USER MOD reduce.3.24.130724 H: found=0, std=0, add=576, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 577 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 473 THR OG1 : rot 121:sc= 1.48 USER MOD Set 1.2: A 479 TYR OH : rot 92:sc= -1.33 USER MOD Set 2.1: A 470 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 474 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 421 LYS NZ :NH3+ -150:sc= -0.79 (180deg=-0.941) USER MOD Set 3.2: A 439 THR OG1 : rot -99:sc= 0.372 USER MOD Single : A 413 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 416 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 420 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 423 TYR OH : rot 164:sc= -1.44 USER MOD Single : A 424 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 427 GLN : amide:sc= -2.61 K(o=-2.6,f=-1.7) USER MOD Single : A 429 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 430 ASN : amide:sc= -1.25 X(o=-1.3,f=-0.85) USER MOD Single : A 431 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 433 SER OG : rot 103:sc= 1.13 USER MOD Single : A 435 GLN : amide:sc= -0.735 K(o=-0.74,f=0) USER MOD Single : A 437 LYS NZ :NH3+ -117:sc= -0.936 (180deg=-2.47!) USER MOD Single : A 443 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 445 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 446 GLN : amide:sc= -1.81 K(o=-1.8,f=-1.2) USER MOD Single : A 447 HIS : no HE2:sc= -15.3! C(o=-15!,f=-15!) USER MOD Single : A 449 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 450 ASN : amide:sc= -3.28 K(o=-3.3,f=-1.7) USER MOD Single : A 456 SER OG : rot 180:sc= 0 USER MOD Single : A 461 LYS NZ :NH3+ 149:sc= -2.06 (180deg=-3.88!) USER MOD Single : A 462 THR OG1 : rot 180:sc= -1.92 USER MOD Single : A 466 CYS SG : rot 34:sc= 1.53 USER MOD Single : A 469 TYR OH : rot 30:sc= -2.67! USER MOD Single : A 471 TYR OH : rot 180:sc= 0 USER MOD Single : A 475 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 476 ASN : amide:sc= -2.07 K(o=-2.1,f=-6!) USER MOD Single : A 478 ASN : amide:sc= -0.004 X(o=-0.004,f=-0.28) USER MOD Single : A 480 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 413 4.542 5.495 26.118 1.00 10.00 N ATOM 2 CA ASN A 413 5.270 6.244 25.101 1.00 10.00 C ATOM 3 C ASN A 413 6.282 5.352 24.388 1.00 10.00 C ATOM 4 O ASN A 413 6.559 4.236 24.828 1.00 10.00 O ATOM 5 CB ASN A 413 5.983 7.442 25.730 1.00 10.00 C ATOM 6 CG ASN A 413 5.076 8.649 25.865 1.00 10.00 C ATOM 7 OD1 ASN A 413 4.872 9.396 24.909 1.00 10.00 O ATOM 8 ND2 ASN A 413 4.526 8.845 27.058 1.00 10.00 N ATOM 0 HA ASN A 413 4.549 6.604 24.367 1.00 10.00 H new ATOM 0 HB2 ASN A 413 6.359 7.162 26.714 1.00 10.00 H new ATOM 0 HB3 ASN A 413 6.848 7.707 25.122 1.00 10.00 H new ATOM 0 HD21 ASN A 413 3.906 9.641 27.209 1.00 10.00 H new ATOM 0 HD22 ASN A 413 4.723 8.200 27.823 1.00 10.00 H new ATOM 15 N GLY A 414 6.829 5.851 23.285 1.00 10.00 N ATOM 16 CA GLY A 414 7.804 5.087 22.530 1.00 10.00 C ATOM 17 C GLY A 414 7.246 3.770 22.028 1.00 10.00 C ATOM 18 O GLY A 414 6.093 3.433 22.297 1.00 10.00 O ATOM 0 H GLY A 414 6.614 6.771 22.900 1.00 10.00 H new ATOM 0 HA2 GLY A 414 8.147 5.679 21.682 1.00 10.00 H new ATOM 0 HA3 GLY A 414 8.674 4.894 23.157 1.00 10.00 H new ATOM 22 N LEU A 415 8.065 3.022 21.294 1.00 10.00 N ATOM 23 CA LEU A 415 7.647 1.735 20.754 1.00 10.00 C ATOM 24 C LEU A 415 6.455 1.900 19.816 1.00 10.00 C ATOM 25 O LEU A 415 5.453 1.195 19.936 1.00 10.00 O ATOM 26 CB LEU A 415 7.290 0.773 21.890 1.00 10.00 C ATOM 27 CG LEU A 415 7.408 -0.712 21.542 1.00 10.00 C ATOM 28 CD1 LEU A 415 8.861 -1.090 21.301 1.00 10.00 C ATOM 29 CD2 LEU A 415 6.809 -1.566 22.649 1.00 10.00 C ATOM 0 H LEU A 415 9.022 3.286 21.060 1.00 10.00 H new ATOM 0 HA LEU A 415 8.479 1.320 20.185 1.00 10.00 H new ATOM 0 HB2 LEU A 415 7.938 0.984 22.741 1.00 10.00 H new ATOM 0 HB3 LEU A 415 6.268 0.976 22.209 1.00 10.00 H new ATOM 0 HG LEU A 415 6.850 -0.897 20.624 1.00 10.00 H new ATOM 0 HD11 LEU A 415 8.925 -2.150 21.055 1.00 10.00 H new ATOM 0 HD12 LEU A 415 9.258 -0.501 20.474 1.00 10.00 H new ATOM 0 HD13 LEU A 415 9.443 -0.891 22.201 1.00 10.00 H new ATOM 0 HD21 LEU A 415 6.901 -2.620 22.386 1.00 10.00 H new ATOM 0 HD22 LEU A 415 7.340 -1.377 23.582 1.00 10.00 H new ATOM 0 HD23 LEU A 415 5.756 -1.314 22.774 1.00 10.00 H new ATOM 41 N MET A 416 6.572 2.837 18.880 1.00 10.00 N ATOM 42 CA MET A 416 5.504 3.096 17.920 1.00 10.00 C ATOM 43 C MET A 416 5.782 2.394 16.595 1.00 10.00 C ATOM 44 O MET A 416 5.437 2.903 15.528 1.00 10.00 O ATOM 45 CB MET A 416 5.349 4.601 17.693 1.00 10.00 C ATOM 46 CG MET A 416 4.384 5.267 18.659 1.00 10.00 C ATOM 47 SD MET A 416 4.907 6.927 19.129 1.00 10.00 S ATOM 48 CE MET A 416 4.030 7.134 20.676 1.00 10.00 C ATOM 0 H MET A 416 7.395 3.429 18.766 1.00 10.00 H new ATOM 0 HA MET A 416 4.575 2.701 18.331 1.00 10.00 H new ATOM 0 HB2 MET A 416 6.326 5.076 17.784 1.00 10.00 H new ATOM 0 HB3 MET A 416 5.005 4.772 16.673 1.00 10.00 H new ATOM 0 HG2 MET A 416 3.396 5.317 18.202 1.00 10.00 H new ATOM 0 HG3 MET A 416 4.290 4.653 19.554 1.00 10.00 H new ATOM 0 HE1 MET A 416 4.253 8.117 21.092 1.00 10.00 H new ATOM 0 HE2 MET A 416 2.958 7.049 20.501 1.00 10.00 H new ATOM 0 HE3 MET A 416 4.345 6.363 21.379 1.00 10.00 H new ATOM 58 N ALA A 417 6.407 1.224 16.671 1.00 10.00 N ATOM 59 CA ALA A 417 6.732 0.452 15.477 1.00 10.00 C ATOM 60 C ALA A 417 6.169 -0.961 15.569 1.00 10.00 C ATOM 61 O ALA A 417 6.631 -1.774 16.370 1.00 10.00 O ATOM 62 CB ALA A 417 8.238 0.411 15.269 1.00 10.00 C ATOM 0 H ALA A 417 6.699 0.790 17.547 1.00 10.00 H new ATOM 0 HA ALA A 417 6.272 0.943 14.619 1.00 10.00 H new ATOM 0 HB1 ALA A 417 8.466 -0.168 14.374 1.00 10.00 H new ATOM 0 HB2 ALA A 417 8.617 1.426 15.150 1.00 10.00 H new ATOM 0 HB3 ALA A 417 8.712 -0.054 16.133 1.00 10.00 H new ATOM 68 N ASP A 418 5.168 -1.249 14.744 1.00 10.00 N ATOM 69 CA ASP A 418 4.541 -2.566 14.732 1.00 10.00 C ATOM 70 C ASP A 418 3.849 -2.829 13.396 1.00 10.00 C ATOM 71 O ASP A 418 2.664 -2.537 13.235 1.00 10.00 O ATOM 72 CB ASP A 418 3.531 -2.683 15.875 1.00 10.00 C ATOM 73 CG ASP A 418 2.468 -1.603 15.820 1.00 10.00 C ATOM 74 OD1 ASP A 418 2.758 -0.463 16.241 1.00 10.00 O ATOM 75 OD2 ASP A 418 1.347 -1.897 15.355 1.00 10.00 O ATOM 0 H ASP A 418 4.773 -0.588 14.075 1.00 10.00 H new ATOM 0 HA ASP A 418 5.322 -3.314 14.868 1.00 10.00 H new ATOM 0 HB2 ASP A 418 3.053 -3.662 15.835 1.00 10.00 H new ATOM 0 HB3 ASP A 418 4.057 -2.624 16.828 1.00 10.00 H new ATOM 80 N PRO A 419 4.582 -3.386 12.418 1.00 10.00 N ATOM 81 CA PRO A 419 4.031 -3.687 11.092 1.00 10.00 C ATOM 82 C PRO A 419 3.012 -4.821 11.133 1.00 10.00 C ATOM 83 O PRO A 419 3.309 -5.918 11.607 1.00 10.00 O ATOM 84 CB PRO A 419 5.259 -4.101 10.279 1.00 10.00 C ATOM 85 CG PRO A 419 6.237 -4.591 11.291 1.00 10.00 C ATOM 86 CD PRO A 419 6.003 -3.766 12.525 1.00 10.00 C ATOM 0 HA PRO A 419 3.494 -2.836 10.672 1.00 10.00 H new ATOM 0 HB2 PRO A 419 5.012 -4.880 9.558 1.00 10.00 H new ATOM 0 HB3 PRO A 419 5.662 -3.260 9.714 1.00 10.00 H new ATOM 0 HG2 PRO A 419 6.088 -5.651 11.496 1.00 10.00 H new ATOM 0 HG3 PRO A 419 7.260 -4.476 10.933 1.00 10.00 H new ATOM 0 HD2 PRO A 419 6.199 -4.337 13.433 1.00 10.00 H new ATOM 0 HD3 PRO A 419 6.652 -2.891 12.552 1.00 10.00 H new ATOM 94 N MET A 420 1.811 -4.550 10.634 1.00 10.00 N ATOM 95 CA MET A 420 0.748 -5.544 10.612 1.00 10.00 C ATOM 96 C MET A 420 0.178 -5.684 9.211 1.00 10.00 C ATOM 97 O MET A 420 0.596 -6.561 8.457 1.00 10.00 O ATOM 98 CB MET A 420 -0.354 -5.157 11.601 1.00 10.00 C ATOM 99 CG MET A 420 -0.415 -6.054 12.827 1.00 10.00 C ATOM 100 SD MET A 420 -2.068 -6.145 13.540 1.00 10.00 S ATOM 101 CE MET A 420 -1.860 -7.485 14.710 1.00 10.00 C ATOM 0 H MET A 420 1.550 -3.647 10.238 1.00 10.00 H new ATOM 0 HA MET A 420 1.164 -6.506 10.910 1.00 10.00 H new ATOM 0 HB2 MET A 420 -0.197 -4.127 11.922 1.00 10.00 H new ATOM 0 HB3 MET A 420 -1.316 -5.188 11.090 1.00 10.00 H new ATOM 0 HG2 MET A 420 -0.085 -7.057 12.555 1.00 10.00 H new ATOM 0 HG3 MET A 420 0.281 -5.682 13.579 1.00 10.00 H new ATOM 0 HE1 MET A 420 -2.800 -7.662 15.232 1.00 10.00 H new ATOM 0 HE2 MET A 420 -1.565 -8.390 14.178 1.00 10.00 H new ATOM 0 HE3 MET A 420 -1.088 -7.220 15.433 1.00 10.00 H new ATOM 111 N LYS A 421 -0.771 -4.821 8.859 1.00 10.00 N ATOM 112 CA LYS A 421 -1.383 -4.874 7.535 1.00 10.00 C ATOM 113 C LYS A 421 -0.314 -4.940 6.467 1.00 10.00 C ATOM 114 O LYS A 421 0.252 -3.926 6.063 1.00 10.00 O ATOM 115 CB LYS A 421 -2.289 -3.684 7.294 1.00 10.00 C ATOM 116 CG LYS A 421 -3.316 -3.929 6.206 1.00 10.00 C ATOM 117 CD LYS A 421 -2.674 -4.345 4.893 1.00 10.00 C ATOM 118 CE LYS A 421 -3.596 -4.087 3.709 1.00 10.00 C ATOM 119 NZ LYS A 421 -5.033 -4.257 4.067 1.00 10.00 N ATOM 0 H LYS A 421 -1.130 -4.084 9.465 1.00 10.00 H new ATOM 0 HA LYS A 421 -1.994 -5.775 7.486 1.00 10.00 H new ATOM 0 HB2 LYS A 421 -2.804 -3.433 8.221 1.00 10.00 H new ATOM 0 HB3 LYS A 421 -1.681 -2.821 7.024 1.00 10.00 H new ATOM 0 HG2 LYS A 421 -4.009 -4.705 6.531 1.00 10.00 H new ATOM 0 HG3 LYS A 421 -3.902 -3.023 6.051 1.00 10.00 H new ATOM 0 HD2 LYS A 421 -1.742 -3.798 4.754 1.00 10.00 H new ATOM 0 HD3 LYS A 421 -2.419 -5.404 4.932 1.00 10.00 H new ATOM 0 HE2 LYS A 421 -3.433 -3.075 3.338 1.00 10.00 H new ATOM 0 HE3 LYS A 421 -3.342 -4.769 2.898 1.00 10.00 H new ATOM 0 HZ1 LYS A 421 -5.564 -4.576 3.231 1.00 10.00 H new ATOM 0 HZ2 LYS A 421 -5.121 -4.965 4.824 1.00 10.00 H new ATOM 0 HZ3 LYS A 421 -5.418 -3.349 4.396 1.00 10.00 H new ATOM 133 N VAL A 422 -0.033 -6.156 6.043 1.00 10.00 N ATOM 134 CA VAL A 422 0.983 -6.413 5.052 1.00 10.00 C ATOM 135 C VAL A 422 1.079 -7.911 4.814 1.00 10.00 C ATOM 136 O VAL A 422 1.181 -8.380 3.682 1.00 10.00 O ATOM 137 CB VAL A 422 2.328 -5.849 5.537 1.00 10.00 C ATOM 138 CG1 VAL A 422 3.020 -6.807 6.500 1.00 10.00 C ATOM 139 CG2 VAL A 422 3.230 -5.507 4.364 1.00 10.00 C ATOM 0 H VAL A 422 -0.507 -6.994 6.380 1.00 10.00 H new ATOM 0 HA VAL A 422 0.723 -5.924 4.113 1.00 10.00 H new ATOM 0 HB VAL A 422 2.121 -4.928 6.082 1.00 10.00 H new ATOM 0 HG11 VAL A 422 3.968 -6.377 6.823 1.00 10.00 H new ATOM 0 HG12 VAL A 422 2.383 -6.974 7.368 1.00 10.00 H new ATOM 0 HG13 VAL A 422 3.205 -7.757 5.998 1.00 10.00 H new ATOM 0 HG21 VAL A 422 4.175 -5.110 4.735 1.00 10.00 H new ATOM 0 HG22 VAL A 422 3.420 -6.405 3.777 1.00 10.00 H new ATOM 0 HG23 VAL A 422 2.744 -4.760 3.737 1.00 10.00 H new ATOM 149 N TYR A 423 1.003 -8.644 5.914 1.00 10.00 N ATOM 150 CA TYR A 423 1.026 -10.100 5.896 1.00 10.00 C ATOM 151 C TYR A 423 -0.011 -10.640 4.909 1.00 10.00 C ATOM 152 O TYR A 423 0.114 -11.764 4.422 1.00 10.00 O ATOM 153 CB TYR A 423 0.763 -10.664 7.310 1.00 10.00 C ATOM 154 CG TYR A 423 -0.026 -9.748 8.234 1.00 10.00 C ATOM 155 CD1 TYR A 423 -0.902 -8.794 7.733 1.00 10.00 C ATOM 156 CD2 TYR A 423 0.123 -9.830 9.613 1.00 10.00 C ATOM 157 CE1 TYR A 423 -1.596 -7.954 8.563 1.00 10.00 C ATOM 158 CE2 TYR A 423 -0.576 -8.989 10.457 1.00 10.00 C ATOM 159 CZ TYR A 423 -1.433 -8.050 9.926 1.00 10.00 C ATOM 160 OH TYR A 423 -2.134 -7.211 10.762 1.00 10.00 O ATOM 0 H TYR A 423 0.923 -8.245 6.849 1.00 10.00 H new ATOM 0 HA TYR A 423 2.015 -10.423 5.572 1.00 10.00 H new ATOM 0 HB2 TYR A 423 0.226 -11.607 7.214 1.00 10.00 H new ATOM 0 HB3 TYR A 423 1.721 -10.889 7.778 1.00 10.00 H new ATOM 0 HD1 TYR A 423 -1.039 -8.713 6.665 1.00 10.00 H new ATOM 0 HD2 TYR A 423 0.796 -10.563 10.032 1.00 10.00 H new ATOM 0 HE1 TYR A 423 -2.269 -7.218 8.149 1.00 10.00 H new ATOM 0 HE2 TYR A 423 -0.451 -9.067 11.527 1.00 10.00 H new ATOM 0 HH TYR A 423 -2.110 -7.564 11.676 1.00 10.00 H new ATOM 170 N LYS A 424 -1.029 -9.831 4.604 1.00 10.00 N ATOM 171 CA LYS A 424 -2.068 -10.235 3.664 1.00 10.00 C ATOM 172 C LYS A 424 -1.946 -9.456 2.355 1.00 10.00 C ATOM 173 O LYS A 424 -2.851 -9.478 1.521 1.00 10.00 O ATOM 174 CB LYS A 424 -3.448 -10.003 4.274 1.00 10.00 C ATOM 175 CG LYS A 424 -3.863 -11.074 5.270 1.00 10.00 C ATOM 176 CD LYS A 424 -5.369 -11.274 5.278 1.00 10.00 C ATOM 177 CE LYS A 424 -5.736 -12.730 5.513 1.00 10.00 C ATOM 178 NZ LYS A 424 -7.209 -12.945 5.469 1.00 10.00 N ATOM 0 H LYS A 424 -1.152 -8.897 4.995 1.00 10.00 H new ATOM 0 HA LYS A 424 -1.942 -11.297 3.452 1.00 10.00 H new ATOM 0 HB2 LYS A 424 -3.457 -9.033 4.772 1.00 10.00 H new ATOM 0 HB3 LYS A 424 -4.187 -9.958 3.474 1.00 10.00 H new ATOM 0 HG2 LYS A 424 -3.371 -12.014 5.020 1.00 10.00 H new ATOM 0 HG3 LYS A 424 -3.527 -10.794 6.268 1.00 10.00 H new ATOM 0 HD2 LYS A 424 -5.815 -10.655 6.056 1.00 10.00 H new ATOM 0 HD3 LYS A 424 -5.786 -10.941 4.328 1.00 10.00 H new ATOM 0 HE2 LYS A 424 -5.256 -13.352 4.758 1.00 10.00 H new ATOM 0 HE3 LYS A 424 -5.351 -13.050 6.481 1.00 10.00 H new ATOM 0 HZ1 LYS A 424 -7.418 -13.950 5.634 1.00 10.00 H new ATOM 0 HZ2 LYS A 424 -7.666 -12.371 6.206 1.00 10.00 H new ATOM 0 HZ3 LYS A 424 -7.573 -12.664 4.536 1.00 10.00 H new ATOM 192 N ASP A 425 -0.825 -8.760 2.189 1.00 10.00 N ATOM 193 CA ASP A 425 -0.582 -7.964 0.993 1.00 10.00 C ATOM 194 C ASP A 425 0.555 -8.538 0.149 1.00 10.00 C ATOM 195 O ASP A 425 0.818 -8.056 -0.952 1.00 10.00 O ATOM 196 CB ASP A 425 -0.257 -6.519 1.374 1.00 10.00 C ATOM 197 CG ASP A 425 -1.254 -5.933 2.353 1.00 10.00 C ATOM 198 OD1 ASP A 425 -2.173 -6.665 2.779 1.00 10.00 O ATOM 199 OD2 ASP A 425 -1.117 -4.739 2.693 1.00 10.00 O ATOM 0 H ASP A 425 -0.068 -8.732 2.872 1.00 10.00 H new ATOM 0 HA ASP A 425 -1.493 -7.990 0.396 1.00 10.00 H new ATOM 0 HB2 ASP A 425 0.741 -6.479 1.810 1.00 10.00 H new ATOM 0 HB3 ASP A 425 -0.236 -5.906 0.473 1.00 10.00 H new ATOM 204 N ARG A 426 1.232 -9.565 0.658 1.00 10.00 N ATOM 205 CA ARG A 426 2.335 -10.182 -0.077 1.00 10.00 C ATOM 206 C ARG A 426 1.893 -10.575 -1.484 1.00 10.00 C ATOM 207 O ARG A 426 2.713 -10.693 -2.395 1.00 10.00 O ATOM 208 CB ARG A 426 2.859 -11.408 0.672 1.00 10.00 C ATOM 209 CG ARG A 426 4.370 -11.561 0.606 1.00 10.00 C ATOM 210 CD ARG A 426 4.786 -13.021 0.684 1.00 10.00 C ATOM 211 NE ARG A 426 6.072 -13.259 0.033 1.00 10.00 N ATOM 212 CZ ARG A 426 6.548 -14.470 -0.249 1.00 10.00 C ATOM 213 NH1 ARG A 426 5.847 -15.555 0.062 1.00 10.00 N ATOM 214 NH2 ARG A 426 7.726 -14.598 -0.843 1.00 10.00 N ATOM 0 H ARG A 426 1.039 -9.985 1.567 1.00 10.00 H new ATOM 0 HA ARG A 426 3.140 -9.451 -0.158 1.00 10.00 H new ATOM 0 HB2 ARG A 426 2.554 -11.343 1.716 1.00 10.00 H new ATOM 0 HB3 ARG A 426 2.393 -12.303 0.259 1.00 10.00 H new ATOM 0 HG2 ARG A 426 4.741 -11.125 -0.322 1.00 10.00 H new ATOM 0 HG3 ARG A 426 4.829 -11.007 1.425 1.00 10.00 H new ATOM 0 HD2 ARG A 426 4.847 -13.325 1.729 1.00 10.00 H new ATOM 0 HD3 ARG A 426 4.022 -13.641 0.215 1.00 10.00 H new ATOM 0 HE ARG A 426 6.639 -12.450 -0.220 1.00 10.00 H new ATOM 0 HH11 ARG A 426 4.940 -15.462 0.519 1.00 10.00 H new ATOM 0 HH12 ARG A 426 6.216 -16.481 -0.156 1.00 10.00 H new ATOM 0 HH21 ARG A 426 8.268 -13.768 -1.084 1.00 10.00 H new ATOM 0 HH22 ARG A 426 8.090 -15.526 -1.059 1.00 10.00 H new ATOM 228 N GLN A 427 0.588 -10.753 -1.656 1.00 10.00 N ATOM 229 CA GLN A 427 0.026 -11.105 -2.952 1.00 10.00 C ATOM 230 C GLN A 427 -0.610 -9.876 -3.585 1.00 10.00 C ATOM 231 O GLN A 427 -1.587 -9.970 -4.329 1.00 10.00 O ATOM 232 CB GLN A 427 -1.004 -12.236 -2.812 1.00 10.00 C ATOM 233 CG GLN A 427 -1.715 -12.268 -1.464 1.00 10.00 C ATOM 234 CD GLN A 427 -0.847 -12.830 -0.351 1.00 10.00 C ATOM 235 OE1 GLN A 427 -0.291 -13.922 -0.472 1.00 10.00 O ATOM 236 NE2 GLN A 427 -0.727 -12.081 0.743 1.00 10.00 N ATOM 0 H GLN A 427 -0.102 -10.659 -0.910 1.00 10.00 H new ATOM 0 HA GLN A 427 0.828 -11.463 -3.598 1.00 10.00 H new ATOM 0 HB2 GLN A 427 -1.749 -12.134 -3.601 1.00 10.00 H new ATOM 0 HB3 GLN A 427 -0.502 -13.191 -2.969 1.00 10.00 H new ATOM 0 HG2 GLN A 427 -2.027 -11.258 -1.199 1.00 10.00 H new ATOM 0 HG3 GLN A 427 -2.620 -12.869 -1.551 1.00 10.00 H new ATOM 0 HE21 GLN A 427 -1.206 -11.182 0.801 1.00 10.00 H new ATOM 0 HE22 GLN A 427 -0.157 -12.406 1.524 1.00 10.00 H new ATOM 245 N VAL A 428 -0.029 -8.723 -3.278 1.00 10.00 N ATOM 246 CA VAL A 428 -0.499 -7.448 -3.799 1.00 10.00 C ATOM 247 C VAL A 428 0.547 -6.827 -4.706 1.00 10.00 C ATOM 248 O VAL A 428 0.216 -6.146 -5.675 1.00 10.00 O ATOM 249 CB VAL A 428 -0.828 -6.461 -2.666 1.00 10.00 C ATOM 250 CG1 VAL A 428 -1.181 -5.094 -3.228 1.00 10.00 C ATOM 251 CG2 VAL A 428 -1.957 -6.997 -1.805 1.00 10.00 C ATOM 0 H VAL A 428 0.780 -8.647 -2.662 1.00 10.00 H new ATOM 0 HA VAL A 428 -1.409 -7.647 -4.365 1.00 10.00 H new ATOM 0 HB VAL A 428 0.057 -6.350 -2.040 1.00 10.00 H new ATOM 0 HG11 VAL A 428 -1.410 -4.412 -2.409 1.00 10.00 H new ATOM 0 HG12 VAL A 428 -0.337 -4.706 -3.798 1.00 10.00 H new ATOM 0 HG13 VAL A 428 -2.050 -5.182 -3.881 1.00 10.00 H new ATOM 0 HG21 VAL A 428 -2.176 -6.286 -1.009 1.00 10.00 H new ATOM 0 HG22 VAL A 428 -2.846 -7.140 -2.419 1.00 10.00 H new ATOM 0 HG23 VAL A 428 -1.660 -7.951 -1.368 1.00 10.00 H new ATOM 261 N MET A 429 1.818 -7.078 -4.398 1.00 10.00 N ATOM 262 CA MET A 429 2.913 -6.549 -5.206 1.00 10.00 C ATOM 263 C MET A 429 2.643 -6.791 -6.690 1.00 10.00 C ATOM 264 O MET A 429 3.137 -6.062 -7.550 1.00 10.00 O ATOM 265 CB MET A 429 4.236 -7.200 -4.800 1.00 10.00 C ATOM 266 CG MET A 429 4.185 -8.719 -4.777 1.00 10.00 C ATOM 267 SD MET A 429 4.847 -9.460 -6.282 1.00 10.00 S ATOM 268 CE MET A 429 5.488 -11.005 -5.645 1.00 10.00 C ATOM 0 H MET A 429 2.113 -7.641 -3.600 1.00 10.00 H new ATOM 0 HA MET A 429 2.983 -5.475 -5.033 1.00 10.00 H new ATOM 0 HB2 MET A 429 5.015 -6.881 -5.492 1.00 10.00 H new ATOM 0 HB3 MET A 429 4.521 -6.839 -3.812 1.00 10.00 H new ATOM 0 HG2 MET A 429 4.749 -9.084 -3.919 1.00 10.00 H new ATOM 0 HG3 MET A 429 3.153 -9.042 -4.641 1.00 10.00 H new ATOM 0 HE1 MET A 429 5.932 -11.578 -6.459 1.00 10.00 H new ATOM 0 HE2 MET A 429 6.247 -10.800 -4.890 1.00 10.00 H new ATOM 0 HE3 MET A 429 4.676 -11.579 -5.198 1.00 10.00 H new ATOM 278 N ASN A 430 1.849 -7.822 -6.976 1.00 10.00 N ATOM 279 CA ASN A 430 1.501 -8.168 -8.346 1.00 10.00 C ATOM 280 C ASN A 430 -0.015 -8.260 -8.521 1.00 10.00 C ATOM 281 O ASN A 430 -0.501 -8.918 -9.440 1.00 10.00 O ATOM 282 CB ASN A 430 2.152 -9.500 -8.724 1.00 10.00 C ATOM 283 CG ASN A 430 1.937 -9.861 -10.181 1.00 10.00 C ATOM 284 OD1 ASN A 430 2.555 -9.282 -11.073 1.00 10.00 O ATOM 285 ND2 ASN A 430 1.055 -10.823 -10.428 1.00 10.00 N ATOM 0 H ASN A 430 1.435 -8.432 -6.271 1.00 10.00 H new ATOM 0 HA ASN A 430 1.872 -7.382 -9.004 1.00 10.00 H new ATOM 0 HB2 ASN A 430 3.222 -9.448 -8.520 1.00 10.00 H new ATOM 0 HB3 ASN A 430 1.745 -10.291 -8.094 1.00 10.00 H new ATOM 0 HD21 ASN A 430 0.868 -11.109 -11.389 1.00 10.00 H new ATOM 0 HD22 ASN A 430 0.565 -11.276 -9.657 1.00 10.00 H new ATOM 292 N MET A 431 -0.760 -7.593 -7.639 1.00 10.00 N ATOM 293 CA MET A 431 -2.220 -7.602 -7.708 1.00 10.00 C ATOM 294 C MET A 431 -2.845 -6.948 -6.481 1.00 10.00 C ATOM 295 O MET A 431 -3.170 -7.623 -5.504 1.00 10.00 O ATOM 296 CB MET A 431 -2.748 -9.031 -7.830 1.00 10.00 C ATOM 297 CG MET A 431 -3.181 -9.404 -9.239 1.00 10.00 C ATOM 298 SD MET A 431 -2.778 -11.109 -9.660 1.00 10.00 S ATOM 299 CE MET A 431 -4.339 -11.670 -10.336 1.00 10.00 C ATOM 0 H MET A 431 -0.377 -7.042 -6.871 1.00 10.00 H new ATOM 0 HA MET A 431 -2.499 -7.029 -8.593 1.00 10.00 H new ATOM 0 HB2 MET A 431 -1.974 -9.724 -7.502 1.00 10.00 H new ATOM 0 HB3 MET A 431 -3.594 -9.155 -7.154 1.00 10.00 H new ATOM 0 HG2 MET A 431 -4.256 -9.254 -9.336 1.00 10.00 H new ATOM 0 HG3 MET A 431 -2.700 -8.734 -9.952 1.00 10.00 H new ATOM 0 HE1 MET A 431 -4.249 -12.712 -10.643 1.00 10.00 H new ATOM 0 HE2 MET A 431 -5.117 -11.581 -9.578 1.00 10.00 H new ATOM 0 HE3 MET A 431 -4.602 -11.059 -11.199 1.00 10.00 H new ATOM 309 N TRP A 432 -3.046 -5.642 -6.551 1.00 10.00 N ATOM 310 CA TRP A 432 -3.670 -4.909 -5.458 1.00 10.00 C ATOM 311 C TRP A 432 -5.179 -5.018 -5.589 1.00 10.00 C ATOM 312 O TRP A 432 -5.803 -4.323 -6.393 1.00 10.00 O ATOM 313 CB TRP A 432 -3.232 -3.443 -5.463 1.00 10.00 C ATOM 314 CG TRP A 432 -1.777 -3.227 -5.785 1.00 10.00 C ATOM 315 CD1 TRP A 432 -1.142 -3.512 -6.957 1.00 10.00 C ATOM 316 CD2 TRP A 432 -0.778 -2.667 -4.925 1.00 10.00 C ATOM 317 NE1 TRP A 432 0.173 -3.130 -6.887 1.00 10.00 N ATOM 318 CE2 TRP A 432 0.424 -2.621 -5.650 1.00 10.00 C ATOM 319 CE3 TRP A 432 -0.785 -2.193 -3.618 1.00 10.00 C ATOM 320 CZ2 TRP A 432 1.602 -2.113 -5.110 1.00 10.00 C ATOM 321 CZ3 TRP A 432 0.383 -1.697 -3.076 1.00 10.00 C ATOM 322 CH2 TRP A 432 1.563 -1.656 -3.822 1.00 10.00 C ATOM 0 H TRP A 432 -2.787 -5.067 -7.352 1.00 10.00 H new ATOM 0 HA TRP A 432 -3.355 -5.342 -4.509 1.00 10.00 H new ATOM 0 HB2 TRP A 432 -3.836 -2.899 -6.189 1.00 10.00 H new ATOM 0 HB3 TRP A 432 -3.443 -3.011 -4.485 1.00 10.00 H new ATOM 0 HD1 TRP A 432 -1.607 -3.972 -7.816 1.00 10.00 H new ATOM 0 HE1 TRP A 432 0.854 -3.214 -7.641 1.00 10.00 H new ATOM 0 HE3 TRP A 432 -1.693 -2.213 -3.034 1.00 10.00 H new ATOM 0 HZ2 TRP A 432 2.514 -2.081 -5.688 1.00 10.00 H new ATOM 0 HZ3 TRP A 432 0.385 -1.335 -2.059 1.00 10.00 H new ATOM 0 HH2 TRP A 432 2.460 -1.256 -3.374 1.00 10.00 H new ATOM 333 N SER A 433 -5.751 -5.919 -4.808 1.00 10.00 N ATOM 334 CA SER A 433 -7.188 -6.166 -4.839 1.00 10.00 C ATOM 335 C SER A 433 -7.975 -4.924 -4.450 1.00 10.00 C ATOM 336 O SER A 433 -7.520 -4.117 -3.642 1.00 10.00 O ATOM 337 CB SER A 433 -7.546 -7.320 -3.901 1.00 10.00 C ATOM 338 OG SER A 433 -6.609 -8.378 -4.012 1.00 10.00 O ATOM 0 H SER A 433 -5.241 -6.496 -4.140 1.00 10.00 H new ATOM 0 HA SER A 433 -7.457 -6.432 -5.861 1.00 10.00 H new ATOM 0 HB2 SER A 433 -7.574 -6.961 -2.872 1.00 10.00 H new ATOM 0 HB3 SER A 433 -8.544 -7.688 -4.137 1.00 10.00 H new ATOM 0 HG SER A 433 -5.995 -8.353 -3.249 1.00 10.00 H new ATOM 344 N GLU A 434 -9.170 -4.781 -5.021 1.00 10.00 N ATOM 345 CA GLU A 434 -10.027 -3.641 -4.718 1.00 10.00 C ATOM 346 C GLU A 434 -10.143 -3.460 -3.209 1.00 10.00 C ATOM 347 O GLU A 434 -10.323 -2.347 -2.715 1.00 10.00 O ATOM 348 CB GLU A 434 -11.415 -3.837 -5.332 1.00 10.00 C ATOM 349 CG GLU A 434 -12.103 -5.117 -4.884 1.00 10.00 C ATOM 350 CD GLU A 434 -12.969 -5.723 -5.969 1.00 10.00 C ATOM 351 OE1 GLU A 434 -13.729 -4.969 -6.613 1.00 10.00 O ATOM 352 OE2 GLU A 434 -12.889 -6.952 -6.177 1.00 10.00 O ATOM 0 H GLU A 434 -9.564 -5.439 -5.693 1.00 10.00 H new ATOM 0 HA GLU A 434 -9.580 -2.745 -5.149 1.00 10.00 H new ATOM 0 HB2 GLU A 434 -12.043 -2.986 -5.069 1.00 10.00 H new ATOM 0 HB3 GLU A 434 -11.325 -3.844 -6.418 1.00 10.00 H new ATOM 0 HG2 GLU A 434 -11.349 -5.843 -4.578 1.00 10.00 H new ATOM 0 HG3 GLU A 434 -12.717 -4.908 -4.008 1.00 10.00 H new ATOM 359 N GLN A 435 -10.022 -4.569 -2.484 1.00 10.00 N ATOM 360 CA GLN A 435 -10.095 -4.548 -1.032 1.00 10.00 C ATOM 361 C GLN A 435 -8.720 -4.278 -0.437 1.00 10.00 C ATOM 362 O GLN A 435 -8.603 -3.660 0.622 1.00 10.00 O ATOM 363 CB GLN A 435 -10.641 -5.875 -0.506 1.00 10.00 C ATOM 364 CG GLN A 435 -11.422 -5.740 0.791 1.00 10.00 C ATOM 365 CD GLN A 435 -12.916 -5.607 0.562 1.00 10.00 C ATOM 366 OE1 GLN A 435 -13.721 -6.187 1.292 1.00 10.00 O ATOM 367 NE2 GLN A 435 -13.294 -4.844 -0.457 1.00 10.00 N ATOM 0 H GLN A 435 -9.872 -5.495 -2.884 1.00 10.00 H new ATOM 0 HA GLN A 435 -10.772 -3.747 -0.733 1.00 10.00 H new ATOM 0 HB2 GLN A 435 -11.286 -6.319 -1.264 1.00 10.00 H new ATOM 0 HB3 GLN A 435 -9.811 -6.564 -0.350 1.00 10.00 H new ATOM 0 HG2 GLN A 435 -11.231 -6.611 1.418 1.00 10.00 H new ATOM 0 HG3 GLN A 435 -11.063 -4.868 1.338 1.00 10.00 H new ATOM 0 HE21 GLN A 435 -12.593 -4.382 -1.036 1.00 10.00 H new ATOM 0 HE22 GLN A 435 -14.286 -4.720 -0.661 1.00 10.00 H new ATOM 376 N GLU A 436 -7.676 -4.727 -1.131 1.00 10.00 N ATOM 377 CA GLU A 436 -6.321 -4.516 -0.674 1.00 10.00 C ATOM 378 C GLU A 436 -5.937 -3.067 -0.910 1.00 10.00 C ATOM 379 O GLU A 436 -5.578 -2.348 0.024 1.00 10.00 O ATOM 380 CB GLU A 436 -5.385 -5.481 -1.399 1.00 10.00 C ATOM 381 CG GLU A 436 -4.730 -6.492 -0.471 1.00 10.00 C ATOM 382 CD GLU A 436 -4.717 -7.894 -1.050 1.00 10.00 C ATOM 383 OE1 GLU A 436 -4.774 -8.024 -2.292 1.00 10.00 O ATOM 384 OE2 GLU A 436 -4.651 -8.861 -0.263 1.00 10.00 O ATOM 0 H GLU A 436 -7.752 -5.238 -2.011 1.00 10.00 H new ATOM 0 HA GLU A 436 -6.240 -4.716 0.394 1.00 10.00 H new ATOM 0 HB2 GLU A 436 -5.946 -6.013 -2.167 1.00 10.00 H new ATOM 0 HB3 GLU A 436 -4.609 -4.910 -1.909 1.00 10.00 H new ATOM 0 HG2 GLU A 436 -3.707 -6.179 -0.264 1.00 10.00 H new ATOM 0 HG3 GLU A 436 -5.260 -6.501 0.482 1.00 10.00 H new ATOM 391 N LYS A 437 -6.064 -2.626 -2.153 1.00 10.00 N ATOM 392 CA LYS A 437 -5.780 -1.240 -2.506 1.00 10.00 C ATOM 393 C LYS A 437 -6.581 -0.311 -1.602 1.00 10.00 C ATOM 394 O LYS A 437 -6.236 0.852 -1.427 1.00 10.00 O ATOM 395 CB LYS A 437 -6.140 -0.989 -3.971 1.00 10.00 C ATOM 396 CG LYS A 437 -5.536 0.286 -4.537 1.00 10.00 C ATOM 397 CD LYS A 437 -6.587 1.160 -5.206 1.00 10.00 C ATOM 398 CE LYS A 437 -7.731 1.494 -4.260 1.00 10.00 C ATOM 399 NZ LYS A 437 -8.918 0.625 -4.491 1.00 10.00 N ATOM 0 H LYS A 437 -6.362 -3.208 -2.936 1.00 10.00 H new ATOM 0 HA LYS A 437 -4.717 -1.043 -2.370 1.00 10.00 H new ATOM 0 HB2 LYS A 437 -5.805 -1.836 -4.569 1.00 10.00 H new ATOM 0 HB3 LYS A 437 -7.225 -0.941 -4.067 1.00 10.00 H new ATOM 0 HG2 LYS A 437 -5.053 0.846 -3.736 1.00 10.00 H new ATOM 0 HG3 LYS A 437 -4.761 0.031 -5.260 1.00 10.00 H new ATOM 0 HD2 LYS A 437 -6.123 2.083 -5.555 1.00 10.00 H new ATOM 0 HD3 LYS A 437 -6.980 0.648 -6.084 1.00 10.00 H new ATOM 0 HE2 LYS A 437 -7.394 1.381 -3.230 1.00 10.00 H new ATOM 0 HE3 LYS A 437 -8.015 2.538 -4.390 1.00 10.00 H new ATOM 0 HZ1 LYS A 437 -9.722 1.210 -4.797 1.00 10.00 H new ATOM 0 HZ2 LYS A 437 -8.698 -0.074 -5.229 1.00 10.00 H new ATOM 0 HZ3 LYS A 437 -9.164 0.132 -3.609 1.00 10.00 H new ATOM 413 N GLU A 438 -7.648 -0.849 -1.021 1.00 10.00 N ATOM 414 CA GLU A 438 -8.501 -0.081 -0.128 1.00 10.00 C ATOM 415 C GLU A 438 -7.740 0.375 1.110 1.00 10.00 C ATOM 416 O GLU A 438 -8.096 1.378 1.724 1.00 10.00 O ATOM 417 CB GLU A 438 -9.713 -0.915 0.289 1.00 10.00 C ATOM 418 CG GLU A 438 -10.956 -0.086 0.565 1.00 10.00 C ATOM 419 CD GLU A 438 -12.055 -0.889 1.236 1.00 10.00 C ATOM 420 OE1 GLU A 438 -11.886 -1.254 2.417 1.00 10.00 O ATOM 421 OE2 GLU A 438 -13.083 -1.151 0.577 1.00 10.00 O ATOM 0 H GLU A 438 -7.941 -1.817 -1.154 1.00 10.00 H new ATOM 0 HA GLU A 438 -8.837 0.805 -0.667 1.00 10.00 H new ATOM 0 HB2 GLU A 438 -9.935 -1.637 -0.497 1.00 10.00 H new ATOM 0 HB3 GLU A 438 -9.461 -1.485 1.183 1.00 10.00 H new ATOM 0 HG2 GLU A 438 -10.691 0.760 1.199 1.00 10.00 H new ATOM 0 HG3 GLU A 438 -11.331 0.323 -0.373 1.00 10.00 H new ATOM 428 N THR A 439 -6.702 -0.365 1.489 1.00 10.00 N ATOM 429 CA THR A 439 -5.923 -0.009 2.673 1.00 10.00 C ATOM 430 C THR A 439 -4.770 0.935 2.336 1.00 10.00 C ATOM 431 O THR A 439 -4.548 1.923 3.035 1.00 10.00 O ATOM 432 CB THR A 439 -5.389 -1.268 3.357 1.00 10.00 C ATOM 433 OG1 THR A 439 -6.455 -2.130 3.718 1.00 10.00 O ATOM 434 CG2 THR A 439 -4.590 -0.979 4.612 1.00 10.00 C ATOM 0 H THR A 439 -6.383 -1.203 1.003 1.00 10.00 H new ATOM 0 HA THR A 439 -6.591 0.516 3.356 1.00 10.00 H new ATOM 0 HB THR A 439 -4.729 -1.735 2.626 1.00 10.00 H new ATOM 0 HG1 THR A 439 -6.666 -2.010 4.667 1.00 10.00 H new ATOM 0 HG21 THR A 439 -4.242 -1.916 5.046 1.00 10.00 H new ATOM 0 HG22 THR A 439 -3.733 -0.354 4.362 1.00 10.00 H new ATOM 0 HG23 THR A 439 -5.220 -0.458 5.333 1.00 10.00 H new ATOM 442 N PHE A 440 -4.038 0.629 1.273 1.00 10.00 N ATOM 443 CA PHE A 440 -2.915 1.455 0.861 1.00 10.00 C ATOM 444 C PHE A 440 -3.412 2.711 0.159 1.00 10.00 C ATOM 445 O PHE A 440 -2.826 3.785 0.300 1.00 10.00 O ATOM 446 CB PHE A 440 -1.982 0.663 -0.060 1.00 10.00 C ATOM 447 CG PHE A 440 -2.382 -0.762 -0.249 1.00 10.00 C ATOM 448 CD1 PHE A 440 -2.367 -1.665 0.799 1.00 10.00 C ATOM 449 CD2 PHE A 440 -2.792 -1.188 -1.484 1.00 10.00 C ATOM 450 CE1 PHE A 440 -2.753 -2.971 0.594 1.00 10.00 C ATOM 451 CE2 PHE A 440 -3.181 -2.482 -1.692 1.00 10.00 C ATOM 452 CZ PHE A 440 -3.158 -3.369 -0.660 1.00 10.00 C ATOM 0 H PHE A 440 -4.203 -0.185 0.682 1.00 10.00 H new ATOM 0 HA PHE A 440 -2.357 1.752 1.749 1.00 10.00 H new ATOM 0 HB2 PHE A 440 -1.948 1.152 -1.033 1.00 10.00 H new ATOM 0 HB3 PHE A 440 -0.972 0.695 0.348 1.00 10.00 H new ATOM 0 HD1 PHE A 440 -2.052 -1.345 1.781 1.00 10.00 H new ATOM 0 HD2 PHE A 440 -2.808 -0.490 -2.308 1.00 10.00 H new ATOM 0 HE1 PHE A 440 -2.738 -3.677 1.411 1.00 10.00 H new ATOM 0 HE2 PHE A 440 -3.505 -2.799 -2.672 1.00 10.00 H new ATOM 0 HZ PHE A 440 -3.460 -4.393 -0.826 1.00 10.00 H new ATOM 462 N ARG A 441 -4.506 2.575 -0.587 1.00 10.00 N ATOM 463 CA ARG A 441 -5.081 3.712 -1.292 1.00 10.00 C ATOM 464 C ARG A 441 -5.822 4.620 -0.316 1.00 10.00 C ATOM 465 O ARG A 441 -5.961 5.819 -0.555 1.00 10.00 O ATOM 466 CB ARG A 441 -6.039 3.257 -2.393 1.00 10.00 C ATOM 467 CG ARG A 441 -6.454 4.378 -3.333 1.00 10.00 C ATOM 468 CD ARG A 441 -7.684 5.110 -2.818 1.00 10.00 C ATOM 469 NE ARG A 441 -8.891 4.742 -3.556 1.00 10.00 N ATOM 470 CZ ARG A 441 -10.126 4.925 -3.096 1.00 10.00 C ATOM 471 NH1 ARG A 441 -10.324 5.470 -1.902 1.00 10.00 N ATOM 472 NH2 ARG A 441 -11.168 4.561 -3.831 1.00 10.00 N ATOM 0 H ARG A 441 -5.007 1.696 -0.717 1.00 10.00 H new ATOM 0 HA ARG A 441 -4.262 4.264 -1.753 1.00 10.00 H new ATOM 0 HB2 ARG A 441 -5.565 2.464 -2.972 1.00 10.00 H new ATOM 0 HB3 ARG A 441 -6.930 2.828 -1.935 1.00 10.00 H new ATOM 0 HG2 ARG A 441 -5.630 5.083 -3.446 1.00 10.00 H new ATOM 0 HG3 ARG A 441 -6.661 3.968 -4.321 1.00 10.00 H new ATOM 0 HD2 ARG A 441 -7.823 4.885 -1.761 1.00 10.00 H new ATOM 0 HD3 ARG A 441 -7.525 6.185 -2.897 1.00 10.00 H new ATOM 0 HE ARG A 441 -8.780 4.320 -4.478 1.00 10.00 H new ATOM 0 HH11 ARG A 441 -9.527 5.751 -1.331 1.00 10.00 H new ATOM 0 HH12 ARG A 441 -11.273 5.608 -1.555 1.00 10.00 H new ATOM 0 HH21 ARG A 441 -11.023 4.141 -4.749 1.00 10.00 H new ATOM 0 HH22 ARG A 441 -12.115 4.701 -3.478 1.00 10.00 H new ATOM 486 N GLU A 442 -6.297 4.039 0.790 1.00 10.00 N ATOM 487 CA GLU A 442 -7.020 4.807 1.795 1.00 10.00 C ATOM 488 C GLU A 442 -6.049 5.581 2.670 1.00 10.00 C ATOM 489 O GLU A 442 -6.307 6.727 3.033 1.00 10.00 O ATOM 490 CB GLU A 442 -7.892 3.891 2.657 1.00 10.00 C ATOM 491 CG GLU A 442 -8.599 4.612 3.796 1.00 10.00 C ATOM 492 CD GLU A 442 -8.339 3.970 5.145 1.00 10.00 C ATOM 493 OE1 GLU A 442 -8.102 2.743 5.183 1.00 10.00 O ATOM 494 OE2 GLU A 442 -8.371 4.693 6.163 1.00 10.00 O ATOM 0 H GLU A 442 -6.193 3.048 1.007 1.00 10.00 H new ATOM 0 HA GLU A 442 -7.669 5.514 1.279 1.00 10.00 H new ATOM 0 HB2 GLU A 442 -8.638 3.413 2.023 1.00 10.00 H new ATOM 0 HB3 GLU A 442 -7.270 3.097 3.072 1.00 10.00 H new ATOM 0 HG2 GLU A 442 -8.270 5.651 3.823 1.00 10.00 H new ATOM 0 HG3 GLU A 442 -9.672 4.622 3.604 1.00 10.00 H new ATOM 501 N LYS A 443 -4.922 4.957 2.989 1.00 10.00 N ATOM 502 CA LYS A 443 -3.914 5.605 3.800 1.00 10.00 C ATOM 503 C LYS A 443 -3.219 6.670 2.971 1.00 10.00 C ATOM 504 O LYS A 443 -3.007 7.789 3.427 1.00 10.00 O ATOM 505 CB LYS A 443 -2.902 4.581 4.316 1.00 10.00 C ATOM 506 CG LYS A 443 -3.444 3.692 5.426 1.00 10.00 C ATOM 507 CD LYS A 443 -4.016 4.510 6.573 1.00 10.00 C ATOM 508 CE LYS A 443 -5.530 4.390 6.645 1.00 10.00 C ATOM 509 NZ LYS A 443 -5.961 3.380 7.649 1.00 10.00 N ATOM 0 H LYS A 443 -4.689 4.008 2.697 1.00 10.00 H new ATOM 0 HA LYS A 443 -4.389 6.072 4.663 1.00 10.00 H new ATOM 0 HB2 LYS A 443 -2.578 3.954 3.486 1.00 10.00 H new ATOM 0 HB3 LYS A 443 -2.020 5.107 4.682 1.00 10.00 H new ATOM 0 HG2 LYS A 443 -4.218 3.039 5.024 1.00 10.00 H new ATOM 0 HG3 LYS A 443 -2.647 3.049 5.799 1.00 10.00 H new ATOM 0 HD2 LYS A 443 -3.579 4.175 7.513 1.00 10.00 H new ATOM 0 HD3 LYS A 443 -3.739 5.557 6.448 1.00 10.00 H new ATOM 0 HE2 LYS A 443 -5.959 5.359 6.898 1.00 10.00 H new ATOM 0 HE3 LYS A 443 -5.919 4.116 5.664 1.00 10.00 H new ATOM 0 HZ1 LYS A 443 -7.000 3.329 7.667 1.00 10.00 H new ATOM 0 HZ2 LYS A 443 -5.573 2.449 7.394 1.00 10.00 H new ATOM 0 HZ3 LYS A 443 -5.612 3.654 8.589 1.00 10.00 H new ATOM 523 N PHE A 444 -2.899 6.321 1.730 1.00 10.00 N ATOM 524 CA PHE A 444 -2.263 7.254 0.820 1.00 10.00 C ATOM 525 C PHE A 444 -3.220 8.397 0.546 1.00 10.00 C ATOM 526 O PHE A 444 -2.806 9.534 0.324 1.00 10.00 O ATOM 527 CB PHE A 444 -1.851 6.532 -0.462 1.00 10.00 C ATOM 528 CG PHE A 444 -1.237 7.424 -1.499 1.00 10.00 C ATOM 529 CD1 PHE A 444 -2.003 8.354 -2.181 1.00 10.00 C ATOM 530 CD2 PHE A 444 0.112 7.324 -1.795 1.00 10.00 C ATOM 531 CE1 PHE A 444 -1.436 9.170 -3.141 1.00 10.00 C ATOM 532 CE2 PHE A 444 0.686 8.138 -2.754 1.00 10.00 C ATOM 533 CZ PHE A 444 -0.089 9.062 -3.428 1.00 10.00 C ATOM 0 H PHE A 444 -3.072 5.397 1.335 1.00 10.00 H new ATOM 0 HA PHE A 444 -1.356 7.664 1.265 1.00 10.00 H new ATOM 0 HB2 PHE A 444 -1.141 5.744 -0.210 1.00 10.00 H new ATOM 0 HB3 PHE A 444 -2.728 6.046 -0.890 1.00 10.00 H new ATOM 0 HD1 PHE A 444 -3.056 8.443 -1.960 1.00 10.00 H new ATOM 0 HD2 PHE A 444 0.722 6.603 -1.271 1.00 10.00 H new ATOM 0 HE1 PHE A 444 -2.045 9.891 -3.666 1.00 10.00 H new ATOM 0 HE2 PHE A 444 1.739 8.052 -2.976 1.00 10.00 H new ATOM 0 HZ PHE A 444 0.357 9.699 -4.178 1.00 10.00 H new ATOM 543 N MET A 445 -4.510 8.091 0.633 1.00 10.00 N ATOM 544 CA MET A 445 -5.533 9.099 0.468 1.00 10.00 C ATOM 545 C MET A 445 -5.658 9.861 1.783 1.00 10.00 C ATOM 546 O MET A 445 -5.967 11.052 1.812 1.00 10.00 O ATOM 547 CB MET A 445 -6.871 8.463 0.085 1.00 10.00 C ATOM 548 CG MET A 445 -7.034 8.240 -1.409 1.00 10.00 C ATOM 549 SD MET A 445 -7.270 9.777 -2.320 1.00 10.00 S ATOM 550 CE MET A 445 -6.053 9.591 -3.621 1.00 10.00 C ATOM 0 H MET A 445 -4.865 7.152 0.817 1.00 10.00 H new ATOM 0 HA MET A 445 -5.257 9.779 -0.338 1.00 10.00 H new ATOM 0 HB2 MET A 445 -6.970 7.507 0.599 1.00 10.00 H new ATOM 0 HB3 MET A 445 -7.681 9.100 0.439 1.00 10.00 H new ATOM 0 HG2 MET A 445 -6.153 7.726 -1.794 1.00 10.00 H new ATOM 0 HG3 MET A 445 -7.887 7.584 -1.583 1.00 10.00 H new ATOM 0 HE1 MET A 445 -6.078 10.466 -4.270 1.00 10.00 H new ATOM 0 HE2 MET A 445 -5.061 9.494 -3.180 1.00 10.00 H new ATOM 0 HE3 MET A 445 -6.279 8.699 -4.206 1.00 10.00 H new ATOM 560 N GLN A 446 -5.373 9.142 2.871 1.00 10.00 N ATOM 561 CA GLN A 446 -5.398 9.696 4.217 1.00 10.00 C ATOM 562 C GLN A 446 -4.231 10.649 4.402 1.00 10.00 C ATOM 563 O GLN A 446 -4.346 11.696 5.040 1.00 10.00 O ATOM 564 CB GLN A 446 -5.276 8.559 5.238 1.00 10.00 C ATOM 565 CG GLN A 446 -5.695 8.951 6.645 1.00 10.00 C ATOM 566 CD GLN A 446 -6.409 7.827 7.370 1.00 10.00 C ATOM 567 OE1 GLN A 446 -6.061 7.482 8.500 1.00 10.00 O ATOM 568 NE2 GLN A 446 -7.414 7.248 6.723 1.00 10.00 N ATOM 0 H GLN A 446 -5.118 8.155 2.838 1.00 10.00 H new ATOM 0 HA GLN A 446 -6.336 10.232 4.365 1.00 10.00 H new ATOM 0 HB2 GLN A 446 -5.887 7.719 4.908 1.00 10.00 H new ATOM 0 HB3 GLN A 446 -4.243 8.212 5.260 1.00 10.00 H new ATOM 0 HG2 GLN A 446 -4.814 9.245 7.215 1.00 10.00 H new ATOM 0 HG3 GLN A 446 -6.349 9.822 6.597 1.00 10.00 H new ATOM 0 HE21 GLN A 446 -7.669 7.566 5.788 1.00 10.00 H new ATOM 0 HE22 GLN A 446 -7.931 6.486 7.161 1.00 10.00 H new ATOM 577 N HIS A 447 -3.100 10.248 3.844 1.00 10.00 N ATOM 578 CA HIS A 447 -1.870 11.011 3.927 1.00 10.00 C ATOM 579 C HIS A 447 -1.500 11.568 2.554 1.00 10.00 C ATOM 580 O HIS A 447 -1.114 10.815 1.662 1.00 10.00 O ATOM 581 CB HIS A 447 -0.759 10.104 4.468 1.00 10.00 C ATOM 582 CG HIS A 447 -1.229 9.217 5.585 1.00 10.00 C ATOM 583 ND1 HIS A 447 -1.478 9.692 6.855 1.00 10.00 N ATOM 584 CD2 HIS A 447 -1.535 7.889 5.619 1.00 10.00 C ATOM 585 CE1 HIS A 447 -1.912 8.706 7.617 1.00 10.00 C ATOM 586 NE2 HIS A 447 -1.958 7.604 6.893 1.00 10.00 N ATOM 0 H HIS A 447 -3.012 9.378 3.318 1.00 10.00 H new ATOM 0 HA HIS A 447 -2.003 11.855 4.603 1.00 10.00 H new ATOM 0 HB2 HIS A 447 -0.372 9.487 3.657 1.00 10.00 H new ATOM 0 HB3 HIS A 447 0.068 10.720 4.822 1.00 10.00 H new ATOM 0 HD1 HIS A 447 -1.347 10.657 7.159 1.00 10.00 H new ATOM 0 HD2 HIS A 447 -1.459 7.192 4.798 1.00 10.00 H new ATOM 0 HE1 HIS A 447 -2.184 8.787 8.659 1.00 10.00 H new ATOM 595 N PRO A 448 -1.630 12.898 2.363 1.00 10.00 N ATOM 596 CA PRO A 448 -1.325 13.562 1.091 1.00 10.00 C ATOM 597 C PRO A 448 -0.104 12.983 0.384 1.00 10.00 C ATOM 598 O PRO A 448 1.008 13.489 0.530 1.00 10.00 O ATOM 599 CB PRO A 448 -1.064 15.000 1.524 1.00 10.00 C ATOM 600 CG PRO A 448 -1.967 15.206 2.692 1.00 10.00 C ATOM 601 CD PRO A 448 -2.100 13.866 3.376 1.00 10.00 C ATOM 0 HA PRO A 448 -2.130 13.445 0.366 1.00 10.00 H new ATOM 0 HB2 PRO A 448 -0.020 15.149 1.798 1.00 10.00 H new ATOM 0 HB3 PRO A 448 -1.286 15.703 0.721 1.00 10.00 H new ATOM 0 HG2 PRO A 448 -1.555 15.950 3.374 1.00 10.00 H new ATOM 0 HG3 PRO A 448 -2.941 15.574 2.369 1.00 10.00 H new ATOM 0 HD2 PRO A 448 -1.497 13.819 4.283 1.00 10.00 H new ATOM 0 HD3 PRO A 448 -3.131 13.668 3.669 1.00 10.00 H new ATOM 609 N LYS A 449 -0.329 11.919 -0.389 1.00 10.00 N ATOM 610 CA LYS A 449 0.739 11.255 -1.134 1.00 10.00 C ATOM 611 C LYS A 449 2.034 11.200 -0.330 1.00 10.00 C ATOM 612 O LYS A 449 3.082 11.659 -0.788 1.00 10.00 O ATOM 613 CB LYS A 449 0.980 11.971 -2.465 1.00 10.00 C ATOM 614 CG LYS A 449 -0.299 12.316 -3.210 1.00 10.00 C ATOM 615 CD LYS A 449 -0.111 12.213 -4.715 1.00 10.00 C ATOM 616 CE LYS A 449 -1.362 11.681 -5.396 1.00 10.00 C ATOM 617 NZ LYS A 449 -1.493 12.186 -6.791 1.00 10.00 N ATOM 0 H LYS A 449 -1.249 11.497 -0.515 1.00 10.00 H new ATOM 0 HA LYS A 449 0.420 10.231 -1.327 1.00 10.00 H new ATOM 0 HB2 LYS A 449 1.541 12.887 -2.279 1.00 10.00 H new ATOM 0 HB3 LYS A 449 1.602 11.340 -3.100 1.00 10.00 H new ATOM 0 HG2 LYS A 449 -1.097 11.644 -2.895 1.00 10.00 H new ATOM 0 HG3 LYS A 449 -0.612 13.327 -2.950 1.00 10.00 H new ATOM 0 HD2 LYS A 449 0.136 13.194 -5.120 1.00 10.00 H new ATOM 0 HD3 LYS A 449 0.731 11.556 -4.934 1.00 10.00 H new ATOM 0 HE2 LYS A 449 -1.335 10.591 -5.406 1.00 10.00 H new ATOM 0 HE3 LYS A 449 -2.240 11.973 -4.820 1.00 10.00 H new ATOM 0 HZ1 LYS A 449 -2.358 11.800 -7.220 1.00 10.00 H new ATOM 0 HZ2 LYS A 449 -1.545 13.225 -6.781 1.00 10.00 H new ATOM 0 HZ3 LYS A 449 -0.667 11.886 -7.348 1.00 10.00 H new ATOM 631 N ASN A 450 1.960 10.643 0.875 1.00 10.00 N ATOM 632 CA ASN A 450 3.121 10.539 1.731 1.00 10.00 C ATOM 633 C ASN A 450 3.820 9.197 1.517 1.00 10.00 C ATOM 634 O ASN A 450 5.043 9.139 1.389 1.00 10.00 O ATOM 635 CB ASN A 450 2.684 10.729 3.192 1.00 10.00 C ATOM 636 CG ASN A 450 3.411 9.830 4.166 1.00 10.00 C ATOM 637 OD1 ASN A 450 4.641 9.804 4.209 1.00 10.00 O ATOM 638 ND2 ASN A 450 2.651 9.084 4.956 1.00 10.00 N ATOM 0 H ASN A 450 1.104 10.258 1.275 1.00 10.00 H new ATOM 0 HA ASN A 450 3.840 11.319 1.481 1.00 10.00 H new ATOM 0 HB2 ASN A 450 2.848 11.768 3.479 1.00 10.00 H new ATOM 0 HB3 ASN A 450 1.613 10.542 3.269 1.00 10.00 H new ATOM 0 HD21 ASN A 450 3.083 8.456 5.634 1.00 10.00 H new ATOM 0 HD22 ASN A 450 1.635 9.138 4.886 1.00 10.00 H new ATOM 645 N PHE A 451 3.030 8.128 1.472 1.00 10.00 N ATOM 646 CA PHE A 451 3.555 6.775 1.269 1.00 10.00 C ATOM 647 C PHE A 451 4.372 6.304 2.472 1.00 10.00 C ATOM 648 O PHE A 451 4.258 5.157 2.896 1.00 10.00 O ATOM 649 CB PHE A 451 4.409 6.702 -0.004 1.00 10.00 C ATOM 650 CG PHE A 451 3.678 6.173 -1.212 1.00 10.00 C ATOM 651 CD1 PHE A 451 2.719 5.178 -1.089 1.00 10.00 C ATOM 652 CD2 PHE A 451 3.952 6.676 -2.475 1.00 10.00 C ATOM 653 CE1 PHE A 451 2.050 4.699 -2.197 1.00 10.00 C ATOM 654 CE2 PHE A 451 3.286 6.198 -3.588 1.00 10.00 C ATOM 655 CZ PHE A 451 2.333 5.209 -3.448 1.00 10.00 C ATOM 0 H PHE A 451 2.016 8.170 1.574 1.00 10.00 H new ATOM 0 HA PHE A 451 2.698 6.111 1.157 1.00 10.00 H new ATOM 0 HB2 PHE A 451 4.788 7.698 -0.231 1.00 10.00 H new ATOM 0 HB3 PHE A 451 5.274 6.068 0.189 1.00 10.00 H new ATOM 0 HD1 PHE A 451 2.493 4.773 -0.114 1.00 10.00 H new ATOM 0 HD2 PHE A 451 4.695 7.451 -2.590 1.00 10.00 H new ATOM 0 HE1 PHE A 451 1.305 3.925 -2.085 1.00 10.00 H new ATOM 0 HE2 PHE A 451 3.511 6.598 -4.566 1.00 10.00 H new ATOM 0 HZ PHE A 451 1.810 4.835 -4.316 1.00 10.00 H new ATOM 665 N GLY A 452 5.192 7.197 3.022 1.00 10.00 N ATOM 666 CA GLY A 452 6.013 6.858 4.172 1.00 10.00 C ATOM 667 C GLY A 452 5.226 6.136 5.244 1.00 10.00 C ATOM 668 O GLY A 452 5.780 5.346 6.006 1.00 10.00 O ATOM 0 H GLY A 452 5.302 8.155 2.689 1.00 10.00 H new ATOM 0 HA2 GLY A 452 6.845 6.231 3.850 1.00 10.00 H new ATOM 0 HA3 GLY A 452 6.443 7.768 4.590 1.00 10.00 H new ATOM 672 N LEU A 453 3.924 6.393 5.281 1.00 10.00 N ATOM 673 CA LEU A 453 3.049 5.746 6.245 1.00 10.00 C ATOM 674 C LEU A 453 2.543 4.441 5.666 1.00 10.00 C ATOM 675 O LEU A 453 2.583 3.396 6.316 1.00 10.00 O ATOM 676 CB LEU A 453 1.867 6.642 6.610 1.00 10.00 C ATOM 677 CG LEU A 453 0.870 5.999 7.570 1.00 10.00 C ATOM 678 CD1 LEU A 453 0.294 7.033 8.522 1.00 10.00 C ATOM 679 CD2 LEU A 453 -0.233 5.283 6.800 1.00 10.00 C ATOM 0 H LEU A 453 3.453 7.045 4.654 1.00 10.00 H new ATOM 0 HA LEU A 453 3.619 5.554 7.154 1.00 10.00 H new ATOM 0 HB2 LEU A 453 2.246 7.560 7.058 1.00 10.00 H new ATOM 0 HB3 LEU A 453 1.344 6.925 5.697 1.00 10.00 H new ATOM 0 HG LEU A 453 1.399 5.256 8.167 1.00 10.00 H new ATOM 0 HD11 LEU A 453 -0.414 6.552 9.197 1.00 10.00 H new ATOM 0 HD12 LEU A 453 1.100 7.482 9.102 1.00 10.00 H new ATOM 0 HD13 LEU A 453 -0.218 7.808 7.951 1.00 10.00 H new ATOM 0 HD21 LEU A 453 -0.933 4.831 7.503 1.00 10.00 H new ATOM 0 HD22 LEU A 453 -0.761 5.999 6.171 1.00 10.00 H new ATOM 0 HD23 LEU A 453 0.206 4.505 6.175 1.00 10.00 H new ATOM 691 N ILE A 454 2.089 4.506 4.422 1.00 10.00 N ATOM 692 CA ILE A 454 1.602 3.333 3.733 1.00 10.00 C ATOM 693 C ILE A 454 2.714 2.308 3.638 1.00 10.00 C ATOM 694 O ILE A 454 2.620 1.216 4.197 1.00 10.00 O ATOM 695 CB ILE A 454 1.083 3.715 2.340 1.00 10.00 C ATOM 696 CG1 ILE A 454 -0.275 4.368 2.497 1.00 10.00 C ATOM 697 CG2 ILE A 454 1.008 2.510 1.409 1.00 10.00 C ATOM 698 CD1 ILE A 454 -0.187 5.875 2.469 1.00 10.00 C ATOM 0 H ILE A 454 2.050 5.365 3.873 1.00 10.00 H new ATOM 0 HA ILE A 454 0.773 2.898 4.291 1.00 10.00 H new ATOM 0 HB ILE A 454 1.781 4.414 1.880 1.00 10.00 H new ATOM 0 HG12 ILE A 454 -0.934 4.029 1.698 1.00 10.00 H new ATOM 0 HG13 ILE A 454 -0.724 4.049 3.438 1.00 10.00 H new ATOM 0 HG21 ILE A 454 0.636 2.826 0.434 1.00 10.00 H new ATOM 0 HG22 ILE A 454 2.001 2.076 1.295 1.00 10.00 H new ATOM 0 HG23 ILE A 454 0.333 1.765 1.831 1.00 10.00 H new ATOM 0 HD11 ILE A 454 -1.184 6.300 2.585 1.00 10.00 H new ATOM 0 HD12 ILE A 454 0.450 6.217 3.284 1.00 10.00 H new ATOM 0 HD13 ILE A 454 0.236 6.197 1.518 1.00 10.00 H new ATOM 710 N ALA A 455 3.792 2.698 2.977 1.00 10.00 N ATOM 711 CA ALA A 455 4.963 1.846 2.847 1.00 10.00 C ATOM 712 C ALA A 455 5.487 1.447 4.226 1.00 10.00 C ATOM 713 O ALA A 455 6.327 0.556 4.345 1.00 10.00 O ATOM 714 CB ALA A 455 6.049 2.560 2.055 1.00 10.00 C ATOM 0 H ALA A 455 3.880 3.605 2.519 1.00 10.00 H new ATOM 0 HA ALA A 455 4.677 0.942 2.310 1.00 10.00 H new ATOM 0 HB1 ALA A 455 6.920 1.911 1.965 1.00 10.00 H new ATOM 0 HB2 ALA A 455 5.674 2.804 1.061 1.00 10.00 H new ATOM 0 HB3 ALA A 455 6.332 3.478 2.571 1.00 10.00 H new ATOM 720 N SER A 456 4.981 2.113 5.267 1.00 10.00 N ATOM 721 CA SER A 456 5.397 1.823 6.632 1.00 10.00 C ATOM 722 C SER A 456 4.501 0.759 7.258 1.00 10.00 C ATOM 723 O SER A 456 4.981 -0.119 7.975 1.00 10.00 O ATOM 724 CB SER A 456 5.379 3.097 7.482 1.00 10.00 C ATOM 725 OG SER A 456 5.229 2.795 8.859 1.00 10.00 O ATOM 0 H SER A 456 4.285 2.854 5.186 1.00 10.00 H new ATOM 0 HA SER A 456 6.417 1.439 6.600 1.00 10.00 H new ATOM 0 HB2 SER A 456 6.304 3.653 7.328 1.00 10.00 H new ATOM 0 HB3 SER A 456 4.562 3.742 7.158 1.00 10.00 H new ATOM 0 HG SER A 456 5.222 3.627 9.377 1.00 10.00 H new ATOM 731 N PHE A 457 3.198 0.832 6.986 1.00 10.00 N ATOM 732 CA PHE A 457 2.266 -0.146 7.535 1.00 10.00 C ATOM 733 C PHE A 457 2.244 -1.410 6.673 1.00 10.00 C ATOM 734 O PHE A 457 1.929 -2.496 7.160 1.00 10.00 O ATOM 735 CB PHE A 457 0.860 0.463 7.693 1.00 10.00 C ATOM 736 CG PHE A 457 -0.013 0.367 6.473 1.00 10.00 C ATOM 737 CD1 PHE A 457 -0.568 -0.845 6.094 1.00 10.00 C ATOM 738 CD2 PHE A 457 -0.287 1.494 5.709 1.00 10.00 C ATOM 739 CE1 PHE A 457 -1.370 -0.936 4.978 1.00 10.00 C ATOM 740 CE2 PHE A 457 -1.090 1.406 4.591 1.00 10.00 C ATOM 741 CZ PHE A 457 -1.630 0.192 4.224 1.00 10.00 C ATOM 0 H PHE A 457 2.771 1.548 6.398 1.00 10.00 H new ATOM 0 HA PHE A 457 2.608 -0.431 8.530 1.00 10.00 H new ATOM 0 HB2 PHE A 457 0.356 -0.034 8.522 1.00 10.00 H new ATOM 0 HB3 PHE A 457 0.964 1.513 7.966 1.00 10.00 H new ATOM 0 HD1 PHE A 457 -0.369 -1.729 6.681 1.00 10.00 H new ATOM 0 HD2 PHE A 457 0.132 2.448 5.993 1.00 10.00 H new ATOM 0 HE1 PHE A 457 -1.795 -1.887 4.693 1.00 10.00 H new ATOM 0 HE2 PHE A 457 -1.296 2.288 4.003 1.00 10.00 H new ATOM 0 HZ PHE A 457 -2.256 0.123 3.347 1.00 10.00 H new ATOM 751 N LEU A 458 2.607 -1.266 5.397 1.00 10.00 N ATOM 752 CA LEU A 458 2.656 -2.403 4.479 1.00 10.00 C ATOM 753 C LEU A 458 4.046 -2.515 3.852 1.00 10.00 C ATOM 754 O LEU A 458 4.192 -2.550 2.632 1.00 10.00 O ATOM 755 CB LEU A 458 1.580 -2.280 3.391 1.00 10.00 C ATOM 756 CG LEU A 458 1.400 -0.884 2.787 1.00 10.00 C ATOM 757 CD1 LEU A 458 2.699 -0.389 2.176 1.00 10.00 C ATOM 758 CD2 LEU A 458 0.294 -0.896 1.740 1.00 10.00 C ATOM 0 H LEU A 458 2.871 -0.374 4.977 1.00 10.00 H new ATOM 0 HA LEU A 458 2.454 -3.311 5.047 1.00 10.00 H new ATOM 0 HB2 LEU A 458 1.822 -2.975 2.587 1.00 10.00 H new ATOM 0 HB3 LEU A 458 0.626 -2.599 3.812 1.00 10.00 H new ATOM 0 HG LEU A 458 1.116 -0.201 3.588 1.00 10.00 H new ATOM 0 HD11 LEU A 458 2.547 0.604 1.753 1.00 10.00 H new ATOM 0 HD12 LEU A 458 3.469 -0.342 2.946 1.00 10.00 H new ATOM 0 HD13 LEU A 458 3.015 -1.074 1.389 1.00 10.00 H new ATOM 0 HD21 LEU A 458 0.179 0.104 1.321 1.00 10.00 H new ATOM 0 HD22 LEU A 458 0.553 -1.595 0.945 1.00 10.00 H new ATOM 0 HD23 LEU A 458 -0.643 -1.205 2.204 1.00 10.00 H new ATOM 770 N GLU A 459 5.060 -2.551 4.715 1.00 10.00 N ATOM 771 CA GLU A 459 6.471 -2.636 4.312 1.00 10.00 C ATOM 772 C GLU A 459 6.688 -3.338 2.968 1.00 10.00 C ATOM 773 O GLU A 459 7.445 -2.849 2.129 1.00 10.00 O ATOM 774 CB GLU A 459 7.275 -3.356 5.396 1.00 10.00 C ATOM 775 CG GLU A 459 7.579 -2.488 6.606 1.00 10.00 C ATOM 776 CD GLU A 459 8.787 -1.596 6.396 1.00 10.00 C ATOM 777 OE1 GLU A 459 8.655 -0.575 5.688 1.00 10.00 O ATOM 778 OE2 GLU A 459 9.865 -1.919 6.937 1.00 10.00 O ATOM 0 H GLU A 459 4.928 -2.522 5.726 1.00 10.00 H new ATOM 0 HA GLU A 459 6.816 -1.609 4.188 1.00 10.00 H new ATOM 0 HB2 GLU A 459 6.722 -4.237 5.721 1.00 10.00 H new ATOM 0 HB3 GLU A 459 8.213 -3.708 4.967 1.00 10.00 H new ATOM 0 HG2 GLU A 459 6.710 -1.870 6.832 1.00 10.00 H new ATOM 0 HG3 GLU A 459 7.750 -3.127 7.473 1.00 10.00 H new ATOM 785 N ARG A 460 6.044 -4.486 2.768 1.00 10.00 N ATOM 786 CA ARG A 460 6.198 -5.242 1.526 1.00 10.00 C ATOM 787 C ARG A 460 6.058 -4.336 0.305 1.00 10.00 C ATOM 788 O ARG A 460 6.634 -4.603 -0.749 1.00 10.00 O ATOM 789 CB ARG A 460 5.177 -6.380 1.462 1.00 10.00 C ATOM 790 CG ARG A 460 5.758 -7.738 1.826 1.00 10.00 C ATOM 791 CD ARG A 460 5.251 -8.222 3.174 1.00 10.00 C ATOM 792 NE ARG A 460 5.977 -9.403 3.639 1.00 10.00 N ATOM 793 CZ ARG A 460 5.510 -10.250 4.553 1.00 10.00 C ATOM 794 NH1 ARG A 460 4.318 -10.053 5.104 1.00 10.00 N ATOM 795 NH2 ARG A 460 6.236 -11.298 4.918 1.00 10.00 N ATOM 0 H ARG A 460 5.413 -4.912 3.447 1.00 10.00 H new ATOM 0 HA ARG A 460 7.201 -5.668 1.517 1.00 10.00 H new ATOM 0 HB2 ARG A 460 4.351 -6.155 2.136 1.00 10.00 H new ATOM 0 HB3 ARG A 460 4.762 -6.429 0.455 1.00 10.00 H new ATOM 0 HG2 ARG A 460 5.496 -8.464 1.056 1.00 10.00 H new ATOM 0 HG3 ARG A 460 6.846 -7.675 1.848 1.00 10.00 H new ATOM 0 HD2 ARG A 460 5.351 -7.422 3.908 1.00 10.00 H new ATOM 0 HD3 ARG A 460 4.189 -8.455 3.100 1.00 10.00 H new ATOM 0 HE ARG A 460 6.897 -9.589 3.239 1.00 10.00 H new ATOM 0 HH11 ARG A 460 3.755 -9.249 4.827 1.00 10.00 H new ATOM 0 HH12 ARG A 460 3.966 -10.706 5.804 1.00 10.00 H new ATOM 0 HH21 ARG A 460 7.152 -11.455 4.498 1.00 10.00 H new ATOM 0 HH22 ARG A 460 5.878 -11.947 5.619 1.00 10.00 H new ATOM 809 N LYS A 461 5.295 -3.260 0.459 1.00 10.00 N ATOM 810 CA LYS A 461 5.084 -2.307 -0.625 1.00 10.00 C ATOM 811 C LYS A 461 5.727 -0.964 -0.288 1.00 10.00 C ATOM 812 O LYS A 461 5.065 -0.053 0.209 1.00 10.00 O ATOM 813 CB LYS A 461 3.586 -2.116 -0.915 1.00 10.00 C ATOM 814 CG LYS A 461 2.660 -3.026 -0.109 1.00 10.00 C ATOM 815 CD LYS A 461 2.908 -4.508 -0.372 1.00 10.00 C ATOM 816 CE LYS A 461 3.411 -4.776 -1.784 1.00 10.00 C ATOM 817 NZ LYS A 461 2.475 -4.252 -2.818 1.00 10.00 N ATOM 0 H LYS A 461 4.811 -3.025 1.326 1.00 10.00 H new ATOM 0 HA LYS A 461 5.556 -2.712 -1.520 1.00 10.00 H new ATOM 0 HB2 LYS A 461 3.320 -1.078 -0.713 1.00 10.00 H new ATOM 0 HB3 LYS A 461 3.410 -2.289 -1.977 1.00 10.00 H new ATOM 0 HG2 LYS A 461 2.794 -2.823 0.954 1.00 10.00 H new ATOM 0 HG3 LYS A 461 1.624 -2.788 -0.351 1.00 10.00 H new ATOM 0 HD2 LYS A 461 3.636 -4.884 0.347 1.00 10.00 H new ATOM 0 HD3 LYS A 461 1.984 -5.062 -0.208 1.00 10.00 H new ATOM 0 HE2 LYS A 461 4.390 -4.315 -1.914 1.00 10.00 H new ATOM 0 HE3 LYS A 461 3.543 -5.849 -1.924 1.00 10.00 H new ATOM 0 HZ1 LYS A 461 3.013 -3.967 -3.661 1.00 10.00 H new ATOM 0 HZ2 LYS A 461 1.793 -4.994 -3.077 1.00 10.00 H new ATOM 0 HZ3 LYS A 461 1.964 -3.429 -2.439 1.00 10.00 H new ATOM 831 N THR A 462 7.025 -0.851 -0.559 1.00 10.00 N ATOM 832 CA THR A 462 7.767 0.378 -0.281 1.00 10.00 C ATOM 833 C THR A 462 7.103 1.585 -0.937 1.00 10.00 C ATOM 834 O THR A 462 6.158 1.442 -1.712 1.00 10.00 O ATOM 835 CB THR A 462 9.213 0.246 -0.768 1.00 10.00 C ATOM 836 OG1 THR A 462 9.335 -0.815 -1.699 1.00 10.00 O ATOM 837 CG2 THR A 462 10.198 -0.011 0.352 1.00 10.00 C ATOM 0 H THR A 462 7.586 -1.596 -0.971 1.00 10.00 H new ATOM 0 HA THR A 462 7.765 0.534 0.798 1.00 10.00 H new ATOM 0 HB THR A 462 9.452 1.204 -1.229 1.00 10.00 H new ATOM 0 HG1 THR A 462 10.266 -0.882 -1.999 1.00 10.00 H new ATOM 0 HG21 THR A 462 11.204 -0.094 -0.060 1.00 10.00 H new ATOM 0 HG22 THR A 462 10.164 0.815 1.063 1.00 10.00 H new ATOM 0 HG23 THR A 462 9.936 -0.939 0.861 1.00 10.00 H new ATOM 845 N VAL A 463 7.606 2.773 -0.620 1.00 10.00 N ATOM 846 CA VAL A 463 7.066 4.009 -1.175 1.00 10.00 C ATOM 847 C VAL A 463 7.149 4.010 -2.697 1.00 10.00 C ATOM 848 O VAL A 463 6.129 4.045 -3.384 1.00 10.00 O ATOM 849 CB VAL A 463 7.816 5.241 -0.628 1.00 10.00 C ATOM 850 CG1 VAL A 463 7.231 6.530 -1.192 1.00 10.00 C ATOM 851 CG2 VAL A 463 7.784 5.252 0.894 1.00 10.00 C ATOM 0 H VAL A 463 8.389 2.906 0.020 1.00 10.00 H new ATOM 0 HA VAL A 463 6.020 4.064 -0.873 1.00 10.00 H new ATOM 0 HB VAL A 463 8.856 5.177 -0.949 1.00 10.00 H new ATOM 0 HG11 VAL A 463 7.777 7.384 -0.791 1.00 10.00 H new ATOM 0 HG12 VAL A 463 7.316 6.523 -2.279 1.00 10.00 H new ATOM 0 HG13 VAL A 463 6.181 6.607 -0.911 1.00 10.00 H new ATOM 0 HG21 VAL A 463 8.318 6.128 1.263 1.00 10.00 H new ATOM 0 HG22 VAL A 463 6.750 5.287 1.236 1.00 10.00 H new ATOM 0 HG23 VAL A 463 8.262 4.349 1.275 1.00 10.00 H new ATOM 861 N ALA A 464 8.370 3.971 -3.215 1.00 10.00 N ATOM 862 CA ALA A 464 8.588 3.968 -4.656 1.00 10.00 C ATOM 863 C ALA A 464 8.088 2.672 -5.290 1.00 10.00 C ATOM 864 O ALA A 464 7.973 2.576 -6.512 1.00 10.00 O ATOM 865 CB ALA A 464 10.063 4.174 -4.966 1.00 10.00 C ATOM 0 H ALA A 464 9.225 3.941 -2.659 1.00 10.00 H new ATOM 0 HA ALA A 464 8.017 4.792 -5.084 1.00 10.00 H new ATOM 0 HB1 ALA A 464 10.212 4.170 -6.046 1.00 10.00 H new ATOM 0 HB2 ALA A 464 10.390 5.130 -4.558 1.00 10.00 H new ATOM 0 HB3 ALA A 464 10.645 3.370 -4.516 1.00 10.00 H new ATOM 871 N GLU A 465 7.799 1.676 -4.457 1.00 10.00 N ATOM 872 CA GLU A 465 7.320 0.389 -4.946 1.00 10.00 C ATOM 873 C GLU A 465 5.798 0.292 -4.871 1.00 10.00 C ATOM 874 O GLU A 465 5.194 -0.548 -5.538 1.00 10.00 O ATOM 875 CB GLU A 465 7.950 -0.750 -4.144 1.00 10.00 C ATOM 876 CG GLU A 465 7.588 -2.132 -4.663 1.00 10.00 C ATOM 877 CD GLU A 465 8.045 -3.241 -3.736 1.00 10.00 C ATOM 878 OE1 GLU A 465 8.134 -2.995 -2.515 1.00 10.00 O ATOM 879 OE2 GLU A 465 8.315 -4.355 -4.232 1.00 10.00 O ATOM 0 H GLU A 465 7.888 1.736 -3.443 1.00 10.00 H new ATOM 0 HA GLU A 465 7.615 0.303 -5.992 1.00 10.00 H new ATOM 0 HB2 GLU A 465 9.034 -0.638 -4.159 1.00 10.00 H new ATOM 0 HB3 GLU A 465 7.636 -0.668 -3.104 1.00 10.00 H new ATOM 0 HG2 GLU A 465 6.508 -2.195 -4.794 1.00 10.00 H new ATOM 0 HG3 GLU A 465 8.038 -2.276 -5.645 1.00 10.00 H new ATOM 886 N CYS A 466 5.176 1.144 -4.055 1.00 10.00 N ATOM 887 CA CYS A 466 3.727 1.120 -3.915 1.00 10.00 C ATOM 888 C CYS A 466 3.056 1.917 -5.026 1.00 10.00 C ATOM 889 O CYS A 466 1.953 1.580 -5.457 1.00 10.00 O ATOM 890 CB CYS A 466 3.312 1.660 -2.546 1.00 10.00 C ATOM 891 SG CYS A 466 1.598 1.294 -2.098 1.00 10.00 S ATOM 0 H CYS A 466 5.649 1.849 -3.490 1.00 10.00 H new ATOM 0 HA CYS A 466 3.398 0.084 -3.996 1.00 10.00 H new ATOM 0 HB2 CYS A 466 3.972 1.241 -1.787 1.00 10.00 H new ATOM 0 HB3 CYS A 466 3.457 2.740 -2.534 1.00 10.00 H new ATOM 0 HG CYS A 466 1.262 0.134 -2.578 1.00 10.00 H new ATOM 897 N VAL A 467 3.729 2.961 -5.506 1.00 10.00 N ATOM 898 CA VAL A 467 3.185 3.774 -6.590 1.00 10.00 C ATOM 899 C VAL A 467 2.721 2.878 -7.728 1.00 10.00 C ATOM 900 O VAL A 467 1.805 3.219 -8.472 1.00 10.00 O ATOM 901 CB VAL A 467 4.222 4.776 -7.138 1.00 10.00 C ATOM 902 CG1 VAL A 467 5.523 4.066 -7.477 1.00 10.00 C ATOM 903 CG2 VAL A 467 3.674 5.508 -8.360 1.00 10.00 C ATOM 0 H VAL A 467 4.642 3.261 -5.165 1.00 10.00 H new ATOM 0 HA VAL A 467 2.346 4.337 -6.181 1.00 10.00 H new ATOM 0 HB VAL A 467 4.426 5.515 -6.363 1.00 10.00 H new ATOM 0 HG11 VAL A 467 6.242 4.789 -7.862 1.00 10.00 H new ATOM 0 HG12 VAL A 467 5.926 3.596 -6.580 1.00 10.00 H new ATOM 0 HG13 VAL A 467 5.335 3.303 -8.233 1.00 10.00 H new ATOM 0 HG21 VAL A 467 4.422 6.209 -8.730 1.00 10.00 H new ATOM 0 HG22 VAL A 467 3.437 4.785 -9.141 1.00 10.00 H new ATOM 0 HG23 VAL A 467 2.771 6.053 -8.083 1.00 10.00 H new ATOM 913 N LEU A 468 3.365 1.723 -7.851 1.00 10.00 N ATOM 914 CA LEU A 468 3.028 0.768 -8.891 1.00 10.00 C ATOM 915 C LEU A 468 1.529 0.482 -8.916 1.00 10.00 C ATOM 916 O LEU A 468 0.996 0.085 -9.941 1.00 10.00 O ATOM 917 CB LEU A 468 3.806 -0.534 -8.688 1.00 10.00 C ATOM 918 CG LEU A 468 5.140 -0.614 -9.431 1.00 10.00 C ATOM 919 CD1 LEU A 468 6.237 0.072 -8.632 1.00 10.00 C ATOM 920 CD2 LEU A 468 5.507 -2.063 -9.710 1.00 10.00 C ATOM 0 H LEU A 468 4.126 1.428 -7.239 1.00 10.00 H new ATOM 0 HA LEU A 468 3.306 1.206 -9.850 1.00 10.00 H new ATOM 0 HB2 LEU A 468 3.993 -0.665 -7.622 1.00 10.00 H new ATOM 0 HB3 LEU A 468 3.180 -1.367 -9.007 1.00 10.00 H new ATOM 0 HG LEU A 468 5.036 -0.096 -10.385 1.00 10.00 H new ATOM 0 HD11 LEU A 468 7.179 0.005 -9.176 1.00 10.00 H new ATOM 0 HD12 LEU A 468 5.977 1.120 -8.483 1.00 10.00 H new ATOM 0 HD13 LEU A 468 6.342 -0.417 -7.663 1.00 10.00 H new ATOM 0 HD21 LEU A 468 6.459 -2.102 -10.239 1.00 10.00 H new ATOM 0 HD22 LEU A 468 5.593 -2.604 -8.768 1.00 10.00 H new ATOM 0 HD23 LEU A 468 4.732 -2.523 -10.323 1.00 10.00 H new ATOM 932 N TYR A 469 0.867 0.681 -7.777 1.00 10.00 N ATOM 933 CA TYR A 469 -0.567 0.436 -7.654 1.00 10.00 C ATOM 934 C TYR A 469 -1.392 1.689 -7.956 1.00 10.00 C ATOM 935 O TYR A 469 -2.618 1.624 -8.047 1.00 10.00 O ATOM 936 CB TYR A 469 -0.887 -0.101 -6.248 1.00 10.00 C ATOM 937 CG TYR A 469 -1.304 0.931 -5.221 1.00 10.00 C ATOM 938 CD1 TYR A 469 -0.757 2.203 -5.237 1.00 10.00 C ATOM 939 CD2 TYR A 469 -2.235 0.627 -4.224 1.00 10.00 C ATOM 940 CE1 TYR A 469 -1.119 3.152 -4.305 1.00 10.00 C ATOM 941 CE2 TYR A 469 -2.601 1.576 -3.289 1.00 10.00 C ATOM 942 CZ TYR A 469 -2.041 2.835 -3.334 1.00 10.00 C ATOM 943 OH TYR A 469 -2.398 3.779 -2.402 1.00 10.00 O ATOM 0 H TYR A 469 1.307 1.014 -6.919 1.00 10.00 H new ATOM 0 HA TYR A 469 -0.843 -0.313 -8.396 1.00 10.00 H new ATOM 0 HB2 TYR A 469 -1.684 -0.840 -6.336 1.00 10.00 H new ATOM 0 HB3 TYR A 469 -0.008 -0.624 -5.872 1.00 10.00 H new ATOM 0 HD1 TYR A 469 -0.031 2.457 -5.996 1.00 10.00 H new ATOM 0 HD2 TYR A 469 -2.673 -0.360 -4.184 1.00 10.00 H new ATOM 0 HE1 TYR A 469 -0.681 4.139 -4.337 1.00 10.00 H new ATOM 0 HE2 TYR A 469 -3.324 1.332 -2.525 1.00 10.00 H new ATOM 0 HH TYR A 469 -2.324 4.673 -2.797 1.00 10.00 H new ATOM 953 N TYR A 470 -0.723 2.830 -8.091 1.00 10.00 N ATOM 954 CA TYR A 470 -1.411 4.085 -8.361 1.00 10.00 C ATOM 955 C TYR A 470 -1.739 4.225 -9.843 1.00 10.00 C ATOM 956 O TYR A 470 -2.694 4.908 -10.210 1.00 10.00 O ATOM 957 CB TYR A 470 -0.567 5.271 -7.860 1.00 10.00 C ATOM 958 CG TYR A 470 0.001 6.160 -8.949 1.00 10.00 C ATOM 959 CD1 TYR A 470 0.839 5.646 -9.930 1.00 10.00 C ATOM 960 CD2 TYR A 470 -0.300 7.516 -8.988 1.00 10.00 C ATOM 961 CE1 TYR A 470 1.360 6.455 -10.919 1.00 10.00 C ATOM 962 CE2 TYR A 470 0.217 8.333 -9.976 1.00 10.00 C ATOM 963 CZ TYR A 470 1.046 7.797 -10.938 1.00 10.00 C ATOM 964 OH TYR A 470 1.564 8.608 -11.924 1.00 10.00 O ATOM 0 H TYR A 470 0.291 2.910 -8.018 1.00 10.00 H new ATOM 0 HA TYR A 470 -2.357 4.084 -7.819 1.00 10.00 H new ATOM 0 HB2 TYR A 470 -1.182 5.881 -7.198 1.00 10.00 H new ATOM 0 HB3 TYR A 470 0.258 4.883 -7.262 1.00 10.00 H new ATOM 0 HD1 TYR A 470 1.087 4.595 -9.919 1.00 10.00 H new ATOM 0 HD2 TYR A 470 -0.948 7.938 -8.234 1.00 10.00 H new ATOM 0 HE1 TYR A 470 2.010 6.039 -11.674 1.00 10.00 H new ATOM 0 HE2 TYR A 470 -0.027 9.385 -9.994 1.00 10.00 H new ATOM 0 HH TYR A 470 1.244 9.525 -11.794 1.00 10.00 H new ATOM 974 N TYR A 471 -0.948 3.577 -10.695 1.00 10.00 N ATOM 975 CA TYR A 471 -1.185 3.652 -12.129 1.00 10.00 C ATOM 976 C TYR A 471 -1.982 2.446 -12.632 1.00 10.00 C ATOM 977 O TYR A 471 -2.359 2.393 -13.803 1.00 10.00 O ATOM 978 CB TYR A 471 0.132 3.821 -12.899 1.00 10.00 C ATOM 979 CG TYR A 471 0.985 2.578 -12.999 1.00 10.00 C ATOM 980 CD1 TYR A 471 0.753 1.635 -13.991 1.00 10.00 C ATOM 981 CD2 TYR A 471 2.040 2.361 -12.118 1.00 10.00 C ATOM 982 CE1 TYR A 471 1.542 0.505 -14.102 1.00 10.00 C ATOM 983 CE2 TYR A 471 2.835 1.234 -12.226 1.00 10.00 C ATOM 984 CZ TYR A 471 2.581 0.311 -13.218 1.00 10.00 C ATOM 985 OH TYR A 471 3.370 -0.812 -13.327 1.00 10.00 O ATOM 0 H TYR A 471 -0.150 3.003 -10.421 1.00 10.00 H new ATOM 0 HA TYR A 471 -1.792 4.537 -12.317 1.00 10.00 H new ATOM 0 HB2 TYR A 471 -0.097 4.167 -13.907 1.00 10.00 H new ATOM 0 HB3 TYR A 471 0.717 4.605 -12.418 1.00 10.00 H new ATOM 0 HD1 TYR A 471 -0.058 1.787 -14.688 1.00 10.00 H new ATOM 0 HD2 TYR A 471 2.241 3.082 -11.339 1.00 10.00 H new ATOM 0 HE1 TYR A 471 1.345 -0.221 -14.877 1.00 10.00 H new ATOM 0 HE2 TYR A 471 3.651 1.078 -11.536 1.00 10.00 H new ATOM 0 HH TYR A 471 4.058 -0.797 -12.629 1.00 10.00 H new ATOM 995 N LEU A 472 -2.272 1.495 -11.739 1.00 10.00 N ATOM 996 CA LEU A 472 -3.067 0.322 -12.112 1.00 10.00 C ATOM 997 C LEU A 472 -4.530 0.541 -11.740 1.00 10.00 C ATOM 998 O LEU A 472 -5.435 -0.010 -12.368 1.00 10.00 O ATOM 999 CB LEU A 472 -2.559 -0.949 -11.420 1.00 10.00 C ATOM 1000 CG LEU A 472 -1.099 -0.920 -10.996 1.00 10.00 C ATOM 1001 CD1 LEU A 472 -0.789 -2.059 -10.036 1.00 10.00 C ATOM 1002 CD2 LEU A 472 -0.195 -0.984 -12.214 1.00 10.00 C ATOM 0 H LEU A 472 -1.972 1.513 -10.764 1.00 10.00 H new ATOM 0 HA LEU A 472 -2.970 0.191 -13.190 1.00 10.00 H new ATOM 0 HB2 LEU A 472 -3.173 -1.132 -10.538 1.00 10.00 H new ATOM 0 HB3 LEU A 472 -2.708 -1.793 -12.093 1.00 10.00 H new ATOM 0 HG LEU A 472 -0.912 0.019 -10.474 1.00 10.00 H new ATOM 0 HD11 LEU A 472 0.261 -2.016 -9.748 1.00 10.00 H new ATOM 0 HD12 LEU A 472 -1.413 -1.966 -9.147 1.00 10.00 H new ATOM 0 HD13 LEU A 472 -0.993 -3.012 -10.524 1.00 10.00 H new ATOM 0 HD21 LEU A 472 0.847 -0.962 -11.895 1.00 10.00 H new ATOM 0 HD22 LEU A 472 -0.388 -1.906 -12.762 1.00 10.00 H new ATOM 0 HD23 LEU A 472 -0.394 -0.129 -12.860 1.00 10.00 H new ATOM 1014 N THR A 473 -4.746 1.345 -10.704 1.00 10.00 N ATOM 1015 CA THR A 473 -6.086 1.644 -10.222 1.00 10.00 C ATOM 1016 C THR A 473 -6.729 2.779 -11.016 1.00 10.00 C ATOM 1017 O THR A 473 -7.943 2.978 -10.951 1.00 10.00 O ATOM 1018 CB THR A 473 -6.027 1.999 -8.735 1.00 10.00 C ATOM 1019 OG1 THR A 473 -5.367 3.238 -8.542 1.00 10.00 O ATOM 1020 CG2 THR A 473 -5.302 0.960 -7.905 1.00 10.00 C ATOM 0 H THR A 473 -4.001 1.804 -10.179 1.00 10.00 H new ATOM 0 HA THR A 473 -6.706 0.758 -10.361 1.00 10.00 H new ATOM 0 HB THR A 473 -7.065 2.049 -8.405 1.00 10.00 H new ATOM 0 HG1 THR A 473 -5.973 3.866 -8.096 1.00 10.00 H new ATOM 0 HG21 THR A 473 -5.294 1.270 -6.860 1.00 10.00 H new ATOM 0 HG22 THR A 473 -5.812 0.001 -7.995 1.00 10.00 H new ATOM 0 HG23 THR A 473 -4.277 0.860 -8.261 1.00 10.00 H new ATOM 1028 N LYS A 474 -5.919 3.520 -11.765 1.00 10.00 N ATOM 1029 CA LYS A 474 -6.429 4.630 -12.562 1.00 10.00 C ATOM 1030 C LYS A 474 -6.538 4.252 -14.035 1.00 10.00 C ATOM 1031 O LYS A 474 -7.317 4.847 -14.780 1.00 10.00 O ATOM 1032 CB LYS A 474 -5.527 5.856 -12.404 1.00 10.00 C ATOM 1033 CG LYS A 474 -4.128 5.656 -12.961 1.00 10.00 C ATOM 1034 CD LYS A 474 -3.204 6.793 -12.559 1.00 10.00 C ATOM 1035 CE LYS A 474 -1.917 6.780 -13.367 1.00 10.00 C ATOM 1036 NZ LYS A 474 -1.516 8.149 -13.795 1.00 10.00 N ATOM 0 H LYS A 474 -4.912 3.373 -11.837 1.00 10.00 H new ATOM 0 HA LYS A 474 -7.428 4.869 -12.198 1.00 10.00 H new ATOM 0 HB2 LYS A 474 -5.991 6.705 -12.905 1.00 10.00 H new ATOM 0 HB3 LYS A 474 -5.455 6.110 -11.347 1.00 10.00 H new ATOM 0 HG2 LYS A 474 -3.723 4.711 -12.600 1.00 10.00 H new ATOM 0 HG3 LYS A 474 -4.174 5.589 -14.048 1.00 10.00 H new ATOM 0 HD2 LYS A 474 -3.714 7.745 -12.702 1.00 10.00 H new ATOM 0 HD3 LYS A 474 -2.969 6.714 -11.498 1.00 10.00 H new ATOM 0 HE2 LYS A 474 -1.119 6.338 -12.771 1.00 10.00 H new ATOM 0 HE3 LYS A 474 -2.046 6.148 -14.246 1.00 10.00 H new ATOM 0 HZ1 LYS A 474 -0.634 8.097 -14.343 1.00 10.00 H new ATOM 0 HZ2 LYS A 474 -2.266 8.562 -14.385 1.00 10.00 H new ATOM 0 HZ3 LYS A 474 -1.367 8.745 -12.956 1.00 10.00 H new ATOM 1050 N LYS A 475 -5.762 3.261 -14.454 1.00 10.00 N ATOM 1051 CA LYS A 475 -5.788 2.813 -15.841 1.00 10.00 C ATOM 1052 C LYS A 475 -7.144 2.205 -16.195 1.00 10.00 C ATOM 1053 O LYS A 475 -7.462 2.022 -17.371 1.00 10.00 O ATOM 1054 CB LYS A 475 -4.675 1.792 -16.092 1.00 10.00 C ATOM 1055 CG LYS A 475 -4.862 0.489 -15.332 1.00 10.00 C ATOM 1056 CD LYS A 475 -4.051 -0.638 -15.952 1.00 10.00 C ATOM 1057 CE LYS A 475 -4.891 -1.461 -16.917 1.00 10.00 C ATOM 1058 NZ LYS A 475 -4.144 -2.643 -17.433 1.00 10.00 N ATOM 0 H LYS A 475 -5.109 2.754 -13.857 1.00 10.00 H new ATOM 0 HA LYS A 475 -5.624 3.682 -16.478 1.00 10.00 H new ATOM 0 HB2 LYS A 475 -4.625 1.576 -17.159 1.00 10.00 H new ATOM 0 HB3 LYS A 475 -3.719 2.233 -15.811 1.00 10.00 H new ATOM 0 HG2 LYS A 475 -4.562 0.626 -14.293 1.00 10.00 H new ATOM 0 HG3 LYS A 475 -5.918 0.218 -15.326 1.00 10.00 H new ATOM 0 HD2 LYS A 475 -3.192 -0.223 -16.478 1.00 10.00 H new ATOM 0 HD3 LYS A 475 -3.661 -1.283 -15.165 1.00 10.00 H new ATOM 0 HE2 LYS A 475 -5.798 -1.796 -16.414 1.00 10.00 H new ATOM 0 HE3 LYS A 475 -5.202 -0.835 -17.753 1.00 10.00 H new ATOM 0 HZ1 LYS A 475 -4.750 -3.178 -18.087 1.00 10.00 H new ATOM 0 HZ2 LYS A 475 -3.291 -2.323 -17.935 1.00 10.00 H new ATOM 0 HZ3 LYS A 475 -3.869 -3.254 -16.638 1.00 10.00 H new ATOM 1072 N ASN A 476 -7.938 1.882 -15.175 1.00 10.00 N ATOM 1073 CA ASN A 476 -9.252 1.286 -15.390 1.00 10.00 C ATOM 1074 C ASN A 476 -10.373 2.158 -14.824 1.00 10.00 C ATOM 1075 O ASN A 476 -11.521 2.053 -15.253 1.00 10.00 O ATOM 1076 CB ASN A 476 -9.306 -0.104 -14.752 1.00 10.00 C ATOM 1077 CG ASN A 476 -9.138 -0.057 -13.246 1.00 10.00 C ATOM 1078 OD1 ASN A 476 -9.908 0.597 -12.544 1.00 10.00 O ATOM 1079 ND2 ASN A 476 -8.126 -0.753 -12.742 1.00 10.00 N ATOM 0 H ASN A 476 -7.694 2.023 -14.195 1.00 10.00 H new ATOM 0 HA ASN A 476 -9.404 1.205 -16.466 1.00 10.00 H new ATOM 0 HB2 ASN A 476 -10.259 -0.575 -14.994 1.00 10.00 H new ATOM 0 HB3 ASN A 476 -8.524 -0.729 -15.183 1.00 10.00 H new ATOM 0 HD21 ASN A 476 -7.963 -0.759 -11.735 1.00 10.00 H new ATOM 0 HD22 ASN A 476 -7.512 -1.282 -13.362 1.00 10.00 H new ATOM 1086 N GLU A 477 -10.044 3.011 -13.856 1.00 10.00 N ATOM 1087 CA GLU A 477 -11.046 3.881 -13.242 1.00 10.00 C ATOM 1088 C GLU A 477 -10.758 5.352 -13.527 1.00 10.00 C ATOM 1089 O GLU A 477 -11.678 6.167 -13.614 1.00 10.00 O ATOM 1090 CB GLU A 477 -11.094 3.645 -11.732 1.00 10.00 C ATOM 1091 CG GLU A 477 -12.031 2.520 -11.321 1.00 10.00 C ATOM 1092 CD GLU A 477 -12.697 2.776 -9.984 1.00 10.00 C ATOM 1093 OE1 GLU A 477 -12.023 2.614 -8.944 1.00 10.00 O ATOM 1094 OE2 GLU A 477 -13.892 3.140 -9.975 1.00 10.00 O ATOM 0 H GLU A 477 -9.101 3.118 -13.482 1.00 10.00 H new ATOM 0 HA GLU A 477 -12.014 3.634 -13.679 1.00 10.00 H new ATOM 0 HB2 GLU A 477 -10.089 3.418 -11.376 1.00 10.00 H new ATOM 0 HB3 GLU A 477 -11.406 4.565 -11.239 1.00 10.00 H new ATOM 0 HG2 GLU A 477 -12.797 2.392 -12.086 1.00 10.00 H new ATOM 0 HG3 GLU A 477 -11.471 1.586 -11.271 1.00 10.00 H new ATOM 1101 N ASN A 478 -9.482 5.689 -13.665 1.00 10.00 N ATOM 1102 CA ASN A 478 -9.077 7.064 -13.933 1.00 10.00 C ATOM 1103 C ASN A 478 -9.472 7.973 -12.773 1.00 10.00 C ATOM 1104 O ASN A 478 -10.412 8.762 -12.880 1.00 10.00 O ATOM 1105 CB ASN A 478 -9.712 7.564 -15.232 1.00 10.00 C ATOM 1106 CG ASN A 478 -8.811 7.354 -16.433 1.00 10.00 C ATOM 1107 OD1 ASN A 478 -8.569 6.222 -16.853 1.00 10.00 O ATOM 1108 ND2 ASN A 478 -8.306 8.448 -16.993 1.00 10.00 N ATOM 0 H ASN A 478 -8.708 5.028 -13.596 1.00 10.00 H new ATOM 0 HA ASN A 478 -7.993 7.087 -14.041 1.00 10.00 H new ATOM 0 HB2 ASN A 478 -10.657 7.045 -15.395 1.00 10.00 H new ATOM 0 HB3 ASN A 478 -9.943 8.625 -15.136 1.00 10.00 H new ATOM 0 HD21 ASN A 478 -7.692 8.369 -17.803 1.00 10.00 H new ATOM 0 HD22 ASN A 478 -8.533 9.367 -16.613 1.00 10.00 H new ATOM 1115 N TYR A 479 -8.751 7.854 -11.663 1.00 10.00 N ATOM 1116 CA TYR A 479 -9.027 8.661 -10.481 1.00 10.00 C ATOM 1117 C TYR A 479 -7.733 9.055 -9.775 1.00 10.00 C ATOM 1118 O TYR A 479 -7.665 9.076 -8.546 1.00 10.00 O ATOM 1119 CB TYR A 479 -9.935 7.888 -9.518 1.00 10.00 C ATOM 1120 CG TYR A 479 -9.207 6.838 -8.706 1.00 10.00 C ATOM 1121 CD1 TYR A 479 -8.525 5.798 -9.328 1.00 10.00 C ATOM 1122 CD2 TYR A 479 -9.196 6.892 -7.318 1.00 10.00 C ATOM 1123 CE1 TYR A 479 -7.855 4.843 -8.588 1.00 10.00 C ATOM 1124 CE2 TYR A 479 -8.526 5.940 -6.573 1.00 10.00 C ATOM 1125 CZ TYR A 479 -7.859 4.918 -7.212 1.00 10.00 C ATOM 1126 OH TYR A 479 -7.191 3.969 -6.473 1.00 10.00 O ATOM 0 H TYR A 479 -7.971 7.206 -11.558 1.00 10.00 H new ATOM 0 HA TYR A 479 -9.534 9.572 -10.800 1.00 10.00 H new ATOM 0 HB2 TYR A 479 -10.413 8.593 -8.838 1.00 10.00 H new ATOM 0 HB3 TYR A 479 -10.729 7.407 -10.089 1.00 10.00 H new ATOM 0 HD1 TYR A 479 -8.519 5.736 -10.406 1.00 10.00 H new ATOM 0 HD2 TYR A 479 -9.719 7.691 -6.813 1.00 10.00 H new ATOM 0 HE1 TYR A 479 -7.330 4.041 -9.086 1.00 10.00 H new ATOM 0 HE2 TYR A 479 -8.525 5.997 -5.495 1.00 10.00 H new ATOM 0 HH TYR A 479 -6.277 4.275 -6.297 1.00 10.00 H new ATOM 1136 N LYS A 480 -6.707 9.363 -10.559 1.00 10.00 N ATOM 1137 CA LYS A 480 -5.415 9.750 -10.006 1.00 10.00 C ATOM 1138 C LYS A 480 -5.563 10.909 -9.023 1.00 10.00 C ATOM 1139 O LYS A 480 -4.769 10.973 -8.061 1.00 10.00 O ATOM 1140 CB LYS A 480 -4.452 10.139 -11.129 1.00 10.00 C ATOM 1141 CG LYS A 480 -4.870 11.389 -11.885 1.00 10.00 C ATOM 1142 CD LYS A 480 -3.787 11.846 -12.849 1.00 10.00 C ATOM 1143 CE LYS A 480 -3.680 13.362 -12.887 1.00 10.00 C ATOM 1144 NZ LYS A 480 -4.417 13.942 -14.043 1.00 10.00 N ATOM 1145 OXT LYS A 480 -6.470 11.743 -9.225 1.00 10.00 O ATOM 0 H LYS A 480 -6.744 9.352 -11.578 1.00 10.00 H new ATOM 0 HA LYS A 480 -5.010 8.893 -9.468 1.00 10.00 H new ATOM 0 HB2 LYS A 480 -3.459 10.295 -10.707 1.00 10.00 H new ATOM 0 HB3 LYS A 480 -4.373 9.309 -11.832 1.00 10.00 H new ATOM 0 HG2 LYS A 480 -5.789 11.192 -12.436 1.00 10.00 H new ATOM 0 HG3 LYS A 480 -5.088 12.188 -11.176 1.00 10.00 H new ATOM 0 HD2 LYS A 480 -2.829 11.420 -12.551 1.00 10.00 H new ATOM 0 HD3 LYS A 480 -4.006 11.470 -13.849 1.00 10.00 H new ATOM 0 HE2 LYS A 480 -4.075 13.777 -11.960 1.00 10.00 H new ATOM 0 HE3 LYS A 480 -2.630 13.650 -12.944 1.00 10.00 H new ATOM 0 HZ1 LYS A 480 -4.319 14.977 -14.033 1.00 10.00 H new ATOM 0 HZ2 LYS A 480 -4.024 13.566 -14.929 1.00 10.00 H new ATOM 0 HZ3 LYS A 480 -5.423 13.689 -13.976 1.00 10.00 H new TER 1159 LYS A 480