USER MOD reduce.3.24.130724 H: found=0, std=0, add=841, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 841 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 519 SER OG : rot -112:sc= 0.365 USER MOD Set 1.2: A 521 SER OG : rot 180:sc= 0.336 USER MOD Set 2.1: A 496 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 498 TYR OH : rot 30:sc=-0.00711 USER MOD Set 3.1: A 459 HIS : no HD1:sc= 0.0131 X(o=0.025,f=0) USER MOD Set 3.2: A 463 SER OG : rot 113:sc= 0.0115 USER MOD Single : A 420 SER OG : rot 180:sc= 0 USER MOD Single : A 421 SER OG : rot 38:sc= 0.631 USER MOD Single : A 423 SER OG : rot 125:sc= 0.0447 USER MOD Single : A 424 SER OG : rot 180:sc= -0.0211 USER MOD Single : A 426 SER OG : rot 180:sc= 0 USER MOD Single : A 428 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 444 THR OG1 : rot 180:sc= -0.154 USER MOD Single : A 446 SER OG : rot 160:sc= 0 USER MOD Single : A 460 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 464 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 465 SER OG : rot 180:sc= 0 USER MOD Single : A 466 TYR OH : rot 180:sc= 0 USER MOD Single : A 470 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 472 TYR OH : rot 180:sc= 0 USER MOD Single : A 478 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 481 SER OG : rot 180:sc= 0 USER MOD Single : A 482 SER OG : rot -119:sc= 1.39 USER MOD Single : A 484 GLN : amide:sc= -0.135 X(o=-0.14,f=-0.14) USER MOD Single : A 490 CYS SG : rot 55:sc= -2.61! USER MOD Single : A 500 CYS SG : rot 28:sc= 0.191 USER MOD Single : A 502 SER OG : rot 180:sc=-0.00591 USER MOD Single : A 503 SER OG : rot -96:sc= 0 USER MOD Single : A 505 THR OG1 : rot 180:sc= 0.0302 USER MOD Single : A 507 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 509 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 512 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 517 ASN : amide:sc= -0.406 K(o=-0.41,f=-1.2) USER MOD Single : A 525 MET CE :methyl -164:sc= -0.031 (180deg=-0.347) USER MOD Single : A 527 SER OG : rot 180:sc= 0 USER MOD Single : A 530 SER OG : rot 18:sc= 0.374 USER MOD Single : A 531 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 419 -21.227 10.699 2.713 1.00 0.00 N ATOM 2 CA GLY A 419 -20.382 10.470 1.555 1.00 0.00 C ATOM 3 C GLY A 419 -19.801 11.754 0.998 1.00 0.00 C ATOM 4 O GLY A 419 -20.514 12.743 0.827 1.00 0.00 O ATOM 0 HA2 GLY A 419 -19.570 9.796 1.829 1.00 0.00 H new ATOM 0 HA3 GLY A 419 -20.962 9.971 0.779 1.00 0.00 H new ATOM 8 N SER A 420 -18.503 11.741 0.714 1.00 0.00 N ATOM 9 CA SER A 420 -17.825 12.915 0.178 1.00 0.00 C ATOM 10 C SER A 420 -16.976 12.546 -1.035 1.00 0.00 C ATOM 11 O SER A 420 -15.986 11.824 -0.917 1.00 0.00 O ATOM 12 CB SER A 420 -16.947 13.559 1.252 1.00 0.00 C ATOM 13 OG SER A 420 -16.085 14.533 0.691 1.00 0.00 O ATOM 0 H SER A 420 -17.899 10.930 0.846 1.00 0.00 H new ATOM 0 HA SER A 420 -18.585 13.630 -0.136 1.00 0.00 H new ATOM 0 HB2 SER A 420 -17.577 14.021 2.012 1.00 0.00 H new ATOM 0 HB3 SER A 420 -16.356 12.791 1.752 1.00 0.00 H new ATOM 0 HG SER A 420 -15.536 14.930 1.399 1.00 0.00 H new ATOM 19 N SER A 421 -17.372 13.047 -2.201 1.00 0.00 N ATOM 20 CA SER A 421 -16.651 12.768 -3.437 1.00 0.00 C ATOM 21 C SER A 421 -16.347 14.058 -4.193 1.00 0.00 C ATOM 22 O SER A 421 -17.237 14.669 -4.783 1.00 0.00 O ATOM 23 CB SER A 421 -17.464 11.823 -4.325 1.00 0.00 C ATOM 24 OG SER A 421 -18.742 12.364 -4.608 1.00 0.00 O ATOM 0 H SER A 421 -18.188 13.648 -2.315 1.00 0.00 H new ATOM 0 HA SER A 421 -15.707 12.289 -3.177 1.00 0.00 H new ATOM 0 HB2 SER A 421 -16.928 11.643 -5.257 1.00 0.00 H new ATOM 0 HB3 SER A 421 -17.575 10.859 -3.829 1.00 0.00 H new ATOM 0 HG SER A 421 -18.665 13.331 -4.745 1.00 0.00 H new ATOM 30 N GLY A 422 -15.082 14.467 -4.169 1.00 0.00 N ATOM 31 CA GLY A 422 -14.682 15.682 -4.854 1.00 0.00 C ATOM 32 C GLY A 422 -13.503 15.464 -5.781 1.00 0.00 C ATOM 33 O GLY A 422 -13.680 15.201 -6.970 1.00 0.00 O ATOM 0 H GLY A 422 -14.327 13.978 -3.687 1.00 0.00 H new ATOM 0 HA2 GLY A 422 -15.525 16.066 -5.428 1.00 0.00 H new ATOM 0 HA3 GLY A 422 -14.425 16.443 -4.117 1.00 0.00 H new ATOM 37 N SER A 423 -12.296 15.575 -5.236 1.00 0.00 N ATOM 38 CA SER A 423 -11.082 15.393 -6.024 1.00 0.00 C ATOM 39 C SER A 423 -10.234 14.256 -5.461 1.00 0.00 C ATOM 40 O SER A 423 -10.226 14.012 -4.255 1.00 0.00 O ATOM 41 CB SER A 423 -10.268 16.687 -6.051 1.00 0.00 C ATOM 42 OG SER A 423 -11.005 17.742 -6.645 1.00 0.00 O ATOM 0 H SER A 423 -12.132 15.790 -4.252 1.00 0.00 H new ATOM 0 HA SER A 423 -11.374 15.135 -7.042 1.00 0.00 H new ATOM 0 HB2 SER A 423 -9.986 16.964 -5.035 1.00 0.00 H new ATOM 0 HB3 SER A 423 -9.344 16.527 -6.606 1.00 0.00 H new ATOM 0 HG SER A 423 -11.039 18.504 -6.030 1.00 0.00 H new ATOM 48 N SER A 424 -9.521 13.565 -6.344 1.00 0.00 N ATOM 49 CA SER A 424 -8.672 12.451 -5.937 1.00 0.00 C ATOM 50 C SER A 424 -7.792 12.844 -4.755 1.00 0.00 C ATOM 51 O SER A 424 -7.536 14.024 -4.521 1.00 0.00 O ATOM 52 CB SER A 424 -7.799 11.994 -7.107 1.00 0.00 C ATOM 53 OG SER A 424 -6.973 10.905 -6.733 1.00 0.00 O ATOM 0 H SER A 424 -9.514 13.757 -7.346 1.00 0.00 H new ATOM 0 HA SER A 424 -9.317 11.627 -5.631 1.00 0.00 H new ATOM 0 HB2 SER A 424 -8.432 11.703 -7.945 1.00 0.00 H new ATOM 0 HB3 SER A 424 -7.180 12.824 -7.448 1.00 0.00 H new ATOM 0 HG SER A 424 -6.426 10.631 -7.499 1.00 0.00 H new ATOM 59 N GLY A 425 -7.331 11.843 -4.010 1.00 0.00 N ATOM 60 CA GLY A 425 -6.484 12.102 -2.860 1.00 0.00 C ATOM 61 C GLY A 425 -5.009 12.037 -3.200 1.00 0.00 C ATOM 62 O GLY A 425 -4.614 12.305 -4.335 1.00 0.00 O ATOM 0 H GLY A 425 -7.529 10.857 -4.183 1.00 0.00 H new ATOM 0 HA2 GLY A 425 -6.717 13.087 -2.455 1.00 0.00 H new ATOM 0 HA3 GLY A 425 -6.706 11.375 -2.078 1.00 0.00 H new ATOM 66 N SER A 426 -4.191 11.681 -2.214 1.00 0.00 N ATOM 67 CA SER A 426 -2.750 11.587 -2.413 1.00 0.00 C ATOM 68 C SER A 426 -2.370 10.234 -3.008 1.00 0.00 C ATOM 69 O SER A 426 -3.229 9.382 -3.237 1.00 0.00 O ATOM 70 CB SER A 426 -2.016 11.798 -1.088 1.00 0.00 C ATOM 71 OG SER A 426 -1.826 13.178 -0.824 1.00 0.00 O ATOM 0 H SER A 426 -4.502 11.453 -1.270 1.00 0.00 H new ATOM 0 HA SER A 426 -2.454 12.368 -3.113 1.00 0.00 H new ATOM 0 HB2 SER A 426 -2.586 11.344 -0.277 1.00 0.00 H new ATOM 0 HB3 SER A 426 -1.050 11.294 -1.120 1.00 0.00 H new ATOM 0 HG SER A 426 -1.356 13.286 0.029 1.00 0.00 H new ATOM 77 N ARG A 427 -1.078 10.045 -3.255 1.00 0.00 N ATOM 78 CA ARG A 427 -0.584 8.797 -3.824 1.00 0.00 C ATOM 79 C ARG A 427 -0.510 7.706 -2.759 1.00 0.00 C ATOM 80 O ARG A 427 -1.045 6.612 -2.937 1.00 0.00 O ATOM 81 CB ARG A 427 0.795 9.008 -4.450 1.00 0.00 C ATOM 82 CG ARG A 427 0.792 9.984 -5.616 1.00 0.00 C ATOM 83 CD ARG A 427 2.124 9.980 -6.349 1.00 0.00 C ATOM 84 NE ARG A 427 3.173 10.648 -5.583 1.00 0.00 N ATOM 85 CZ ARG A 427 3.272 11.967 -5.469 1.00 0.00 C ATOM 86 NH1 ARG A 427 2.391 12.756 -6.068 1.00 0.00 N ATOM 87 NH2 ARG A 427 4.255 12.500 -4.755 1.00 0.00 N ATOM 0 H ARG A 427 -0.355 10.740 -3.070 1.00 0.00 H new ATOM 0 HA ARG A 427 -1.282 8.478 -4.598 1.00 0.00 H new ATOM 0 HB2 ARG A 427 1.480 9.372 -3.684 1.00 0.00 H new ATOM 0 HB3 ARG A 427 1.180 8.047 -4.792 1.00 0.00 H new ATOM 0 HG2 ARG A 427 -0.007 9.722 -6.309 1.00 0.00 H new ATOM 0 HG3 ARG A 427 0.580 10.989 -5.250 1.00 0.00 H new ATOM 0 HD2 ARG A 427 2.423 8.952 -6.552 1.00 0.00 H new ATOM 0 HD3 ARG A 427 2.008 10.475 -7.313 1.00 0.00 H new ATOM 0 HE ARG A 427 3.867 10.070 -5.110 1.00 0.00 H new ATOM 0 HH11 ARG A 427 1.634 12.350 -6.618 1.00 0.00 H new ATOM 0 HH12 ARG A 427 2.470 13.769 -5.978 1.00 0.00 H new ATOM 0 HH21 ARG A 427 4.935 11.896 -4.293 1.00 0.00 H new ATOM 0 HH22 ARG A 427 4.330 13.513 -4.668 1.00 0.00 H new ATOM 101 N LYS A 428 0.159 8.012 -1.652 1.00 0.00 N ATOM 102 CA LYS A 428 0.304 7.059 -0.558 1.00 0.00 C ATOM 103 C LYS A 428 -1.026 6.380 -0.248 1.00 0.00 C ATOM 104 O LYS A 428 -2.084 7.006 -0.310 1.00 0.00 O ATOM 105 CB LYS A 428 0.832 7.765 0.693 1.00 0.00 C ATOM 106 CG LYS A 428 2.345 7.894 0.727 1.00 0.00 C ATOM 107 CD LYS A 428 2.845 8.233 2.121 1.00 0.00 C ATOM 108 CE LYS A 428 4.321 8.599 2.109 1.00 0.00 C ATOM 109 NZ LYS A 428 4.766 9.152 3.419 1.00 0.00 N ATOM 0 H LYS A 428 0.609 8.913 -1.489 1.00 0.00 H new ATOM 0 HA LYS A 428 1.018 6.296 -0.866 1.00 0.00 H new ATOM 0 HB2 LYS A 428 0.390 8.759 0.752 1.00 0.00 H new ATOM 0 HB3 LYS A 428 0.503 7.216 1.576 1.00 0.00 H new ATOM 0 HG2 LYS A 428 2.798 6.960 0.394 1.00 0.00 H new ATOM 0 HG3 LYS A 428 2.661 8.668 0.028 1.00 0.00 H new ATOM 0 HD2 LYS A 428 2.266 9.064 2.524 1.00 0.00 H new ATOM 0 HD3 LYS A 428 2.685 7.382 2.783 1.00 0.00 H new ATOM 0 HE2 LYS A 428 4.912 7.716 1.868 1.00 0.00 H new ATOM 0 HE3 LYS A 428 4.507 9.331 1.323 1.00 0.00 H new ATOM 0 HZ1 LYS A 428 5.777 9.389 3.370 1.00 0.00 H new ATOM 0 HZ2 LYS A 428 4.220 10.009 3.638 1.00 0.00 H new ATOM 0 HZ3 LYS A 428 4.612 8.444 4.165 1.00 0.00 H new ATOM 123 N VAL A 429 -0.965 5.095 0.086 1.00 0.00 N ATOM 124 CA VAL A 429 -2.164 4.331 0.409 1.00 0.00 C ATOM 125 C VAL A 429 -1.938 3.440 1.625 1.00 0.00 C ATOM 126 O VAL A 429 -1.097 2.541 1.601 1.00 0.00 O ATOM 127 CB VAL A 429 -2.609 3.457 -0.779 1.00 0.00 C ATOM 128 CG1 VAL A 429 -3.897 2.719 -0.447 1.00 0.00 C ATOM 129 CG2 VAL A 429 -2.779 4.305 -2.030 1.00 0.00 C ATOM 0 H VAL A 429 -0.098 4.561 0.140 1.00 0.00 H new ATOM 0 HA VAL A 429 -2.949 5.054 0.633 1.00 0.00 H new ATOM 0 HB VAL A 429 -1.833 2.716 -0.972 1.00 0.00 H new ATOM 0 HG11 VAL A 429 -4.195 2.107 -1.298 1.00 0.00 H new ATOM 0 HG12 VAL A 429 -3.737 2.080 0.421 1.00 0.00 H new ATOM 0 HG13 VAL A 429 -4.683 3.441 -0.226 1.00 0.00 H new ATOM 0 HG21 VAL A 429 -3.094 3.671 -2.859 1.00 0.00 H new ATOM 0 HG22 VAL A 429 -3.535 5.070 -1.851 1.00 0.00 H new ATOM 0 HG23 VAL A 429 -1.831 4.782 -2.278 1.00 0.00 H new ATOM 139 N PHE A 430 -2.695 3.694 2.687 1.00 0.00 N ATOM 140 CA PHE A 430 -2.577 2.915 3.914 1.00 0.00 C ATOM 141 C PHE A 430 -3.334 1.596 3.795 1.00 0.00 C ATOM 142 O PHE A 430 -4.565 1.573 3.778 1.00 0.00 O ATOM 143 CB PHE A 430 -3.108 3.716 5.105 1.00 0.00 C ATOM 144 CG PHE A 430 -3.428 2.868 6.303 1.00 0.00 C ATOM 145 CD1 PHE A 430 -2.596 1.823 6.670 1.00 0.00 C ATOM 146 CD2 PHE A 430 -4.561 3.116 7.061 1.00 0.00 C ATOM 147 CE1 PHE A 430 -2.888 1.041 7.772 1.00 0.00 C ATOM 148 CE2 PHE A 430 -4.858 2.338 8.164 1.00 0.00 C ATOM 149 CZ PHE A 430 -4.020 1.300 8.520 1.00 0.00 C ATOM 0 H PHE A 430 -3.397 4.433 2.723 1.00 0.00 H new ATOM 0 HA PHE A 430 -1.522 2.695 4.075 1.00 0.00 H new ATOM 0 HB2 PHE A 430 -2.369 4.465 5.387 1.00 0.00 H new ATOM 0 HB3 PHE A 430 -4.006 4.253 4.800 1.00 0.00 H new ATOM 0 HD1 PHE A 430 -1.709 1.617 6.089 1.00 0.00 H new ATOM 0 HD2 PHE A 430 -5.220 3.927 6.787 1.00 0.00 H new ATOM 0 HE1 PHE A 430 -2.232 0.229 8.048 1.00 0.00 H new ATOM 0 HE2 PHE A 430 -5.744 2.542 8.747 1.00 0.00 H new ATOM 0 HZ PHE A 430 -4.249 0.691 9.382 1.00 0.00 H new ATOM 159 N VAL A 431 -2.589 0.498 3.714 1.00 0.00 N ATOM 160 CA VAL A 431 -3.189 -0.826 3.598 1.00 0.00 C ATOM 161 C VAL A 431 -2.987 -1.635 4.874 1.00 0.00 C ATOM 162 O VAL A 431 -1.864 -1.794 5.350 1.00 0.00 O ATOM 163 CB VAL A 431 -2.597 -1.607 2.409 1.00 0.00 C ATOM 164 CG1 VAL A 431 -3.312 -2.939 2.237 1.00 0.00 C ATOM 165 CG2 VAL A 431 -2.679 -0.780 1.135 1.00 0.00 C ATOM 0 H VAL A 431 -1.569 0.499 3.727 1.00 0.00 H new ATOM 0 HA VAL A 431 -4.256 -0.677 3.431 1.00 0.00 H new ATOM 0 HB VAL A 431 -1.546 -1.810 2.616 1.00 0.00 H new ATOM 0 HG11 VAL A 431 -2.881 -3.477 1.393 1.00 0.00 H new ATOM 0 HG12 VAL A 431 -3.197 -3.534 3.143 1.00 0.00 H new ATOM 0 HG13 VAL A 431 -4.371 -2.762 2.052 1.00 0.00 H new ATOM 0 HG21 VAL A 431 -2.256 -1.347 0.305 1.00 0.00 H new ATOM 0 HG22 VAL A 431 -3.721 -0.545 0.920 1.00 0.00 H new ATOM 0 HG23 VAL A 431 -2.118 0.145 1.265 1.00 0.00 H new ATOM 175 N GLY A 432 -4.085 -2.144 5.425 1.00 0.00 N ATOM 176 CA GLY A 432 -4.008 -2.931 6.642 1.00 0.00 C ATOM 177 C GLY A 432 -4.759 -4.243 6.532 1.00 0.00 C ATOM 178 O GLY A 432 -5.914 -4.272 6.110 1.00 0.00 O ATOM 0 H GLY A 432 -5.026 -2.025 5.050 1.00 0.00 H new ATOM 0 HA2 GLY A 432 -2.962 -3.133 6.875 1.00 0.00 H new ATOM 0 HA3 GLY A 432 -4.414 -2.352 7.472 1.00 0.00 H new ATOM 182 N GLY A 433 -4.101 -5.334 6.913 1.00 0.00 N ATOM 183 CA GLY A 433 -4.729 -6.640 6.847 1.00 0.00 C ATOM 184 C GLY A 433 -3.997 -7.588 5.917 1.00 0.00 C ATOM 185 O GLY A 433 -4.516 -8.649 5.566 1.00 0.00 O ATOM 0 H GLY A 433 -3.144 -5.336 7.266 1.00 0.00 H new ATOM 0 HA2 GLY A 433 -4.766 -7.073 7.847 1.00 0.00 H new ATOM 0 HA3 GLY A 433 -5.759 -6.528 6.509 1.00 0.00 H new ATOM 189 N LEU A 434 -2.790 -7.206 5.515 1.00 0.00 N ATOM 190 CA LEU A 434 -1.986 -8.029 4.618 1.00 0.00 C ATOM 191 C LEU A 434 -1.606 -9.348 5.283 1.00 0.00 C ATOM 192 O LEU A 434 -1.349 -9.414 6.485 1.00 0.00 O ATOM 193 CB LEU A 434 -0.724 -7.275 4.196 1.00 0.00 C ATOM 194 CG LEU A 434 -0.940 -6.044 3.315 1.00 0.00 C ATOM 195 CD1 LEU A 434 0.322 -5.197 3.263 1.00 0.00 C ATOM 196 CD2 LEU A 434 -1.365 -6.459 1.914 1.00 0.00 C ATOM 0 H LEU A 434 -2.346 -6.332 5.796 1.00 0.00 H new ATOM 0 HA LEU A 434 -2.583 -8.249 3.733 1.00 0.00 H new ATOM 0 HB2 LEU A 434 -0.193 -6.964 5.096 1.00 0.00 H new ATOM 0 HB3 LEU A 434 -0.072 -7.968 3.664 1.00 0.00 H new ATOM 0 HG LEU A 434 -1.738 -5.443 3.752 1.00 0.00 H new ATOM 0 HD11 LEU A 434 0.149 -4.325 2.632 1.00 0.00 H new ATOM 0 HD12 LEU A 434 0.582 -4.870 4.270 1.00 0.00 H new ATOM 0 HD13 LEU A 434 1.140 -5.788 2.850 1.00 0.00 H new ATOM 0 HD21 LEU A 434 -1.514 -5.570 1.301 1.00 0.00 H new ATOM 0 HD22 LEU A 434 -0.589 -7.082 1.468 1.00 0.00 H new ATOM 0 HD23 LEU A 434 -2.296 -7.023 1.968 1.00 0.00 H new ATOM 208 N PRO A 435 -1.567 -10.424 4.484 1.00 0.00 N ATOM 209 CA PRO A 435 -1.216 -11.761 4.973 1.00 0.00 C ATOM 210 C PRO A 435 0.034 -11.750 5.845 1.00 0.00 C ATOM 211 O PRO A 435 0.955 -10.958 5.641 1.00 0.00 O ATOM 212 CB PRO A 435 -0.965 -12.554 3.688 1.00 0.00 C ATOM 213 CG PRO A 435 -1.803 -11.881 2.657 1.00 0.00 C ATOM 214 CD PRO A 435 -1.862 -10.420 3.041 1.00 0.00 C ATOM 0 HA PRO A 435 -1.998 -12.182 5.604 1.00 0.00 H new ATOM 0 HB2 PRO A 435 0.090 -12.538 3.413 1.00 0.00 H new ATOM 0 HB3 PRO A 435 -1.248 -13.600 3.807 1.00 0.00 H new ATOM 0 HG2 PRO A 435 -1.370 -12.004 1.664 1.00 0.00 H new ATOM 0 HG3 PRO A 435 -2.802 -12.315 2.625 1.00 0.00 H new ATOM 0 HD2 PRO A 435 -1.133 -9.831 2.485 1.00 0.00 H new ATOM 0 HD3 PRO A 435 -2.843 -9.991 2.834 1.00 0.00 H new ATOM 222 N PRO A 436 0.071 -12.647 6.841 1.00 0.00 N ATOM 223 CA PRO A 436 1.204 -12.761 7.764 1.00 0.00 C ATOM 224 C PRO A 436 2.377 -13.518 7.151 1.00 0.00 C ATOM 225 O PRO A 436 3.405 -13.720 7.798 1.00 0.00 O ATOM 226 CB PRO A 436 0.623 -13.541 8.946 1.00 0.00 C ATOM 227 CG PRO A 436 -0.472 -14.361 8.356 1.00 0.00 C ATOM 228 CD PRO A 436 -0.992 -13.621 7.143 1.00 0.00 C ATOM 0 HA PRO A 436 1.607 -11.786 8.037 1.00 0.00 H new ATOM 0 HB2 PRO A 436 1.379 -14.170 9.416 1.00 0.00 H new ATOM 0 HB3 PRO A 436 0.244 -12.869 9.716 1.00 0.00 H new ATOM 0 HG2 PRO A 436 -0.103 -15.347 8.074 1.00 0.00 H new ATOM 0 HG3 PRO A 436 -1.270 -14.515 9.082 1.00 0.00 H new ATOM 0 HD2 PRO A 436 -1.164 -14.297 6.306 1.00 0.00 H new ATOM 0 HD3 PRO A 436 -1.940 -13.126 7.353 1.00 0.00 H new ATOM 236 N ASP A 437 2.217 -13.935 5.900 1.00 0.00 N ATOM 237 CA ASP A 437 3.264 -14.670 5.199 1.00 0.00 C ATOM 238 C ASP A 437 3.502 -14.084 3.811 1.00 0.00 C ATOM 239 O ASP A 437 3.829 -14.806 2.869 1.00 0.00 O ATOM 240 CB ASP A 437 2.890 -16.148 5.084 1.00 0.00 C ATOM 241 CG ASP A 437 2.350 -16.711 6.384 1.00 0.00 C ATOM 242 OD1 ASP A 437 3.051 -16.608 7.412 1.00 0.00 O ATOM 243 OD2 ASP A 437 1.226 -17.256 6.373 1.00 0.00 O ATOM 0 H ASP A 437 1.373 -13.777 5.350 1.00 0.00 H new ATOM 0 HA ASP A 437 4.185 -14.580 5.775 1.00 0.00 H new ATOM 0 HB2 ASP A 437 2.143 -16.271 4.300 1.00 0.00 H new ATOM 0 HB3 ASP A 437 3.767 -16.719 4.781 1.00 0.00 H new ATOM 248 N ILE A 438 3.334 -12.771 3.692 1.00 0.00 N ATOM 249 CA ILE A 438 3.531 -12.088 2.419 1.00 0.00 C ATOM 250 C ILE A 438 4.778 -11.211 2.453 1.00 0.00 C ATOM 251 O ILE A 438 5.171 -10.714 3.508 1.00 0.00 O ATOM 252 CB ILE A 438 2.315 -11.219 2.052 1.00 0.00 C ATOM 253 CG1 ILE A 438 2.462 -10.670 0.631 1.00 0.00 C ATOM 254 CG2 ILE A 438 2.156 -10.082 3.051 1.00 0.00 C ATOM 255 CD1 ILE A 438 1.166 -10.155 0.045 1.00 0.00 C ATOM 0 H ILE A 438 3.062 -12.159 4.461 1.00 0.00 H new ATOM 0 HA ILE A 438 3.655 -12.862 1.662 1.00 0.00 H new ATOM 0 HB ILE A 438 1.419 -11.839 2.090 1.00 0.00 H new ATOM 0 HG12 ILE A 438 3.195 -9.863 0.636 1.00 0.00 H new ATOM 0 HG13 ILE A 438 2.856 -11.455 -0.014 1.00 0.00 H new ATOM 0 HG21 ILE A 438 1.292 -9.476 2.778 1.00 0.00 H new ATOM 0 HG22 ILE A 438 2.010 -10.493 4.050 1.00 0.00 H new ATOM 0 HG23 ILE A 438 3.052 -9.461 3.041 1.00 0.00 H new ATOM 0 HD11 ILE A 438 1.346 -9.781 -0.963 1.00 0.00 H new ATOM 0 HD12 ILE A 438 0.437 -10.964 0.008 1.00 0.00 H new ATOM 0 HD13 ILE A 438 0.781 -9.348 0.668 1.00 0.00 H new ATOM 267 N ASP A 439 5.394 -11.022 1.291 1.00 0.00 N ATOM 268 CA ASP A 439 6.595 -10.202 1.186 1.00 0.00 C ATOM 269 C ASP A 439 6.333 -8.961 0.338 1.00 0.00 C ATOM 270 O ASP A 439 5.229 -8.767 -0.169 1.00 0.00 O ATOM 271 CB ASP A 439 7.743 -11.013 0.584 1.00 0.00 C ATOM 272 CG ASP A 439 7.612 -11.175 -0.918 1.00 0.00 C ATOM 273 OD1 ASP A 439 7.569 -10.145 -1.624 1.00 0.00 O ATOM 274 OD2 ASP A 439 7.553 -12.330 -1.387 1.00 0.00 O ATOM 0 H ASP A 439 5.081 -11.426 0.408 1.00 0.00 H new ATOM 0 HA ASP A 439 6.875 -9.882 2.190 1.00 0.00 H new ATOM 0 HB2 ASP A 439 8.689 -10.523 0.812 1.00 0.00 H new ATOM 0 HB3 ASP A 439 7.773 -11.997 1.051 1.00 0.00 H new ATOM 279 N GLU A 440 7.356 -8.125 0.190 1.00 0.00 N ATOM 280 CA GLU A 440 7.234 -6.902 -0.595 1.00 0.00 C ATOM 281 C GLU A 440 6.696 -7.203 -1.991 1.00 0.00 C ATOM 282 O GLU A 440 5.540 -6.909 -2.298 1.00 0.00 O ATOM 283 CB GLU A 440 8.590 -6.200 -0.700 1.00 0.00 C ATOM 284 CG GLU A 440 8.555 -4.930 -1.533 1.00 0.00 C ATOM 285 CD GLU A 440 9.879 -4.641 -2.212 1.00 0.00 C ATOM 286 OE1 GLU A 440 10.322 -5.477 -3.028 1.00 0.00 O ATOM 287 OE2 GLU A 440 10.473 -3.580 -1.928 1.00 0.00 O ATOM 0 H GLU A 440 8.277 -8.272 0.603 1.00 0.00 H new ATOM 0 HA GLU A 440 6.530 -6.243 -0.087 1.00 0.00 H new ATOM 0 HB2 GLU A 440 8.943 -5.957 0.302 1.00 0.00 H new ATOM 0 HB3 GLU A 440 9.314 -6.889 -1.134 1.00 0.00 H new ATOM 0 HG2 GLU A 440 7.775 -5.017 -2.289 1.00 0.00 H new ATOM 0 HG3 GLU A 440 8.287 -4.088 -0.894 1.00 0.00 H new ATOM 294 N ASP A 441 7.541 -7.789 -2.831 1.00 0.00 N ATOM 295 CA ASP A 441 7.151 -8.131 -4.194 1.00 0.00 C ATOM 296 C ASP A 441 5.681 -8.535 -4.253 1.00 0.00 C ATOM 297 O ASP A 441 4.866 -7.855 -4.876 1.00 0.00 O ATOM 298 CB ASP A 441 8.027 -9.265 -4.728 1.00 0.00 C ATOM 299 CG ASP A 441 7.989 -9.363 -6.241 1.00 0.00 C ATOM 300 OD1 ASP A 441 8.256 -8.341 -6.907 1.00 0.00 O ATOM 301 OD2 ASP A 441 7.691 -10.460 -6.758 1.00 0.00 O ATOM 0 H ASP A 441 8.501 -8.037 -2.592 1.00 0.00 H new ATOM 0 HA ASP A 441 7.292 -7.249 -4.819 1.00 0.00 H new ATOM 0 HB2 ASP A 441 9.056 -9.110 -4.403 1.00 0.00 H new ATOM 0 HB3 ASP A 441 7.696 -10.210 -4.297 1.00 0.00 H new ATOM 306 N GLU A 442 5.351 -9.646 -3.603 1.00 0.00 N ATOM 307 CA GLU A 442 3.980 -10.141 -3.584 1.00 0.00 C ATOM 308 C GLU A 442 2.984 -8.984 -3.560 1.00 0.00 C ATOM 309 O GLU A 442 2.094 -8.899 -4.406 1.00 0.00 O ATOM 310 CB GLU A 442 3.757 -11.046 -2.371 1.00 0.00 C ATOM 311 CG GLU A 442 4.416 -12.409 -2.499 1.00 0.00 C ATOM 312 CD GLU A 442 3.696 -13.482 -1.706 1.00 0.00 C ATOM 313 OE1 GLU A 442 2.449 -13.534 -1.775 1.00 0.00 O ATOM 314 OE2 GLU A 442 4.377 -14.269 -1.016 1.00 0.00 O ATOM 0 H GLU A 442 6.014 -10.220 -3.083 1.00 0.00 H new ATOM 0 HA GLU A 442 3.817 -10.719 -4.494 1.00 0.00 H new ATOM 0 HB2 GLU A 442 4.142 -10.548 -1.481 1.00 0.00 H new ATOM 0 HB3 GLU A 442 2.686 -11.182 -2.222 1.00 0.00 H new ATOM 0 HG2 GLU A 442 4.445 -12.697 -3.550 1.00 0.00 H new ATOM 0 HG3 GLU A 442 5.449 -12.342 -2.158 1.00 0.00 H new ATOM 321 N ILE A 443 3.142 -8.097 -2.583 1.00 0.00 N ATOM 322 CA ILE A 443 2.258 -6.946 -2.448 1.00 0.00 C ATOM 323 C ILE A 443 2.163 -6.169 -3.757 1.00 0.00 C ATOM 324 O ILE A 443 1.082 -6.023 -4.329 1.00 0.00 O ATOM 325 CB ILE A 443 2.737 -5.995 -1.335 1.00 0.00 C ATOM 326 CG1 ILE A 443 2.835 -6.743 -0.004 1.00 0.00 C ATOM 327 CG2 ILE A 443 1.796 -4.806 -1.212 1.00 0.00 C ATOM 328 CD1 ILE A 443 3.674 -6.027 1.032 1.00 0.00 C ATOM 0 H ILE A 443 3.873 -8.153 -1.874 1.00 0.00 H new ATOM 0 HA ILE A 443 1.274 -7.334 -2.185 1.00 0.00 H new ATOM 0 HB ILE A 443 3.728 -5.623 -1.596 1.00 0.00 H new ATOM 0 HG12 ILE A 443 1.831 -6.893 0.394 1.00 0.00 H new ATOM 0 HG13 ILE A 443 3.258 -7.731 -0.182 1.00 0.00 H new ATOM 0 HG21 ILE A 443 2.148 -4.144 -0.421 1.00 0.00 H new ATOM 0 HG22 ILE A 443 1.771 -4.263 -2.157 1.00 0.00 H new ATOM 0 HG23 ILE A 443 0.794 -5.159 -0.970 1.00 0.00 H new ATOM 0 HD11 ILE A 443 3.699 -6.615 1.950 1.00 0.00 H new ATOM 0 HD12 ILE A 443 4.689 -5.900 0.654 1.00 0.00 H new ATOM 0 HD13 ILE A 443 3.240 -5.049 1.239 1.00 0.00 H new ATOM 340 N THR A 444 3.303 -5.674 -4.230 1.00 0.00 N ATOM 341 CA THR A 444 3.349 -4.913 -5.472 1.00 0.00 C ATOM 342 C THR A 444 2.539 -5.598 -6.567 1.00 0.00 C ATOM 343 O THR A 444 1.763 -4.955 -7.273 1.00 0.00 O ATOM 344 CB THR A 444 4.797 -4.725 -5.962 1.00 0.00 C ATOM 345 OG1 THR A 444 5.576 -4.078 -4.950 1.00 0.00 O ATOM 346 CG2 THR A 444 4.833 -3.901 -7.240 1.00 0.00 C ATOM 0 H THR A 444 4.207 -5.787 -3.771 1.00 0.00 H new ATOM 0 HA THR A 444 2.915 -3.936 -5.260 1.00 0.00 H new ATOM 0 HB THR A 444 5.217 -5.709 -6.171 1.00 0.00 H new ATOM 0 HG1 THR A 444 6.496 -3.964 -5.268 1.00 0.00 H new ATOM 0 HG21 THR A 444 5.866 -3.782 -7.567 1.00 0.00 H new ATOM 0 HG22 THR A 444 4.263 -4.410 -8.017 1.00 0.00 H new ATOM 0 HG23 THR A 444 4.396 -2.920 -7.053 1.00 0.00 H new ATOM 354 N ALA A 445 2.724 -6.907 -6.702 1.00 0.00 N ATOM 355 CA ALA A 445 2.008 -7.680 -7.709 1.00 0.00 C ATOM 356 C ALA A 445 0.500 -7.575 -7.512 1.00 0.00 C ATOM 357 O ALA A 445 -0.257 -7.482 -8.478 1.00 0.00 O ATOM 358 CB ALA A 445 2.448 -9.136 -7.668 1.00 0.00 C ATOM 0 H ALA A 445 3.364 -7.454 -6.126 1.00 0.00 H new ATOM 0 HA ALA A 445 2.249 -7.267 -8.688 1.00 0.00 H new ATOM 0 HB1 ALA A 445 1.905 -9.702 -8.425 1.00 0.00 H new ATOM 0 HB2 ALA A 445 3.518 -9.198 -7.866 1.00 0.00 H new ATOM 0 HB3 ALA A 445 2.236 -9.552 -6.683 1.00 0.00 H new ATOM 364 N SER A 446 0.070 -7.592 -6.255 1.00 0.00 N ATOM 365 CA SER A 446 -1.350 -7.503 -5.931 1.00 0.00 C ATOM 366 C SER A 446 -1.918 -6.149 -6.345 1.00 0.00 C ATOM 367 O SER A 446 -3.118 -6.013 -6.585 1.00 0.00 O ATOM 368 CB SER A 446 -1.568 -7.724 -4.433 1.00 0.00 C ATOM 369 OG SER A 446 -1.750 -9.099 -4.141 1.00 0.00 O ATOM 0 H SER A 446 0.684 -7.667 -5.444 1.00 0.00 H new ATOM 0 HA SER A 446 -1.873 -8.282 -6.486 1.00 0.00 H new ATOM 0 HB2 SER A 446 -0.712 -7.341 -3.877 1.00 0.00 H new ATOM 0 HB3 SER A 446 -2.440 -7.160 -4.102 1.00 0.00 H new ATOM 0 HG SER A 446 -1.568 -9.259 -3.191 1.00 0.00 H new ATOM 375 N PHE A 447 -1.046 -5.149 -6.427 1.00 0.00 N ATOM 376 CA PHE A 447 -1.460 -3.804 -6.811 1.00 0.00 C ATOM 377 C PHE A 447 -0.699 -3.334 -8.047 1.00 0.00 C ATOM 378 O PHE A 447 -0.619 -2.136 -8.321 1.00 0.00 O ATOM 379 CB PHE A 447 -1.231 -2.828 -5.655 1.00 0.00 C ATOM 380 CG PHE A 447 -2.089 -3.109 -4.455 1.00 0.00 C ATOM 381 CD1 PHE A 447 -1.799 -4.170 -3.612 1.00 0.00 C ATOM 382 CD2 PHE A 447 -3.186 -2.311 -4.169 1.00 0.00 C ATOM 383 CE1 PHE A 447 -2.588 -4.430 -2.508 1.00 0.00 C ATOM 384 CE2 PHE A 447 -3.978 -2.567 -3.066 1.00 0.00 C ATOM 385 CZ PHE A 447 -3.678 -3.627 -2.233 1.00 0.00 C ATOM 0 H PHE A 447 -0.049 -5.244 -6.233 1.00 0.00 H new ATOM 0 HA PHE A 447 -2.523 -3.831 -7.049 1.00 0.00 H new ATOM 0 HB2 PHE A 447 -0.183 -2.867 -5.359 1.00 0.00 H new ATOM 0 HB3 PHE A 447 -1.427 -1.814 -6.002 1.00 0.00 H new ATOM 0 HD1 PHE A 447 -0.947 -4.800 -3.820 1.00 0.00 H new ATOM 0 HD2 PHE A 447 -3.424 -1.480 -4.816 1.00 0.00 H new ATOM 0 HE1 PHE A 447 -2.353 -5.261 -1.860 1.00 0.00 H new ATOM 0 HE2 PHE A 447 -4.831 -1.939 -2.855 1.00 0.00 H new ATOM 0 HZ PHE A 447 -4.294 -3.828 -1.369 1.00 0.00 H new ATOM 395 N ARG A 448 -0.141 -4.285 -8.789 1.00 0.00 N ATOM 396 CA ARG A 448 0.615 -3.968 -9.995 1.00 0.00 C ATOM 397 C ARG A 448 -0.309 -3.871 -11.206 1.00 0.00 C ATOM 398 O ARG A 448 -0.053 -3.103 -12.134 1.00 0.00 O ATOM 399 CB ARG A 448 1.688 -5.030 -10.243 1.00 0.00 C ATOM 400 CG ARG A 448 2.364 -4.908 -11.599 1.00 0.00 C ATOM 401 CD ARG A 448 3.047 -3.559 -11.761 1.00 0.00 C ATOM 402 NE ARG A 448 4.131 -3.609 -12.738 1.00 0.00 N ATOM 403 CZ ARG A 448 5.250 -4.302 -12.560 1.00 0.00 C ATOM 404 NH1 ARG A 448 5.431 -5.001 -11.448 1.00 0.00 N ATOM 405 NH2 ARG A 448 6.191 -4.298 -13.496 1.00 0.00 N ATOM 0 H ARG A 448 -0.198 -5.281 -8.576 1.00 0.00 H new ATOM 0 HA ARG A 448 1.097 -3.001 -9.849 1.00 0.00 H new ATOM 0 HB2 ARG A 448 2.445 -4.959 -9.462 1.00 0.00 H new ATOM 0 HB3 ARG A 448 1.235 -6.018 -10.160 1.00 0.00 H new ATOM 0 HG2 ARG A 448 3.099 -5.705 -11.714 1.00 0.00 H new ATOM 0 HG3 ARG A 448 1.624 -5.040 -12.389 1.00 0.00 H new ATOM 0 HD2 ARG A 448 2.313 -2.816 -12.072 1.00 0.00 H new ATOM 0 HD3 ARG A 448 3.441 -3.234 -10.798 1.00 0.00 H new ATOM 0 HE ARG A 448 4.023 -3.083 -13.605 1.00 0.00 H new ATOM 0 HH11 ARG A 448 4.710 -5.007 -10.727 1.00 0.00 H new ATOM 0 HH12 ARG A 448 6.291 -5.532 -11.314 1.00 0.00 H new ATOM 0 HH21 ARG A 448 6.055 -3.762 -14.353 1.00 0.00 H new ATOM 0 HH22 ARG A 448 7.050 -4.831 -13.358 1.00 0.00 H new ATOM 419 N ARG A 449 -1.382 -4.655 -11.190 1.00 0.00 N ATOM 420 CA ARG A 449 -2.342 -4.658 -12.287 1.00 0.00 C ATOM 421 C ARG A 449 -2.745 -3.235 -12.661 1.00 0.00 C ATOM 422 O ARG A 449 -2.999 -2.937 -13.828 1.00 0.00 O ATOM 423 CB ARG A 449 -3.583 -5.467 -11.904 1.00 0.00 C ATOM 424 CG ARG A 449 -4.355 -4.881 -10.733 1.00 0.00 C ATOM 425 CD ARG A 449 -5.433 -3.917 -11.203 1.00 0.00 C ATOM 426 NE ARG A 449 -6.716 -4.586 -11.403 1.00 0.00 N ATOM 427 CZ ARG A 449 -7.433 -5.110 -10.416 1.00 0.00 C ATOM 428 NH1 ARG A 449 -6.997 -5.042 -9.166 1.00 0.00 N ATOM 429 NH2 ARG A 449 -8.591 -5.703 -10.678 1.00 0.00 N ATOM 0 H ARG A 449 -1.608 -5.296 -10.430 1.00 0.00 H new ATOM 0 HA ARG A 449 -1.867 -5.121 -13.151 1.00 0.00 H new ATOM 0 HB2 ARG A 449 -4.244 -5.532 -12.768 1.00 0.00 H new ATOM 0 HB3 ARG A 449 -3.281 -6.484 -11.656 1.00 0.00 H new ATOM 0 HG2 ARG A 449 -4.811 -5.686 -10.157 1.00 0.00 H new ATOM 0 HG3 ARG A 449 -3.667 -4.362 -10.065 1.00 0.00 H new ATOM 0 HD2 ARG A 449 -5.551 -3.119 -10.470 1.00 0.00 H new ATOM 0 HD3 ARG A 449 -5.119 -3.449 -12.136 1.00 0.00 H new ATOM 0 HE ARG A 449 -7.081 -4.654 -12.353 1.00 0.00 H new ATOM 0 HH11 ARG A 449 -6.108 -4.586 -8.960 1.00 0.00 H new ATOM 0 HH12 ARG A 449 -7.550 -5.446 -8.410 1.00 0.00 H new ATOM 0 HH21 ARG A 449 -8.931 -5.756 -11.638 1.00 0.00 H new ATOM 0 HH22 ARG A 449 -9.141 -6.105 -9.919 1.00 0.00 H new ATOM 443 N PHE A 450 -2.802 -2.360 -11.662 1.00 0.00 N ATOM 444 CA PHE A 450 -3.176 -0.968 -11.886 1.00 0.00 C ATOM 445 C PHE A 450 -2.043 -0.202 -12.562 1.00 0.00 C ATOM 446 O PHE A 450 -2.280 0.725 -13.335 1.00 0.00 O ATOM 447 CB PHE A 450 -3.540 -0.296 -10.560 1.00 0.00 C ATOM 448 CG PHE A 450 -4.650 -0.988 -9.822 1.00 0.00 C ATOM 449 CD1 PHE A 450 -5.969 -0.822 -10.213 1.00 0.00 C ATOM 450 CD2 PHE A 450 -4.374 -1.806 -8.738 1.00 0.00 C ATOM 451 CE1 PHE A 450 -6.992 -1.457 -9.535 1.00 0.00 C ATOM 452 CE2 PHE A 450 -5.394 -2.444 -8.056 1.00 0.00 C ATOM 453 CZ PHE A 450 -6.704 -2.270 -8.456 1.00 0.00 C ATOM 0 H PHE A 450 -2.594 -2.590 -10.690 1.00 0.00 H new ATOM 0 HA PHE A 450 -4.045 -0.953 -12.544 1.00 0.00 H new ATOM 0 HB2 PHE A 450 -2.656 -0.264 -9.923 1.00 0.00 H new ATOM 0 HB3 PHE A 450 -3.831 0.736 -10.753 1.00 0.00 H new ATOM 0 HD1 PHE A 450 -6.200 -0.189 -11.057 1.00 0.00 H new ATOM 0 HD2 PHE A 450 -3.351 -1.947 -8.422 1.00 0.00 H new ATOM 0 HE1 PHE A 450 -8.016 -1.318 -9.848 1.00 0.00 H new ATOM 0 HE2 PHE A 450 -5.166 -3.078 -7.212 1.00 0.00 H new ATOM 0 HZ PHE A 450 -7.502 -2.769 -7.926 1.00 0.00 H new ATOM 463 N GLY A 451 -0.809 -0.598 -12.265 1.00 0.00 N ATOM 464 CA GLY A 451 0.344 0.061 -12.852 1.00 0.00 C ATOM 465 C GLY A 451 1.578 -0.044 -11.979 1.00 0.00 C ATOM 466 O GLY A 451 1.616 -0.801 -11.008 1.00 0.00 O ATOM 0 H GLY A 451 -0.587 -1.363 -11.628 1.00 0.00 H new ATOM 0 HA2 GLY A 451 0.554 -0.380 -13.827 1.00 0.00 H new ATOM 0 HA3 GLY A 451 0.111 1.112 -13.021 1.00 0.00 H new ATOM 470 N PRO A 452 2.619 0.729 -12.324 1.00 0.00 N ATOM 471 CA PRO A 452 3.881 0.736 -11.578 1.00 0.00 C ATOM 472 C PRO A 452 3.771 1.495 -10.260 1.00 0.00 C ATOM 473 O PRO A 452 3.371 2.660 -10.234 1.00 0.00 O ATOM 474 CB PRO A 452 4.849 1.449 -12.526 1.00 0.00 C ATOM 475 CG PRO A 452 3.985 2.342 -13.348 1.00 0.00 C ATOM 476 CD PRO A 452 2.644 1.655 -13.469 1.00 0.00 C ATOM 0 HA PRO A 452 4.197 -0.270 -11.301 1.00 0.00 H new ATOM 0 HB2 PRO A 452 5.596 2.019 -11.974 1.00 0.00 H new ATOM 0 HB3 PRO A 452 5.389 0.737 -13.150 1.00 0.00 H new ATOM 0 HG2 PRO A 452 3.879 3.319 -12.877 1.00 0.00 H new ATOM 0 HG3 PRO A 452 4.425 2.509 -14.331 1.00 0.00 H new ATOM 0 HD2 PRO A 452 1.823 2.370 -13.423 1.00 0.00 H new ATOM 0 HD3 PRO A 452 2.551 1.123 -14.416 1.00 0.00 H new ATOM 484 N LEU A 453 4.127 0.829 -9.167 1.00 0.00 N ATOM 485 CA LEU A 453 4.068 1.441 -7.844 1.00 0.00 C ATOM 486 C LEU A 453 5.213 0.948 -6.965 1.00 0.00 C ATOM 487 O LEU A 453 5.973 0.062 -7.356 1.00 0.00 O ATOM 488 CB LEU A 453 2.727 1.133 -7.177 1.00 0.00 C ATOM 489 CG LEU A 453 2.575 -0.273 -6.595 1.00 0.00 C ATOM 490 CD1 LEU A 453 1.446 -0.310 -5.576 1.00 0.00 C ATOM 491 CD2 LEU A 453 2.328 -1.286 -7.704 1.00 0.00 C ATOM 0 H LEU A 453 4.460 -0.135 -9.171 1.00 0.00 H new ATOM 0 HA LEU A 453 4.166 2.520 -7.965 1.00 0.00 H new ATOM 0 HB2 LEU A 453 2.568 1.855 -6.376 1.00 0.00 H new ATOM 0 HB3 LEU A 453 1.935 1.289 -7.910 1.00 0.00 H new ATOM 0 HG LEU A 453 3.503 -0.538 -6.088 1.00 0.00 H new ATOM 0 HD11 LEU A 453 1.353 -1.318 -5.173 1.00 0.00 H new ATOM 0 HD12 LEU A 453 1.664 0.386 -4.766 1.00 0.00 H new ATOM 0 HD13 LEU A 453 0.511 -0.024 -6.058 1.00 0.00 H new ATOM 0 HD21 LEU A 453 2.222 -2.281 -7.271 1.00 0.00 H new ATOM 0 HD22 LEU A 453 1.415 -1.024 -8.239 1.00 0.00 H new ATOM 0 HD23 LEU A 453 3.169 -1.279 -8.397 1.00 0.00 H new ATOM 503 N VAL A 454 5.328 1.526 -5.774 1.00 0.00 N ATOM 504 CA VAL A 454 6.378 1.143 -4.837 1.00 0.00 C ATOM 505 C VAL A 454 5.832 1.028 -3.418 1.00 0.00 C ATOM 506 O VAL A 454 5.161 1.934 -2.923 1.00 0.00 O ATOM 507 CB VAL A 454 7.538 2.156 -4.848 1.00 0.00 C ATOM 508 CG1 VAL A 454 7.072 3.507 -4.327 1.00 0.00 C ATOM 509 CG2 VAL A 454 8.709 1.634 -4.029 1.00 0.00 C ATOM 0 H VAL A 454 4.707 2.261 -5.435 1.00 0.00 H new ATOM 0 HA VAL A 454 6.752 0.171 -5.160 1.00 0.00 H new ATOM 0 HB VAL A 454 7.874 2.287 -5.877 1.00 0.00 H new ATOM 0 HG11 VAL A 454 7.905 4.210 -4.342 1.00 0.00 H new ATOM 0 HG12 VAL A 454 6.268 3.883 -4.960 1.00 0.00 H new ATOM 0 HG13 VAL A 454 6.708 3.397 -3.305 1.00 0.00 H new ATOM 0 HG21 VAL A 454 9.520 2.362 -4.048 1.00 0.00 H new ATOM 0 HG22 VAL A 454 8.390 1.473 -2.999 1.00 0.00 H new ATOM 0 HG23 VAL A 454 9.058 0.692 -4.452 1.00 0.00 H new ATOM 519 N VAL A 455 6.125 -0.094 -2.766 1.00 0.00 N ATOM 520 CA VAL A 455 5.665 -0.328 -1.403 1.00 0.00 C ATOM 521 C VAL A 455 6.692 0.157 -0.386 1.00 0.00 C ATOM 522 O VAL A 455 7.896 0.136 -0.645 1.00 0.00 O ATOM 523 CB VAL A 455 5.379 -1.821 -1.155 1.00 0.00 C ATOM 524 CG1 VAL A 455 4.504 -2.000 0.076 1.00 0.00 C ATOM 525 CG2 VAL A 455 4.728 -2.448 -2.378 1.00 0.00 C ATOM 0 H VAL A 455 6.679 -0.854 -3.161 1.00 0.00 H new ATOM 0 HA VAL A 455 4.741 0.236 -1.280 1.00 0.00 H new ATOM 0 HB VAL A 455 6.326 -2.330 -0.975 1.00 0.00 H new ATOM 0 HG11 VAL A 455 4.313 -3.061 0.235 1.00 0.00 H new ATOM 0 HG12 VAL A 455 5.013 -1.588 0.947 1.00 0.00 H new ATOM 0 HG13 VAL A 455 3.558 -1.479 -0.071 1.00 0.00 H new ATOM 0 HG21 VAL A 455 4.533 -3.503 -2.186 1.00 0.00 H new ATOM 0 HG22 VAL A 455 3.789 -1.938 -2.592 1.00 0.00 H new ATOM 0 HG23 VAL A 455 5.395 -2.353 -3.234 1.00 0.00 H new ATOM 535 N ASP A 456 6.210 0.593 0.773 1.00 0.00 N ATOM 536 CA ASP A 456 7.086 1.082 1.831 1.00 0.00 C ATOM 537 C ASP A 456 6.416 0.951 3.195 1.00 0.00 C ATOM 538 O ASP A 456 5.435 1.637 3.483 1.00 0.00 O ATOM 539 CB ASP A 456 7.467 2.540 1.573 1.00 0.00 C ATOM 540 CG ASP A 456 8.443 3.074 2.604 1.00 0.00 C ATOM 541 OD1 ASP A 456 8.060 3.172 3.788 1.00 0.00 O ATOM 542 OD2 ASP A 456 9.589 3.396 2.225 1.00 0.00 O ATOM 0 H ASP A 456 5.217 0.618 1.003 1.00 0.00 H new ATOM 0 HA ASP A 456 7.990 0.473 1.831 1.00 0.00 H new ATOM 0 HB2 ASP A 456 7.908 2.627 0.580 1.00 0.00 H new ATOM 0 HB3 ASP A 456 6.566 3.154 1.577 1.00 0.00 H new ATOM 547 N TRP A 457 6.952 0.067 4.029 1.00 0.00 N ATOM 548 CA TRP A 457 6.404 -0.154 5.363 1.00 0.00 C ATOM 549 C TRP A 457 7.208 0.605 6.414 1.00 0.00 C ATOM 550 O TRP A 457 8.367 0.962 6.204 1.00 0.00 O ATOM 551 CB TRP A 457 6.394 -1.647 5.691 1.00 0.00 C ATOM 552 CG TRP A 457 7.628 -2.364 5.234 1.00 0.00 C ATOM 553 CD1 TRP A 457 8.667 -2.787 6.013 1.00 0.00 C ATOM 554 CD2 TRP A 457 7.953 -2.740 3.891 1.00 0.00 C ATOM 555 NE1 TRP A 457 9.618 -3.403 5.236 1.00 0.00 N ATOM 556 CE2 TRP A 457 9.203 -3.388 3.931 1.00 0.00 C ATOM 557 CE3 TRP A 457 7.309 -2.594 2.660 1.00 0.00 C ATOM 558 CZ2 TRP A 457 9.819 -3.887 2.786 1.00 0.00 C ATOM 559 CZ3 TRP A 457 7.922 -3.089 1.525 1.00 0.00 C ATOM 560 CH2 TRP A 457 9.166 -3.730 1.594 1.00 0.00 C ATOM 0 H TRP A 457 7.764 -0.508 3.806 1.00 0.00 H new ATOM 0 HA TRP A 457 5.380 0.220 5.375 1.00 0.00 H new ATOM 0 HB2 TRP A 457 6.287 -1.774 6.768 1.00 0.00 H new ATOM 0 HB3 TRP A 457 5.522 -2.108 5.227 1.00 0.00 H new ATOM 0 HD1 TRP A 457 8.732 -2.656 7.083 1.00 0.00 H new ATOM 0 HE1 TRP A 457 10.491 -3.806 5.576 1.00 0.00 H new ATOM 0 HE3 TRP A 457 6.349 -2.103 2.597 1.00 0.00 H new ATOM 0 HZ2 TRP A 457 10.778 -4.380 2.837 1.00 0.00 H new ATOM 0 HZ3 TRP A 457 7.434 -2.980 0.568 1.00 0.00 H new ATOM 0 HH2 TRP A 457 9.618 -4.107 0.689 1.00 0.00 H new ATOM 571 N PRO A 458 6.580 0.858 7.571 1.00 0.00 N ATOM 572 CA PRO A 458 7.219 1.577 8.678 1.00 0.00 C ATOM 573 C PRO A 458 8.639 1.090 8.942 1.00 0.00 C ATOM 574 O PRO A 458 9.583 1.881 8.969 1.00 0.00 O ATOM 575 CB PRO A 458 6.315 1.264 9.873 1.00 0.00 C ATOM 576 CG PRO A 458 4.971 1.019 9.278 1.00 0.00 C ATOM 577 CD PRO A 458 5.197 0.462 7.890 1.00 0.00 C ATOM 0 HA PRO A 458 7.318 2.642 8.469 1.00 0.00 H new ATOM 0 HB2 PRO A 458 6.671 0.391 10.420 1.00 0.00 H new ATOM 0 HB3 PRO A 458 6.290 2.094 10.579 1.00 0.00 H new ATOM 0 HG2 PRO A 458 4.402 0.317 9.887 1.00 0.00 H new ATOM 0 HG3 PRO A 458 4.395 1.943 9.234 1.00 0.00 H new ATOM 0 HD2 PRO A 458 5.077 -0.621 7.870 1.00 0.00 H new ATOM 0 HD3 PRO A 458 4.487 0.875 7.173 1.00 0.00 H new ATOM 585 N HIS A 459 8.785 -0.217 9.135 1.00 0.00 N ATOM 586 CA HIS A 459 10.092 -0.810 9.396 1.00 0.00 C ATOM 587 C HIS A 459 10.691 -1.389 8.117 1.00 0.00 C ATOM 588 O HIS A 459 10.751 -2.606 7.942 1.00 0.00 O ATOM 589 CB HIS A 459 9.977 -1.903 10.459 1.00 0.00 C ATOM 590 CG HIS A 459 10.079 -1.387 11.861 1.00 0.00 C ATOM 591 ND1 HIS A 459 11.227 -1.487 12.619 1.00 0.00 N ATOM 592 CD2 HIS A 459 9.167 -0.763 12.643 1.00 0.00 C ATOM 593 CE1 HIS A 459 11.017 -0.948 13.806 1.00 0.00 C ATOM 594 NE2 HIS A 459 9.775 -0.501 13.847 1.00 0.00 N ATOM 0 H HIS A 459 8.015 -0.885 9.116 1.00 0.00 H new ATOM 0 HA HIS A 459 10.753 -0.025 9.763 1.00 0.00 H new ATOM 0 HB2 HIS A 459 9.024 -2.417 10.338 1.00 0.00 H new ATOM 0 HB3 HIS A 459 10.761 -2.642 10.295 1.00 0.00 H new ATOM 0 HD2 HIS A 459 8.151 -0.517 12.371 1.00 0.00 H new ATOM 0 HE1 HIS A 459 11.738 -0.884 14.607 1.00 0.00 H new ATOM 0 HE2 HIS A 459 9.338 -0.037 14.643 1.00 0.00 H new ATOM 602 N LYS A 460 11.133 -0.508 7.226 1.00 0.00 N ATOM 603 CA LYS A 460 11.728 -0.930 5.963 1.00 0.00 C ATOM 604 C LYS A 460 13.115 -0.321 5.785 1.00 0.00 C ATOM 605 O LYS A 460 14.094 -1.036 5.569 1.00 0.00 O ATOM 606 CB LYS A 460 10.829 -0.528 4.792 1.00 0.00 C ATOM 607 CG LYS A 460 11.113 -1.298 3.514 1.00 0.00 C ATOM 608 CD LYS A 460 12.206 -0.633 2.694 1.00 0.00 C ATOM 609 CE LYS A 460 12.722 -1.557 1.601 1.00 0.00 C ATOM 610 NZ LYS A 460 13.984 -1.049 0.996 1.00 0.00 N ATOM 0 H LYS A 460 11.090 0.503 7.355 1.00 0.00 H new ATOM 0 HA LYS A 460 11.826 -2.015 5.981 1.00 0.00 H new ATOM 0 HB2 LYS A 460 9.788 -0.682 5.075 1.00 0.00 H new ATOM 0 HB3 LYS A 460 10.953 0.538 4.599 1.00 0.00 H new ATOM 0 HG2 LYS A 460 11.411 -2.317 3.761 1.00 0.00 H new ATOM 0 HG3 LYS A 460 10.202 -1.367 2.920 1.00 0.00 H new ATOM 0 HD2 LYS A 460 11.820 0.283 2.246 1.00 0.00 H new ATOM 0 HD3 LYS A 460 13.029 -0.346 3.348 1.00 0.00 H new ATOM 0 HE2 LYS A 460 12.892 -2.551 2.016 1.00 0.00 H new ATOM 0 HE3 LYS A 460 11.963 -1.661 0.825 1.00 0.00 H new ATOM 0 HZ1 LYS A 460 14.303 -1.706 0.256 1.00 0.00 H new ATOM 0 HZ2 LYS A 460 13.816 -0.112 0.578 1.00 0.00 H new ATOM 0 HZ3 LYS A 460 14.716 -0.974 1.731 1.00 0.00 H new ATOM 624 N ALA A 461 13.192 1.002 5.878 1.00 0.00 N ATOM 625 CA ALA A 461 14.460 1.706 5.731 1.00 0.00 C ATOM 626 C ALA A 461 15.459 1.266 6.795 1.00 0.00 C ATOM 627 O ALA A 461 16.625 1.008 6.496 1.00 0.00 O ATOM 628 CB ALA A 461 14.240 3.210 5.801 1.00 0.00 C ATOM 0 H ALA A 461 12.391 1.608 6.055 1.00 0.00 H new ATOM 0 HA ALA A 461 14.875 1.455 4.755 1.00 0.00 H new ATOM 0 HB1 ALA A 461 15.195 3.723 5.690 1.00 0.00 H new ATOM 0 HB2 ALA A 461 13.568 3.517 5.000 1.00 0.00 H new ATOM 0 HB3 ALA A 461 13.799 3.469 6.764 1.00 0.00 H new ATOM 634 N GLU A 462 14.995 1.182 8.038 1.00 0.00 N ATOM 635 CA GLU A 462 15.850 0.774 9.146 1.00 0.00 C ATOM 636 C GLU A 462 16.026 -0.742 9.169 1.00 0.00 C ATOM 637 O GLU A 462 17.142 -1.246 9.295 1.00 0.00 O ATOM 638 CB GLU A 462 15.261 1.250 10.476 1.00 0.00 C ATOM 639 CG GLU A 462 15.658 2.670 10.844 1.00 0.00 C ATOM 640 CD GLU A 462 17.146 2.812 11.097 1.00 0.00 C ATOM 641 OE1 GLU A 462 17.572 2.620 12.255 1.00 0.00 O ATOM 642 OE2 GLU A 462 17.885 3.117 10.137 1.00 0.00 O ATOM 0 H GLU A 462 14.032 1.391 8.303 1.00 0.00 H new ATOM 0 HA GLU A 462 16.828 1.234 9.004 1.00 0.00 H new ATOM 0 HB2 GLU A 462 14.174 1.187 10.426 1.00 0.00 H new ATOM 0 HB3 GLU A 462 15.583 0.575 11.269 1.00 0.00 H new ATOM 0 HG2 GLU A 462 15.364 3.345 10.041 1.00 0.00 H new ATOM 0 HG3 GLU A 462 15.111 2.977 11.735 1.00 0.00 H new ATOM 649 N SER A 463 14.916 -1.462 9.045 1.00 0.00 N ATOM 650 CA SER A 463 14.945 -2.920 9.055 1.00 0.00 C ATOM 651 C SER A 463 15.312 -3.465 7.679 1.00 0.00 C ATOM 652 O SER A 463 14.640 -3.183 6.686 1.00 0.00 O ATOM 653 CB SER A 463 13.588 -3.476 9.492 1.00 0.00 C ATOM 654 OG SER A 463 13.450 -3.434 10.901 1.00 0.00 O ATOM 0 H SER A 463 13.985 -1.060 8.936 1.00 0.00 H new ATOM 0 HA SER A 463 15.706 -3.239 9.767 1.00 0.00 H new ATOM 0 HB2 SER A 463 12.788 -2.899 9.028 1.00 0.00 H new ATOM 0 HB3 SER A 463 13.483 -4.503 9.144 1.00 0.00 H new ATOM 0 HG SER A 463 12.757 -2.785 11.143 1.00 0.00 H new ATOM 660 N LYS A 464 16.384 -4.249 7.626 1.00 0.00 N ATOM 661 CA LYS A 464 16.843 -4.836 6.373 1.00 0.00 C ATOM 662 C LYS A 464 15.958 -6.011 5.968 1.00 0.00 C ATOM 663 O LYS A 464 15.620 -6.170 4.795 1.00 0.00 O ATOM 664 CB LYS A 464 18.295 -5.299 6.504 1.00 0.00 C ATOM 665 CG LYS A 464 19.308 -4.184 6.313 1.00 0.00 C ATOM 666 CD LYS A 464 19.370 -3.272 7.527 1.00 0.00 C ATOM 667 CE LYS A 464 20.236 -3.866 8.627 1.00 0.00 C ATOM 668 NZ LYS A 464 19.944 -3.256 9.953 1.00 0.00 N ATOM 0 H LYS A 464 16.952 -4.493 8.438 1.00 0.00 H new ATOM 0 HA LYS A 464 16.781 -4.072 5.598 1.00 0.00 H new ATOM 0 HB2 LYS A 464 18.438 -5.744 7.489 1.00 0.00 H new ATOM 0 HB3 LYS A 464 18.486 -6.082 5.770 1.00 0.00 H new ATOM 0 HG2 LYS A 464 20.293 -4.614 6.129 1.00 0.00 H new ATOM 0 HG3 LYS A 464 19.045 -3.600 5.431 1.00 0.00 H new ATOM 0 HD2 LYS A 464 19.768 -2.301 7.234 1.00 0.00 H new ATOM 0 HD3 LYS A 464 18.363 -3.102 7.907 1.00 0.00 H new ATOM 0 HE2 LYS A 464 20.071 -4.942 8.678 1.00 0.00 H new ATOM 0 HE3 LYS A 464 21.288 -3.716 8.382 1.00 0.00 H new ATOM 0 HZ1 LYS A 464 20.555 -3.688 10.676 1.00 0.00 H new ATOM 0 HZ2 LYS A 464 20.126 -2.233 9.912 1.00 0.00 H new ATOM 0 HZ3 LYS A 464 18.947 -3.421 10.199 1.00 0.00 H new ATOM 682 N SER A 465 15.586 -6.831 6.945 1.00 0.00 N ATOM 683 CA SER A 465 14.743 -7.993 6.690 1.00 0.00 C ATOM 684 C SER A 465 13.700 -7.682 5.621 1.00 0.00 C ATOM 685 O SER A 465 13.044 -6.641 5.661 1.00 0.00 O ATOM 686 CB SER A 465 14.051 -8.441 7.979 1.00 0.00 C ATOM 687 OG SER A 465 13.557 -9.764 7.859 1.00 0.00 O ATOM 0 H SER A 465 15.855 -6.712 7.922 1.00 0.00 H new ATOM 0 HA SER A 465 15.379 -8.801 6.329 1.00 0.00 H new ATOM 0 HB2 SER A 465 14.753 -8.386 8.811 1.00 0.00 H new ATOM 0 HB3 SER A 465 13.230 -7.762 8.210 1.00 0.00 H new ATOM 0 HG SER A 465 13.121 -10.028 8.696 1.00 0.00 H new ATOM 693 N TYR A 466 13.551 -8.593 4.665 1.00 0.00 N ATOM 694 CA TYR A 466 12.590 -8.416 3.583 1.00 0.00 C ATOM 695 C TYR A 466 11.228 -8.988 3.966 1.00 0.00 C ATOM 696 O TYR A 466 10.588 -9.679 3.174 1.00 0.00 O ATOM 697 CB TYR A 466 13.098 -9.089 2.307 1.00 0.00 C ATOM 698 CG TYR A 466 13.404 -10.560 2.478 1.00 0.00 C ATOM 699 CD1 TYR A 466 14.578 -10.979 3.091 1.00 0.00 C ATOM 700 CD2 TYR A 466 12.518 -11.531 2.028 1.00 0.00 C ATOM 701 CE1 TYR A 466 14.862 -12.321 3.249 1.00 0.00 C ATOM 702 CE2 TYR A 466 12.793 -12.876 2.183 1.00 0.00 C ATOM 703 CZ TYR A 466 13.966 -13.266 2.794 1.00 0.00 C ATOM 704 OH TYR A 466 14.245 -14.605 2.950 1.00 0.00 O ATOM 0 H TYR A 466 14.084 -9.462 4.618 1.00 0.00 H new ATOM 0 HA TYR A 466 12.477 -7.347 3.402 1.00 0.00 H new ATOM 0 HB2 TYR A 466 12.351 -8.971 1.522 1.00 0.00 H new ATOM 0 HB3 TYR A 466 13.999 -8.576 1.970 1.00 0.00 H new ATOM 0 HD1 TYR A 466 15.281 -10.242 3.450 1.00 0.00 H new ATOM 0 HD2 TYR A 466 11.598 -11.229 1.549 1.00 0.00 H new ATOM 0 HE1 TYR A 466 15.781 -12.629 3.726 1.00 0.00 H new ATOM 0 HE2 TYR A 466 12.093 -13.618 1.828 1.00 0.00 H new ATOM 0 HH TYR A 466 13.512 -15.138 2.577 1.00 0.00 H new ATOM 714 N PHE A 467 10.792 -8.693 5.186 1.00 0.00 N ATOM 715 CA PHE A 467 9.506 -9.177 5.675 1.00 0.00 C ATOM 716 C PHE A 467 8.717 -8.051 6.336 1.00 0.00 C ATOM 717 O PHE A 467 8.898 -7.739 7.513 1.00 0.00 O ATOM 718 CB PHE A 467 9.713 -10.321 6.670 1.00 0.00 C ATOM 719 CG PHE A 467 9.730 -11.679 6.027 1.00 0.00 C ATOM 720 CD1 PHE A 467 10.821 -12.093 5.281 1.00 0.00 C ATOM 721 CD2 PHE A 467 8.653 -12.540 6.168 1.00 0.00 C ATOM 722 CE1 PHE A 467 10.839 -13.342 4.688 1.00 0.00 C ATOM 723 CE2 PHE A 467 8.666 -13.790 5.579 1.00 0.00 C ATOM 724 CZ PHE A 467 9.760 -14.191 4.836 1.00 0.00 C ATOM 0 H PHE A 467 11.310 -8.122 5.854 1.00 0.00 H new ATOM 0 HA PHE A 467 8.936 -9.545 4.822 1.00 0.00 H new ATOM 0 HB2 PHE A 467 10.654 -10.166 7.199 1.00 0.00 H new ATOM 0 HB3 PHE A 467 8.919 -10.291 7.416 1.00 0.00 H new ATOM 0 HD1 PHE A 467 11.667 -11.433 5.161 1.00 0.00 H new ATOM 0 HD2 PHE A 467 7.794 -12.230 6.745 1.00 0.00 H new ATOM 0 HE1 PHE A 467 11.696 -13.653 4.110 1.00 0.00 H new ATOM 0 HE2 PHE A 467 7.822 -14.453 5.699 1.00 0.00 H new ATOM 0 HZ PHE A 467 9.771 -15.166 4.372 1.00 0.00 H new ATOM 734 N PRO A 468 7.819 -7.424 5.561 1.00 0.00 N ATOM 735 CA PRO A 468 6.984 -6.323 6.048 1.00 0.00 C ATOM 736 C PRO A 468 6.377 -6.617 7.416 1.00 0.00 C ATOM 737 O PRO A 468 6.305 -7.765 7.856 1.00 0.00 O ATOM 738 CB PRO A 468 5.886 -6.214 4.988 1.00 0.00 C ATOM 739 CG PRO A 468 6.517 -6.719 3.736 1.00 0.00 C ATOM 740 CD PRO A 468 7.550 -7.743 4.149 1.00 0.00 C ATOM 0 HA PRO A 468 7.557 -5.406 6.183 1.00 0.00 H new ATOM 0 HB2 PRO A 468 5.013 -6.808 5.259 1.00 0.00 H new ATOM 0 HB3 PRO A 468 5.547 -5.184 4.873 1.00 0.00 H new ATOM 0 HG2 PRO A 468 5.770 -7.166 3.080 1.00 0.00 H new ATOM 0 HG3 PRO A 468 6.981 -5.904 3.181 1.00 0.00 H new ATOM 0 HD2 PRO A 468 7.174 -8.759 4.034 1.00 0.00 H new ATOM 0 HD3 PRO A 468 8.453 -7.667 3.543 1.00 0.00 H new ATOM 748 N PRO A 469 5.928 -5.558 8.105 1.00 0.00 N ATOM 749 CA PRO A 469 5.317 -5.678 9.432 1.00 0.00 C ATOM 750 C PRO A 469 4.233 -6.750 9.477 1.00 0.00 C ATOM 751 O PRO A 469 3.932 -7.385 8.467 1.00 0.00 O ATOM 752 CB PRO A 469 4.711 -4.293 9.671 1.00 0.00 C ATOM 753 CG PRO A 469 5.545 -3.369 8.854 1.00 0.00 C ATOM 754 CD PRO A 469 5.980 -4.161 7.642 1.00 0.00 C ATOM 0 HA PRO A 469 6.042 -5.977 10.189 1.00 0.00 H new ATOM 0 HB2 PRO A 469 3.666 -4.260 9.363 1.00 0.00 H new ATOM 0 HB3 PRO A 469 4.741 -4.024 10.727 1.00 0.00 H new ATOM 0 HG2 PRO A 469 4.976 -2.487 8.560 1.00 0.00 H new ATOM 0 HG3 PRO A 469 6.407 -3.018 9.421 1.00 0.00 H new ATOM 0 HD2 PRO A 469 5.315 -3.994 6.794 1.00 0.00 H new ATOM 0 HD3 PRO A 469 6.983 -3.882 7.320 1.00 0.00 H new ATOM 762 N LYS A 470 3.649 -6.945 10.654 1.00 0.00 N ATOM 763 CA LYS A 470 2.596 -7.938 10.831 1.00 0.00 C ATOM 764 C LYS A 470 1.660 -7.959 9.627 1.00 0.00 C ATOM 765 O LYS A 470 1.609 -8.940 8.885 1.00 0.00 O ATOM 766 CB LYS A 470 1.799 -7.646 12.104 1.00 0.00 C ATOM 767 CG LYS A 470 1.217 -8.888 12.757 1.00 0.00 C ATOM 768 CD LYS A 470 0.076 -8.541 13.698 1.00 0.00 C ATOM 769 CE LYS A 470 -0.037 -9.549 14.832 1.00 0.00 C ATOM 770 NZ LYS A 470 -1.135 -9.200 15.775 1.00 0.00 N ATOM 0 H LYS A 470 3.887 -6.428 11.500 1.00 0.00 H new ATOM 0 HA LYS A 470 3.067 -8.917 10.921 1.00 0.00 H new ATOM 0 HB2 LYS A 470 2.447 -7.139 12.820 1.00 0.00 H new ATOM 0 HB3 LYS A 470 0.988 -6.958 11.865 1.00 0.00 H new ATOM 0 HG2 LYS A 470 0.859 -9.571 11.987 1.00 0.00 H new ATOM 0 HG3 LYS A 470 1.999 -9.410 13.309 1.00 0.00 H new ATOM 0 HD2 LYS A 470 0.233 -7.544 14.110 1.00 0.00 H new ATOM 0 HD3 LYS A 470 -0.860 -8.512 13.141 1.00 0.00 H new ATOM 0 HE2 LYS A 470 -0.214 -10.542 14.419 1.00 0.00 H new ATOM 0 HE3 LYS A 470 0.907 -9.593 15.374 1.00 0.00 H new ATOM 0 HZ1 LYS A 470 -1.180 -9.910 16.533 1.00 0.00 H new ATOM 0 HZ2 LYS A 470 -0.953 -8.263 16.188 1.00 0.00 H new ATOM 0 HZ3 LYS A 470 -2.040 -9.183 15.263 1.00 0.00 H new ATOM 784 N GLY A 471 0.921 -6.870 9.437 1.00 0.00 N ATOM 785 CA GLY A 471 -0.002 -6.785 8.321 1.00 0.00 C ATOM 786 C GLY A 471 -0.442 -5.362 8.041 1.00 0.00 C ATOM 787 O GLY A 471 -1.614 -5.022 8.211 1.00 0.00 O ATOM 0 H GLY A 471 0.945 -6.045 10.036 1.00 0.00 H new ATOM 0 HA2 GLY A 471 0.471 -7.198 7.430 1.00 0.00 H new ATOM 0 HA3 GLY A 471 -0.878 -7.399 8.530 1.00 0.00 H new ATOM 791 N TYR A 472 0.497 -4.526 7.612 1.00 0.00 N ATOM 792 CA TYR A 472 0.200 -3.131 7.312 1.00 0.00 C ATOM 793 C TYR A 472 1.392 -2.452 6.643 1.00 0.00 C ATOM 794 O TYR A 472 2.521 -2.540 7.123 1.00 0.00 O ATOM 795 CB TYR A 472 -0.176 -2.381 8.591 1.00 0.00 C ATOM 796 CG TYR A 472 0.784 -2.618 9.735 1.00 0.00 C ATOM 797 CD1 TYR A 472 0.645 -3.722 10.567 1.00 0.00 C ATOM 798 CD2 TYR A 472 1.829 -1.737 9.984 1.00 0.00 C ATOM 799 CE1 TYR A 472 1.519 -3.941 11.615 1.00 0.00 C ATOM 800 CE2 TYR A 472 2.709 -1.949 11.028 1.00 0.00 C ATOM 801 CZ TYR A 472 2.549 -3.052 11.841 1.00 0.00 C ATOM 802 OH TYR A 472 3.423 -3.268 12.882 1.00 0.00 O ATOM 0 H TYR A 472 1.471 -4.791 7.464 1.00 0.00 H new ATOM 0 HA TYR A 472 -0.644 -3.106 6.623 1.00 0.00 H new ATOM 0 HB2 TYR A 472 -0.217 -1.313 8.377 1.00 0.00 H new ATOM 0 HB3 TYR A 472 -1.177 -2.683 8.899 1.00 0.00 H new ATOM 0 HD1 TYR A 472 -0.160 -4.421 10.392 1.00 0.00 H new ATOM 0 HD2 TYR A 472 1.956 -0.871 9.351 1.00 0.00 H new ATOM 0 HE1 TYR A 472 1.396 -4.803 12.253 1.00 0.00 H new ATOM 0 HE2 TYR A 472 3.517 -1.255 11.206 1.00 0.00 H new ATOM 0 HH TYR A 472 4.090 -2.551 12.903 1.00 0.00 H new ATOM 812 N ALA A 473 1.130 -1.774 5.530 1.00 0.00 N ATOM 813 CA ALA A 473 2.178 -1.077 4.795 1.00 0.00 C ATOM 814 C ALA A 473 1.613 0.113 4.028 1.00 0.00 C ATOM 815 O ALA A 473 0.399 0.309 3.973 1.00 0.00 O ATOM 816 CB ALA A 473 2.881 -2.034 3.844 1.00 0.00 C ATOM 0 H ALA A 473 0.201 -1.693 5.118 1.00 0.00 H new ATOM 0 HA ALA A 473 2.903 -0.700 5.516 1.00 0.00 H new ATOM 0 HB1 ALA A 473 3.661 -1.500 3.302 1.00 0.00 H new ATOM 0 HB2 ALA A 473 3.328 -2.850 4.413 1.00 0.00 H new ATOM 0 HB3 ALA A 473 2.159 -2.439 3.135 1.00 0.00 H new ATOM 822 N PHE A 474 2.501 0.907 3.438 1.00 0.00 N ATOM 823 CA PHE A 474 2.090 2.080 2.676 1.00 0.00 C ATOM 824 C PHE A 474 2.514 1.955 1.215 1.00 0.00 C ATOM 825 O PHE A 474 3.702 1.845 0.909 1.00 0.00 O ATOM 826 CB PHE A 474 2.691 3.348 3.287 1.00 0.00 C ATOM 827 CG PHE A 474 1.950 3.841 4.496 1.00 0.00 C ATOM 828 CD1 PHE A 474 1.763 3.017 5.594 1.00 0.00 C ATOM 829 CD2 PHE A 474 1.439 5.128 4.535 1.00 0.00 C ATOM 830 CE1 PHE A 474 1.081 3.467 6.709 1.00 0.00 C ATOM 831 CE2 PHE A 474 0.756 5.584 5.647 1.00 0.00 C ATOM 832 CZ PHE A 474 0.576 4.752 6.735 1.00 0.00 C ATOM 0 H PHE A 474 3.510 0.759 3.473 1.00 0.00 H new ATOM 0 HA PHE A 474 1.003 2.146 2.716 1.00 0.00 H new ATOM 0 HB2 PHE A 474 3.728 3.153 3.561 1.00 0.00 H new ATOM 0 HB3 PHE A 474 2.703 4.135 2.533 1.00 0.00 H new ATOM 0 HD1 PHE A 474 2.155 2.011 5.579 1.00 0.00 H new ATOM 0 HD2 PHE A 474 1.576 5.783 3.687 1.00 0.00 H new ATOM 0 HE1 PHE A 474 0.943 2.815 7.559 1.00 0.00 H new ATOM 0 HE2 PHE A 474 0.363 6.590 5.665 1.00 0.00 H new ATOM 0 HZ PHE A 474 0.041 5.106 7.604 1.00 0.00 H new ATOM 842 N LEU A 475 1.534 1.972 0.318 1.00 0.00 N ATOM 843 CA LEU A 475 1.804 1.860 -1.111 1.00 0.00 C ATOM 844 C LEU A 475 1.919 3.239 -1.753 1.00 0.00 C ATOM 845 O LEU A 475 1.190 4.166 -1.394 1.00 0.00 O ATOM 846 CB LEU A 475 0.698 1.056 -1.797 1.00 0.00 C ATOM 847 CG LEU A 475 0.344 -0.284 -1.152 1.00 0.00 C ATOM 848 CD1 LEU A 475 -0.950 -0.831 -1.735 1.00 0.00 C ATOM 849 CD2 LEU A 475 1.478 -1.281 -1.337 1.00 0.00 C ATOM 0 H LEU A 475 0.546 2.062 0.555 1.00 0.00 H new ATOM 0 HA LEU A 475 2.754 1.341 -1.237 1.00 0.00 H new ATOM 0 HB2 LEU A 475 -0.202 1.670 -1.830 1.00 0.00 H new ATOM 0 HB3 LEU A 475 0.997 0.872 -2.829 1.00 0.00 H new ATOM 0 HG LEU A 475 0.198 -0.124 -0.084 1.00 0.00 H new ATOM 0 HD11 LEU A 475 -1.186 -1.785 -1.264 1.00 0.00 H new ATOM 0 HD12 LEU A 475 -1.759 -0.125 -1.550 1.00 0.00 H new ATOM 0 HD13 LEU A 475 -0.833 -0.976 -2.809 1.00 0.00 H new ATOM 0 HD21 LEU A 475 1.208 -2.229 -0.872 1.00 0.00 H new ATOM 0 HD22 LEU A 475 1.656 -1.437 -2.401 1.00 0.00 H new ATOM 0 HD23 LEU A 475 2.384 -0.893 -0.871 1.00 0.00 H new ATOM 861 N LEU A 476 2.836 3.368 -2.705 1.00 0.00 N ATOM 862 CA LEU A 476 3.045 4.634 -3.400 1.00 0.00 C ATOM 863 C LEU A 476 2.960 4.446 -4.911 1.00 0.00 C ATOM 864 O LEU A 476 3.929 4.039 -5.552 1.00 0.00 O ATOM 865 CB LEU A 476 4.404 5.226 -3.024 1.00 0.00 C ATOM 866 CG LEU A 476 4.471 5.953 -1.680 1.00 0.00 C ATOM 867 CD1 LEU A 476 5.914 6.094 -1.221 1.00 0.00 C ATOM 868 CD2 LEU A 476 3.805 7.318 -1.778 1.00 0.00 C ATOM 0 H LEU A 476 3.447 2.612 -3.014 1.00 0.00 H new ATOM 0 HA LEU A 476 2.258 5.323 -3.093 1.00 0.00 H new ATOM 0 HB2 LEU A 476 5.139 4.421 -3.016 1.00 0.00 H new ATOM 0 HB3 LEU A 476 4.703 5.923 -3.807 1.00 0.00 H new ATOM 0 HG LEU A 476 3.932 5.360 -0.941 1.00 0.00 H new ATOM 0 HD11 LEU A 476 5.942 6.614 -0.263 1.00 0.00 H new ATOM 0 HD12 LEU A 476 6.359 5.105 -1.111 1.00 0.00 H new ATOM 0 HD13 LEU A 476 6.477 6.665 -1.960 1.00 0.00 H new ATOM 0 HD21 LEU A 476 3.862 7.821 -0.813 1.00 0.00 H new ATOM 0 HD22 LEU A 476 4.315 7.919 -2.531 1.00 0.00 H new ATOM 0 HD23 LEU A 476 2.760 7.193 -2.061 1.00 0.00 H new ATOM 880 N PHE A 477 1.795 4.748 -5.475 1.00 0.00 N ATOM 881 CA PHE A 477 1.583 4.613 -6.912 1.00 0.00 C ATOM 882 C PHE A 477 2.338 5.697 -7.676 1.00 0.00 C ATOM 883 O PHE A 477 2.187 6.886 -7.398 1.00 0.00 O ATOM 884 CB PHE A 477 0.090 4.689 -7.238 1.00 0.00 C ATOM 885 CG PHE A 477 -0.668 3.448 -6.865 1.00 0.00 C ATOM 886 CD1 PHE A 477 -0.780 2.394 -7.758 1.00 0.00 C ATOM 887 CD2 PHE A 477 -1.269 3.334 -5.622 1.00 0.00 C ATOM 888 CE1 PHE A 477 -1.479 1.251 -7.418 1.00 0.00 C ATOM 889 CE2 PHE A 477 -1.969 2.193 -5.276 1.00 0.00 C ATOM 890 CZ PHE A 477 -2.073 1.150 -6.175 1.00 0.00 C ATOM 0 H PHE A 477 0.983 5.088 -4.959 1.00 0.00 H new ATOM 0 HA PHE A 477 1.966 3.641 -7.222 1.00 0.00 H new ATOM 0 HB2 PHE A 477 -0.345 5.541 -6.716 1.00 0.00 H new ATOM 0 HB3 PHE A 477 -0.032 4.873 -8.305 1.00 0.00 H new ATOM 0 HD1 PHE A 477 -0.316 2.467 -8.730 1.00 0.00 H new ATOM 0 HD2 PHE A 477 -1.190 4.146 -4.915 1.00 0.00 H new ATOM 0 HE1 PHE A 477 -1.561 0.438 -8.124 1.00 0.00 H new ATOM 0 HE2 PHE A 477 -2.434 2.118 -4.304 1.00 0.00 H new ATOM 0 HZ PHE A 477 -2.618 0.257 -5.907 1.00 0.00 H new ATOM 900 N GLN A 478 3.151 5.276 -8.640 1.00 0.00 N ATOM 901 CA GLN A 478 3.930 6.210 -9.444 1.00 0.00 C ATOM 902 C GLN A 478 3.050 7.334 -9.978 1.00 0.00 C ATOM 903 O GLN A 478 3.273 8.506 -9.676 1.00 0.00 O ATOM 904 CB GLN A 478 4.603 5.477 -10.606 1.00 0.00 C ATOM 905 CG GLN A 478 5.684 6.294 -11.296 1.00 0.00 C ATOM 906 CD GLN A 478 6.213 5.622 -12.548 1.00 0.00 C ATOM 907 OE1 GLN A 478 5.570 5.644 -13.597 1.00 0.00 O ATOM 908 NE2 GLN A 478 7.392 5.019 -12.444 1.00 0.00 N ATOM 0 H GLN A 478 3.287 4.295 -8.883 1.00 0.00 H new ATOM 0 HA GLN A 478 4.698 6.647 -8.806 1.00 0.00 H new ATOM 0 HB2 GLN A 478 5.041 4.550 -10.235 1.00 0.00 H new ATOM 0 HB3 GLN A 478 3.845 5.201 -11.339 1.00 0.00 H new ATOM 0 HG2 GLN A 478 5.283 7.274 -11.556 1.00 0.00 H new ATOM 0 HG3 GLN A 478 6.508 6.460 -10.602 1.00 0.00 H new ATOM 0 HE21 GLN A 478 7.891 5.025 -11.555 1.00 0.00 H new ATOM 0 HE22 GLN A 478 7.798 4.550 -13.254 1.00 0.00 H new ATOM 917 N GLU A 479 2.050 6.969 -10.774 1.00 0.00 N ATOM 918 CA GLU A 479 1.137 7.949 -11.351 1.00 0.00 C ATOM 919 C GLU A 479 -0.121 8.089 -10.499 1.00 0.00 C ATOM 920 O GLU A 479 -0.824 7.111 -10.248 1.00 0.00 O ATOM 921 CB GLU A 479 0.757 7.547 -12.778 1.00 0.00 C ATOM 922 CG GLU A 479 1.791 7.944 -13.818 1.00 0.00 C ATOM 923 CD GLU A 479 1.623 9.375 -14.291 1.00 0.00 C ATOM 924 OE1 GLU A 479 1.384 10.258 -13.440 1.00 0.00 O ATOM 925 OE2 GLU A 479 1.730 9.613 -15.512 1.00 0.00 O ATOM 0 H GLU A 479 1.852 6.003 -11.034 1.00 0.00 H new ATOM 0 HA GLU A 479 1.647 8.912 -11.376 1.00 0.00 H new ATOM 0 HB2 GLU A 479 0.612 6.467 -12.816 1.00 0.00 H new ATOM 0 HB3 GLU A 479 -0.198 8.006 -13.034 1.00 0.00 H new ATOM 0 HG2 GLU A 479 2.789 7.819 -13.399 1.00 0.00 H new ATOM 0 HG3 GLU A 479 1.718 7.272 -14.673 1.00 0.00 H new ATOM 932 N GLU A 480 -0.396 9.312 -10.057 1.00 0.00 N ATOM 933 CA GLU A 480 -1.568 9.580 -9.231 1.00 0.00 C ATOM 934 C GLU A 480 -2.802 8.880 -9.794 1.00 0.00 C ATOM 935 O GLU A 480 -3.554 8.239 -9.061 1.00 0.00 O ATOM 936 CB GLU A 480 -1.820 11.086 -9.137 1.00 0.00 C ATOM 937 CG GLU A 480 -1.098 11.753 -7.979 1.00 0.00 C ATOM 938 CD GLU A 480 -1.616 13.150 -7.695 1.00 0.00 C ATOM 939 OE1 GLU A 480 -1.823 13.915 -8.660 1.00 0.00 O ATOM 940 OE2 GLU A 480 -1.816 13.478 -6.507 1.00 0.00 O ATOM 0 H GLU A 480 0.176 10.132 -10.257 1.00 0.00 H new ATOM 0 HA GLU A 480 -1.374 9.189 -8.232 1.00 0.00 H new ATOM 0 HB2 GLU A 480 -1.507 11.557 -10.069 1.00 0.00 H new ATOM 0 HB3 GLU A 480 -2.891 11.261 -9.035 1.00 0.00 H new ATOM 0 HG2 GLU A 480 -1.209 11.140 -7.085 1.00 0.00 H new ATOM 0 HG3 GLU A 480 -0.032 11.803 -8.201 1.00 0.00 H new ATOM 947 N SER A 481 -3.002 9.009 -11.102 1.00 0.00 N ATOM 948 CA SER A 481 -4.146 8.394 -11.764 1.00 0.00 C ATOM 949 C SER A 481 -4.428 7.010 -11.188 1.00 0.00 C ATOM 950 O SER A 481 -5.575 6.664 -10.906 1.00 0.00 O ATOM 951 CB SER A 481 -3.896 8.290 -13.270 1.00 0.00 C ATOM 952 OG SER A 481 -2.694 7.590 -13.540 1.00 0.00 O ATOM 0 H SER A 481 -2.387 9.534 -11.724 1.00 0.00 H new ATOM 0 HA SER A 481 -5.017 9.026 -11.590 1.00 0.00 H new ATOM 0 HB2 SER A 481 -4.733 7.779 -13.746 1.00 0.00 H new ATOM 0 HB3 SER A 481 -3.844 9.289 -13.703 1.00 0.00 H new ATOM 0 HG SER A 481 -2.558 7.536 -14.509 1.00 0.00 H new ATOM 958 N SER A 482 -3.371 6.222 -11.015 1.00 0.00 N ATOM 959 CA SER A 482 -3.504 4.873 -10.476 1.00 0.00 C ATOM 960 C SER A 482 -4.418 4.864 -9.254 1.00 0.00 C ATOM 961 O SER A 482 -5.369 4.084 -9.182 1.00 0.00 O ATOM 962 CB SER A 482 -2.130 4.314 -10.102 1.00 0.00 C ATOM 963 OG SER A 482 -2.101 2.903 -10.233 1.00 0.00 O ATOM 0 H SER A 482 -2.414 6.494 -11.240 1.00 0.00 H new ATOM 0 HA SER A 482 -3.949 4.242 -11.246 1.00 0.00 H new ATOM 0 HB2 SER A 482 -1.367 4.758 -10.742 1.00 0.00 H new ATOM 0 HB3 SER A 482 -1.887 4.592 -9.076 1.00 0.00 H new ATOM 0 HG SER A 482 -1.911 2.497 -9.361 1.00 0.00 H new ATOM 969 N VAL A 483 -4.124 5.736 -8.296 1.00 0.00 N ATOM 970 CA VAL A 483 -4.919 5.830 -7.077 1.00 0.00 C ATOM 971 C VAL A 483 -6.408 5.713 -7.382 1.00 0.00 C ATOM 972 O VAL A 483 -7.119 4.925 -6.759 1.00 0.00 O ATOM 973 CB VAL A 483 -4.661 7.157 -6.339 1.00 0.00 C ATOM 974 CG1 VAL A 483 -5.564 7.276 -5.121 1.00 0.00 C ATOM 975 CG2 VAL A 483 -3.197 7.268 -5.940 1.00 0.00 C ATOM 0 H VAL A 483 -3.341 6.388 -8.340 1.00 0.00 H new ATOM 0 HA VAL A 483 -4.615 5.002 -6.437 1.00 0.00 H new ATOM 0 HB VAL A 483 -4.894 7.980 -7.015 1.00 0.00 H new ATOM 0 HG11 VAL A 483 -5.367 8.220 -4.613 1.00 0.00 H new ATOM 0 HG12 VAL A 483 -6.607 7.245 -5.437 1.00 0.00 H new ATOM 0 HG13 VAL A 483 -5.366 6.449 -4.439 1.00 0.00 H new ATOM 0 HG21 VAL A 483 -3.032 8.212 -5.420 1.00 0.00 H new ATOM 0 HG22 VAL A 483 -2.936 6.440 -5.281 1.00 0.00 H new ATOM 0 HG23 VAL A 483 -2.573 7.232 -6.833 1.00 0.00 H new ATOM 985 N GLN A 484 -6.873 6.501 -8.346 1.00 0.00 N ATOM 986 CA GLN A 484 -8.279 6.485 -8.734 1.00 0.00 C ATOM 987 C GLN A 484 -8.731 5.071 -9.083 1.00 0.00 C ATOM 988 O GLN A 484 -9.607 4.510 -8.426 1.00 0.00 O ATOM 989 CB GLN A 484 -8.511 7.417 -9.925 1.00 0.00 C ATOM 990 CG GLN A 484 -9.978 7.595 -10.280 1.00 0.00 C ATOM 991 CD GLN A 484 -10.796 8.141 -9.127 1.00 0.00 C ATOM 992 OE1 GLN A 484 -10.714 9.325 -8.798 1.00 0.00 O ATOM 993 NE2 GLN A 484 -11.592 7.279 -8.504 1.00 0.00 N ATOM 0 H GLN A 484 -6.297 7.158 -8.873 1.00 0.00 H new ATOM 0 HA GLN A 484 -8.868 6.836 -7.887 1.00 0.00 H new ATOM 0 HB2 GLN A 484 -8.079 8.392 -9.702 1.00 0.00 H new ATOM 0 HB3 GLN A 484 -7.981 7.024 -10.792 1.00 0.00 H new ATOM 0 HG2 GLN A 484 -10.062 8.270 -11.132 1.00 0.00 H new ATOM 0 HG3 GLN A 484 -10.391 6.636 -10.591 1.00 0.00 H new ATOM 0 HE21 GLN A 484 -11.629 6.307 -8.810 1.00 0.00 H new ATOM 0 HE22 GLN A 484 -12.166 7.590 -7.720 1.00 0.00 H new ATOM 1002 N ALA A 485 -8.128 4.502 -10.121 1.00 0.00 N ATOM 1003 CA ALA A 485 -8.468 3.153 -10.556 1.00 0.00 C ATOM 1004 C ALA A 485 -8.623 2.214 -9.364 1.00 0.00 C ATOM 1005 O ALA A 485 -9.578 1.440 -9.292 1.00 0.00 O ATOM 1006 CB ALA A 485 -7.409 2.624 -11.512 1.00 0.00 C ATOM 0 H ALA A 485 -7.402 4.954 -10.676 1.00 0.00 H new ATOM 0 HA ALA A 485 -9.424 3.197 -11.078 1.00 0.00 H new ATOM 0 HB1 ALA A 485 -7.676 1.616 -11.829 1.00 0.00 H new ATOM 0 HB2 ALA A 485 -7.349 3.275 -12.385 1.00 0.00 H new ATOM 0 HB3 ALA A 485 -6.443 2.602 -11.008 1.00 0.00 H new ATOM 1012 N LEU A 486 -7.680 2.288 -8.432 1.00 0.00 N ATOM 1013 CA LEU A 486 -7.712 1.444 -7.243 1.00 0.00 C ATOM 1014 C LEU A 486 -9.003 1.656 -6.459 1.00 0.00 C ATOM 1015 O LEU A 486 -9.775 0.720 -6.250 1.00 0.00 O ATOM 1016 CB LEU A 486 -6.505 1.741 -6.350 1.00 0.00 C ATOM 1017 CG LEU A 486 -6.367 0.874 -5.098 1.00 0.00 C ATOM 1018 CD1 LEU A 486 -5.971 -0.546 -5.473 1.00 0.00 C ATOM 1019 CD2 LEU A 486 -5.350 1.478 -4.141 1.00 0.00 C ATOM 0 H LEU A 486 -6.884 2.924 -8.476 1.00 0.00 H new ATOM 0 HA LEU A 486 -7.671 0.403 -7.565 1.00 0.00 H new ATOM 0 HB2 LEU A 486 -5.600 1.628 -6.947 1.00 0.00 H new ATOM 0 HB3 LEU A 486 -6.555 2.785 -6.041 1.00 0.00 H new ATOM 0 HG LEU A 486 -7.333 0.839 -4.595 1.00 0.00 H new ATOM 0 HD11 LEU A 486 -5.877 -1.148 -4.569 1.00 0.00 H new ATOM 0 HD12 LEU A 486 -6.735 -0.978 -6.120 1.00 0.00 H new ATOM 0 HD13 LEU A 486 -5.017 -0.531 -5.999 1.00 0.00 H new ATOM 0 HD21 LEU A 486 -5.265 0.848 -3.256 1.00 0.00 H new ATOM 0 HD22 LEU A 486 -4.380 1.544 -4.634 1.00 0.00 H new ATOM 0 HD23 LEU A 486 -5.675 2.476 -3.846 1.00 0.00 H new ATOM 1031 N ILE A 487 -9.232 2.893 -6.030 1.00 0.00 N ATOM 1032 CA ILE A 487 -10.431 3.228 -5.272 1.00 0.00 C ATOM 1033 C ILE A 487 -11.677 2.641 -5.926 1.00 0.00 C ATOM 1034 O ILE A 487 -12.467 1.956 -5.276 1.00 0.00 O ATOM 1035 CB ILE A 487 -10.605 4.753 -5.139 1.00 0.00 C ATOM 1036 CG1 ILE A 487 -9.383 5.370 -4.456 1.00 0.00 C ATOM 1037 CG2 ILE A 487 -11.873 5.076 -4.363 1.00 0.00 C ATOM 1038 CD1 ILE A 487 -9.337 6.879 -4.548 1.00 0.00 C ATOM 0 H ILE A 487 -8.603 3.679 -6.194 1.00 0.00 H new ATOM 0 HA ILE A 487 -10.307 2.796 -4.279 1.00 0.00 H new ATOM 0 HB ILE A 487 -10.695 5.182 -6.137 1.00 0.00 H new ATOM 0 HG12 ILE A 487 -9.378 5.078 -3.406 1.00 0.00 H new ATOM 0 HG13 ILE A 487 -8.479 4.959 -4.906 1.00 0.00 H new ATOM 0 HG21 ILE A 487 -11.982 6.157 -4.278 1.00 0.00 H new ATOM 0 HG22 ILE A 487 -12.735 4.665 -4.888 1.00 0.00 H new ATOM 0 HG23 ILE A 487 -11.812 4.638 -3.367 1.00 0.00 H new ATOM 0 HD11 ILE A 487 -8.444 7.247 -4.042 1.00 0.00 H new ATOM 0 HD12 ILE A 487 -9.311 7.179 -5.596 1.00 0.00 H new ATOM 0 HD13 ILE A 487 -10.223 7.300 -4.072 1.00 0.00 H new ATOM 1050 N ASP A 488 -11.844 2.911 -7.216 1.00 0.00 N ATOM 1051 CA ASP A 488 -12.992 2.406 -7.960 1.00 0.00 C ATOM 1052 C ASP A 488 -13.137 0.899 -7.780 1.00 0.00 C ATOM 1053 O ASP A 488 -14.236 0.393 -7.553 1.00 0.00 O ATOM 1054 CB ASP A 488 -12.853 2.744 -9.445 1.00 0.00 C ATOM 1055 CG ASP A 488 -14.115 2.442 -10.229 1.00 0.00 C ATOM 1056 OD1 ASP A 488 -15.165 3.043 -9.917 1.00 0.00 O ATOM 1057 OD2 ASP A 488 -14.053 1.606 -11.154 1.00 0.00 O ATOM 0 H ASP A 488 -11.199 3.477 -7.768 1.00 0.00 H new ATOM 0 HA ASP A 488 -13.888 2.888 -7.568 1.00 0.00 H new ATOM 0 HB2 ASP A 488 -12.606 3.800 -9.552 1.00 0.00 H new ATOM 0 HB3 ASP A 488 -12.023 2.178 -9.867 1.00 0.00 H new ATOM 1062 N ALA A 489 -12.020 0.185 -7.883 1.00 0.00 N ATOM 1063 CA ALA A 489 -12.023 -1.264 -7.730 1.00 0.00 C ATOM 1064 C ALA A 489 -12.378 -1.665 -6.303 1.00 0.00 C ATOM 1065 O ALA A 489 -13.214 -2.543 -6.084 1.00 0.00 O ATOM 1066 CB ALA A 489 -10.669 -1.838 -8.120 1.00 0.00 C ATOM 0 H ALA A 489 -11.102 0.587 -8.072 1.00 0.00 H new ATOM 0 HA ALA A 489 -12.784 -1.673 -8.394 1.00 0.00 H new ATOM 0 HB1 ALA A 489 -10.685 -2.921 -8.001 1.00 0.00 H new ATOM 0 HB2 ALA A 489 -10.455 -1.590 -9.160 1.00 0.00 H new ATOM 0 HB3 ALA A 489 -9.896 -1.414 -7.479 1.00 0.00 H new ATOM 1072 N CYS A 490 -11.739 -1.018 -5.335 1.00 0.00 N ATOM 1073 CA CYS A 490 -11.987 -1.308 -3.927 1.00 0.00 C ATOM 1074 C CYS A 490 -13.462 -1.124 -3.586 1.00 0.00 C ATOM 1075 O CYS A 490 -14.089 -0.148 -3.999 1.00 0.00 O ATOM 1076 CB CYS A 490 -11.129 -0.406 -3.040 1.00 0.00 C ATOM 1077 SG CYS A 490 -9.369 -0.423 -3.452 1.00 0.00 S ATOM 0 H CYS A 490 -11.045 -0.289 -5.499 1.00 0.00 H new ATOM 0 HA CYS A 490 -11.717 -2.348 -3.743 1.00 0.00 H new ATOM 0 HB2 CYS A 490 -11.499 0.617 -3.115 1.00 0.00 H new ATOM 0 HB3 CYS A 490 -11.251 -0.714 -2.002 1.00 0.00 H new ATOM 0 HG CYS A 490 -9.215 -0.130 -4.709 1.00 0.00 H new ATOM 1083 N LEU A 491 -14.011 -2.069 -2.830 1.00 0.00 N ATOM 1084 CA LEU A 491 -15.414 -2.012 -2.434 1.00 0.00 C ATOM 1085 C LEU A 491 -15.650 -0.894 -1.423 1.00 0.00 C ATOM 1086 O LEU A 491 -14.708 -0.382 -0.819 1.00 0.00 O ATOM 1087 CB LEU A 491 -15.851 -3.352 -1.840 1.00 0.00 C ATOM 1088 CG LEU A 491 -15.943 -4.523 -2.819 1.00 0.00 C ATOM 1089 CD1 LEU A 491 -15.900 -5.847 -2.073 1.00 0.00 C ATOM 1090 CD2 LEU A 491 -17.210 -4.420 -3.656 1.00 0.00 C ATOM 0 H LEU A 491 -13.506 -2.883 -2.479 1.00 0.00 H new ATOM 0 HA LEU A 491 -16.009 -1.804 -3.323 1.00 0.00 H new ATOM 0 HB2 LEU A 491 -15.152 -3.621 -1.048 1.00 0.00 H new ATOM 0 HB3 LEU A 491 -16.826 -3.218 -1.372 1.00 0.00 H new ATOM 0 HG LEU A 491 -15.085 -4.480 -3.489 1.00 0.00 H new ATOM 0 HD11 LEU A 491 -15.967 -6.669 -2.786 1.00 0.00 H new ATOM 0 HD12 LEU A 491 -14.964 -5.922 -1.519 1.00 0.00 H new ATOM 0 HD13 LEU A 491 -16.738 -5.901 -1.378 1.00 0.00 H new ATOM 0 HD21 LEU A 491 -17.259 -5.261 -4.347 1.00 0.00 H new ATOM 0 HD22 LEU A 491 -18.081 -4.437 -3.001 1.00 0.00 H new ATOM 0 HD23 LEU A 491 -17.199 -3.487 -4.220 1.00 0.00 H new ATOM 1102 N GLU A 492 -16.913 -0.521 -1.245 1.00 0.00 N ATOM 1103 CA GLU A 492 -17.272 0.536 -0.306 1.00 0.00 C ATOM 1104 C GLU A 492 -18.150 -0.009 0.817 1.00 0.00 C ATOM 1105 O GLU A 492 -19.240 -0.525 0.570 1.00 0.00 O ATOM 1106 CB GLU A 492 -17.999 1.669 -1.033 1.00 0.00 C ATOM 1107 CG GLU A 492 -18.077 2.956 -0.230 1.00 0.00 C ATOM 1108 CD GLU A 492 -19.139 3.905 -0.749 1.00 0.00 C ATOM 1109 OE1 GLU A 492 -19.171 4.145 -1.975 1.00 0.00 O ATOM 1110 OE2 GLU A 492 -19.938 4.408 0.068 1.00 0.00 O ATOM 0 H GLU A 492 -17.704 -0.934 -1.738 1.00 0.00 H new ATOM 0 HA GLU A 492 -16.353 0.926 0.132 1.00 0.00 H new ATOM 0 HB2 GLU A 492 -17.491 1.869 -1.976 1.00 0.00 H new ATOM 0 HB3 GLU A 492 -19.009 1.342 -1.279 1.00 0.00 H new ATOM 0 HG2 GLU A 492 -18.287 2.717 0.813 1.00 0.00 H new ATOM 0 HG3 GLU A 492 -17.108 3.454 -0.254 1.00 0.00 H new ATOM 1117 N GLU A 493 -17.667 0.110 2.049 1.00 0.00 N ATOM 1118 CA GLU A 493 -18.407 -0.372 3.209 1.00 0.00 C ATOM 1119 C GLU A 493 -18.458 0.692 4.302 1.00 0.00 C ATOM 1120 O GLU A 493 -17.611 0.720 5.195 1.00 0.00 O ATOM 1121 CB GLU A 493 -17.768 -1.650 3.756 1.00 0.00 C ATOM 1122 CG GLU A 493 -17.741 -2.793 2.755 1.00 0.00 C ATOM 1123 CD GLU A 493 -19.111 -3.402 2.528 1.00 0.00 C ATOM 1124 OE1 GLU A 493 -19.466 -4.351 3.258 1.00 0.00 O ATOM 1125 OE2 GLU A 493 -19.828 -2.930 1.621 1.00 0.00 O ATOM 0 H GLU A 493 -16.767 0.536 2.270 1.00 0.00 H new ATOM 0 HA GLU A 493 -19.426 -0.592 2.891 1.00 0.00 H new ATOM 0 HB2 GLU A 493 -16.748 -1.430 4.071 1.00 0.00 H new ATOM 0 HB3 GLU A 493 -18.314 -1.968 4.644 1.00 0.00 H new ATOM 0 HG2 GLU A 493 -17.347 -2.430 1.806 1.00 0.00 H new ATOM 0 HG3 GLU A 493 -17.058 -3.565 3.109 1.00 0.00 H new ATOM 1132 N ASP A 494 -19.456 1.565 4.224 1.00 0.00 N ATOM 1133 CA ASP A 494 -19.619 2.631 5.206 1.00 0.00 C ATOM 1134 C ASP A 494 -18.511 3.671 5.068 1.00 0.00 C ATOM 1135 O ASP A 494 -17.945 4.126 6.061 1.00 0.00 O ATOM 1136 CB ASP A 494 -19.618 2.053 6.622 1.00 0.00 C ATOM 1137 CG ASP A 494 -20.263 2.986 7.628 1.00 0.00 C ATOM 1138 OD1 ASP A 494 -21.504 2.949 7.762 1.00 0.00 O ATOM 1139 OD2 ASP A 494 -19.526 3.753 8.282 1.00 0.00 O ATOM 0 H ASP A 494 -20.165 1.556 3.491 1.00 0.00 H new ATOM 0 HA ASP A 494 -20.576 3.119 5.021 1.00 0.00 H new ATOM 0 HB2 ASP A 494 -20.147 1.100 6.623 1.00 0.00 H new ATOM 0 HB3 ASP A 494 -18.592 1.848 6.927 1.00 0.00 H new ATOM 1144 N GLY A 495 -18.206 4.042 3.828 1.00 0.00 N ATOM 1145 CA GLY A 495 -17.167 5.025 3.582 1.00 0.00 C ATOM 1146 C GLY A 495 -15.794 4.396 3.447 1.00 0.00 C ATOM 1147 O GLY A 495 -14.988 4.817 2.618 1.00 0.00 O ATOM 0 H GLY A 495 -18.660 3.679 2.990 1.00 0.00 H new ATOM 0 HA2 GLY A 495 -17.401 5.577 2.672 1.00 0.00 H new ATOM 0 HA3 GLY A 495 -17.154 5.747 4.398 1.00 0.00 H new ATOM 1151 N LYS A 496 -15.526 3.384 4.266 1.00 0.00 N ATOM 1152 CA LYS A 496 -14.242 2.695 4.236 1.00 0.00 C ATOM 1153 C LYS A 496 -14.131 1.804 3.003 1.00 0.00 C ATOM 1154 O LYS A 496 -15.091 1.136 2.619 1.00 0.00 O ATOM 1155 CB LYS A 496 -14.061 1.855 5.503 1.00 0.00 C ATOM 1156 CG LYS A 496 -14.150 2.663 6.786 1.00 0.00 C ATOM 1157 CD LYS A 496 -14.251 1.762 8.006 1.00 0.00 C ATOM 1158 CE LYS A 496 -15.684 1.319 8.255 1.00 0.00 C ATOM 1159 NZ LYS A 496 -15.755 0.185 9.218 1.00 0.00 N ATOM 0 H LYS A 496 -16.182 3.023 4.959 1.00 0.00 H new ATOM 0 HA LYS A 496 -13.455 3.448 4.191 1.00 0.00 H new ATOM 0 HB2 LYS A 496 -14.821 1.073 5.522 1.00 0.00 H new ATOM 0 HB3 LYS A 496 -13.092 1.357 5.463 1.00 0.00 H new ATOM 0 HG2 LYS A 496 -13.272 3.302 6.876 1.00 0.00 H new ATOM 0 HG3 LYS A 496 -15.019 3.319 6.744 1.00 0.00 H new ATOM 0 HD2 LYS A 496 -13.617 0.886 7.866 1.00 0.00 H new ATOM 0 HD3 LYS A 496 -13.875 2.291 8.882 1.00 0.00 H new ATOM 0 HE2 LYS A 496 -16.262 2.159 8.640 1.00 0.00 H new ATOM 0 HE3 LYS A 496 -16.142 1.023 7.311 1.00 0.00 H new ATOM 0 HZ1 LYS A 496 -16.748 -0.087 9.361 1.00 0.00 H new ATOM 0 HZ2 LYS A 496 -15.225 -0.626 8.839 1.00 0.00 H new ATOM 0 HZ3 LYS A 496 -15.341 0.475 10.127 1.00 0.00 H new ATOM 1173 N LEU A 497 -12.954 1.799 2.387 1.00 0.00 N ATOM 1174 CA LEU A 497 -12.717 0.988 1.197 1.00 0.00 C ATOM 1175 C LEU A 497 -12.014 -0.316 1.558 1.00 0.00 C ATOM 1176 O LEU A 497 -11.272 -0.383 2.538 1.00 0.00 O ATOM 1177 CB LEU A 497 -11.878 1.769 0.183 1.00 0.00 C ATOM 1178 CG LEU A 497 -12.488 3.075 -0.328 1.00 0.00 C ATOM 1179 CD1 LEU A 497 -11.444 3.897 -1.067 1.00 0.00 C ATOM 1180 CD2 LEU A 497 -13.681 2.789 -1.229 1.00 0.00 C ATOM 0 H LEU A 497 -12.149 2.347 2.691 1.00 0.00 H new ATOM 0 HA LEU A 497 -13.683 0.748 0.753 1.00 0.00 H new ATOM 0 HB2 LEU A 497 -10.913 1.995 0.637 1.00 0.00 H new ATOM 0 HB3 LEU A 497 -11.684 1.122 -0.673 1.00 0.00 H new ATOM 0 HG LEU A 497 -12.836 3.652 0.529 1.00 0.00 H new ATOM 0 HD11 LEU A 497 -11.895 4.823 -1.424 1.00 0.00 H new ATOM 0 HD12 LEU A 497 -10.621 4.131 -0.392 1.00 0.00 H new ATOM 0 HD13 LEU A 497 -11.066 3.327 -1.916 1.00 0.00 H new ATOM 0 HD21 LEU A 497 -14.103 3.729 -1.584 1.00 0.00 H new ATOM 0 HD22 LEU A 497 -13.358 2.192 -2.082 1.00 0.00 H new ATOM 0 HD23 LEU A 497 -14.438 2.241 -0.668 1.00 0.00 H new ATOM 1192 N TYR A 498 -12.251 -1.351 0.759 1.00 0.00 N ATOM 1193 CA TYR A 498 -11.641 -2.654 0.994 1.00 0.00 C ATOM 1194 C TYR A 498 -11.345 -3.363 -0.324 1.00 0.00 C ATOM 1195 O TYR A 498 -12.216 -3.484 -1.187 1.00 0.00 O ATOM 1196 CB TYR A 498 -12.559 -3.521 1.857 1.00 0.00 C ATOM 1197 CG TYR A 498 -12.752 -2.989 3.259 1.00 0.00 C ATOM 1198 CD1 TYR A 498 -11.889 -3.350 4.286 1.00 0.00 C ATOM 1199 CD2 TYR A 498 -13.799 -2.124 3.556 1.00 0.00 C ATOM 1200 CE1 TYR A 498 -12.063 -2.866 5.568 1.00 0.00 C ATOM 1201 CE2 TYR A 498 -13.979 -1.635 4.836 1.00 0.00 C ATOM 1202 CZ TYR A 498 -13.109 -2.009 5.838 1.00 0.00 C ATOM 1203 OH TYR A 498 -13.285 -1.524 7.114 1.00 0.00 O ATOM 0 H TYR A 498 -12.861 -1.312 -0.057 1.00 0.00 H new ATOM 0 HA TYR A 498 -10.699 -2.497 1.520 1.00 0.00 H new ATOM 0 HB2 TYR A 498 -13.531 -3.602 1.371 1.00 0.00 H new ATOM 0 HB3 TYR A 498 -12.146 -4.528 1.913 1.00 0.00 H new ATOM 0 HD1 TYR A 498 -11.068 -4.020 4.079 1.00 0.00 H new ATOM 0 HD2 TYR A 498 -14.483 -1.829 2.774 1.00 0.00 H new ATOM 0 HE1 TYR A 498 -11.383 -3.157 6.355 1.00 0.00 H new ATOM 0 HE2 TYR A 498 -14.797 -0.963 5.050 1.00 0.00 H new ATOM 0 HH TYR A 498 -12.416 -1.460 7.562 1.00 0.00 H new ATOM 1213 N LEU A 499 -10.110 -3.830 -0.473 1.00 0.00 N ATOM 1214 CA LEU A 499 -9.697 -4.528 -1.685 1.00 0.00 C ATOM 1215 C LEU A 499 -9.333 -5.978 -1.381 1.00 0.00 C ATOM 1216 O LEU A 499 -8.876 -6.296 -0.283 1.00 0.00 O ATOM 1217 CB LEU A 499 -8.506 -3.815 -2.327 1.00 0.00 C ATOM 1218 CG LEU A 499 -8.183 -4.211 -3.768 1.00 0.00 C ATOM 1219 CD1 LEU A 499 -9.290 -3.759 -4.707 1.00 0.00 C ATOM 1220 CD2 LEU A 499 -6.846 -3.624 -4.196 1.00 0.00 C ATOM 0 H LEU A 499 -9.377 -3.738 0.231 1.00 0.00 H new ATOM 0 HA LEU A 499 -10.535 -4.522 -2.382 1.00 0.00 H new ATOM 0 HB2 LEU A 499 -8.693 -2.742 -2.300 1.00 0.00 H new ATOM 0 HB3 LEU A 499 -7.624 -4.000 -1.714 1.00 0.00 H new ATOM 0 HG LEU A 499 -8.113 -5.298 -3.818 1.00 0.00 H new ATOM 0 HD11 LEU A 499 -9.042 -4.050 -5.728 1.00 0.00 H new ATOM 0 HD12 LEU A 499 -10.230 -4.228 -4.414 1.00 0.00 H new ATOM 0 HD13 LEU A 499 -9.393 -2.675 -4.653 1.00 0.00 H new ATOM 0 HD21 LEU A 499 -6.633 -3.916 -5.224 1.00 0.00 H new ATOM 0 HD22 LEU A 499 -6.888 -2.537 -4.129 1.00 0.00 H new ATOM 0 HD23 LEU A 499 -6.058 -3.998 -3.542 1.00 0.00 H new ATOM 1232 N CYS A 500 -9.536 -6.851 -2.361 1.00 0.00 N ATOM 1233 CA CYS A 500 -9.228 -8.267 -2.199 1.00 0.00 C ATOM 1234 C CYS A 500 -7.864 -8.599 -2.796 1.00 0.00 C ATOM 1235 O CYS A 500 -7.561 -8.218 -3.927 1.00 0.00 O ATOM 1236 CB CYS A 500 -10.309 -9.125 -2.859 1.00 0.00 C ATOM 1237 SG CYS A 500 -10.480 -8.856 -4.639 1.00 0.00 S ATOM 0 H CYS A 500 -9.912 -6.603 -3.276 1.00 0.00 H new ATOM 0 HA CYS A 500 -9.201 -8.487 -1.132 1.00 0.00 H new ATOM 0 HB2 CYS A 500 -10.082 -10.176 -2.681 1.00 0.00 H new ATOM 0 HB3 CYS A 500 -11.265 -8.919 -2.378 1.00 0.00 H new ATOM 0 HG CYS A 500 -9.341 -8.469 -5.131 1.00 0.00 H new ATOM 1243 N VAL A 501 -7.044 -9.309 -2.028 1.00 0.00 N ATOM 1244 CA VAL A 501 -5.712 -9.691 -2.481 1.00 0.00 C ATOM 1245 C VAL A 501 -5.380 -11.120 -2.066 1.00 0.00 C ATOM 1246 O VAL A 501 -5.116 -11.392 -0.895 1.00 0.00 O ATOM 1247 CB VAL A 501 -4.635 -8.743 -1.921 1.00 0.00 C ATOM 1248 CG1 VAL A 501 -4.832 -7.334 -2.461 1.00 0.00 C ATOM 1249 CG2 VAL A 501 -4.660 -8.748 -0.400 1.00 0.00 C ATOM 0 H VAL A 501 -7.279 -9.631 -1.089 1.00 0.00 H new ATOM 0 HA VAL A 501 -5.716 -9.622 -3.569 1.00 0.00 H new ATOM 0 HB VAL A 501 -3.657 -9.098 -2.247 1.00 0.00 H new ATOM 0 HG11 VAL A 501 -4.062 -6.678 -2.055 1.00 0.00 H new ATOM 0 HG12 VAL A 501 -4.760 -7.348 -3.549 1.00 0.00 H new ATOM 0 HG13 VAL A 501 -5.815 -6.966 -2.167 1.00 0.00 H new ATOM 0 HG21 VAL A 501 -3.893 -8.073 -0.021 1.00 0.00 H new ATOM 0 HG22 VAL A 501 -5.638 -8.418 -0.051 1.00 0.00 H new ATOM 0 HG23 VAL A 501 -4.467 -9.757 -0.036 1.00 0.00 H new ATOM 1259 N SER A 502 -5.394 -12.030 -3.035 1.00 0.00 N ATOM 1260 CA SER A 502 -5.097 -13.433 -2.771 1.00 0.00 C ATOM 1261 C SER A 502 -3.599 -13.700 -2.873 1.00 0.00 C ATOM 1262 O SER A 502 -2.899 -13.078 -3.672 1.00 0.00 O ATOM 1263 CB SER A 502 -5.854 -14.330 -3.752 1.00 0.00 C ATOM 1264 OG SER A 502 -6.149 -15.588 -3.170 1.00 0.00 O ATOM 0 H SER A 502 -5.608 -11.821 -4.010 1.00 0.00 H new ATOM 0 HA SER A 502 -5.421 -13.662 -1.756 1.00 0.00 H new ATOM 0 HB2 SER A 502 -6.779 -13.841 -4.057 1.00 0.00 H new ATOM 0 HB3 SER A 502 -5.257 -14.474 -4.653 1.00 0.00 H new ATOM 0 HG SER A 502 -6.634 -16.142 -3.817 1.00 0.00 H new ATOM 1270 N SER A 503 -3.113 -14.629 -2.056 1.00 0.00 N ATOM 1271 CA SER A 503 -1.696 -14.977 -2.050 1.00 0.00 C ATOM 1272 C SER A 503 -1.506 -16.483 -2.207 1.00 0.00 C ATOM 1273 O SER A 503 -2.408 -17.279 -1.946 1.00 0.00 O ATOM 1274 CB SER A 503 -1.038 -14.500 -0.754 1.00 0.00 C ATOM 1275 OG SER A 503 -0.760 -13.111 -0.805 1.00 0.00 O ATOM 0 H SER A 503 -3.679 -15.154 -1.390 1.00 0.00 H new ATOM 0 HA SER A 503 -1.221 -14.479 -2.895 1.00 0.00 H new ATOM 0 HB2 SER A 503 -1.694 -14.712 0.090 1.00 0.00 H new ATOM 0 HB3 SER A 503 -0.114 -15.053 -0.586 1.00 0.00 H new ATOM 0 HG SER A 503 0.171 -12.974 -1.079 1.00 0.00 H new ATOM 1281 N PRO A 504 -0.303 -16.884 -2.643 1.00 0.00 N ATOM 1282 CA PRO A 504 0.036 -18.296 -2.844 1.00 0.00 C ATOM 1283 C PRO A 504 -0.395 -19.168 -1.670 1.00 0.00 C ATOM 1284 O PRO A 504 -0.558 -20.381 -1.810 1.00 0.00 O ATOM 1285 CB PRO A 504 1.562 -18.281 -2.967 1.00 0.00 C ATOM 1286 CG PRO A 504 1.885 -16.927 -3.497 1.00 0.00 C ATOM 1287 CD PRO A 504 0.820 -15.990 -2.973 1.00 0.00 C ATOM 0 HA PRO A 504 -0.471 -18.717 -3.712 1.00 0.00 H new ATOM 0 HB2 PRO A 504 2.039 -18.453 -2.002 1.00 0.00 H new ATOM 0 HB3 PRO A 504 1.913 -19.064 -3.640 1.00 0.00 H new ATOM 0 HG2 PRO A 504 2.875 -16.609 -3.170 1.00 0.00 H new ATOM 0 HG3 PRO A 504 1.895 -16.930 -4.587 1.00 0.00 H new ATOM 0 HD2 PRO A 504 1.166 -15.442 -2.097 1.00 0.00 H new ATOM 0 HD3 PRO A 504 0.536 -15.250 -3.721 1.00 0.00 H new ATOM 1295 N THR A 505 -0.580 -18.544 -0.511 1.00 0.00 N ATOM 1296 CA THR A 505 -0.991 -19.263 0.688 1.00 0.00 C ATOM 1297 C THR A 505 -2.385 -18.836 1.135 1.00 0.00 C ATOM 1298 O THR A 505 -3.315 -19.642 1.151 1.00 0.00 O ATOM 1299 CB THR A 505 -0.001 -19.037 1.847 1.00 0.00 C ATOM 1300 OG1 THR A 505 0.259 -17.638 2.002 1.00 0.00 O ATOM 1301 CG2 THR A 505 1.304 -19.776 1.595 1.00 0.00 C ATOM 0 H THR A 505 -0.451 -17.541 -0.377 1.00 0.00 H new ATOM 0 HA THR A 505 -1.003 -20.322 0.432 1.00 0.00 H new ATOM 0 HB THR A 505 -0.450 -19.426 2.761 1.00 0.00 H new ATOM 0 HG1 THR A 505 0.888 -17.502 2.741 1.00 0.00 H new ATOM 0 HG21 THR A 505 1.987 -19.602 2.426 1.00 0.00 H new ATOM 0 HG22 THR A 505 1.106 -20.844 1.506 1.00 0.00 H new ATOM 0 HG23 THR A 505 1.756 -19.413 0.672 1.00 0.00 H new ATOM 1309 N ILE A 506 -2.521 -17.564 1.495 1.00 0.00 N ATOM 1310 CA ILE A 506 -3.803 -17.030 1.940 1.00 0.00 C ATOM 1311 C ILE A 506 -4.723 -16.752 0.756 1.00 0.00 C ATOM 1312 O ILE A 506 -4.262 -16.451 -0.345 1.00 0.00 O ATOM 1313 CB ILE A 506 -3.621 -15.734 2.751 1.00 0.00 C ATOM 1314 CG1 ILE A 506 -2.812 -16.009 4.020 1.00 0.00 C ATOM 1315 CG2 ILE A 506 -4.975 -15.133 3.100 1.00 0.00 C ATOM 1316 CD1 ILE A 506 -3.598 -16.728 5.094 1.00 0.00 C ATOM 0 H ILE A 506 -1.760 -16.885 1.487 1.00 0.00 H new ATOM 0 HA ILE A 506 -4.257 -17.788 2.579 1.00 0.00 H new ATOM 0 HB ILE A 506 -3.072 -15.016 2.141 1.00 0.00 H new ATOM 0 HG12 ILE A 506 -1.937 -16.605 3.761 1.00 0.00 H new ATOM 0 HG13 ILE A 506 -2.447 -15.063 4.420 1.00 0.00 H new ATOM 0 HG21 ILE A 506 -4.830 -14.217 3.673 1.00 0.00 H new ATOM 0 HG22 ILE A 506 -5.519 -14.905 2.183 1.00 0.00 H new ATOM 0 HG23 ILE A 506 -5.547 -15.846 3.694 1.00 0.00 H new ATOM 0 HD11 ILE A 506 -2.962 -16.890 5.964 1.00 0.00 H new ATOM 0 HD12 ILE A 506 -4.459 -16.124 5.381 1.00 0.00 H new ATOM 0 HD13 ILE A 506 -3.941 -17.689 4.712 1.00 0.00 H new ATOM 1328 N LYS A 507 -6.027 -16.852 0.991 1.00 0.00 N ATOM 1329 CA LYS A 507 -7.014 -16.608 -0.054 1.00 0.00 C ATOM 1330 C LYS A 507 -7.352 -15.123 -0.147 1.00 0.00 C ATOM 1331 O LYS A 507 -6.929 -14.327 0.691 1.00 0.00 O ATOM 1332 CB LYS A 507 -8.285 -17.415 0.219 1.00 0.00 C ATOM 1333 CG LYS A 507 -8.272 -18.799 -0.407 1.00 0.00 C ATOM 1334 CD LYS A 507 -8.410 -18.730 -1.918 1.00 0.00 C ATOM 1335 CE LYS A 507 -8.112 -20.072 -2.568 1.00 0.00 C ATOM 1336 NZ LYS A 507 -8.023 -19.964 -4.050 1.00 0.00 N ATOM 0 H LYS A 507 -6.425 -17.101 1.897 1.00 0.00 H new ATOM 0 HA LYS A 507 -6.586 -16.925 -1.005 1.00 0.00 H new ATOM 0 HB2 LYS A 507 -8.418 -17.514 1.296 1.00 0.00 H new ATOM 0 HB3 LYS A 507 -9.145 -16.862 -0.159 1.00 0.00 H new ATOM 0 HG2 LYS A 507 -7.343 -19.307 -0.149 1.00 0.00 H new ATOM 0 HG3 LYS A 507 -9.086 -19.394 0.007 1.00 0.00 H new ATOM 0 HD2 LYS A 507 -9.421 -18.415 -2.178 1.00 0.00 H new ATOM 0 HD3 LYS A 507 -7.730 -17.975 -2.312 1.00 0.00 H new ATOM 0 HE2 LYS A 507 -7.174 -20.465 -2.176 1.00 0.00 H new ATOM 0 HE3 LYS A 507 -8.892 -20.785 -2.302 1.00 0.00 H new ATOM 0 HZ1 LYS A 507 -7.819 -20.900 -4.455 1.00 0.00 H new ATOM 0 HZ2 LYS A 507 -8.926 -19.613 -4.427 1.00 0.00 H new ATOM 0 HZ3 LYS A 507 -7.262 -19.303 -4.305 1.00 0.00 H new ATOM 1350 N ASP A 508 -8.117 -14.759 -1.170 1.00 0.00 N ATOM 1351 CA ASP A 508 -8.514 -13.370 -1.370 1.00 0.00 C ATOM 1352 C ASP A 508 -8.812 -12.692 -0.037 1.00 0.00 C ATOM 1353 O ASP A 508 -9.854 -12.929 0.574 1.00 0.00 O ATOM 1354 CB ASP A 508 -9.742 -13.295 -2.280 1.00 0.00 C ATOM 1355 CG ASP A 508 -10.986 -13.858 -1.622 1.00 0.00 C ATOM 1356 OD1 ASP A 508 -11.042 -15.088 -1.415 1.00 0.00 O ATOM 1357 OD2 ASP A 508 -11.904 -13.069 -1.314 1.00 0.00 O ATOM 0 H ASP A 508 -8.474 -15.406 -1.873 1.00 0.00 H new ATOM 0 HA ASP A 508 -7.685 -12.846 -1.846 1.00 0.00 H new ATOM 0 HB2 ASP A 508 -9.921 -12.257 -2.559 1.00 0.00 H new ATOM 0 HB3 ASP A 508 -9.542 -13.843 -3.201 1.00 0.00 H new ATOM 1362 N LYS A 509 -7.889 -11.846 0.410 1.00 0.00 N ATOM 1363 CA LYS A 509 -8.051 -11.133 1.671 1.00 0.00 C ATOM 1364 C LYS A 509 -8.496 -9.694 1.428 1.00 0.00 C ATOM 1365 O LYS A 509 -7.875 -8.946 0.672 1.00 0.00 O ATOM 1366 CB LYS A 509 -6.740 -11.146 2.460 1.00 0.00 C ATOM 1367 CG LYS A 509 -6.934 -11.042 3.963 1.00 0.00 C ATOM 1368 CD LYS A 509 -7.086 -12.412 4.602 1.00 0.00 C ATOM 1369 CE LYS A 509 -8.498 -12.952 4.434 1.00 0.00 C ATOM 1370 NZ LYS A 509 -8.755 -14.118 5.323 1.00 0.00 N ATOM 0 H LYS A 509 -7.021 -11.638 -0.083 1.00 0.00 H new ATOM 0 HA LYS A 509 -8.822 -11.641 2.251 1.00 0.00 H new ATOM 0 HB2 LYS A 509 -6.199 -12.065 2.235 1.00 0.00 H new ATOM 0 HB3 LYS A 509 -6.115 -10.318 2.124 1.00 0.00 H new ATOM 0 HG2 LYS A 509 -6.082 -10.526 4.406 1.00 0.00 H new ATOM 0 HG3 LYS A 509 -7.818 -10.440 4.176 1.00 0.00 H new ATOM 0 HD2 LYS A 509 -6.375 -13.105 4.153 1.00 0.00 H new ATOM 0 HD3 LYS A 509 -6.843 -12.349 5.663 1.00 0.00 H new ATOM 0 HE2 LYS A 509 -9.217 -12.163 4.653 1.00 0.00 H new ATOM 0 HE3 LYS A 509 -8.653 -13.246 3.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 509 -9.728 -14.457 5.179 1.00 0.00 H new ATOM 0 HZ2 LYS A 509 -8.085 -14.881 5.097 1.00 0.00 H new ATOM 0 HZ3 LYS A 509 -8.632 -13.832 6.315 1.00 0.00 H new ATOM 1384 N PRO A 510 -9.595 -9.295 2.084 1.00 0.00 N ATOM 1385 CA PRO A 510 -10.146 -7.942 1.957 1.00 0.00 C ATOM 1386 C PRO A 510 -9.369 -6.920 2.780 1.00 0.00 C ATOM 1387 O PRO A 510 -9.830 -6.475 3.831 1.00 0.00 O ATOM 1388 CB PRO A 510 -11.572 -8.088 2.494 1.00 0.00 C ATOM 1389 CG PRO A 510 -11.499 -9.218 3.462 1.00 0.00 C ATOM 1390 CD PRO A 510 -10.385 -10.133 3.002 1.00 0.00 C ATOM 0 HA PRO A 510 -10.097 -7.577 0.931 1.00 0.00 H new ATOM 0 HB2 PRO A 510 -11.908 -7.172 2.980 1.00 0.00 H new ATOM 0 HB3 PRO A 510 -12.278 -8.300 1.691 1.00 0.00 H new ATOM 0 HG2 PRO A 510 -11.303 -8.849 4.469 1.00 0.00 H new ATOM 0 HG3 PRO A 510 -12.447 -9.755 3.498 1.00 0.00 H new ATOM 0 HD2 PRO A 510 -9.784 -10.483 3.841 1.00 0.00 H new ATOM 0 HD3 PRO A 510 -10.776 -11.017 2.499 1.00 0.00 H new ATOM 1398 N VAL A 511 -8.187 -6.552 2.295 1.00 0.00 N ATOM 1399 CA VAL A 511 -7.347 -5.581 2.985 1.00 0.00 C ATOM 1400 C VAL A 511 -8.046 -4.230 3.098 1.00 0.00 C ATOM 1401 O VAL A 511 -8.884 -3.884 2.266 1.00 0.00 O ATOM 1402 CB VAL A 511 -6.000 -5.391 2.263 1.00 0.00 C ATOM 1403 CG1 VAL A 511 -5.138 -6.636 2.403 1.00 0.00 C ATOM 1404 CG2 VAL A 511 -6.225 -5.050 0.798 1.00 0.00 C ATOM 0 H VAL A 511 -7.790 -6.912 1.427 1.00 0.00 H new ATOM 0 HA VAL A 511 -7.163 -5.976 3.984 1.00 0.00 H new ATOM 0 HB VAL A 511 -5.472 -4.559 2.729 1.00 0.00 H new ATOM 0 HG11 VAL A 511 -4.191 -6.483 1.886 1.00 0.00 H new ATOM 0 HG12 VAL A 511 -4.948 -6.830 3.459 1.00 0.00 H new ATOM 0 HG13 VAL A 511 -5.656 -7.489 1.964 1.00 0.00 H new ATOM 0 HG21 VAL A 511 -5.263 -4.919 0.303 1.00 0.00 H new ATOM 0 HG22 VAL A 511 -6.774 -5.859 0.316 1.00 0.00 H new ATOM 0 HG23 VAL A 511 -6.800 -4.127 0.723 1.00 0.00 H new ATOM 1414 N GLN A 512 -7.694 -3.472 4.131 1.00 0.00 N ATOM 1415 CA GLN A 512 -8.289 -2.159 4.352 1.00 0.00 C ATOM 1416 C GLN A 512 -7.507 -1.077 3.615 1.00 0.00 C ATOM 1417 O GLN A 512 -6.431 -0.669 4.052 1.00 0.00 O ATOM 1418 CB GLN A 512 -8.335 -1.842 5.848 1.00 0.00 C ATOM 1419 CG GLN A 512 -9.006 -0.516 6.168 1.00 0.00 C ATOM 1420 CD GLN A 512 -9.134 -0.272 7.659 1.00 0.00 C ATOM 1421 OE1 GLN A 512 -9.822 -1.011 8.364 1.00 0.00 O ATOM 1422 NE2 GLN A 512 -8.471 0.769 8.148 1.00 0.00 N ATOM 0 H GLN A 512 -7.000 -3.744 4.828 1.00 0.00 H new ATOM 0 HA GLN A 512 -9.306 -2.178 3.960 1.00 0.00 H new ATOM 0 HB2 GLN A 512 -8.865 -2.642 6.364 1.00 0.00 H new ATOM 0 HB3 GLN A 512 -7.318 -1.829 6.240 1.00 0.00 H new ATOM 0 HG2 GLN A 512 -8.433 0.295 5.719 1.00 0.00 H new ATOM 0 HG3 GLN A 512 -9.997 -0.495 5.714 1.00 0.00 H new ATOM 0 HE21 GLN A 512 -7.913 1.355 7.528 1.00 0.00 H new ATOM 0 HE22 GLN A 512 -8.520 0.983 9.144 1.00 0.00 H new ATOM 1431 N ILE A 513 -8.055 -0.617 2.495 1.00 0.00 N ATOM 1432 CA ILE A 513 -7.409 0.418 1.698 1.00 0.00 C ATOM 1433 C ILE A 513 -7.832 1.809 2.157 1.00 0.00 C ATOM 1434 O ILE A 513 -8.984 2.208 1.982 1.00 0.00 O ATOM 1435 CB ILE A 513 -7.735 0.262 0.201 1.00 0.00 C ATOM 1436 CG1 ILE A 513 -7.433 -1.165 -0.263 1.00 0.00 C ATOM 1437 CG2 ILE A 513 -6.945 1.270 -0.621 1.00 0.00 C ATOM 1438 CD1 ILE A 513 -5.995 -1.580 -0.044 1.00 0.00 C ATOM 0 H ILE A 513 -8.945 -0.945 2.119 1.00 0.00 H new ATOM 0 HA ILE A 513 -6.335 0.302 1.841 1.00 0.00 H new ATOM 0 HB ILE A 513 -8.798 0.455 0.054 1.00 0.00 H new ATOM 0 HG12 ILE A 513 -8.087 -1.857 0.267 1.00 0.00 H new ATOM 0 HG13 ILE A 513 -7.670 -1.251 -1.323 1.00 0.00 H new ATOM 0 HG21 ILE A 513 -7.186 1.147 -1.677 1.00 0.00 H new ATOM 0 HG22 ILE A 513 -7.204 2.280 -0.305 1.00 0.00 H new ATOM 0 HG23 ILE A 513 -5.878 1.105 -0.471 1.00 0.00 H new ATOM 0 HD11 ILE A 513 -5.854 -2.602 -0.396 1.00 0.00 H new ATOM 0 HD12 ILE A 513 -5.335 -0.911 -0.597 1.00 0.00 H new ATOM 0 HD13 ILE A 513 -5.759 -1.526 1.019 1.00 0.00 H new ATOM 1450 N ARG A 514 -6.893 2.545 2.743 1.00 0.00 N ATOM 1451 CA ARG A 514 -7.169 3.892 3.226 1.00 0.00 C ATOM 1452 C ARG A 514 -6.228 4.904 2.580 1.00 0.00 C ATOM 1453 O ARG A 514 -5.121 5.153 3.058 1.00 0.00 O ATOM 1454 CB ARG A 514 -7.029 3.950 4.748 1.00 0.00 C ATOM 1455 CG ARG A 514 -7.026 5.363 5.307 1.00 0.00 C ATOM 1456 CD ARG A 514 -8.439 5.892 5.492 1.00 0.00 C ATOM 1457 NE ARG A 514 -9.101 5.292 6.648 1.00 0.00 N ATOM 1458 CZ ARG A 514 -10.152 5.832 7.255 1.00 0.00 C ATOM 1459 NH1 ARG A 514 -10.659 6.977 6.818 1.00 0.00 N ATOM 1460 NH2 ARG A 514 -10.700 5.226 8.301 1.00 0.00 N ATOM 0 H ARG A 514 -5.935 2.231 2.895 1.00 0.00 H new ATOM 0 HA ARG A 514 -8.193 4.146 2.952 1.00 0.00 H new ATOM 0 HB2 ARG A 514 -7.848 3.391 5.201 1.00 0.00 H new ATOM 0 HB3 ARG A 514 -6.104 3.452 5.038 1.00 0.00 H new ATOM 0 HG2 ARG A 514 -6.503 5.376 6.263 1.00 0.00 H new ATOM 0 HG3 ARG A 514 -6.475 6.020 4.634 1.00 0.00 H new ATOM 0 HD2 ARG A 514 -8.408 6.975 5.614 1.00 0.00 H new ATOM 0 HD3 ARG A 514 -9.023 5.689 4.594 1.00 0.00 H new ATOM 0 HE ARG A 514 -8.736 4.410 7.009 1.00 0.00 H new ATOM 0 HH11 ARG A 514 -10.242 7.445 6.014 1.00 0.00 H new ATOM 0 HH12 ARG A 514 -11.466 7.389 7.286 1.00 0.00 H new ATOM 0 HH21 ARG A 514 -10.314 4.345 8.640 1.00 0.00 H new ATOM 0 HH22 ARG A 514 -11.507 5.642 8.766 1.00 0.00 H new ATOM 1474 N PRO A 515 -6.676 5.503 1.467 1.00 0.00 N ATOM 1475 CA PRO A 515 -5.890 6.498 0.731 1.00 0.00 C ATOM 1476 C PRO A 515 -5.263 7.538 1.653 1.00 0.00 C ATOM 1477 O PRO A 515 -5.879 7.970 2.627 1.00 0.00 O ATOM 1478 CB PRO A 515 -6.921 7.153 -0.192 1.00 0.00 C ATOM 1479 CG PRO A 515 -7.954 6.103 -0.412 1.00 0.00 C ATOM 1480 CD PRO A 515 -7.986 5.256 0.840 1.00 0.00 C ATOM 0 HA PRO A 515 -5.052 6.045 0.202 1.00 0.00 H new ATOM 0 HB2 PRO A 515 -7.353 8.043 0.265 1.00 0.00 H new ATOM 0 HB3 PRO A 515 -6.468 7.466 -1.133 1.00 0.00 H new ATOM 0 HG2 PRO A 515 -8.929 6.553 -0.600 1.00 0.00 H new ATOM 0 HG3 PRO A 515 -7.709 5.496 -1.284 1.00 0.00 H new ATOM 0 HD2 PRO A 515 -8.805 5.546 1.498 1.00 0.00 H new ATOM 0 HD3 PRO A 515 -8.124 4.201 0.605 1.00 0.00 H new ATOM 1488 N TRP A 516 -4.035 7.936 1.339 1.00 0.00 N ATOM 1489 CA TRP A 516 -3.325 8.927 2.139 1.00 0.00 C ATOM 1490 C TRP A 516 -4.050 10.268 2.115 1.00 0.00 C ATOM 1491 O TRP A 516 -4.536 10.702 1.071 1.00 0.00 O ATOM 1492 CB TRP A 516 -1.894 9.097 1.626 1.00 0.00 C ATOM 1493 CG TRP A 516 -1.022 9.891 2.551 1.00 0.00 C ATOM 1494 CD1 TRP A 516 -0.319 11.021 2.245 1.00 0.00 C ATOM 1495 CD2 TRP A 516 -0.760 9.614 3.931 1.00 0.00 C ATOM 1496 NE1 TRP A 516 0.365 11.464 3.352 1.00 0.00 N ATOM 1497 CE2 TRP A 516 0.111 10.618 4.399 1.00 0.00 C ATOM 1498 CE3 TRP A 516 -1.176 8.618 4.817 1.00 0.00 C ATOM 1499 CZ2 TRP A 516 0.571 10.651 5.713 1.00 0.00 C ATOM 1500 CZ3 TRP A 516 -0.719 8.651 6.120 1.00 0.00 C ATOM 1501 CH2 TRP A 516 0.147 9.662 6.559 1.00 0.00 C ATOM 0 H TRP A 516 -3.511 7.588 0.536 1.00 0.00 H new ATOM 0 HA TRP A 516 -3.294 8.571 3.169 1.00 0.00 H new ATOM 0 HB2 TRP A 516 -1.450 8.113 1.475 1.00 0.00 H new ATOM 0 HB3 TRP A 516 -1.920 9.587 0.653 1.00 0.00 H new ATOM 0 HD1 TRP A 516 -0.303 11.497 1.276 1.00 0.00 H new ATOM 0 HE1 TRP A 516 0.964 12.289 3.388 1.00 0.00 H new ATOM 0 HE3 TRP A 516 -1.844 7.835 4.489 1.00 0.00 H new ATOM 0 HZ2 TRP A 516 1.239 11.429 6.052 1.00 0.00 H new ATOM 0 HZ3 TRP A 516 -1.034 7.885 6.813 1.00 0.00 H new ATOM 0 HH2 TRP A 516 0.486 9.661 7.584 1.00 0.00 H new ATOM 1512 N ASN A 517 -4.118 10.920 3.271 1.00 0.00 N ATOM 1513 CA ASN A 517 -4.785 12.213 3.380 1.00 0.00 C ATOM 1514 C ASN A 517 -3.907 13.216 4.122 1.00 0.00 C ATOM 1515 O ASN A 517 -3.401 12.931 5.208 1.00 0.00 O ATOM 1516 CB ASN A 517 -6.125 12.060 4.102 1.00 0.00 C ATOM 1517 CG ASN A 517 -6.997 10.986 3.480 1.00 0.00 C ATOM 1518 OD1 ASN A 517 -7.062 9.860 3.975 1.00 0.00 O ATOM 1519 ND2 ASN A 517 -7.672 11.330 2.390 1.00 0.00 N ATOM 0 H ASN A 517 -3.720 10.575 4.145 1.00 0.00 H new ATOM 0 HA ASN A 517 -4.964 12.588 2.372 1.00 0.00 H new ATOM 0 HB2 ASN A 517 -5.945 11.817 5.149 1.00 0.00 H new ATOM 0 HB3 ASN A 517 -6.656 13.012 4.083 1.00 0.00 H new ATOM 0 HD21 ASN A 517 -8.275 10.650 1.928 1.00 0.00 H new ATOM 0 HD22 ASN A 517 -7.588 12.275 2.015 1.00 0.00 H new ATOM 1526 N LEU A 518 -3.731 14.392 3.529 1.00 0.00 N ATOM 1527 CA LEU A 518 -2.915 15.439 4.134 1.00 0.00 C ATOM 1528 C LEU A 518 -3.777 16.623 4.562 1.00 0.00 C ATOM 1529 O LEU A 518 -3.682 17.095 5.694 1.00 0.00 O ATOM 1530 CB LEU A 518 -1.840 15.906 3.151 1.00 0.00 C ATOM 1531 CG LEU A 518 -1.151 17.229 3.488 1.00 0.00 C ATOM 1532 CD1 LEU A 518 -0.017 17.004 4.476 1.00 0.00 C ATOM 1533 CD2 LEU A 518 -0.633 17.898 2.223 1.00 0.00 C ATOM 0 H LEU A 518 -4.142 14.644 2.630 1.00 0.00 H new ATOM 0 HA LEU A 518 -2.434 15.024 5.020 1.00 0.00 H new ATOM 0 HB2 LEU A 518 -1.078 15.130 3.082 1.00 0.00 H new ATOM 0 HB3 LEU A 518 -2.293 15.997 2.164 1.00 0.00 H new ATOM 0 HG LEU A 518 -1.883 17.890 3.951 1.00 0.00 H new ATOM 0 HD11 LEU A 518 0.461 17.957 4.704 1.00 0.00 H new ATOM 0 HD12 LEU A 518 -0.414 16.569 5.393 1.00 0.00 H new ATOM 0 HD13 LEU A 518 0.716 16.325 4.040 1.00 0.00 H new ATOM 0 HD21 LEU A 518 -0.146 18.838 2.482 1.00 0.00 H new ATOM 0 HD22 LEU A 518 0.084 17.241 1.731 1.00 0.00 H new ATOM 0 HD23 LEU A 518 -1.466 18.095 1.548 1.00 0.00 H new ATOM 1545 N SER A 519 -4.620 17.095 3.649 1.00 0.00 N ATOM 1546 CA SER A 519 -5.498 18.225 3.931 1.00 0.00 C ATOM 1547 C SER A 519 -6.959 17.785 3.949 1.00 0.00 C ATOM 1548 O SER A 519 -7.379 16.955 3.143 1.00 0.00 O ATOM 1549 CB SER A 519 -5.298 19.327 2.889 1.00 0.00 C ATOM 1550 OG SER A 519 -6.044 20.484 3.221 1.00 0.00 O ATOM 0 H SER A 519 -4.714 16.713 2.708 1.00 0.00 H new ATOM 0 HA SER A 519 -5.242 18.616 4.916 1.00 0.00 H new ATOM 0 HB2 SER A 519 -4.240 19.580 2.821 1.00 0.00 H new ATOM 0 HB3 SER A 519 -5.602 18.963 1.908 1.00 0.00 H new ATOM 0 HG SER A 519 -6.767 20.605 2.571 1.00 0.00 H new ATOM 1556 N ASP A 520 -7.728 18.349 4.874 1.00 0.00 N ATOM 1557 CA ASP A 520 -9.143 18.017 4.998 1.00 0.00 C ATOM 1558 C ASP A 520 -9.976 18.806 3.992 1.00 0.00 C ATOM 1559 O ASP A 520 -11.066 19.281 4.310 1.00 0.00 O ATOM 1560 CB ASP A 520 -9.633 18.301 6.418 1.00 0.00 C ATOM 1561 CG ASP A 520 -9.789 19.784 6.691 1.00 0.00 C ATOM 1562 OD1 ASP A 520 -8.759 20.486 6.765 1.00 0.00 O ATOM 1563 OD2 ASP A 520 -10.942 20.243 6.832 1.00 0.00 O ATOM 0 H ASP A 520 -7.396 19.038 5.549 1.00 0.00 H new ATOM 0 HA ASP A 520 -9.261 16.954 4.787 1.00 0.00 H new ATOM 0 HB2 ASP A 520 -10.590 17.803 6.575 1.00 0.00 H new ATOM 0 HB3 ASP A 520 -8.930 17.875 7.134 1.00 0.00 H new ATOM 1568 N SER A 521 -9.454 18.942 2.777 1.00 0.00 N ATOM 1569 CA SER A 521 -10.147 19.677 1.725 1.00 0.00 C ATOM 1570 C SER A 521 -9.789 19.125 0.349 1.00 0.00 C ATOM 1571 O SER A 521 -8.702 18.581 0.150 1.00 0.00 O ATOM 1572 CB SER A 521 -9.797 21.164 1.798 1.00 0.00 C ATOM 1573 OG SER A 521 -8.413 21.374 1.578 1.00 0.00 O ATOM 0 H SER A 521 -8.554 18.553 2.497 1.00 0.00 H new ATOM 0 HA SER A 521 -11.219 19.555 1.877 1.00 0.00 H new ATOM 0 HB2 SER A 521 -10.374 21.713 1.054 1.00 0.00 H new ATOM 0 HB3 SER A 521 -10.077 21.559 2.774 1.00 0.00 H new ATOM 0 HG SER A 521 -8.216 22.333 1.628 1.00 0.00 H new ATOM 1579 N ASP A 522 -10.709 19.270 -0.598 1.00 0.00 N ATOM 1580 CA ASP A 522 -10.491 18.787 -1.956 1.00 0.00 C ATOM 1581 C ASP A 522 -10.493 19.944 -2.951 1.00 0.00 C ATOM 1582 O ASP A 522 -10.733 19.751 -4.143 1.00 0.00 O ATOM 1583 CB ASP A 522 -11.566 17.769 -2.338 1.00 0.00 C ATOM 1584 CG ASP A 522 -11.172 16.349 -1.982 1.00 0.00 C ATOM 1585 OD1 ASP A 522 -10.072 15.920 -2.388 1.00 0.00 O ATOM 1586 OD2 ASP A 522 -11.963 15.667 -1.297 1.00 0.00 O ATOM 0 H ASP A 522 -11.613 19.718 -0.450 1.00 0.00 H new ATOM 0 HA ASP A 522 -9.515 18.303 -1.990 1.00 0.00 H new ATOM 0 HB2 ASP A 522 -12.498 18.022 -1.832 1.00 0.00 H new ATOM 0 HB3 ASP A 522 -11.758 17.832 -3.409 1.00 0.00 H new ATOM 1591 N PHE A 523 -10.225 21.146 -2.452 1.00 0.00 N ATOM 1592 CA PHE A 523 -10.198 22.335 -3.297 1.00 0.00 C ATOM 1593 C PHE A 523 -9.386 22.084 -4.564 1.00 0.00 C ATOM 1594 O PHE A 523 -8.413 21.329 -4.552 1.00 0.00 O ATOM 1595 CB PHE A 523 -9.610 23.520 -2.527 1.00 0.00 C ATOM 1596 CG PHE A 523 -8.115 23.620 -2.632 1.00 0.00 C ATOM 1597 CD1 PHE A 523 -7.297 22.919 -1.761 1.00 0.00 C ATOM 1598 CD2 PHE A 523 -7.527 24.416 -3.603 1.00 0.00 C ATOM 1599 CE1 PHE A 523 -5.921 23.009 -1.855 1.00 0.00 C ATOM 1600 CE2 PHE A 523 -6.152 24.510 -3.702 1.00 0.00 C ATOM 1601 CZ PHE A 523 -5.348 23.807 -2.827 1.00 0.00 C ATOM 0 H PHE A 523 -10.024 21.323 -1.468 1.00 0.00 H new ATOM 0 HA PHE A 523 -11.223 22.569 -3.584 1.00 0.00 H new ATOM 0 HB2 PHE A 523 -10.055 24.442 -2.900 1.00 0.00 H new ATOM 0 HB3 PHE A 523 -9.888 23.434 -1.476 1.00 0.00 H new ATOM 0 HD1 PHE A 523 -7.740 22.295 -0.999 1.00 0.00 H new ATOM 0 HD2 PHE A 523 -8.151 24.969 -4.290 1.00 0.00 H new ATOM 0 HE1 PHE A 523 -5.295 22.457 -1.170 1.00 0.00 H new ATOM 0 HE2 PHE A 523 -5.706 25.133 -4.463 1.00 0.00 H new ATOM 0 HZ PHE A 523 -4.273 23.881 -2.902 1.00 0.00 H new ATOM 1611 N VAL A 524 -9.793 22.722 -5.657 1.00 0.00 N ATOM 1612 CA VAL A 524 -9.104 22.569 -6.933 1.00 0.00 C ATOM 1613 C VAL A 524 -9.527 23.652 -7.919 1.00 0.00 C ATOM 1614 O VAL A 524 -10.715 23.928 -8.081 1.00 0.00 O ATOM 1615 CB VAL A 524 -9.378 21.187 -7.556 1.00 0.00 C ATOM 1616 CG1 VAL A 524 -10.874 20.946 -7.684 1.00 0.00 C ATOM 1617 CG2 VAL A 524 -8.692 21.068 -8.909 1.00 0.00 C ATOM 0 H VAL A 524 -10.596 23.350 -5.684 1.00 0.00 H new ATOM 0 HA VAL A 524 -8.037 22.663 -6.730 1.00 0.00 H new ATOM 0 HB VAL A 524 -8.967 20.422 -6.897 1.00 0.00 H new ATOM 0 HG11 VAL A 524 -11.048 19.965 -8.126 1.00 0.00 H new ATOM 0 HG12 VAL A 524 -11.335 20.986 -6.697 1.00 0.00 H new ATOM 0 HG13 VAL A 524 -11.313 21.714 -8.321 1.00 0.00 H new ATOM 0 HG21 VAL A 524 -8.896 20.086 -9.335 1.00 0.00 H new ATOM 0 HG22 VAL A 524 -9.072 21.840 -9.579 1.00 0.00 H new ATOM 0 HG23 VAL A 524 -7.616 21.193 -8.784 1.00 0.00 H new ATOM 1627 N MET A 525 -8.546 24.261 -8.576 1.00 0.00 N ATOM 1628 CA MET A 525 -8.817 25.314 -9.549 1.00 0.00 C ATOM 1629 C MET A 525 -8.070 25.054 -10.853 1.00 0.00 C ATOM 1630 O MET A 525 -7.214 25.842 -11.256 1.00 0.00 O ATOM 1631 CB MET A 525 -8.417 26.677 -8.981 1.00 0.00 C ATOM 1632 CG MET A 525 -6.984 26.729 -8.477 1.00 0.00 C ATOM 1633 SD MET A 525 -6.551 28.335 -7.779 1.00 0.00 S ATOM 1634 CE MET A 525 -6.567 29.357 -9.250 1.00 0.00 C ATOM 0 H MET A 525 -7.557 24.044 -8.453 1.00 0.00 H new ATOM 0 HA MET A 525 -9.887 25.315 -9.758 1.00 0.00 H new ATOM 0 HB2 MET A 525 -8.550 27.436 -9.752 1.00 0.00 H new ATOM 0 HB3 MET A 525 -9.091 26.932 -8.163 1.00 0.00 H new ATOM 0 HG2 MET A 525 -6.841 25.958 -7.720 1.00 0.00 H new ATOM 0 HG3 MET A 525 -6.305 26.499 -9.299 1.00 0.00 H new ATOM 0 HE1 MET A 525 -6.053 30.296 -9.046 1.00 0.00 H new ATOM 0 HE2 MET A 525 -6.061 28.835 -10.062 1.00 0.00 H new ATOM 0 HE3 MET A 525 -7.598 29.563 -9.539 1.00 0.00 H new ATOM 1644 N ASP A 526 -8.398 23.946 -11.507 1.00 0.00 N ATOM 1645 CA ASP A 526 -7.759 23.583 -12.766 1.00 0.00 C ATOM 1646 C ASP A 526 -8.798 23.378 -13.864 1.00 0.00 C ATOM 1647 O ASP A 526 -9.830 22.743 -13.646 1.00 0.00 O ATOM 1648 CB ASP A 526 -6.925 22.312 -12.592 1.00 0.00 C ATOM 1649 CG ASP A 526 -5.856 22.171 -13.658 1.00 0.00 C ATOM 1650 OD1 ASP A 526 -6.097 22.612 -14.801 1.00 0.00 O ATOM 1651 OD2 ASP A 526 -4.780 21.618 -13.349 1.00 0.00 O ATOM 0 H ASP A 526 -9.103 23.283 -11.186 1.00 0.00 H new ATOM 0 HA ASP A 526 -7.102 24.402 -13.060 1.00 0.00 H new ATOM 0 HB2 ASP A 526 -6.455 22.321 -11.609 1.00 0.00 H new ATOM 0 HB3 ASP A 526 -7.582 21.443 -12.623 1.00 0.00 H new ATOM 1656 N SER A 527 -8.519 23.921 -15.045 1.00 0.00 N ATOM 1657 CA SER A 527 -9.432 23.802 -16.176 1.00 0.00 C ATOM 1658 C SER A 527 -10.145 22.454 -16.159 1.00 0.00 C ATOM 1659 O SER A 527 -11.373 22.387 -16.208 1.00 0.00 O ATOM 1660 CB SER A 527 -8.671 23.973 -17.492 1.00 0.00 C ATOM 1661 OG SER A 527 -8.504 25.343 -17.811 1.00 0.00 O ATOM 0 H SER A 527 -7.668 24.447 -15.243 1.00 0.00 H new ATOM 0 HA SER A 527 -10.180 24.590 -16.092 1.00 0.00 H new ATOM 0 HB2 SER A 527 -7.695 23.493 -17.416 1.00 0.00 H new ATOM 0 HB3 SER A 527 -9.211 23.473 -18.296 1.00 0.00 H new ATOM 0 HG SER A 527 -8.013 25.425 -18.655 1.00 0.00 H new ATOM 1667 N GLY A 528 -9.365 21.379 -16.089 1.00 0.00 N ATOM 1668 CA GLY A 528 -9.938 20.046 -16.067 1.00 0.00 C ATOM 1669 C GLY A 528 -8.890 18.961 -16.212 1.00 0.00 C ATOM 1670 O GLY A 528 -7.946 19.082 -16.993 1.00 0.00 O ATOM 0 H GLY A 528 -8.346 21.408 -16.047 1.00 0.00 H new ATOM 0 HA2 GLY A 528 -10.478 19.902 -15.131 1.00 0.00 H new ATOM 0 HA3 GLY A 528 -10.666 19.954 -16.873 1.00 0.00 H new ATOM 1674 N PRO A 529 -9.049 17.872 -15.445 1.00 0.00 N ATOM 1675 CA PRO A 529 -8.117 16.741 -15.474 1.00 0.00 C ATOM 1676 C PRO A 529 -7.791 16.294 -16.894 1.00 0.00 C ATOM 1677 O PRO A 529 -8.602 16.452 -17.807 1.00 0.00 O ATOM 1678 CB PRO A 529 -8.873 15.640 -14.727 1.00 0.00 C ATOM 1679 CG PRO A 529 -9.785 16.368 -13.800 1.00 0.00 C ATOM 1680 CD PRO A 529 -10.151 17.661 -14.492 1.00 0.00 C ATOM 0 HA PRO A 529 -7.155 16.994 -15.029 1.00 0.00 H new ATOM 0 HB2 PRO A 529 -9.432 15.006 -15.416 1.00 0.00 H new ATOM 0 HB3 PRO A 529 -8.189 14.991 -14.181 1.00 0.00 H new ATOM 0 HG2 PRO A 529 -10.675 15.776 -13.586 1.00 0.00 H new ATOM 0 HG3 PRO A 529 -9.295 16.563 -12.846 1.00 0.00 H new ATOM 0 HD2 PRO A 529 -11.112 17.584 -15.001 1.00 0.00 H new ATOM 0 HD3 PRO A 529 -10.231 18.485 -13.784 1.00 0.00 H new ATOM 1688 N SER A 530 -6.599 15.735 -17.075 1.00 0.00 N ATOM 1689 CA SER A 530 -6.164 15.268 -18.387 1.00 0.00 C ATOM 1690 C SER A 530 -5.171 14.118 -18.252 1.00 0.00 C ATOM 1691 O SER A 530 -4.524 13.959 -17.217 1.00 0.00 O ATOM 1692 CB SER A 530 -5.529 16.415 -19.175 1.00 0.00 C ATOM 1693 OG SER A 530 -6.520 17.241 -19.761 1.00 0.00 O ATOM 0 H SER A 530 -5.917 15.594 -16.330 1.00 0.00 H new ATOM 0 HA SER A 530 -7.040 14.907 -18.926 1.00 0.00 H new ATOM 0 HB2 SER A 530 -4.900 17.010 -18.513 1.00 0.00 H new ATOM 0 HB3 SER A 530 -4.881 16.011 -19.953 1.00 0.00 H new ATOM 0 HG SER A 530 -7.378 17.090 -19.313 1.00 0.00 H new ATOM 1699 N SER A 531 -5.057 13.317 -19.306 1.00 0.00 N ATOM 1700 CA SER A 531 -4.146 12.178 -19.306 1.00 0.00 C ATOM 1701 C SER A 531 -3.768 11.784 -20.731 1.00 0.00 C ATOM 1702 O SER A 531 -4.529 12.009 -21.672 1.00 0.00 O ATOM 1703 CB SER A 531 -4.785 10.987 -18.588 1.00 0.00 C ATOM 1704 OG SER A 531 -5.866 10.460 -19.337 1.00 0.00 O ATOM 0 H SER A 531 -5.584 13.435 -20.171 1.00 0.00 H new ATOM 0 HA SER A 531 -3.239 12.470 -18.776 1.00 0.00 H new ATOM 0 HB2 SER A 531 -4.037 10.211 -18.428 1.00 0.00 H new ATOM 0 HB3 SER A 531 -5.137 11.298 -17.604 1.00 0.00 H new ATOM 0 HG SER A 531 -6.256 9.699 -18.858 1.00 0.00 H new ATOM 1710 N GLY A 532 -2.587 11.193 -20.881 1.00 0.00 N ATOM 1711 CA GLY A 532 -2.127 10.776 -22.193 1.00 0.00 C ATOM 1712 C GLY A 532 -2.011 11.937 -23.162 1.00 0.00 C ATOM 1713 O GLY A 532 -2.413 13.057 -22.850 1.00 0.00 O ATOM 0 H GLY A 532 -1.940 10.995 -20.117 1.00 0.00 H new ATOM 0 HA2 GLY A 532 -1.157 10.289 -22.097 1.00 0.00 H new ATOM 0 HA3 GLY A 532 -2.817 10.036 -22.598 1.00 0.00 H new TER 1717 GLY A 532