM 0 HB3 ASN A 609 3.259 8.811 -4.158 1.00 0.00 H new ATOM 0 HD21 ASN A 609 2.988 5.001 -4.001 1.00 0.00 H new ATOM 0 HD22 ASN A 609 2.390 6.286 -2.946 1.00 0.00 H new ATOM 1692 N LYS A 610 6.511 10.491 -2.297 1.00 0.00 N ATOM 1693 CA LYS A 610 6.730 11.727 -1.537 1.00 0.00 C ATOM 1694 C LYS A 610 6.180 11.623 -0.110 1.00 0.00 C ATOM 1695 O LYS A 610 6.294 12.565 0.677 1.00 0.00 O ATOM 1696 CB LYS A 610 6.135 12.933 -2.273 1.00 0.00 C ATOM 1697 CG LYS A 610 6.778 13.182 -3.627 1.00 0.00 C ATOM 1698 CD LYS A 610 6.010 14.206 -4.444 1.00 0.00 C ATOM 1699 CE LYS A 610 6.664 14.440 -5.798 1.00 0.00 C ATOM 1700 NZ LYS A 610 6.799 13.182 -6.587 1.00 0.00 N1+ ATOM 0 H LYS A 610 7.351 9.921 -2.393 1.00 0.00 H new ATOM 0 HA LYS A 610 7.807 11.875 -1.456 1.00 0.00 H new ATOM 0 HB2 LYS A 610 5.065 12.776 -2.409 1.00 0.00 H new ATOM 0 HB3 LYS A 610 6.251 13.822 -1.654 1.00 0.00 H new ATOM 0 HG2 LYS A 610 7.802 13.527 -3.484 1.00 0.00 H new ATOM 0 HG3 LYS A 610 6.832 12.244 -4.180 1.00 0.00 H new ATOM 0 HD2 LYS A 610 4.985 13.864 -4.588 1.00 0.00 H new ATOM 0 HD3 LYS A 610 5.959 15.147 -3.896 1.00 0.00 H new ATOM 0 HE2 LYS A 610 6.073 15.160 -6.365 1.00 0.00 H new ATOM 0 HE3 LYS A 610 7.650 14.882 -5.651 1.00 0.00 H new ATOM 0 HZ1 LYS A 610 7.139 13.407 -7.544 1.00 0.00 H new ATOM 0 HZ2 LYS A 610 7.478 12.549 -6.118 1.00 0.00 H new ATOM 0 HZ3 LYS A 610 5.874 12.711 -6.650 1.00 0.00 H new ATOM 1714 N GLU A 611 5.603 10.472 0.221 1.00 0.00 N ATOM 1715 CA GLU A 611 5.134 10.204 1.577 1.00 0.00 C ATOM 1716 C GLU A 611 6.159 9.351 2.324 1.00 0.00 C ATOM 1717 O GLU A 611 6.625 8.336 1.809 1.00 0.00 O ATOM 1718 CB GLU A 611 3.786 9.475 1.563 1.00 0.00 C ATOM 1719 CG GLU A 611 2.641 10.244 0.916 1.00 0.00 C ATOM 1720 CD GLU A 611 2.397 11.613 1.531 1.00 0.00 C ATOM 1721 OE1 GLU A 611 3.187 12.544 1.272 1.00 0.00 O ATOM 1722 OE2 GLU A 611 1.392 11.777 2.256 1.00 0.00 O1- ATOM 0 H GLU A 611 5.448 9.706 -0.435 1.00 0.00 H new ATOM 0 HA GLU A 611 5.008 11.161 2.083 1.00 0.00 H new ATOM 0 HB2 GLU A 611 3.909 8.527 1.038 1.00 0.00 H new ATOM 0 HB3 GLU A 611 3.509 9.237 2.590 1.00 0.00 H new ATOM 0 HG2 GLU A 611 2.852 10.366 -0.146 1.00 0.00 H new ATOM 0 HG3 GLU A 611 1.729 9.653 0.994 1.00 0.00 H new ATOM 1729 N PRO A 612 6.540 9.764 3.538 1.00 0.00 N ATOM 1730 CA PRO A 612 7.508 9.033 4.363 1.00 0.00 C ATOM 1731 C PRO A 612 6.969 7.696 4.876 1.00 0.00 C ATOM 1732 O PRO A 612 5.840 7.608 5.363 1.00 0.00 O ATOM 1733 CB PRO A 612 7.776 9.983 5.542 1.00 0.00 C ATOM 1734 CG PRO A 612 7.210 11.301 5.131 1.00 0.00 C ATOM 1735 CD PRO A 612 6.080 10.991 4.198 1.00 0.00 C ATOM 0 HA PRO A 612 8.398 8.775 3.789 1.00 0.00 H new ATOM 0 HB2 PRO A 612 7.302 9.620 6.454 1.00 0.00 H new ATOM 0 HB3 PRO A 612 8.844 10.062 5.747 1.00 0.00 H new ATOM 0 HG2 PRO A 612 6.859 11.862 5.997 1.00 0.00 H new ATOM 0 HG3 PRO A 612 7.965 11.914 4.639 1.00 0.00 H new ATOM 0 HD2 PRO A 612 5.143 10.837 4.733 1.00 0.00 H new ATOM 0 HD3 PRO A 612 5.911 11.797 3.484 1.00 0.00 H new ATOM 1743 N VAL A 613 7.792 6.659 4.765 1.00 0.00 N ATOM 1744 CA VAL A 613 7.445 5.337 5.263 1.00 0.00 C ATOM 1745 C VAL A 613 7.823 5.227 6.735 1.00 0.00 C ATOM 1746 O VAL A 613 8.844 5.766 7.162 1.00 0.00 O ATOM 1747 CB VAL A 613 8.170 4.222 4.467 1.00 0.00 C ATOM 1748 CG1 VAL A 613 7.763 2.838 4.943 1.00 0.00 C ATOM 1749 CG2 VAL A 613 7.903 4.361 2.979 1.00 0.00 C ATOM 0 H VAL A 613 8.713 6.712 4.330 1.00 0.00 H new ATOM 0 HA VAL A 613 6.370 5.205 5.139 1.00 0.00 H new ATOM 0 HB VAL A 613 9.239 4.339 4.647 1.00 0.00 H new ATOM 0 HG11 VAL A 613 8.292 2.083 4.361 1.00 0.00 H new ATOM 0 HG12 VAL A 613 8.016 2.727 5.997 1.00 0.00 H new ATOM 0 HG13 VAL A 613 6.689 2.710 4.812 1.00 0.00 H new ATOM 0 HG21 VAL A 613 8.422 3.568 2.441 1.00 0.00 H new ATOM 0 HG22 VAL A 613 6.832 4.285 2.793 1.00 0.00 H new ATOM 0 HG23 VAL A 613 8.264 5.330 2.634 1.00 0.00 H new ATOM 1759 N ALA A 614 7.000 4.532 7.499 1.00 0.00 N ATOM 1760 CA ALA A 614 7.229 4.371 8.926 1.00 0.00 C ATOM 1761 C ALA A 614 8.087 3.143 9.197 1.00 0.00 C ATOM 1762 O ALA A 614 8.977 3.171 10.045 1.00 0.00 O ATOM 1763 CB ALA A 614 5.905 4.272 9.670 1.00 0.00 C ATOM 0 H ALA A 614 6.161 4.066 7.153 1.00 0.00 H new ATOM 0 HA ALA A 614 7.764 5.249 9.289 1.00 0.00 H new ATOM 0 HB1 ALA A 614 6.095 4.152 10.737 1.00 0.00 H new ATOM 0 HB2 ALA A 614 5.326 5.181 9.505 1.00 0.00 H new ATOM 0 HB3 ALA A 614 5.344 3.413 9.302 1.00 0.00 H new ATOM 1769 N GLU A 615 7.814 2.061 8.476 1.00 0.00 N ATOM 1770 CA GLU A 615 8.610 0.849 8.602 1.00 0.00 C ATOM 1771 C GLU A 615 8.583 0.036 7.312 1.00 0.00 C ATOM 1772 O GLU A 615 7.571 -0.583 6.978 1.00 0.00 O ATOM 1773 CB GLU A 615 8.117 -0.009 9.770 1.00 0.00 C ATOM 1774 CG GLU A 615 8.918 -1.291 9.952 1.00 0.00 C ATOM 1775 CD GLU A 615 8.585 -2.017 11.239 1.00 0.00 C ATOM 1776 OE1 GLU A 615 9.079 -1.590 12.302 1.00 0.00 O1- ATOM 1777 OE2 GLU A 615 7.846 -3.024 11.192 1.00 0.00 O ATOM 0 H GLU A 615 7.051 2.000 7.802 1.00 0.00 H new ATOM 0 HA GLU A 615 9.639 1.152 8.799 1.00 0.00 H new ATOM 0 HB2 GLU A 615 8.166 0.576 10.688 1.00 0.00 H new ATOM 0 HB3 GLU A 615 7.069 -0.263 9.609 1.00 0.00 H new ATOM 0 HG2 GLU A 615 8.730 -1.954 9.108 1.00 0.00 H new ATOM 0 HG3 GLU A 615 9.982 -1.054 9.940 1.00 0.00 H new ATOM 1784 N PRO A 616 9.677 0.070 6.539 1.00 0.00 N ATOM 1785 CA PRO A 616 9.841 -0.792 5.367 1.00 0.00 C ATOM 1786 C PRO A 616 10.147 -2.245 5.729 1.00 0.00 C ATOM 1787 O PRO A 616 10.619 -2.536 6.829 1.00 0.00 O ATOM 1788 CB PRO A 616 11.053 -0.177 4.661 1.00 0.00 C ATOM 1789 CG PRO A 616 11.848 0.411 5.769 1.00 0.00 C ATOM 1790 CD PRO A 616 10.829 0.986 6.707 1.00 0.00 C ATOM 0 HA PRO A 616 8.930 -0.833 4.770 1.00 0.00 H new ATOM 0 HB2 PRO A 616 11.623 -0.929 4.116 1.00 0.00 H new ATOM 0 HB3 PRO A 616 10.753 0.581 3.938 1.00 0.00 H new ATOM 0 HG2 PRO A 616 12.458 -0.345 6.263 1.00 0.00 H new ATOM 0 HG3 PRO A 616 12.528 1.180 5.403 1.00 0.00 H new ATOM 0 HD2 PRO A 616 11.188 1.000 7.736 1.00 0.00 H new ATOM 0 HD3 PRO A 616 10.572 2.012 6.445 1.00 0.00 H new ATOM 1798 N ASP A 617 9.846 -3.135 4.785 1.00 0.00 N ATOM 1799 CA ASP A 617 10.320 -4.522 4.799 1.00 0.00 C ATOM 1800 C ASP A 617 9.555 -5.397 5.789 1.00 0.00 C ATOM 1801 O ASP A 617 10.120 -5.939 6.739 1.00 0.00 O ATOM 1802 CB ASP A 617 11.823 -4.585 5.081 1.00 0.00 C ATOM 1803 CG ASP A 617 12.488 -5.767 4.404 1.00 0.00 C ATOM 1804 OD1 ASP A 617 12.888 -5.625 3.223 1.00 0.00 O ATOM 1805 OD2 ASP A 617 12.633 -6.827 5.048 1.00 0.00 O1- ATOM 0 H ASP A 617 9.260 -2.913 3.980 1.00 0.00 H new ATOM 0 HA ASP A 617 10.129 -4.923 3.804 1.00 0.00 H new ATOM 0 HB2 ASP A 617 12.293 -3.663 4.740 1.00 0.00 H new ATOM 0 HB3 ASP A 617 11.986 -4.647 6.157 1.00 0.00 H new ATOM 1810 N ILE A 618 8.255 -5.493 5.580 1.00 0.00 N ATOM 1811 CA ILE A 618 7.447 -6.512 6.219 1.00 0.00 C ATOM 1812 C ILE A 618 7.033 -7.526 5.164 1.00 0.00 C ATOM 1813 O ILE A 618 6.085 -7.305 4.419 1.00 0.00 O ATOM 1814 CB ILE A 618 6.195 -5.907 6.872 1.00 0.00 C ATOM 1815 CG1 ILE A 618 6.595 -4.717 7.742 1.00 0.00 C ATOM 1816 CG2 ILE A 618 5.463 -6.958 7.696 1.00 0.00 C ATOM 1817 CD1 ILE A 618 5.443 -4.088 8.487 1.00 0.00 C ATOM 0 H ILE A 618 7.732 -4.869 4.965 1.00 0.00 H new ATOM 0 HA ILE A 618 8.033 -6.988 7.005 1.00 0.00 H new ATOM 0 HB ILE A 618 5.517 -5.560 6.092 1.00 0.00 H new ATOM 0 HG12 ILE A 618 7.346 -5.042 8.462 1.00 0.00 H new ATOM 0 HG13 ILE A 618 7.064 -3.961 7.112 1.00 0.00 H new ATOM 0 HG21 ILE A 618 4.579 -6.512 8.151 1.00 0.00 H new ATOM 0 HG22 ILE A 618 5.162 -7.782 7.050 1.00 0.00 H new ATOM 0 HG23 ILE A 618 6.124 -7.333 8.478 1.00 0.00 H new ATOM 0 HD11 ILE A 618 5.808 -3.251 9.082 1.00 0.00 H new ATOM 0 HD12 ILE A 618 4.701 -3.730 7.774 1.00 0.00 H new ATOM 0 HD13 ILE A 618 4.987 -4.828 9.144 1.00 0.00 H new ATOM 1829 N MET A 619 7.764 -8.620 5.079 1.00 0.00 N ATOM 1830 CA MET A 619 7.641 -9.519 3.944 1.00 0.00 C ATOM 1831 C MET A 619 6.437 -10.447 4.052 1.00 0.00 C ATOM 1832 O MET A 619 6.078 -10.917 5.134 1.00 0.00 O ATOM 1833 CB MET A 619 8.916 -10.341 3.773 1.00 0.00 C ATOM 1834 CG MET A 619 10.152 -9.498 3.496 1.00 0.00 C ATOM 1835 SD MET A 619 11.531 -10.474 2.866 1.00 0.00 S ATOM 1836 CE MET A 619 10.830 -11.070 1.330 1.00 0.00 C ATOM 0 H MET A 619 8.448 -8.909 5.779 1.00 0.00 H new ATOM 0 HA MET A 619 7.487 -8.892 3.066 1.00 0.00 H new ATOM 0 HB2 MET A 619 9.083 -10.929 4.675 1.00 0.00 H new ATOM 0 HB3 MET A 619 8.776 -11.046 2.954 1.00 0.00 H new ATOM 0 HG2 MET A 619 9.902 -8.720 2.774 1.00 0.00 H new ATOM 0 HG3 MET A 619 10.457 -8.995 4.414 1.00 0.00 H new ATOM 0 HE1 MET A 619 11.630 -11.263 0.616 1.00 0.00 H new ATOM 0 HE2 MET A 619 10.279 -11.992 1.515 1.00 0.00 H new ATOM 0 HE3 MET A 619 10.154 -10.318 0.923 1.00 0.00 H new ATOM 1846 N ALA A 620 5.820 -10.686 2.905 1.00 0.00 N ATOM 1847 CA ALA A 620 4.766 -11.672 2.768 1.00 0.00 C ATOM 1848 C ALA A 620 5.296 -12.821 1.930 1.00 0.00 C ATOM 1849 O ALA A 620 6.469 -12.822 1.557 1.00 0.00 O ATOM 1850 CB ALA A 620 3.541 -11.054 2.115 1.00 0.00 C ATOM 0 H ALA A 620 6.040 -10.196 2.038 1.00 0.00 H new ATOM 0 HA ALA A 620 4.467 -12.037 3.751 1.00 0.00 H new ATOM 0 HB1 ALA A 620 2.760 -11.808 2.020 1.00 0.00 H new ATOM 0 HB2 ALA A 620 3.177 -10.230 2.730 1.00 0.00 H new ATOM 0 HB3 ALA A 620 3.806 -10.679 1.126 1.00 0.00 H new ATOM 1856 N THR A 621 4.457 -13.787 1.609 1.00 0.00 N ATOM 1857 CA THR A 621 4.916 -14.917 0.824 1.00 0.00 C ATOM 1858 C THR A 621 4.927 -14.588 -0.672 1.00 0.00 C ATOM 1859 O THR A 621 5.560 -15.287 -1.464 1.00 0.00 O ATOM 1860 CB THR A 621 4.070 -16.185 1.090 1.00 0.00 C ATOM 1861 OG1 THR A 621 4.697 -17.334 0.507 1.00 0.00 O ATOM 1862 CG2 THR A 621 2.674 -16.035 0.524 1.00 0.00 C ATOM 0 H THR A 621 3.472 -13.814 1.873 1.00 0.00 H new ATOM 0 HA THR A 621 5.939 -15.125 1.139 1.00 0.00 H new ATOM 0 HB THR A 621 4.000 -16.317 2.170 1.00 0.00 H new ATOM 0 HG1 THR A 621 5.161 -17.072 -0.315 1.00 0.00 H new ATOM 0 HG21 THR A 621 2.101 -16.940 0.725 1.00 0.00 H new ATOM 0 HG22 THR A 621 2.182 -15.182 0.992 1.00 0.00 H new ATOM 0 HG23 THR A 621 2.733 -15.874 -0.552 1.00 0.00 H new ATOM 1870 N ASN A 622 4.218 -13.530 -1.052 1.00 0.00 N ATOM 1871 CA ASN A 622 4.129 -13.129 -2.454 1.00 0.00 C ATOM 1872 C ASN A 622 4.684 -11.721 -2.682 1.00 0.00 C ATOM 1873 O ASN A 622 4.447 -11.119 -3.730 1.00 0.00 O ATOM 1874 CB ASN A 622 2.678 -13.208 -2.935 1.00 0.00 C ATOM 1875 CG ASN A 622 1.765 -12.235 -2.217 1.00 0.00 C ATOM 1876 OD1 ASN A 622 2.015 -11.845 -1.076 1.00 0.00 O ATOM 1877 ND2 ASN A 622 0.673 -11.874 -2.859 1.00 0.00 N ATOM 0 H ASN A 622 3.696 -12.934 -0.410 1.00 0.00 H new ATOM 0 HA ASN A 622 4.740 -13.821 -3.033 1.00 0.00 H new ATOM 0 HB2 ASN A 622 2.644 -13.008 -4.006 1.00 0.00 H new ATOM 0 HB3 ASN A 622 2.307 -14.222 -2.789 1.00 0.00 H new ATOM 0 HD21 ASN A 622 0.001 -11.251 -2.411 1.00 0.00 H new ATOM 0 HD22 ASN A 622 0.500 -12.217 -3.804 1.00 0.00 H new ATOM 1884 N GLY A 623 5.414 -11.187 -1.714 1.00 0.00 N ATOM 1885 CA GLY A 623 5.958 -9.857 -1.876 1.00 0.00 C ATOM 1886 C GLY A 623 6.398 -9.233 -0.573 1.00 0.00 C ATOM 1887 O GLY A 623 6.625 -9.930 0.412 1.00 0.00 O ATOM 0 H GLY A 623 5.637 -11.645 -0.830 1.00 0.00 H new ATOM 0 HA2 GLY A 623 6.808 -9.899 -2.557 1.00 0.00 H new ATOM 0 HA3 GLY A 623 5.208 -9.219 -2.342 1.00 0.00 H new ATOM 1891 N VAL A 624 6.519 -7.918 -0.573 1.00 0.00 N ATOM 1892 CA VAL A 624 6.961 -7.186 0.604 1.00 0.00 C ATOM 1893 C VAL A 624 5.972 -6.066 0.931 1.00 0.00 C ATOM 1894 O VAL A 624 5.312 -5.526 0.038 1.00 0.00 O ATOM 1895 CB VAL A 624 8.383 -6.602 0.402 1.00 0.00 C ATOM 1896 CG1 VAL A 624 8.398 -5.569 -0.715 1.00 0.00 C ATOM 1897 CG2 VAL A 624 8.918 -6.007 1.700 1.00 0.00 C ATOM 0 H VAL A 624 6.316 -7.330 -1.381 1.00 0.00 H new ATOM 0 HA VAL A 624 6.999 -7.884 1.440 1.00 0.00 H new ATOM 0 HB VAL A 624 9.041 -7.421 0.110 1.00 0.00 H new ATOM 0 HG11 VAL A 624 9.408 -5.177 -0.834 1.00 0.00 H new ATOM 0 HG12 VAL A 624 8.078 -6.036 -1.647 1.00 0.00 H new ATOM 0 HG13 VAL A 624 7.719 -4.754 -0.466 1.00 0.00 H new ATOM 0 HG21 VAL A 624 9.917 -5.604 1.531 1.00 0.00 H new ATOM 0 HG22 VAL A 624 8.256 -5.208 2.034 1.00 0.00 H new ATOM 0 HG23 VAL A 624 8.964 -6.783 2.464 1.00 0.00 H new ATOM 1907 N VAL A 625 5.848 -5.749 2.210 1.00 0.00 N ATOM 1908 CA VAL A 625 4.953 -4.699 2.668 1.00 0.00 C ATOM 1909 C VAL A 625 5.740 -3.590 3.356 1.00 0.00 C ATOM 1910 O VAL A 625 6.752 -3.846 4.010 1.00 0.00 O ATOM 1911 CB VAL A 625 3.899 -5.269 3.643 1.00 0.00 C ATOM 1912 CG1 VAL A 625 2.980 -4.182 4.184 1.00 0.00 C ATOM 1913 CG2 VAL A 625 3.087 -6.341 2.947 1.00 0.00 C ATOM 0 H VAL A 625 6.364 -6.212 2.958 1.00 0.00 H new ATOM 0 HA VAL A 625 4.443 -4.287 1.797 1.00 0.00 H new ATOM 0 HB VAL A 625 4.427 -5.702 4.492 1.00 0.00 H new ATOM 0 HG11 VAL A 625 2.254 -4.625 4.865 1.00 0.00 H new ATOM 0 HG12 VAL A 625 3.571 -3.438 4.718 1.00 0.00 H new ATOM 0 HG13 VAL A 625 2.456 -3.704 3.357 1.00 0.00 H new ATOM 0 HG21 VAL A 625 2.345 -6.741 3.638 1.00 0.00 H new ATOM 0 HG22 VAL A 625 2.583 -5.911 2.081 1.00 0.00 H new ATOM 0 HG23 VAL A 625 3.748 -7.144 2.620 1.00 0.00 H new ATOM 1923 N HIS A 626 5.284 -2.362 3.190 1.00 0.00 N ATOM 1924 CA HIS A 626 5.926 -1.210 3.813 1.00 0.00 C ATOM 1925 C HIS A 626 4.868 -0.344 4.488 1.00 0.00 C ATOM 1926 O HIS A 626 3.886 0.039 3.855 1.00 0.00 O ATOM 1927 CB HIS A 626 6.705 -0.390 2.771 1.00 0.00 C ATOM 1928 CG HIS A 626 7.710 -1.190 1.987 1.00 0.00 C ATOM 1929 ND1 HIS A 626 9.029 -1.364 2.356 1.00 0.00 N ATOM 1930 CD2 HIS A 626 7.554 -1.885 0.834 1.00 0.00 C ATOM 1931 CE1 HIS A 626 9.617 -2.144 1.437 1.00 0.00 C ATOM 1932 NE2 HIS A 626 8.763 -2.485 0.494 1.00 0.00 N ATOM 0 H HIS A 626 4.466 -2.132 2.626 1.00 0.00 H new ATOM 0 HA HIS A 626 6.636 -1.562 4.562 1.00 0.00 H new ATOM 0 HB2 HIS A 626 5.997 0.063 2.078 1.00 0.00 H new ATOM 0 HB3 HIS A 626 7.221 0.425 3.278 1.00 0.00 H new ATOM 0 HD2 HIS A 626 6.637 -1.961 0.269 1.00 0.00 H new ATOM 0 HE1 HIS A 626 10.652 -2.451 1.466 1.00 0.00 H new ATOM 0 HE2 HIS A 626 8.950 -3.070 -0.320 1.00 0.00 H new ATOM 1940 N VAL A 627 5.060 -0.051 5.770 1.00 0.00 N ATOM 1941 CA VAL A 627 4.079 0.705 6.545 1.00 0.00 C ATOM 1942 C VAL A 627 4.169 2.200 6.265 1.00 0.00 C ATOM 1943 O VAL A 627 5.199 2.821 6.513 1.00 0.00 O ATOM 1944 CB VAL A 627 4.270 0.487 8.062 1.00 0.00 C ATOM 1945 CG1 VAL A 627 3.329 1.378 8.864 1.00 0.00 C ATOM 1946 CG2 VAL A 627 4.068 -0.971 8.430 1.00 0.00 C ATOM 0 H VAL A 627 5.889 -0.326 6.297 1.00 0.00 H new ATOM 0 HA VAL A 627 3.101 0.335 6.238 1.00 0.00 H new ATOM 0 HB VAL A 627 5.295 0.763 8.312 1.00 0.00 H new ATOM 0 HG11 VAL A 627 3.484 1.205 9.929 1.00 0.00 H new ATOM 0 HG12 VAL A 627 3.533 2.424 8.633 1.00 0.00 H new ATOM 0 HG13 VAL A 627 2.297 1.144 8.605 1.00 0.00 H new ATOM 0 HG21 VAL A 627 4.208 -1.098 9.503 1.00 0.00 H new ATOM 0 HG22 VAL A 627 3.059 -1.279 8.157 1.00 0.00 H new ATOM 0 HG23 VAL A 627 4.792 -1.585 7.895 1.00 0.00 H new ATOM 1956 N ILE A 628 3.090 2.771 5.760 1.00 0.00 N ATOM 1957 CA ILE A 628 2.986 4.215 5.616 1.00 0.00 C ATOM 1958 C ILE A 628 1.871 4.749 6.488 1.00 0.00 C ATOM 1959 O ILE A 628 0.849 4.092 6.680 1.00 0.00 O ATOM 1960 CB ILE A 628 2.720 4.663 4.167 1.00 0.00 C ATOM 1961 CG1 ILE A 628 2.022 3.554 3.382 1.00 0.00 C ATOM 1962 CG2 ILE A 628 4.009 5.100 3.491 1.00 0.00 C ATOM 1963 CD1 ILE A 628 1.500 3.998 2.038 1.00 0.00 C ATOM 0 H ILE A 628 2.270 2.256 5.441 1.00 0.00 H new ATOM 0 HA ILE A 628 3.952 4.617 5.922 1.00 0.00 H new ATOM 0 HB ILE A 628 2.053 5.525 4.188 1.00 0.00 H new ATOM 0 HG12 ILE A 628 2.720 2.730 3.236 1.00 0.00 H new ATOM 0 HG13 ILE A 628 1.192 3.168 3.975 1.00 0.00 H new ATOM 0 HG21 ILE A 628 3.796 5.412 2.469 1.00 0.00 H new ATOM 0 HG22 ILE A 628 4.444 5.934 4.042 1.00 0.00 H new ATOM 0 HG23 ILE A 628 4.713 4.268 3.477 1.00 0.00 H new ATOM 0 HD11 ILE A 628 1.018 3.157 1.539 1.00 0.00 H new ATOM 0 HD12 ILE A 628 0.777 4.802 2.176 1.00 0.00 H new ATOM 0 HD13 ILE A 628 2.328 4.356 1.426 1.00 0.00 H new ATOM 1975 N THR A 629 2.067 5.941 7.011 1.00 0.00 N ATOM 1976 CA THR A 629 1.075 6.556 7.867 1.00 0.00 C ATOM 1977 C THR A 629 0.212 7.535 7.075 1.00 0.00 C ATOM 1978 O THR A 629 -0.563 8.302 7.648 1.00 0.00 O ATOM 1979 CB THR A 629 1.756 7.271 9.047 1.00 0.00 C ATOM 1980 OG1 THR A 629 2.815 8.115 8.562 1.00 0.00 O ATOM 1981 CG2 THR A 629 2.320 6.254 10.031 1.00 0.00 C ATOM 0 H THR A 629 2.904 6.503 6.858 1.00 0.00 H new ATOM 0 HA THR A 629 0.428 5.773 8.262 1.00 0.00 H new ATOM 0 HB THR A 629 1.013 7.882 9.560 1.00 0.00 H new ATOM 0 HG1 THR A 629 3.244 8.569 9.317 1.00 0.00 H new ATOM 0 HG21 THR A 629 2.798 6.776 10.860 1.00 0.00 H new ATOM 0 HG22 THR A 629 1.512 5.630 10.413 1.00 0.00 H new ATOM 0 HG23 THR A 629 3.054 5.627 9.525 1.00 0.00 H new ATOM 1989 N ASN A 630 0.360 7.514 5.751 1.00 0.00 N ATOM 1990 CA ASN A 630 -0.454 8.332 4.874 1.00 0.00 C ATOM 1991 C ASN A 630 -0.842 7.554 3.617 1.00 0.00 C ATOM 1992 O ASN A 630 -0.107 6.677 3.170 1.00 0.00 O ATOM 1993 CB ASN A 630 0.312 9.603 4.525 1.00 0.00 C ATOM 1994 CG ASN A 630 1.801 9.360 4.332 1.00 0.00 C ATOM 1995 OD1 ASN A 630 2.229 8.284 3.916 1.00 0.00 O ATOM 1996 ND2 ASN A 630 2.605 10.365 4.642 1.00 0.00 N ATOM 0 H ASN A 630 1.043 6.932 5.266 1.00 0.00 H new ATOM 0 HA ASN A 630 -1.378 8.605 5.383 1.00 0.00 H new ATOM 0 HB2 ASN A 630 -0.102 10.033 3.613 1.00 0.00 H new ATOM 0 HB3 ASN A 630 0.168 10.338 5.317 1.00 0.00 H new ATOM 0 HD21 ASN A 630 3.614 10.261 4.539 1.00 0.00 H new ATOM 0 HD22 ASN A 630 2.215 11.243 4.984 1.00 0.00 H new ATOM 2003 N VAL A 631 -2.024 7.844 3.078 1.00 0.00 N ATOM 2004 CA VAL A 631 -2.491 7.188 1.870 1.00 0.00 C ATOM 2005 C VAL A 631 -1.880 7.874 0.652 1.00 0.00 C ATOM 2006 O VAL A 631 -1.442 9.021 0.737 1.00 0.00 O ATOM 2007 CB VAL A 631 -4.037 7.195 1.792 1.00 0.00 C ATOM 2008 CG1 VAL A 631 -4.525 6.426 0.581 1.00 0.00 C ATOM 2009 CG2 VAL A 631 -4.637 6.598 3.055 1.00 0.00 C ATOM 0 H VAL A 631 -2.673 8.530 3.463 1.00 0.00 H new ATOM 0 HA VAL A 631 -2.173 6.146 1.889 1.00 0.00 H new ATOM 0 HB VAL A 631 -4.360 8.232 1.698 1.00 0.00 H new ATOM 0 HG11 VAL A 631 -5.614 6.447 0.551 1.00 0.00 H new ATOM 0 HG12 VAL A 631 -4.128 6.884 -0.325 1.00 0.00 H new ATOM 0 HG13 VAL A 631 -4.184 5.393 0.644 1.00 0.00 H new ATOM 0 HG21 VAL A 631 -5.725 6.611 2.983 1.00 0.00 H new ATOM 0 HG22 VAL A 631 -4.293 5.570 3.170 1.00 0.00 H new ATOM 0 HG23 VAL A 631 -4.324 7.184 3.919 1.00 0.00 H new ATOM 2019 N LEU A 632 -1.873 7.186 -0.480 1.00 0.00 N ATOM 2020 CA LEU A 632 -1.090 7.608 -1.625 1.00 0.00 C ATOM 2021 C LEU A 632 -2.008 7.954 -2.784 1.00 0.00 C ATOM 2022 O LEU A 632 -2.926 7.201 -3.098 1.00 0.00 O ATOM 2023 CB LEU A 632 -0.140 6.481 -2.029 1.00 0.00 C ATOM 2024 CG LEU A 632 0.748 5.939 -0.903 1.00 0.00 C ATOM 2025 CD1 LEU A 632 1.493 4.695 -1.359 1.00 0.00 C ATOM 2026 CD2 LEU A 632 1.728 6.996 -0.420 1.00 0.00 C ATOM 0 H LEU A 632 -2.405 6.328 -0.627 1.00 0.00 H new ATOM 0 HA LEU A 632 -0.511 8.494 -1.362 1.00 0.00 H new ATOM 0 HB2 LEU A 632 -0.730 5.658 -2.433 1.00 0.00 H new ATOM 0 HB3 LEU A 632 0.501 6.839 -2.835 1.00 0.00 H new ATOM 0 HG LEU A 632 0.101 5.671 -0.068 1.00 0.00 H new ATOM 0 HD11 LEU A 632 2.117 4.326 -0.545 1.00 0.00 H new ATOM 0 HD12 LEU A 632 0.776 3.925 -1.644 1.00 0.00 H new ATOM 0 HD13 LEU A 632 2.121 4.940 -2.216 1.00 0.00 H new ATOM 0 HD21 LEU A 632 2.344 6.583 0.378 1.00 0.00 H new ATOM 0 HD22 LEU A 632 2.366 7.306 -1.248 1.00 0.00 H new ATOM 0 HD23 LEU A 632 1.177 7.858 -0.044 1.00 0.00 H new ATOM 2038 N GLN A 633 -1.771 9.094 -3.406 1.00 0.00 N ATOM 2039 CA GLN A 633 -2.593 9.537 -4.513 1.00 0.00 C ATOM 2040 C GLN A 633 -1.737 10.249 -5.549 1.00 0.00 C ATOM 2041 O GLN A 633 -0.693 10.814 -5.225 1.00 0.00 O ATOM 2042 CB GLN A 633 -3.726 10.448 -4.019 1.00 0.00 C ATOM 2043 CG GLN A 633 -3.280 11.823 -3.517 1.00 0.00 C ATOM 2044 CD GLN A 633 -2.391 11.763 -2.286 1.00 0.00 C ATOM 2045 OE1 GLN A 633 -1.167 11.720 -2.391 1.00 0.00 O ATOM 2046 NE2 GLN A 633 -3.001 11.749 -1.110 1.00 0.00 N ATOM 0 H GLN A 633 -1.013 9.731 -3.161 1.00 0.00 H new ATOM 0 HA GLN A 633 -3.047 8.663 -4.981 1.00 0.00 H new ATOM 0 HB2 GLN A 633 -4.439 10.589 -4.831 1.00 0.00 H new ATOM 0 HB3 GLN A 633 -4.256 9.939 -3.214 1.00 0.00 H new ATOM 0 HG2 GLN A 633 -2.745 12.336 -4.316 1.00 0.00 H new ATOM 0 HG3 GLN A 633 -4.162 12.421 -3.289 1.00 0.00 H new ATOM 0 HE21 GLN A 633 -4.019 11.786 -1.063 1.00 0.00 H new ATOM 0 HE22 GLN A 633 -2.452 11.701 -0.251 1.00 0.00 H new ATOM 2055 N ALA A 634 -2.176 10.204 -6.794 1.00 0.00 N ATOM 2056 CA ALA A 634 -1.428 10.798 -7.886 1.00 0.00 C ATOM 2057 C ALA A 634 -1.952 12.195 -8.188 1.00 0.00 C ATOM 2058 O ALA A 634 -3.141 12.324 -8.550 1.00 0.00 O ATOM 2059 CB ALA A 634 -1.498 9.907 -9.120 1.00 0.00 C ATOM 2060 OXT ALA A 634 -1.172 13.161 -8.069 1.00 0.00 O1- ATOM 0 H ALA A 634 -3.051 9.760 -7.074 1.00 0.00 H new ATOM 0 HA ALA A 634 -0.382 10.886 -7.591 1.00 0.00 H new ATOM 0 HB1 ALA A 634 -0.933 10.365 -9.932 1.00 0.00 H new ATOM 0 HB2 ALA A 634 -1.074 8.930 -8.888 1.00 0.00 H new ATOM 0 HB3 ALA A 634 -2.538 9.788 -9.424 1.00 0.00 H new TER 2066 ALA A 634