USER MOD reduce.3.24.130724 H: found=0, std=0, add=732, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 738 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 39 TYR OH : rot -127:sc= 0.269 USER MOD Single : A 42 THR OG1 : rot -31:sc= 1.1 USER MOD Single : A 45 LYS NZ :NH3+ 174:sc= 1.06 (180deg=1.06) USER MOD Single : A 48 MET CE :methyl -128:sc= 0 (180deg=-1.16) USER MOD Single : A 52 SER OG : rot -35:sc= 1.29 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 ASN : amide:sc= 0 X(o=0,f=-0.41) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 61 ASN : amide:sc= -0.0813 K(o=-0.081,f=-1.2) USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 66 GLN : amide:sc= 0.606 K(o=0.61,f=-6.1!) USER MOD Single : A 68 LYS NZ :NH3+ -158:sc= 1.22 (180deg=1.09) USER MOD Single : A 69 GLN : amide:sc= 0.738 K(o=0.74,f=-0.03) USER MOD Single : A 72 MET CE :methyl -173:sc= -0.119 (180deg=-0.21) USER MOD Single : A 78 ASN : amide:sc= 0.922 K(o=0.92,f=0) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : B 39 TYR OH : rot -128:sc= 0.265 USER MOD Single : B 42 THR OG1 : rot -20:sc= 1.07 USER MOD Single : B 45 LYS NZ :NH3+ 171:sc= 1.09 (180deg=1.03) USER MOD Single : B 48 MET CE :methyl -126:sc= 0 (180deg=-1.16) USER MOD Single : B 52 SER OG : rot -38:sc= 1.26 USER MOD Single : B 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 54 TYR OH : rot 180:sc= 0 USER MOD Single : B 56 ASN : amide:sc= 0 X(o=0,f=-0.39) USER MOD Single : B 58 SER OG : rot 180:sc= 0 USER MOD Single : B 61 ASN : amide:sc= -0.0608 K(o=-0.061,f=-1.2!) USER MOD Single : B 65 SER OG : rot 180:sc= 0 USER MOD Single : B 66 GLN : amide:sc= 0.5 K(o=0.5,f=-6.4!) USER MOD Single : B 68 LYS NZ :NH3+ -157:sc= 1.21 (180deg=1.09) USER MOD Single : B 69 GLN : amide:sc= 0.728 K(o=0.73,f=-0.029) USER MOD Single : B 72 MET CE :methyl -172:sc= -0.12 (180deg=-0.209) USER MOD Single : B 78 ASN : amide:sc= 0.923 K(o=0.92,f=0) USER MOD Single : B 80 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 38 16.057 -8.373 -50.924 1.00 0.00 N ATOM 2 CA ASP A 38 15.703 -8.768 -49.566 1.00 0.00 C ATOM 3 C ASP A 38 14.903 -7.676 -48.866 1.00 0.00 C ATOM 4 O ASP A 38 14.143 -7.950 -47.937 1.00 0.00 O ATOM 5 CB ASP A 38 16.961 -9.087 -48.754 1.00 0.00 C ATOM 6 CG ASP A 38 17.719 -10.296 -49.286 1.00 0.00 C ATOM 7 OD1 ASP A 38 17.101 -11.313 -49.500 1.00 0.00 O ATOM 8 OD2 ASP A 38 18.907 -10.193 -49.472 1.00 0.00 O ATOM 0 HA ASP A 38 15.084 -9.662 -49.633 1.00 0.00 H new ATOM 0 HB2 ASP A 38 17.621 -8.219 -48.760 1.00 0.00 H new ATOM 0 HB3 ASP A 38 16.681 -9.268 -47.716 1.00 0.00 H new ATOM 13 N TYR A 39 15.080 -6.440 -49.317 1.00 0.00 N ATOM 14 CA TYR A 39 14.428 -5.295 -48.691 1.00 0.00 C ATOM 15 C TYR A 39 13.032 -5.077 -49.259 1.00 0.00 C ATOM 16 O TYR A 39 12.038 -5.162 -48.537 1.00 0.00 O ATOM 17 CB TYR A 39 15.277 -4.033 -48.868 1.00 0.00 C ATOM 18 CG TYR A 39 14.694 -2.807 -48.201 1.00 0.00 C ATOM 19 CD1 TYR A 39 14.690 -2.706 -46.818 1.00 0.00 C ATOM 20 CD2 TYR A 39 14.163 -1.785 -48.973 1.00 0.00 C ATOM 21 CE1 TYR A 39 14.157 -1.586 -46.208 1.00 0.00 C ATOM 22 CE2 TYR A 39 13.630 -0.665 -48.364 1.00 0.00 C ATOM 23 CZ TYR A 39 13.626 -0.564 -46.987 1.00 0.00 C ATOM 24 OH TYR A 39 13.096 0.551 -46.381 1.00 0.00 O ATOM 0 H TYR A 39 15.670 -6.204 -50.115 1.00 0.00 H new ATOM 0 HA TYR A 39 14.330 -5.507 -47.626 1.00 0.00 H new ATOM 0 HB2 TYR A 39 16.273 -4.216 -48.464 1.00 0.00 H new ATOM 0 HB3 TYR A 39 15.397 -3.833 -49.933 1.00 0.00 H new ATOM 0 HD1 TYR A 39 15.103 -3.503 -46.217 1.00 0.00 H new ATOM 0 HD2 TYR A 39 14.166 -1.864 -50.050 1.00 0.00 H new ATOM 0 HE1 TYR A 39 14.153 -1.505 -45.131 1.00 0.00 H new ATOM 0 HE2 TYR A 39 13.217 0.131 -48.965 1.00 0.00 H new ATOM 0 HH TYR A 39 12.185 0.700 -46.710 1.00 0.00 H new ATOM 34 N LEU A 40 12.964 -4.795 -50.555 1.00 0.00 N ATOM 35 CA LEU A 40 11.707 -4.419 -51.192 1.00 0.00 C ATOM 36 C LEU A 40 10.738 -5.593 -51.236 1.00 0.00 C ATOM 37 O LEU A 40 9.539 -5.429 -51.007 1.00 0.00 O ATOM 38 CB LEU A 40 11.967 -3.908 -52.615 1.00 0.00 C ATOM 39 CG LEU A 40 12.686 -2.556 -52.717 1.00 0.00 C ATOM 40 CD1 LEU A 40 13.011 -2.262 -54.175 1.00 0.00 C ATOM 41 CD2 LEU A 40 11.805 -1.468 -52.123 1.00 0.00 C ATOM 0 H LEU A 40 13.765 -4.820 -51.186 1.00 0.00 H new ATOM 0 HA LEU A 40 11.256 -3.624 -50.598 1.00 0.00 H new ATOM 0 HB2 LEU A 40 12.558 -4.654 -53.146 1.00 0.00 H new ATOM 0 HB3 LEU A 40 11.011 -3.830 -53.133 1.00 0.00 H new ATOM 0 HG LEU A 40 13.620 -2.587 -52.156 1.00 0.00 H new ATOM 0 HD11 LEU A 40 13.522 -1.302 -54.247 1.00 0.00 H new ATOM 0 HD12 LEU A 40 13.656 -3.047 -54.569 1.00 0.00 H new ATOM 0 HD13 LEU A 40 12.088 -2.227 -54.754 1.00 0.00 H new ATOM 0 HD21 LEU A 40 12.315 -0.507 -52.195 1.00 0.00 H new ATOM 0 HD22 LEU A 40 10.864 -1.422 -52.672 1.00 0.00 H new ATOM 0 HD23 LEU A 40 11.603 -1.694 -51.076 1.00 0.00 H new ATOM 53 N PRO A 41 11.264 -6.776 -51.531 1.00 0.00 N ATOM 54 CA PRO A 41 10.440 -7.976 -51.636 1.00 0.00 C ATOM 55 C PRO A 41 9.556 -8.146 -50.408 1.00 0.00 C ATOM 56 O PRO A 41 8.406 -8.572 -50.513 1.00 0.00 O ATOM 57 CB PRO A 41 11.478 -9.098 -51.745 1.00 0.00 C ATOM 58 CG PRO A 41 12.618 -8.471 -52.473 1.00 0.00 C ATOM 59 CD PRO A 41 12.704 -7.079 -51.908 1.00 0.00 C ATOM 0 HA PRO A 41 9.749 -7.953 -52.479 1.00 0.00 H new ATOM 0 HB2 PRO A 41 11.782 -9.456 -50.762 1.00 0.00 H new ATOM 0 HB3 PRO A 41 11.082 -9.956 -52.288 1.00 0.00 H new ATOM 0 HG2 PRO A 41 13.544 -9.023 -52.312 1.00 0.00 H new ATOM 0 HG3 PRO A 41 12.441 -8.453 -53.548 1.00 0.00 H new ATOM 0 HD2 PRO A 41 13.366 -7.034 -51.043 1.00 0.00 H new ATOM 0 HD3 PRO A 41 13.088 -6.369 -52.640 1.00 0.00 H new ATOM 67 N THR A 42 10.100 -7.811 -49.243 1.00 0.00 N ATOM 68 CA THR A 42 9.365 -7.937 -47.990 1.00 0.00 C ATOM 69 C THR A 42 8.357 -6.806 -47.827 1.00 0.00 C ATOM 70 O THR A 42 7.275 -7.001 -47.272 1.00 0.00 O ATOM 71 CB THR A 42 10.323 -7.954 -46.784 1.00 0.00 C ATOM 72 OG1 THR A 42 11.051 -6.721 -46.731 1.00 0.00 O ATOM 73 CG2 THR A 42 11.301 -9.112 -46.898 1.00 0.00 C ATOM 0 H THR A 42 11.048 -7.450 -49.140 1.00 0.00 H new ATOM 0 HA THR A 42 8.827 -8.884 -48.025 1.00 0.00 H new ATOM 0 HB THR A 42 9.736 -8.076 -45.874 1.00 0.00 H new ATOM 0 HG1 THR A 42 11.177 -6.376 -47.640 1.00 0.00 H new ATOM 0 HG21 THR A 42 11.970 -9.109 -46.038 1.00 0.00 H new ATOM 0 HG22 THR A 42 10.750 -10.052 -46.926 1.00 0.00 H new ATOM 0 HG23 THR A 42 11.885 -9.006 -47.812 1.00 0.00 H new ATOM 81 N LEU A 43 8.718 -5.623 -48.313 1.00 0.00 N ATOM 82 CA LEU A 43 7.805 -4.487 -48.323 1.00 0.00 C ATOM 83 C LEU A 43 6.649 -4.720 -49.288 1.00 0.00 C ATOM 84 O LEU A 43 5.545 -4.215 -49.082 1.00 0.00 O ATOM 85 CB LEU A 43 8.555 -3.207 -48.713 1.00 0.00 C ATOM 86 CG LEU A 43 9.586 -2.704 -47.694 1.00 0.00 C ATOM 87 CD1 LEU A 43 10.279 -1.464 -48.242 1.00 0.00 C ATOM 88 CD2 LEU A 43 8.892 -2.405 -46.374 1.00 0.00 C ATOM 0 H LEU A 43 9.639 -5.426 -48.706 1.00 0.00 H new ATOM 0 HA LEU A 43 7.398 -4.375 -47.318 1.00 0.00 H new ATOM 0 HB2 LEU A 43 9.063 -3.380 -49.661 1.00 0.00 H new ATOM 0 HB3 LEU A 43 7.824 -2.417 -48.883 1.00 0.00 H new ATOM 0 HG LEU A 43 10.341 -3.470 -47.519 1.00 0.00 H new ATOM 0 HD11 LEU A 43 11.011 -1.107 -47.518 1.00 0.00 H new ATOM 0 HD12 LEU A 43 10.783 -1.712 -49.176 1.00 0.00 H new ATOM 0 HD13 LEU A 43 9.539 -0.685 -48.425 1.00 0.00 H new ATOM 0 HD21 LEU A 43 9.625 -2.048 -45.650 1.00 0.00 H new ATOM 0 HD22 LEU A 43 8.131 -1.640 -46.528 1.00 0.00 H new ATOM 0 HD23 LEU A 43 8.422 -3.313 -45.996 1.00 0.00 H new ATOM 100 N ARG A 44 6.910 -5.484 -50.342 1.00 0.00 N ATOM 101 CA ARG A 44 5.870 -5.858 -51.294 1.00 0.00 C ATOM 102 C ARG A 44 4.782 -6.689 -50.623 1.00 0.00 C ATOM 103 O ARG A 44 3.593 -6.415 -50.781 1.00 0.00 O ATOM 104 CB ARG A 44 6.462 -6.646 -52.453 1.00 0.00 C ATOM 105 CG ARG A 44 7.337 -5.835 -53.396 1.00 0.00 C ATOM 106 CD ARG A 44 7.947 -6.688 -54.448 1.00 0.00 C ATOM 107 NE ARG A 44 8.851 -5.932 -55.301 1.00 0.00 N ATOM 108 CZ ARG A 44 9.641 -6.474 -56.248 1.00 0.00 C ATOM 109 NH1 ARG A 44 9.629 -7.772 -56.450 1.00 0.00 N ATOM 110 NH2 ARG A 44 10.429 -5.700 -56.974 1.00 0.00 N ATOM 0 H ARG A 44 7.834 -5.857 -50.560 1.00 0.00 H new ATOM 0 HA ARG A 44 5.426 -4.937 -51.672 1.00 0.00 H new ATOM 0 HB2 ARG A 44 7.052 -7.469 -52.050 1.00 0.00 H new ATOM 0 HB3 ARG A 44 5.648 -7.089 -53.026 1.00 0.00 H new ATOM 0 HG2 ARG A 44 6.740 -5.052 -53.863 1.00 0.00 H new ATOM 0 HG3 ARG A 44 8.124 -5.340 -52.827 1.00 0.00 H new ATOM 0 HD2 ARG A 44 8.490 -7.509 -53.980 1.00 0.00 H new ATOM 0 HD3 ARG A 44 7.160 -7.133 -55.057 1.00 0.00 H new ATOM 0 HE ARG A 44 8.889 -4.921 -55.173 1.00 0.00 H new ATOM 0 HH11 ARG A 44 9.021 -8.370 -55.890 1.00 0.00 H new ATOM 0 HH12 ARG A 44 10.227 -8.182 -57.167 1.00 0.00 H new ATOM 0 HH21 ARG A 44 10.439 -4.692 -56.817 1.00 0.00 H new ATOM 0 HH22 ARG A 44 11.027 -6.111 -57.691 1.00 0.00 H new ATOM 124 N LYS A 45 5.198 -7.704 -49.874 1.00 0.00 N ATOM 125 CA LYS A 45 4.269 -8.509 -49.090 1.00 0.00 C ATOM 126 C LYS A 45 3.533 -7.655 -48.064 1.00 0.00 C ATOM 127 O LYS A 45 2.327 -7.805 -47.868 1.00 0.00 O ATOM 128 CB LYS A 45 5.007 -9.652 -48.391 1.00 0.00 C ATOM 129 CG LYS A 45 4.111 -10.569 -47.569 1.00 0.00 C ATOM 130 CD LYS A 45 4.894 -11.746 -47.006 1.00 0.00 C ATOM 131 CE LYS A 45 3.981 -12.719 -46.274 1.00 0.00 C ATOM 132 NZ LYS A 45 3.534 -12.182 -44.960 1.00 0.00 N ATOM 0 H LYS A 45 6.174 -7.989 -49.793 1.00 0.00 H new ATOM 0 HA LYS A 45 3.533 -8.931 -49.774 1.00 0.00 H new ATOM 0 HB2 LYS A 45 5.524 -10.248 -49.143 1.00 0.00 H new ATOM 0 HB3 LYS A 45 5.771 -9.230 -47.738 1.00 0.00 H new ATOM 0 HG2 LYS A 45 3.661 -10.005 -46.752 1.00 0.00 H new ATOM 0 HG3 LYS A 45 3.295 -10.936 -48.191 1.00 0.00 H new ATOM 0 HD2 LYS A 45 5.407 -12.265 -47.816 1.00 0.00 H new ATOM 0 HD3 LYS A 45 5.662 -11.382 -46.324 1.00 0.00 H new ATOM 0 HE2 LYS A 45 3.110 -12.935 -46.893 1.00 0.00 H new ATOM 0 HE3 LYS A 45 4.505 -13.663 -46.121 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 2.836 -12.828 -44.540 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 4.352 -12.096 -44.324 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 3.101 -11.246 -45.096 1.00 0.00 H new ATOM 146 N GLU A 46 4.266 -6.762 -47.410 1.00 0.00 N ATOM 147 CA GLU A 46 3.682 -5.870 -46.416 1.00 0.00 C ATOM 148 C GLU A 46 2.560 -5.033 -47.019 1.00 0.00 C ATOM 149 O GLU A 46 1.505 -4.861 -46.409 1.00 0.00 O ATOM 150 CB GLU A 46 4.751 -4.968 -45.818 1.00 0.00 C ATOM 0 H GLU A 46 5.268 -6.636 -47.551 1.00 0.00 H new ATOM 0 HA GLU A 46 3.256 -6.485 -45.623 1.00 0.00 H new ATOM 155 N LEU A 47 2.796 -4.514 -48.219 1.00 0.00 N ATOM 156 CA LEU A 47 1.798 -3.711 -48.916 1.00 0.00 C ATOM 157 C LEU A 47 0.567 -4.540 -49.259 1.00 0.00 C ATOM 158 O LEU A 47 -0.564 -4.062 -49.155 1.00 0.00 O ATOM 159 CB LEU A 47 2.396 -3.117 -50.197 1.00 0.00 C ATOM 160 CG LEU A 47 3.410 -1.984 -49.995 1.00 0.00 C ATOM 161 CD1 LEU A 47 4.099 -1.677 -51.317 1.00 0.00 C ATOM 162 CD2 LEU A 47 2.697 -0.755 -49.452 1.00 0.00 C ATOM 0 H LEU A 47 3.671 -4.635 -48.730 1.00 0.00 H new ATOM 0 HA LEU A 47 1.494 -2.903 -48.251 1.00 0.00 H new ATOM 0 HB2 LEU A 47 2.881 -3.918 -50.755 1.00 0.00 H new ATOM 0 HB3 LEU A 47 1.581 -2.744 -50.817 1.00 0.00 H new ATOM 0 HG LEU A 47 4.169 -2.288 -49.274 1.00 0.00 H new ATOM 0 HD11 LEU A 47 4.820 -0.872 -51.173 1.00 0.00 H new ATOM 0 HD12 LEU A 47 4.616 -2.568 -51.673 1.00 0.00 H new ATOM 0 HD13 LEU A 47 3.355 -1.371 -52.053 1.00 0.00 H new ATOM 0 HD21 LEU A 47 3.418 0.050 -49.308 1.00 0.00 H new ATOM 0 HD22 LEU A 47 1.932 -0.436 -50.160 1.00 0.00 H new ATOM 0 HD23 LEU A 47 2.229 -0.998 -48.498 1.00 0.00 H new ATOM 174 N MET A 48 0.792 -5.782 -49.670 1.00 0.00 N ATOM 175 CA MET A 48 -0.301 -6.703 -49.961 1.00 0.00 C ATOM 176 C MET A 48 -1.165 -6.940 -48.729 1.00 0.00 C ATOM 177 O MET A 48 -2.392 -6.978 -48.817 1.00 0.00 O ATOM 178 CB MET A 48 0.250 -8.027 -50.488 1.00 0.00 C ATOM 179 CG MET A 48 0.910 -7.934 -51.857 1.00 0.00 C ATOM 180 SD MET A 48 1.696 -9.479 -52.356 1.00 0.00 S ATOM 181 CE MET A 48 0.266 -10.451 -52.822 1.00 0.00 C ATOM 0 H MET A 48 1.723 -6.175 -49.810 1.00 0.00 H new ATOM 0 HA MET A 48 -0.929 -6.251 -50.729 1.00 0.00 H new ATOM 0 HB2 MET A 48 0.977 -8.414 -49.774 1.00 0.00 H new ATOM 0 HB3 MET A 48 -0.564 -8.750 -50.539 1.00 0.00 H new ATOM 0 HG2 MET A 48 0.161 -7.656 -52.599 1.00 0.00 H new ATOM 0 HG3 MET A 48 1.656 -7.139 -51.843 1.00 0.00 H new ATOM 0 HE1 MET A 48 0.293 -11.410 -52.304 1.00 0.00 H new ATOM 0 HE2 MET A 48 -0.643 -9.916 -52.547 1.00 0.00 H new ATOM 0 HE3 MET A 48 0.276 -10.620 -53.899 1.00 0.00 H new ATOM 191 N GLU A 49 -0.517 -7.099 -47.580 1.00 0.00 N ATOM 192 CA GLU A 49 -1.225 -7.242 -46.314 1.00 0.00 C ATOM 193 C GLU A 49 -2.060 -6.005 -46.007 1.00 0.00 C ATOM 194 O GLU A 49 -3.209 -6.112 -45.578 1.00 0.00 O ATOM 195 CB GLU A 49 -0.236 -7.497 -45.174 1.00 0.00 C ATOM 196 CG GLU A 49 0.463 -8.847 -45.239 1.00 0.00 C ATOM 197 CD GLU A 49 1.541 -8.998 -44.203 1.00 0.00 C ATOM 198 OE1 GLU A 49 1.742 -8.080 -43.444 1.00 0.00 O ATOM 199 OE2 GLU A 49 2.165 -10.032 -44.170 1.00 0.00 O ATOM 0 H GLU A 49 0.499 -7.132 -47.500 1.00 0.00 H new ATOM 0 HA GLU A 49 -1.896 -8.096 -46.403 1.00 0.00 H new ATOM 0 HB2 GLU A 49 0.518 -6.710 -45.181 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -0.767 -7.422 -44.225 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -0.274 -9.639 -45.107 1.00 0.00 H new ATOM 0 HG3 GLU A 49 0.898 -8.978 -46.230 1.00 0.00 H new ATOM 206 N VAL A 50 -1.476 -4.833 -46.230 1.00 0.00 N ATOM 207 CA VAL A 50 -2.177 -3.574 -46.008 1.00 0.00 C ATOM 208 C VAL A 50 -3.421 -3.475 -46.880 1.00 0.00 C ATOM 209 O VAL A 50 -4.464 -2.992 -46.438 1.00 0.00 O ATOM 210 CB VAL A 50 -1.245 -2.384 -46.310 1.00 0.00 C ATOM 211 CG1 VAL A 50 -2.036 -1.085 -46.345 1.00 0.00 C ATOM 212 CG2 VAL A 50 -0.139 -2.315 -45.269 1.00 0.00 C ATOM 0 H VAL A 50 -0.518 -4.729 -46.565 1.00 0.00 H new ATOM 0 HA VAL A 50 -2.482 -3.544 -44.962 1.00 0.00 H new ATOM 0 HB VAL A 50 -0.791 -2.529 -47.290 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -1.363 -0.255 -46.559 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -2.798 -1.144 -47.122 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -2.514 -0.924 -45.379 1.00 0.00 H new ATOM 0 HG21 VAL A 50 0.516 -1.472 -45.489 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -0.578 -2.185 -44.280 1.00 0.00 H new ATOM 0 HG23 VAL A 50 0.439 -3.239 -45.291 1.00 0.00 H new ATOM 222 N LEU A 51 -3.307 -3.935 -48.121 1.00 0.00 N ATOM 223 CA LEU A 51 -4.424 -3.899 -49.058 1.00 0.00 C ATOM 224 C LEU A 51 -5.529 -4.856 -48.633 1.00 0.00 C ATOM 225 O LEU A 51 -6.714 -4.548 -48.766 1.00 0.00 O ATOM 226 CB LEU A 51 -3.943 -4.258 -50.470 1.00 0.00 C ATOM 227 CG LEU A 51 -3.013 -3.237 -51.136 1.00 0.00 C ATOM 228 CD1 LEU A 51 -2.329 -3.878 -52.336 1.00 0.00 C ATOM 229 CD2 LEU A 51 -3.816 -2.014 -51.552 1.00 0.00 C ATOM 0 H LEU A 51 -2.451 -4.338 -48.502 1.00 0.00 H new ATOM 0 HA LEU A 51 -4.827 -2.886 -49.060 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -3.427 -5.217 -50.425 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -4.817 -4.396 -51.107 1.00 0.00 H new ATOM 0 HG LEU A 51 -2.244 -2.920 -50.432 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -1.668 -3.152 -52.809 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -1.746 -4.738 -52.006 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -3.082 -4.204 -53.053 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -3.155 -1.288 -52.025 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -4.593 -2.311 -52.257 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -4.277 -1.565 -50.672 1.00 0.00 H new ATOM 241 N SER A 52 -5.137 -6.018 -48.121 1.00 0.00 N ATOM 242 CA SER A 52 -6.095 -7.015 -47.661 1.00 0.00 C ATOM 243 C SER A 52 -6.834 -6.536 -46.419 1.00 0.00 C ATOM 244 O SER A 52 -7.905 -7.046 -46.087 1.00 0.00 O ATOM 245 CB SER A 52 -5.386 -8.322 -47.365 1.00 0.00 C ATOM 246 OG SER A 52 -4.588 -8.212 -46.218 1.00 0.00 O ATOM 0 H SER A 52 -4.160 -6.292 -48.014 1.00 0.00 H new ATOM 0 HA SER A 52 -6.825 -7.171 -48.455 1.00 0.00 H new ATOM 0 HB2 SER A 52 -6.121 -9.115 -47.226 1.00 0.00 H new ATOM 0 HB3 SER A 52 -4.768 -8.605 -48.217 1.00 0.00 H new ATOM 0 HG SER A 52 -4.205 -7.311 -46.171 1.00 0.00 H new ATOM 252 N LYS A 53 -6.258 -5.554 -45.735 1.00 0.00 N ATOM 253 CA LYS A 53 -6.900 -4.950 -44.573 1.00 0.00 C ATOM 254 C LYS A 53 -7.782 -3.776 -44.980 1.00 0.00 C ATOM 255 O LYS A 53 -8.850 -3.561 -44.404 1.00 0.00 O ATOM 256 CB LYS A 53 -5.850 -4.491 -43.560 1.00 0.00 C ATOM 257 CG LYS A 53 -5.108 -5.626 -42.866 1.00 0.00 C ATOM 258 CD LYS A 53 -4.063 -5.092 -41.897 1.00 0.00 C ATOM 259 CE LYS A 53 -3.319 -6.224 -41.205 1.00 0.00 C ATOM 260 NZ LYS A 53 -2.278 -5.717 -40.271 1.00 0.00 N ATOM 0 H LYS A 53 -5.346 -5.159 -45.965 1.00 0.00 H new ATOM 0 HA LYS A 53 -7.532 -5.707 -44.110 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -5.125 -3.856 -44.069 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -6.337 -3.875 -42.804 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -5.819 -6.253 -42.328 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -4.626 -6.258 -43.612 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -3.353 -4.463 -42.435 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -4.545 -4.461 -41.150 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -4.029 -6.842 -40.656 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -2.853 -6.863 -41.955 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -1.795 -6.520 -39.821 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -1.586 -5.148 -40.799 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -2.725 -5.128 -39.540 1.00 0.00 H new ATOM 274 N TYR A 54 -7.332 -3.020 -45.975 1.00 0.00 N ATOM 275 CA TYR A 54 -8.032 -1.813 -46.398 1.00 0.00 C ATOM 276 C TYR A 54 -9.298 -2.155 -47.174 1.00 0.00 C ATOM 277 O TYR A 54 -10.408 -1.852 -46.735 1.00 0.00 O ATOM 278 CB TYR A 54 -7.113 -0.930 -47.245 1.00 0.00 C ATOM 279 CG TYR A 54 -6.109 -0.140 -46.434 1.00 0.00 C ATOM 280 CD1 TYR A 54 -6.010 -0.342 -45.065 1.00 0.00 C ATOM 281 CD2 TYR A 54 -5.289 0.787 -47.059 1.00 0.00 C ATOM 282 CE1 TYR A 54 -5.094 0.379 -44.325 1.00 0.00 C ATOM 283 CE2 TYR A 54 -4.373 1.508 -46.319 1.00 0.00 C ATOM 284 CZ TYR A 54 -4.273 1.307 -44.958 1.00 0.00 C ATOM 285 OH TYR A 54 -3.360 2.025 -44.220 1.00 0.00 O ATOM 0 H TYR A 54 -6.484 -3.222 -46.505 1.00 0.00 H new ATOM 0 HA TYR A 54 -8.321 -1.262 -45.503 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -6.578 -1.557 -47.958 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -7.723 -0.238 -47.825 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -6.650 -1.063 -44.578 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -5.367 0.945 -48.125 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -5.015 0.223 -43.259 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -3.734 2.230 -46.806 1.00 0.00 H new ATOM 0 HH TYR A 54 -2.864 2.629 -44.811 1.00 0.00 H new ATOM 295 N VAL A 55 -9.125 -2.787 -48.330 1.00 0.00 N ATOM 296 CA VAL A 55 -10.235 -3.032 -49.243 1.00 0.00 C ATOM 297 C VAL A 55 -10.677 -4.488 -49.195 1.00 0.00 C ATOM 298 O VAL A 55 -11.544 -4.910 -49.960 1.00 0.00 O ATOM 299 CB VAL A 55 -9.831 -2.668 -50.684 1.00 0.00 C ATOM 300 CG1 VAL A 55 -9.493 -1.189 -50.786 1.00 0.00 C ATOM 301 CG2 VAL A 55 -8.651 -3.522 -51.123 1.00 0.00 C ATOM 0 H VAL A 55 -8.225 -3.139 -48.657 1.00 0.00 H new ATOM 0 HA VAL A 55 -11.068 -2.405 -48.927 1.00 0.00 H new ATOM 0 HB VAL A 55 -10.672 -2.868 -51.347 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -9.210 -0.950 -51.811 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -10.363 -0.597 -50.503 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -8.664 -0.958 -50.118 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -8.371 -3.259 -52.143 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -7.806 -3.345 -50.458 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -8.929 -4.575 -51.083 1.00 0.00 H new ATOM 311 N ASN A 56 -10.077 -5.254 -48.290 1.00 0.00 N ATOM 312 CA ASN A 56 -10.487 -6.634 -48.060 1.00 0.00 C ATOM 313 C ASN A 56 -10.291 -7.483 -49.310 1.00 0.00 C ATOM 314 O ASN A 56 -11.024 -8.444 -49.540 1.00 0.00 O ATOM 315 CB ASN A 56 -11.930 -6.692 -47.596 1.00 0.00 C ATOM 316 CG ASN A 56 -12.137 -6.022 -46.266 1.00 0.00 C ATOM 317 OD1 ASN A 56 -11.327 -6.182 -45.344 1.00 0.00 O ATOM 318 ND2 ASN A 56 -13.205 -5.276 -46.147 1.00 0.00 N ATOM 0 H ASN A 56 -9.304 -4.941 -47.703 1.00 0.00 H new ATOM 0 HA ASN A 56 -9.854 -7.045 -47.274 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -12.567 -6.216 -48.342 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -12.244 -7.734 -47.527 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -13.397 -4.797 -45.267 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -13.845 -5.173 -46.934 1.00 0.00 H new ATOM 325 N VAL A 57 -9.299 -7.120 -50.116 1.00 0.00 N ATOM 326 CA VAL A 57 -8.956 -7.891 -51.305 1.00 0.00 C ATOM 327 C VAL A 57 -8.138 -9.124 -50.946 1.00 0.00 C ATOM 328 O VAL A 57 -7.473 -9.159 -49.910 1.00 0.00 O ATOM 329 CB VAL A 57 -8.161 -7.020 -52.296 1.00 0.00 C ATOM 330 CG1 VAL A 57 -6.785 -6.698 -51.735 1.00 0.00 C ATOM 331 CG2 VAL A 57 -8.044 -7.734 -53.634 1.00 0.00 C ATOM 0 H VAL A 57 -8.718 -6.295 -49.967 1.00 0.00 H new ATOM 0 HA VAL A 57 -9.887 -8.215 -51.769 1.00 0.00 H new ATOM 0 HB VAL A 57 -8.693 -6.081 -52.447 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -6.237 -6.082 -52.448 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -6.893 -6.157 -50.795 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -6.238 -7.624 -51.559 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -7.481 -7.112 -54.330 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -7.527 -8.684 -53.496 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -9.040 -7.918 -54.036 1.00 0.00 H new ATOM 341 N SER A 58 -8.190 -10.134 -51.807 1.00 0.00 N ATOM 342 CA SER A 58 -7.423 -11.357 -51.601 1.00 0.00 C ATOM 343 C SER A 58 -6.034 -11.246 -52.218 1.00 0.00 C ATOM 344 O SER A 58 -5.842 -10.557 -53.219 1.00 0.00 O ATOM 345 CB SER A 58 -8.157 -12.541 -52.197 1.00 0.00 C ATOM 346 OG SER A 58 -7.385 -13.707 -52.111 1.00 0.00 O ATOM 0 H SER A 58 -8.756 -10.130 -52.655 1.00 0.00 H new ATOM 0 HA SER A 58 -7.310 -11.506 -50.527 1.00 0.00 H new ATOM 0 HB2 SER A 58 -9.102 -12.687 -51.675 1.00 0.00 H new ATOM 0 HB3 SER A 58 -8.398 -12.336 -53.240 1.00 0.00 H new ATOM 0 HG SER A 58 -7.881 -14.457 -52.501 1.00 0.00 H new ATOM 352 N LEU A 59 -5.067 -11.929 -51.614 1.00 0.00 N ATOM 353 CA LEU A 59 -3.677 -11.831 -52.042 1.00 0.00 C ATOM 354 C LEU A 59 -3.515 -12.265 -53.493 1.00 0.00 C ATOM 355 O LEU A 59 -2.726 -11.686 -54.239 1.00 0.00 O ATOM 356 CB LEU A 59 -2.784 -12.693 -51.141 1.00 0.00 C ATOM 357 CG LEU A 59 -2.685 -12.246 -49.677 1.00 0.00 C ATOM 358 CD1 LEU A 59 -1.887 -13.272 -48.885 1.00 0.00 C ATOM 359 CD2 LEU A 59 -2.033 -10.873 -49.608 1.00 0.00 C ATOM 0 H LEU A 59 -5.221 -12.557 -50.825 1.00 0.00 H new ATOM 0 HA LEU A 59 -3.374 -10.787 -51.960 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -3.157 -13.717 -51.164 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -1.780 -12.710 -51.565 1.00 0.00 H new ATOM 0 HG LEU A 59 -3.681 -12.175 -49.241 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -1.817 -12.954 -47.845 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -2.386 -14.240 -48.936 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -0.885 -13.358 -49.306 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -1.963 -10.555 -48.568 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -1.034 -10.923 -50.041 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -2.635 -10.156 -50.166 1.00 0.00 H new ATOM 371 N ASP A 60 -4.268 -13.285 -53.888 1.00 0.00 N ATOM 372 CA ASP A 60 -4.212 -13.798 -55.252 1.00 0.00 C ATOM 373 C ASP A 60 -4.765 -12.783 -56.244 1.00 0.00 C ATOM 374 O ASP A 60 -4.553 -12.903 -57.451 1.00 0.00 O ATOM 375 CB ASP A 60 -4.992 -15.109 -55.365 1.00 0.00 C ATOM 376 CG ASP A 60 -4.302 -16.271 -54.663 1.00 0.00 C ATOM 377 OD1 ASP A 60 -3.137 -16.155 -54.368 1.00 0.00 O ATOM 378 OD2 ASP A 60 -4.948 -17.265 -54.428 1.00 0.00 O ATOM 0 H ASP A 60 -4.926 -13.774 -53.281 1.00 0.00 H new ATOM 0 HA ASP A 60 -3.165 -13.983 -55.493 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -5.986 -14.972 -54.939 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -5.127 -15.356 -56.418 1.00 0.00 H new ATOM 383 N ASN A 61 -5.475 -11.785 -55.729 1.00 0.00 N ATOM 384 CA ASN A 61 -6.068 -10.753 -56.570 1.00 0.00 C ATOM 385 C ASN A 61 -5.212 -9.494 -56.583 1.00 0.00 C ATOM 386 O ASN A 61 -5.652 -8.436 -57.036 1.00 0.00 O ATOM 387 CB ASN A 61 -7.479 -10.435 -56.110 1.00 0.00 C ATOM 388 CG ASN A 61 -8.443 -11.555 -56.387 1.00 0.00 C ATOM 389 OD1 ASN A 61 -8.266 -12.321 -57.341 1.00 0.00 O ATOM 390 ND2 ASN A 61 -9.460 -11.665 -55.570 1.00 0.00 N ATOM 0 H ASN A 61 -5.654 -11.669 -54.731 1.00 0.00 H new ATOM 0 HA ASN A 61 -6.114 -11.137 -57.589 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -7.470 -10.224 -55.041 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -7.825 -9.530 -56.610 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -10.147 -12.406 -55.708 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -9.565 -11.009 -54.796 1.00 0.00 H new ATOM 397 N ILE A 62 -3.986 -9.612 -56.083 1.00 0.00 N ATOM 398 CA ILE A 62 -3.033 -8.509 -56.122 1.00 0.00 C ATOM 399 C ILE A 62 -1.847 -8.840 -57.019 1.00 0.00 C ATOM 400 O ILE A 62 -1.252 -9.911 -56.910 1.00 0.00 O ATOM 401 CB ILE A 62 -2.528 -8.169 -54.708 1.00 0.00 C ATOM 402 CG1 ILE A 62 -3.703 -7.807 -53.795 1.00 0.00 C ATOM 403 CG2 ILE A 62 -1.523 -7.030 -54.762 1.00 0.00 C ATOM 404 CD1 ILE A 62 -3.331 -7.700 -52.334 1.00 0.00 C ATOM 0 H ILE A 62 -3.629 -10.462 -55.646 1.00 0.00 H new ATOM 0 HA ILE A 62 -3.554 -7.644 -56.532 1.00 0.00 H new ATOM 0 HB ILE A 62 -2.030 -9.047 -54.297 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -4.126 -6.858 -54.123 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -4.483 -8.560 -53.907 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -1.176 -6.803 -53.754 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -0.674 -7.323 -55.380 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -1.997 -6.147 -55.191 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -4.215 -7.441 -51.751 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -2.936 -8.655 -51.988 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -2.573 -6.927 -52.207 1.00 0.00 H new ATOM 416 N ARG A 63 -1.506 -7.911 -57.907 1.00 0.00 N ATOM 417 CA ARG A 63 -0.343 -8.067 -58.771 1.00 0.00 C ATOM 418 C ARG A 63 0.734 -7.043 -58.434 1.00 0.00 C ATOM 419 O ARG A 63 0.496 -5.837 -58.484 1.00 0.00 O ATOM 420 CB ARG A 63 -0.738 -7.920 -60.233 1.00 0.00 C ATOM 421 CG ARG A 63 -1.722 -8.964 -60.737 1.00 0.00 C ATOM 422 CD ARG A 63 -1.099 -10.310 -60.823 1.00 0.00 C ATOM 423 NE ARG A 63 -2.032 -11.308 -61.320 1.00 0.00 N ATOM 424 CZ ARG A 63 -2.892 -12.003 -60.550 1.00 0.00 C ATOM 425 NH1 ARG A 63 -2.926 -11.796 -59.252 1.00 0.00 N ATOM 426 NH2 ARG A 63 -3.702 -12.891 -61.099 1.00 0.00 N ATOM 0 H ARG A 63 -2.020 -7.041 -58.046 1.00 0.00 H new ATOM 0 HA ARG A 63 0.058 -9.067 -58.603 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -1.173 -6.931 -60.379 1.00 0.00 H new ATOM 0 HB3 ARG A 63 0.163 -7.966 -60.844 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -2.584 -9.004 -60.071 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -2.092 -8.671 -61.719 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -0.230 -10.267 -61.479 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -0.740 -10.607 -59.838 1.00 0.00 H new ATOM 0 HE ARG A 63 -2.036 -11.495 -62.323 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -2.302 -11.110 -58.828 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -3.577 -12.322 -58.669 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -3.676 -13.051 -62.106 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -4.353 -13.417 -60.516 1.00 0.00 H new ATOM 440 N ILE A 64 1.921 -7.533 -58.090 1.00 0.00 N ATOM 441 CA ILE A 64 3.045 -6.661 -57.769 1.00 0.00 C ATOM 442 C ILE A 64 4.142 -6.768 -58.820 1.00 0.00 C ATOM 443 O ILE A 64 4.581 -7.866 -59.165 1.00 0.00 O ATOM 444 CB ILE A 64 3.625 -7.001 -56.384 1.00 0.00 C ATOM 445 CG1 ILE A 64 2.515 -7.012 -55.329 1.00 0.00 C ATOM 446 CG2 ILE A 64 4.713 -6.008 -56.005 1.00 0.00 C ATOM 447 CD1 ILE A 64 1.841 -5.673 -55.136 1.00 0.00 C ATOM 0 H ILE A 64 2.129 -8.530 -58.026 1.00 0.00 H new ATOM 0 HA ILE A 64 2.669 -5.638 -57.757 1.00 0.00 H new ATOM 0 HB ILE A 64 4.068 -7.996 -56.428 1.00 0.00 H new ATOM 0 HG12 ILE A 64 1.764 -7.748 -55.614 1.00 0.00 H new ATOM 0 HG13 ILE A 64 2.935 -7.337 -54.377 1.00 0.00 H new ATOM 0 HG21 ILE A 64 5.112 -6.263 -55.023 1.00 0.00 H new ATOM 0 HG22 ILE A 64 5.514 -6.046 -56.743 1.00 0.00 H new ATOM 0 HG23 ILE A 64 4.294 -5.002 -55.976 1.00 0.00 H new ATOM 0 HD11 ILE A 64 1.067 -5.762 -54.374 1.00 0.00 H new ATOM 0 HD12 ILE A 64 2.579 -4.936 -54.820 1.00 0.00 H new ATOM 0 HD13 ILE A 64 1.390 -5.354 -56.076 1.00 0.00 H new ATOM 459 N SER A 65 4.583 -5.622 -59.326 1.00 0.00 N ATOM 460 CA SER A 65 5.619 -5.585 -60.352 1.00 0.00 C ATOM 461 C SER A 65 6.519 -4.367 -60.182 1.00 0.00 C ATOM 462 O SER A 65 6.088 -3.330 -59.679 1.00 0.00 O ATOM 463 CB SER A 65 4.989 -5.570 -61.731 1.00 0.00 C ATOM 464 OG SER A 65 5.969 -5.522 -62.731 1.00 0.00 O ATOM 0 H SER A 65 4.239 -4.705 -59.042 1.00 0.00 H new ATOM 0 HA SER A 65 6.231 -6.481 -60.244 1.00 0.00 H new ATOM 0 HB2 SER A 65 4.373 -6.460 -61.863 1.00 0.00 H new ATOM 0 HB3 SER A 65 4.328 -4.708 -61.823 1.00 0.00 H new ATOM 0 HG SER A 65 5.538 -5.515 -63.611 1.00 0.00 H new ATOM 470 N GLN A 66 7.772 -4.501 -60.604 1.00 0.00 N ATOM 471 CA GLN A 66 8.699 -3.376 -60.621 1.00 0.00 C ATOM 472 C GLN A 66 9.405 -3.264 -61.965 1.00 0.00 C ATOM 473 O GLN A 66 9.883 -4.258 -62.511 1.00 0.00 O ATOM 474 CB GLN A 66 9.730 -3.514 -59.498 1.00 0.00 C ATOM 475 CG GLN A 66 10.718 -2.364 -59.414 1.00 0.00 C ATOM 476 CD GLN A 66 11.689 -2.517 -58.258 1.00 0.00 C ATOM 477 OE1 GLN A 66 11.406 -3.214 -57.280 1.00 0.00 O ATOM 478 NE2 GLN A 66 12.841 -1.864 -58.364 1.00 0.00 N ATOM 0 H GLN A 66 8.169 -5.379 -60.939 1.00 0.00 H new ATOM 0 HA GLN A 66 8.120 -2.466 -60.462 1.00 0.00 H new ATOM 0 HB2 GLN A 66 9.205 -3.597 -58.546 1.00 0.00 H new ATOM 0 HB3 GLN A 66 10.282 -4.443 -59.639 1.00 0.00 H new ATOM 0 HG2 GLN A 66 11.277 -2.300 -60.348 1.00 0.00 H new ATOM 0 HG3 GLN A 66 10.172 -1.427 -59.304 1.00 0.00 H new ATOM 0 HE21 GLN A 66 13.033 -1.299 -59.191 1.00 0.00 H new ATOM 0 HE22 GLN A 66 13.534 -1.928 -57.618 1.00 0.00 H new ATOM 487 N GLU A 67 9.470 -2.046 -62.495 1.00 0.00 N ATOM 488 CA GLU A 67 10.030 -1.817 -63.821 1.00 0.00 C ATOM 489 C GLU A 67 11.008 -0.650 -63.812 1.00 0.00 C ATOM 490 O GLU A 67 10.785 0.354 -63.134 1.00 0.00 O ATOM 491 CB GLU A 67 8.912 -1.550 -64.833 1.00 0.00 C ATOM 492 CG GLU A 67 9.392 -1.367 -66.266 1.00 0.00 C ATOM 493 CD GLU A 67 8.264 -1.185 -67.242 1.00 0.00 C ATOM 494 OE1 GLU A 67 7.135 -1.149 -66.815 1.00 0.00 O ATOM 495 OE2 GLU A 67 8.531 -1.083 -68.416 1.00 0.00 O ATOM 0 H GLU A 67 9.141 -1.202 -62.025 1.00 0.00 H new ATOM 0 HA GLU A 67 10.572 -2.716 -64.114 1.00 0.00 H new ATOM 0 HB2 GLU A 67 8.205 -2.379 -64.802 1.00 0.00 H new ATOM 0 HB3 GLU A 67 8.368 -0.656 -64.528 1.00 0.00 H new ATOM 0 HG2 GLU A 67 10.051 -0.501 -66.315 1.00 0.00 H new ATOM 0 HG3 GLU A 67 9.983 -2.235 -66.559 1.00 0.00 H new ATOM 502 N LYS A 68 12.092 -0.786 -64.568 1.00 0.00 N ATOM 503 CA LYS A 68 13.056 0.296 -64.728 1.00 0.00 C ATOM 504 C LYS A 68 12.807 1.068 -66.017 1.00 0.00 C ATOM 505 O LYS A 68 12.975 0.535 -67.114 1.00 0.00 O ATOM 506 CB LYS A 68 14.483 -0.252 -64.710 1.00 0.00 C ATOM 507 CG LYS A 68 15.567 0.818 -64.681 1.00 0.00 C ATOM 508 CD LYS A 68 16.955 0.202 -64.777 1.00 0.00 C ATOM 509 CE LYS A 68 17.253 -0.683 -63.575 1.00 0.00 C ATOM 510 NZ LYS A 68 17.354 0.105 -62.317 1.00 0.00 N ATOM 0 H LYS A 68 12.325 -1.637 -65.080 1.00 0.00 H new ATOM 0 HA LYS A 68 12.930 0.982 -63.890 1.00 0.00 H new ATOM 0 HB2 LYS A 68 14.601 -0.896 -63.838 1.00 0.00 H new ATOM 0 HB3 LYS A 68 14.630 -0.878 -65.590 1.00 0.00 H new ATOM 0 HG2 LYS A 68 15.417 1.513 -65.507 1.00 0.00 H new ATOM 0 HG3 LYS A 68 15.486 1.396 -63.760 1.00 0.00 H new ATOM 0 HD2 LYS A 68 17.032 -0.386 -65.692 1.00 0.00 H new ATOM 0 HD3 LYS A 68 17.702 0.993 -64.843 1.00 0.00 H new ATOM 0 HE2 LYS A 68 16.468 -1.432 -63.472 1.00 0.00 H new ATOM 0 HE3 LYS A 68 18.186 -1.221 -63.743 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 17.905 -0.430 -61.616 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 17.827 1.010 -62.512 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 16.400 0.286 -61.943 1.00 0.00 H new ATOM 524 N GLN A 69 12.407 2.327 -65.878 1.00 0.00 N ATOM 525 CA GLN A 69 12.004 3.135 -67.024 1.00 0.00 C ATOM 526 C GLN A 69 12.488 4.572 -66.884 1.00 0.00 C ATOM 527 O GLN A 69 12.240 5.224 -65.869 1.00 0.00 O ATOM 528 CB GLN A 69 10.482 3.109 -67.189 1.00 0.00 C ATOM 529 CG GLN A 69 9.969 3.931 -68.359 1.00 0.00 C ATOM 530 CD GLN A 69 10.332 3.318 -69.699 1.00 0.00 C ATOM 531 OE1 GLN A 69 10.034 2.150 -69.965 1.00 0.00 O ATOM 532 NE2 GLN A 69 10.979 4.105 -70.552 1.00 0.00 N ATOM 0 H GLN A 69 12.353 2.811 -64.982 1.00 0.00 H new ATOM 0 HA GLN A 69 12.466 2.705 -67.913 1.00 0.00 H new ATOM 0 HB2 GLN A 69 10.159 2.076 -67.316 1.00 0.00 H new ATOM 0 HB3 GLN A 69 10.022 3.476 -66.272 1.00 0.00 H new ATOM 0 HG2 GLN A 69 8.885 4.024 -68.287 1.00 0.00 H new ATOM 0 HG3 GLN A 69 10.380 4.939 -68.300 1.00 0.00 H new ATOM 0 HE21 GLN A 69 11.205 5.064 -70.290 1.00 0.00 H new ATOM 0 HE22 GLN A 69 11.250 3.750 -71.469 1.00 0.00 H new ATOM 541 N ASP A 70 13.179 5.061 -67.908 1.00 0.00 N ATOM 542 CA ASP A 70 13.680 6.431 -67.910 1.00 0.00 C ATOM 543 C ASP A 70 14.657 6.662 -66.764 1.00 0.00 C ATOM 544 O ASP A 70 14.803 7.782 -66.277 1.00 0.00 O ATOM 545 CB ASP A 70 12.521 7.425 -67.808 1.00 0.00 C ATOM 546 CG ASP A 70 11.552 7.328 -68.978 1.00 0.00 C ATOM 547 OD1 ASP A 70 11.941 6.827 -70.006 1.00 0.00 O ATOM 548 OD2 ASP A 70 10.432 7.756 -68.833 1.00 0.00 O ATOM 0 H ASP A 70 13.405 4.529 -68.748 1.00 0.00 H new ATOM 0 HA ASP A 70 14.207 6.589 -68.851 1.00 0.00 H new ATOM 0 HB2 ASP A 70 11.979 7.249 -66.879 1.00 0.00 H new ATOM 0 HB3 ASP A 70 12.921 8.438 -67.757 1.00 0.00 H new ATOM 553 N GLY A 71 15.325 5.595 -66.339 1.00 0.00 N ATOM 554 CA GLY A 71 16.381 5.700 -65.339 1.00 0.00 C ATOM 555 C GLY A 71 15.845 5.418 -63.941 1.00 0.00 C ATOM 556 O GLY A 71 16.610 5.145 -63.016 1.00 0.00 O ATOM 0 H GLY A 71 15.153 4.646 -66.672 1.00 0.00 H new ATOM 0 HA2 GLY A 71 17.180 4.996 -65.574 1.00 0.00 H new ATOM 0 HA3 GLY A 71 16.817 6.699 -65.370 1.00 0.00 H new ATOM 560 N MET A 72 14.526 5.485 -63.793 1.00 0.00 N ATOM 561 CA MET A 72 13.896 5.380 -62.483 1.00 0.00 C ATOM 562 C MET A 72 13.289 3.999 -62.272 1.00 0.00 C ATOM 563 O MET A 72 12.898 3.330 -63.229 1.00 0.00 O ATOM 564 CB MET A 72 12.829 6.462 -62.322 1.00 0.00 C ATOM 565 CG MET A 72 13.321 7.877 -62.594 1.00 0.00 C ATOM 566 SD MET A 72 14.602 8.401 -61.437 1.00 0.00 S ATOM 567 CE MET A 72 13.643 8.603 -59.939 1.00 0.00 C ATOM 0 H MET A 72 13.872 5.612 -64.566 1.00 0.00 H new ATOM 0 HA MET A 72 14.665 5.526 -61.725 1.00 0.00 H new ATOM 0 HB2 MET A 72 12.002 6.242 -62.997 1.00 0.00 H new ATOM 0 HB3 MET A 72 12.433 6.417 -61.307 1.00 0.00 H new ATOM 0 HG2 MET A 72 13.710 7.933 -63.611 1.00 0.00 H new ATOM 0 HG3 MET A 72 12.480 8.568 -62.536 1.00 0.00 H new ATOM 0 HE1 MET A 72 14.269 9.043 -59.163 1.00 0.00 H new ATOM 0 HE2 MET A 72 12.794 9.258 -60.136 1.00 0.00 H new ATOM 0 HE3 MET A 72 13.281 7.631 -59.605 1.00 0.00 H new ATOM 577 N ASP A 73 13.213 3.577 -61.015 1.00 0.00 N ATOM 578 CA ASP A 73 12.587 2.307 -60.669 1.00 0.00 C ATOM 579 C ASP A 73 11.176 2.515 -60.133 1.00 0.00 C ATOM 580 O ASP A 73 10.980 3.184 -59.118 1.00 0.00 O ATOM 581 CB ASP A 73 13.428 1.558 -59.633 1.00 0.00 C ATOM 582 CG ASP A 73 14.747 1.048 -60.197 1.00 0.00 C ATOM 583 OD1 ASP A 73 14.872 0.982 -61.397 1.00 0.00 O ATOM 584 OD2 ASP A 73 15.617 0.730 -59.422 1.00 0.00 O ATOM 0 H ASP A 73 13.578 4.097 -60.217 1.00 0.00 H new ATOM 0 HA ASP A 73 12.526 1.711 -61.579 1.00 0.00 H new ATOM 0 HB2 ASP A 73 13.630 2.219 -58.790 1.00 0.00 H new ATOM 0 HB3 ASP A 73 12.854 0.716 -59.247 1.00 0.00 H new ATOM 589 N VAL A 74 10.196 1.939 -60.820 1.00 0.00 N ATOM 590 CA VAL A 74 8.793 2.175 -60.499 1.00 0.00 C ATOM 591 C VAL A 74 8.127 0.909 -59.976 1.00 0.00 C ATOM 592 O VAL A 74 8.076 -0.108 -60.667 1.00 0.00 O ATOM 593 CB VAL A 74 8.036 2.672 -61.745 1.00 0.00 C ATOM 594 CG1 VAL A 74 6.566 2.889 -61.424 1.00 0.00 C ATOM 595 CG2 VAL A 74 8.671 3.956 -62.258 1.00 0.00 C ATOM 0 H VAL A 74 10.347 1.304 -61.604 1.00 0.00 H new ATOM 0 HA VAL A 74 8.755 2.937 -59.720 1.00 0.00 H new ATOM 0 HB VAL A 74 8.102 1.914 -62.525 1.00 0.00 H new ATOM 0 HG11 VAL A 74 6.047 3.240 -62.316 1.00 0.00 H new ATOM 0 HG12 VAL A 74 6.123 1.950 -61.093 1.00 0.00 H new ATOM 0 HG13 VAL A 74 6.472 3.633 -60.633 1.00 0.00 H new ATOM 0 HG21 VAL A 74 8.131 4.302 -63.139 1.00 0.00 H new ATOM 0 HG22 VAL A 74 8.626 4.720 -61.482 1.00 0.00 H new ATOM 0 HG23 VAL A 74 9.712 3.767 -62.521 1.00 0.00 H new ATOM 605 N LEU A 75 7.619 0.977 -58.750 1.00 0.00 N ATOM 606 CA LEU A 75 6.790 -0.090 -58.204 1.00 0.00 C ATOM 607 C LEU A 75 5.355 0.015 -58.706 1.00 0.00 C ATOM 608 O LEU A 75 4.826 1.113 -58.880 1.00 0.00 O ATOM 609 CB LEU A 75 6.807 -0.042 -56.671 1.00 0.00 C ATOM 610 CG LEU A 75 8.181 -0.225 -56.015 1.00 0.00 C ATOM 611 CD1 LEU A 75 8.069 0.037 -54.519 1.00 0.00 C ATOM 612 CD2 LEU A 75 8.690 -1.633 -56.287 1.00 0.00 C ATOM 0 H LEU A 75 7.768 1.761 -58.115 1.00 0.00 H new ATOM 0 HA LEU A 75 7.203 -1.041 -58.541 1.00 0.00 H new ATOM 0 HB2 LEU A 75 6.397 0.916 -56.351 1.00 0.00 H new ATOM 0 HB3 LEU A 75 6.139 -0.816 -56.294 1.00 0.00 H new ATOM 0 HG LEU A 75 8.893 0.485 -56.436 1.00 0.00 H new ATOM 0 HD11 LEU A 75 9.046 -0.093 -54.053 1.00 0.00 H new ATOM 0 HD12 LEU A 75 7.721 1.056 -54.353 1.00 0.00 H new ATOM 0 HD13 LEU A 75 7.360 -0.665 -54.079 1.00 0.00 H new ATOM 0 HD21 LEU A 75 9.667 -1.763 -55.821 1.00 0.00 H new ATOM 0 HD22 LEU A 75 7.990 -2.359 -55.873 1.00 0.00 H new ATOM 0 HD23 LEU A 75 8.778 -1.787 -57.363 1.00 0.00 H new ATOM 624 N GLU A 76 4.729 -1.134 -58.937 1.00 0.00 N ATOM 625 CA GLU A 76 3.371 -1.174 -59.464 1.00 0.00 C ATOM 626 C GLU A 76 2.499 -2.137 -58.668 1.00 0.00 C ATOM 627 O GLU A 76 2.843 -3.307 -58.502 1.00 0.00 O ATOM 628 CB GLU A 76 3.381 -1.580 -60.939 1.00 0.00 C ATOM 629 CG GLU A 76 2.004 -1.655 -61.581 1.00 0.00 C ATOM 630 CD GLU A 76 2.057 -2.011 -63.041 1.00 0.00 C ATOM 631 OE1 GLU A 76 3.046 -1.719 -63.668 1.00 0.00 O ATOM 632 OE2 GLU A 76 1.107 -2.577 -63.529 1.00 0.00 O ATOM 0 H GLU A 76 5.142 -2.051 -58.767 1.00 0.00 H new ATOM 0 HA GLU A 76 2.950 -0.173 -59.372 1.00 0.00 H new ATOM 0 HB2 GLU A 76 3.989 -0.867 -61.495 1.00 0.00 H new ATOM 0 HB3 GLU A 76 3.865 -2.552 -61.032 1.00 0.00 H new ATOM 0 HG2 GLU A 76 1.403 -2.395 -61.053 1.00 0.00 H new ATOM 0 HG3 GLU A 76 1.502 -0.695 -61.464 1.00 0.00 H new ATOM 639 N LEU A 77 1.369 -1.639 -58.179 1.00 0.00 N ATOM 640 CA LEU A 77 0.391 -2.481 -57.501 1.00 0.00 C ATOM 641 C LEU A 77 -0.953 -2.449 -58.217 1.00 0.00 C ATOM 642 O LEU A 77 -1.492 -1.380 -58.500 1.00 0.00 O ATOM 643 CB LEU A 77 0.213 -2.024 -56.048 1.00 0.00 C ATOM 644 CG LEU A 77 1.450 -2.166 -55.150 1.00 0.00 C ATOM 645 CD1 LEU A 77 2.284 -0.895 -55.229 1.00 0.00 C ATOM 646 CD2 LEU A 77 1.009 -2.444 -53.720 1.00 0.00 C ATOM 0 H LEU A 77 1.107 -0.655 -58.240 1.00 0.00 H new ATOM 0 HA LEU A 77 0.765 -3.505 -57.515 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -0.094 -0.978 -56.050 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -0.603 -2.594 -55.604 1.00 0.00 H new ATOM 0 HG LEU A 77 2.064 -3.001 -55.489 1.00 0.00 H new ATOM 0 HD11 LEU A 77 3.162 -0.996 -54.591 1.00 0.00 H new ATOM 0 HD12 LEU A 77 2.600 -0.731 -56.259 1.00 0.00 H new ATOM 0 HD13 LEU A 77 1.687 -0.047 -54.893 1.00 0.00 H new ATOM 0 HD21 LEU A 77 1.887 -2.545 -53.082 1.00 0.00 H new ATOM 0 HD22 LEU A 77 0.393 -1.619 -53.362 1.00 0.00 H new ATOM 0 HD23 LEU A 77 0.431 -3.368 -53.691 1.00 0.00 H new ATOM 658 N ASN A 78 -1.492 -3.630 -58.508 1.00 0.00 N ATOM 659 CA ASN A 78 -2.808 -3.740 -59.125 1.00 0.00 C ATOM 660 C ASN A 78 -3.758 -4.551 -58.253 1.00 0.00 C ATOM 661 O ASN A 78 -3.482 -5.704 -57.923 1.00 0.00 O ATOM 662 CB ASN A 78 -2.699 -4.353 -60.509 1.00 0.00 C ATOM 663 CG ASN A 78 -1.911 -3.495 -61.460 1.00 0.00 C ATOM 664 OD1 ASN A 78 -2.310 -2.369 -61.776 1.00 0.00 O ATOM 665 ND2 ASN A 78 -0.799 -4.008 -61.924 1.00 0.00 N ATOM 0 H ASN A 78 -1.036 -4.524 -58.326 1.00 0.00 H new ATOM 0 HA ASN A 78 -3.218 -2.735 -59.223 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -2.227 -5.332 -60.433 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -3.699 -4.512 -60.912 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -0.223 -3.473 -62.574 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -0.509 -4.942 -61.635 1.00 0.00 H new ATOM 672 N ILE A 79 -4.879 -3.941 -57.883 1.00 0.00 N ATOM 673 CA ILE A 79 -5.820 -4.562 -56.958 1.00 0.00 C ATOM 674 C ILE A 79 -7.182 -4.760 -57.610 1.00 0.00 C ATOM 675 O ILE A 79 -7.897 -3.796 -57.883 1.00 0.00 O ATOM 676 CB ILE A 79 -5.978 -3.712 -55.683 1.00 0.00 C ATOM 677 CG1 ILE A 79 -4.618 -3.492 -55.016 1.00 0.00 C ATOM 678 CG2 ILE A 79 -6.947 -4.378 -54.718 1.00 0.00 C ATOM 679 CD1 ILE A 79 -3.923 -2.223 -55.453 1.00 0.00 C ATOM 0 H ILE A 79 -5.158 -3.016 -58.210 1.00 0.00 H new ATOM 0 HA ILE A 79 -5.415 -5.537 -56.688 1.00 0.00 H new ATOM 0 HB ILE A 79 -6.385 -2.740 -55.962 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -4.754 -3.467 -53.935 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -3.973 -4.343 -55.237 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -7.048 -3.765 -53.822 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -7.921 -4.485 -55.196 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -6.568 -5.362 -54.443 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -2.966 -2.136 -54.938 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -3.754 -2.253 -56.529 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -4.547 -1.363 -55.207 1.00 0.00 H new ATOM 691 N THR A 80 -7.537 -6.017 -57.856 1.00 0.00 N ATOM 692 CA THR A 80 -8.800 -6.342 -58.507 1.00 0.00 C ATOM 693 C THR A 80 -9.932 -6.447 -57.493 1.00 0.00 C ATOM 694 O THR A 80 -9.917 -7.311 -56.617 1.00 0.00 O ATOM 695 CB THR A 80 -8.693 -7.659 -59.299 1.00 0.00 C ATOM 696 OG1 THR A 80 -7.681 -7.532 -60.307 1.00 0.00 O ATOM 697 CG2 THR A 80 -10.021 -7.995 -59.958 1.00 0.00 C ATOM 0 H THR A 80 -6.967 -6.827 -57.614 1.00 0.00 H new ATOM 0 HA THR A 80 -9.023 -5.530 -59.200 1.00 0.00 H new ATOM 0 HB THR A 80 -8.430 -8.460 -58.609 1.00 0.00 H new ATOM 0 HG1 THR A 80 -7.612 -8.371 -60.809 1.00 0.00 H new ATOM 0 HG21 THR A 80 -9.926 -8.928 -60.513 1.00 0.00 H new ATOM 0 HG22 THR A 80 -10.790 -8.104 -59.193 1.00 0.00 H new ATOM 0 HG23 THR A 80 -10.301 -7.193 -60.642 1.00 0.00 H new ATOM 705 N LEU A 81 -10.913 -5.560 -57.617 1.00 0.00 N ATOM 706 CA LEU A 81 -12.055 -5.548 -56.710 1.00 0.00 C ATOM 707 C LEU A 81 -13.351 -5.848 -57.453 1.00 0.00 C ATOM 708 O LEU A 81 -14.013 -6.801 -57.146 1.00 0.00 O ATOM 709 CB LEU A 81 -12.162 -4.188 -56.009 1.00 0.00 C ATOM 710 CG LEU A 81 -10.947 -3.776 -55.170 1.00 0.00 C ATOM 711 CD1 LEU A 81 -11.152 -2.362 -54.640 1.00 0.00 C ATOM 712 CD2 LEU A 81 -10.757 -4.764 -54.030 1.00 0.00 C ATOM 0 H LEU A 81 -10.940 -4.839 -58.338 1.00 0.00 H new ATOM 0 HA LEU A 81 -11.898 -6.327 -55.964 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -12.335 -3.422 -56.765 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -13.039 -4.201 -55.363 1.00 0.00 H new ATOM 0 HG LEU A 81 -10.048 -3.786 -55.787 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -10.288 -2.068 -54.043 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -11.266 -1.673 -55.477 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -12.048 -2.332 -54.020 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -9.893 -4.470 -53.434 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -11.647 -4.769 -53.401 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -10.595 -5.762 -54.437 1.00 0.00 H new ATOM 725 N ASP B 38 -16.057 8.373 -50.924 1.00 0.00 N ATOM 726 CA ASP B 38 -15.703 8.768 -49.566 1.00 0.00 C ATOM 727 C ASP B 38 -14.903 7.676 -48.866 1.00 0.00 C ATOM 728 O ASP B 38 -14.143 7.950 -47.937 1.00 0.00 O ATOM 729 CB ASP B 38 -16.961 9.087 -48.754 1.00 0.00 C ATOM 730 CG ASP B 38 -17.719 10.296 -49.286 1.00 0.00 C ATOM 731 OD1 ASP B 38 -17.101 11.313 -49.500 1.00 0.00 O ATOM 732 OD2 ASP B 38 -18.907 10.193 -49.472 1.00 0.00 O ATOM 0 HA ASP B 38 -15.084 9.662 -49.633 1.00 0.00 H new ATOM 0 HB2 ASP B 38 -17.621 8.219 -48.760 1.00 0.00 H new ATOM 0 HB3 ASP B 38 -16.681 9.268 -47.716 1.00 0.00 H new ATOM 737 N TYR B 39 -15.080 6.440 -49.317 1.00 0.00 N ATOM 738 CA TYR B 39 -14.428 5.295 -48.691 1.00 0.00 C ATOM 739 C TYR B 39 -13.032 5.077 -49.259 1.00 0.00 C ATOM 740 O TYR B 39 -12.038 5.162 -48.537 1.00 0.00 O ATOM 741 CB TYR B 39 -15.277 4.033 -48.868 1.00 0.00 C ATOM 742 CG TYR B 39 -14.694 2.807 -48.201 1.00 0.00 C ATOM 743 CD1 TYR B 39 -14.690 2.706 -46.818 1.00 0.00 C ATOM 744 CD2 TYR B 39 -14.163 1.785 -48.973 1.00 0.00 C ATOM 745 CE1 TYR B 39 -14.157 1.586 -46.208 1.00 0.00 C ATOM 746 CE2 TYR B 39 -13.630 0.665 -48.364 1.00 0.00 C ATOM 747 CZ TYR B 39 -13.626 0.564 -46.987 1.00 0.00 C ATOM 748 OH TYR B 39 -13.096 -0.551 -46.381 1.00 0.00 O ATOM 0 H TYR B 39 -15.670 6.204 -50.115 1.00 0.00 H new ATOM 0 HA TYR B 39 -14.330 5.507 -47.626 1.00 0.00 H new ATOM 0 HB2 TYR B 39 -16.273 4.216 -48.464 1.00 0.00 H new ATOM 0 HB3 TYR B 39 -15.397 3.833 -49.933 1.00 0.00 H new ATOM 0 HD1 TYR B 39 -15.103 3.503 -46.217 1.00 0.00 H new ATOM 0 HD2 TYR B 39 -14.166 1.864 -50.050 1.00 0.00 H new ATOM 0 HE1 TYR B 39 -14.153 1.505 -45.131 1.00 0.00 H new ATOM 0 HE2 TYR B 39 -13.217 -0.131 -48.965 1.00 0.00 H new ATOM 0 HH TYR B 39 -12.191 -0.709 -46.722 1.00 0.00 H new ATOM 758 N LEU B 40 -12.964 4.795 -50.555 1.00 0.00 N ATOM 759 CA LEU B 40 -11.707 4.419 -51.192 1.00 0.00 C ATOM 760 C LEU B 40 -10.738 5.593 -51.236 1.00 0.00 C ATOM 761 O LEU B 40 -9.539 5.429 -51.007 1.00 0.00 O ATOM 762 CB LEU B 40 -11.967 3.908 -52.615 1.00 0.00 C ATOM 763 CG LEU B 40 -12.686 2.556 -52.717 1.00 0.00 C ATOM 764 CD1 LEU B 40 -13.011 2.262 -54.175 1.00 0.00 C ATOM 765 CD2 LEU B 40 -11.805 1.468 -52.123 1.00 0.00 C ATOM 0 H LEU B 40 -13.765 4.820 -51.186 1.00 0.00 H new ATOM 0 HA LEU B 40 -11.256 3.624 -50.598 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -12.558 4.654 -53.146 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -11.011 3.830 -53.133 1.00 0.00 H new ATOM 0 HG LEU B 40 -13.620 2.587 -52.156 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -13.522 1.302 -54.247 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -13.656 3.047 -54.569 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -12.088 2.227 -54.754 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -12.315 0.507 -52.195 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -10.864 1.422 -52.672 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -11.603 1.694 -51.076 1.00 0.00 H new ATOM 777 N PRO B 41 -11.264 6.776 -51.531 1.00 0.00 N ATOM 778 CA PRO B 41 -10.440 7.976 -51.636 1.00 0.00 C ATOM 779 C PRO B 41 -9.556 8.146 -50.408 1.00 0.00 C ATOM 780 O PRO B 41 -8.406 8.572 -50.513 1.00 0.00 O ATOM 781 CB PRO B 41 -11.478 9.098 -51.745 1.00 0.00 C ATOM 782 CG PRO B 41 -12.618 8.471 -52.473 1.00 0.00 C ATOM 783 CD PRO B 41 -12.704 7.079 -51.908 1.00 0.00 C ATOM 0 HA PRO B 41 -9.749 7.953 -52.479 1.00 0.00 H new ATOM 0 HB2 PRO B 41 -11.782 9.456 -50.762 1.00 0.00 H new ATOM 0 HB3 PRO B 41 -11.082 9.956 -52.288 1.00 0.00 H new ATOM 0 HG2 PRO B 41 -13.544 9.023 -52.312 1.00 0.00 H new ATOM 0 HG3 PRO B 41 -12.441 8.453 -53.548 1.00 0.00 H new ATOM 0 HD2 PRO B 41 -13.366 7.034 -51.043 1.00 0.00 H new ATOM 0 HD3 PRO B 41 -13.088 6.369 -52.640 1.00 0.00 H new ATOM 791 N THR B 42 -10.100 7.811 -49.243 1.00 0.00 N ATOM 792 CA THR B 42 -9.365 7.937 -47.990 1.00 0.00 C ATOM 793 C THR B 42 -8.357 6.806 -47.827 1.00 0.00 C ATOM 794 O THR B 42 -7.275 7.001 -47.272 1.00 0.00 O ATOM 795 CB THR B 42 -10.323 7.954 -46.784 1.00 0.00 C ATOM 796 OG1 THR B 42 -11.051 6.721 -46.731 1.00 0.00 O ATOM 797 CG2 THR B 42 -11.301 9.112 -46.898 1.00 0.00 C ATOM 0 H THR B 42 -11.048 7.450 -49.140 1.00 0.00 H new ATOM 0 HA THR B 42 -8.827 8.884 -48.025 1.00 0.00 H new ATOM 0 HB THR B 42 -9.736 8.076 -45.874 1.00 0.00 H new ATOM 0 HG1 THR B 42 -11.026 6.288 -47.610 1.00 0.00 H new ATOM 0 HG21 THR B 42 -11.970 9.109 -46.038 1.00 0.00 H new ATOM 0 HG22 THR B 42 -10.750 10.052 -46.926 1.00 0.00 H new ATOM 0 HG23 THR B 42 -11.885 9.006 -47.812 1.00 0.00 H new ATOM 805 N LEU B 43 -8.718 5.623 -48.313 1.00 0.00 N ATOM 806 CA LEU B 43 -7.805 4.487 -48.323 1.00 0.00 C ATOM 807 C LEU B 43 -6.649 4.720 -49.288 1.00 0.00 C ATOM 808 O LEU B 43 -5.545 4.215 -49.082 1.00 0.00 O ATOM 809 CB LEU B 43 -8.555 3.207 -48.713 1.00 0.00 C ATOM 810 CG LEU B 43 -9.586 2.704 -47.694 1.00 0.00 C ATOM 811 CD1 LEU B 43 -10.279 1.464 -48.242 1.00 0.00 C ATOM 812 CD2 LEU B 43 -8.892 2.405 -46.374 1.00 0.00 C ATOM 0 H LEU B 43 -9.639 5.426 -48.706 1.00 0.00 H new ATOM 0 HA LEU B 43 -7.398 4.375 -47.318 1.00 0.00 H new ATOM 0 HB2 LEU B 43 -9.063 3.380 -49.661 1.00 0.00 H new ATOM 0 HB3 LEU B 43 -7.824 2.417 -48.883 1.00 0.00 H new ATOM 0 HG LEU B 43 -10.341 3.470 -47.519 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -11.011 1.107 -47.518 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -10.783 1.712 -49.176 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -9.539 0.685 -48.425 1.00 0.00 H new ATOM 0 HD21 LEU B 43 -9.625 2.048 -45.650 1.00 0.00 H new ATOM 0 HD22 LEU B 43 -8.131 1.640 -46.528 1.00 0.00 H new ATOM 0 HD23 LEU B 43 -8.422 3.313 -45.996 1.00 0.00 H new ATOM 824 N ARG B 44 -6.910 5.484 -50.342 1.00 0.00 N ATOM 825 CA ARG B 44 -5.870 5.858 -51.294 1.00 0.00 C ATOM 826 C ARG B 44 -4.782 6.689 -50.623 1.00 0.00 C ATOM 827 O ARG B 44 -3.593 6.415 -50.781 1.00 0.00 O ATOM 828 CB ARG B 44 -6.462 6.646 -52.453 1.00 0.00 C ATOM 829 CG ARG B 44 -7.337 5.835 -53.396 1.00 0.00 C ATOM 830 CD ARG B 44 -7.947 6.688 -54.448 1.00 0.00 C ATOM 831 NE ARG B 44 -8.851 5.932 -55.301 1.00 0.00 N ATOM 832 CZ ARG B 44 -9.641 6.474 -56.248 1.00 0.00 C ATOM 833 NH1 ARG B 44 -9.629 7.772 -56.450 1.00 0.00 N ATOM 834 NH2 ARG B 44 -10.429 5.700 -56.974 1.00 0.00 N ATOM 0 H ARG B 44 -7.834 5.857 -50.560 1.00 0.00 H new ATOM 0 HA ARG B 44 -5.426 4.937 -51.672 1.00 0.00 H new ATOM 0 HB2 ARG B 44 -7.052 7.469 -52.050 1.00 0.00 H new ATOM 0 HB3 ARG B 44 -5.648 7.089 -53.026 1.00 0.00 H new ATOM 0 HG2 ARG B 44 -6.740 5.052 -53.863 1.00 0.00 H new ATOM 0 HG3 ARG B 44 -8.124 5.340 -52.827 1.00 0.00 H new ATOM 0 HD2 ARG B 44 -8.490 7.509 -53.980 1.00 0.00 H new ATOM 0 HD3 ARG B 44 -7.160 7.133 -55.057 1.00 0.00 H new ATOM 0 HE ARG B 44 -8.889 4.921 -55.173 1.00 0.00 H new ATOM 0 HH11 ARG B 44 -9.021 8.370 -55.890 1.00 0.00 H new ATOM 0 HH12 ARG B 44 -10.227 8.182 -57.167 1.00 0.00 H new ATOM 0 HH21 ARG B 44 -10.439 4.692 -56.817 1.00 0.00 H new ATOM 0 HH22 ARG B 44 -11.027 6.111 -57.691 1.00 0.00 H new ATOM 848 N LYS B 45 -5.198 7.704 -49.874 1.00 0.00 N ATOM 849 CA LYS B 45 -4.269 8.509 -49.090 1.00 0.00 C ATOM 850 C LYS B 45 -3.533 7.655 -48.064 1.00 0.00 C ATOM 851 O LYS B 45 -2.327 7.805 -47.868 1.00 0.00 O ATOM 852 CB LYS B 45 -5.007 9.652 -48.391 1.00 0.00 C ATOM 853 CG LYS B 45 -4.111 10.569 -47.569 1.00 0.00 C ATOM 854 CD LYS B 45 -4.894 11.746 -47.006 1.00 0.00 C ATOM 855 CE LYS B 45 -3.981 12.719 -46.274 1.00 0.00 C ATOM 856 NZ LYS B 45 -3.534 12.182 -44.960 1.00 0.00 N ATOM 0 H LYS B 45 -6.174 7.989 -49.793 1.00 0.00 H new ATOM 0 HA LYS B 45 -3.533 8.931 -49.774 1.00 0.00 H new ATOM 0 HB2 LYS B 45 -5.524 10.248 -49.143 1.00 0.00 H new ATOM 0 HB3 LYS B 45 -5.771 9.230 -47.738 1.00 0.00 H new ATOM 0 HG2 LYS B 45 -3.661 10.005 -46.752 1.00 0.00 H new ATOM 0 HG3 LYS B 45 -3.295 10.936 -48.191 1.00 0.00 H new ATOM 0 HD2 LYS B 45 -5.407 12.265 -47.816 1.00 0.00 H new ATOM 0 HD3 LYS B 45 -5.662 11.382 -46.324 1.00 0.00 H new ATOM 0 HE2 LYS B 45 -3.110 12.935 -46.893 1.00 0.00 H new ATOM 0 HE3 LYS B 45 -4.505 13.663 -46.121 1.00 0.00 H new ATOM 0 HZ1 LYS B 45 -2.799 12.802 -44.564 1.00 0.00 H new ATOM 0 HZ2 LYS B 45 -4.343 12.143 -44.307 1.00 0.00 H new ATOM 0 HZ3 LYS B 45 -3.148 11.225 -45.089 1.00 0.00 H new ATOM 870 N GLU B 46 -4.266 6.762 -47.410 1.00 0.00 N ATOM 871 CA GLU B 46 -3.682 5.870 -46.416 1.00 0.00 C ATOM 872 C GLU B 46 -2.560 5.033 -47.019 1.00 0.00 C ATOM 873 O GLU B 46 -1.505 4.861 -46.409 1.00 0.00 O ATOM 874 CB GLU B 46 -4.751 4.968 -45.818 1.00 0.00 C ATOM 0 H GLU B 46 -5.268 6.636 -47.551 1.00 0.00 H new ATOM 0 HA GLU B 46 -3.256 6.485 -45.623 1.00 0.00 H new ATOM 879 N LEU B 47 -2.796 4.514 -48.219 1.00 0.00 N ATOM 880 CA LEU B 47 -1.798 3.711 -48.916 1.00 0.00 C ATOM 881 C LEU B 47 -0.567 4.540 -49.259 1.00 0.00 C ATOM 882 O LEU B 47 0.564 4.062 -49.155 1.00 0.00 O ATOM 883 CB LEU B 47 -2.396 3.117 -50.197 1.00 0.00 C ATOM 884 CG LEU B 47 -3.410 1.984 -49.995 1.00 0.00 C ATOM 885 CD1 LEU B 47 -4.099 1.677 -51.317 1.00 0.00 C ATOM 886 CD2 LEU B 47 -2.697 0.755 -49.452 1.00 0.00 C ATOM 0 H LEU B 47 -3.671 4.635 -48.730 1.00 0.00 H new ATOM 0 HA LEU B 47 -1.494 2.903 -48.251 1.00 0.00 H new ATOM 0 HB2 LEU B 47 -2.881 3.918 -50.755 1.00 0.00 H new ATOM 0 HB3 LEU B 47 -1.581 2.744 -50.817 1.00 0.00 H new ATOM 0 HG LEU B 47 -4.169 2.288 -49.274 1.00 0.00 H new ATOM 0 HD11 LEU B 47 -4.820 0.872 -51.173 1.00 0.00 H new ATOM 0 HD12 LEU B 47 -4.616 2.568 -51.673 1.00 0.00 H new ATOM 0 HD13 LEU B 47 -3.355 1.371 -52.053 1.00 0.00 H new ATOM 0 HD21 LEU B 47 -3.418 -0.050 -49.308 1.00 0.00 H new ATOM 0 HD22 LEU B 47 -1.932 0.436 -50.160 1.00 0.00 H new ATOM 0 HD23 LEU B 47 -2.229 0.998 -48.498 1.00 0.00 H new ATOM 898 N MET B 48 -0.792 5.782 -49.670 1.00 0.00 N ATOM 899 CA MET B 48 0.301 6.703 -49.961 1.00 0.00 C ATOM 900 C MET B 48 1.165 6.940 -48.729 1.00 0.00 C ATOM 901 O MET B 48 2.392 6.978 -48.817 1.00 0.00 O ATOM 902 CB MET B 48 -0.250 8.027 -50.488 1.00 0.00 C ATOM 903 CG MET B 48 -0.910 7.934 -51.857 1.00 0.00 C ATOM 904 SD MET B 48 -1.696 9.479 -52.356 1.00 0.00 S ATOM 905 CE MET B 48 -0.266 10.451 -52.822 1.00 0.00 C ATOM 0 H MET B 48 -1.723 6.175 -49.810 1.00 0.00 H new ATOM 0 HA MET B 48 0.929 6.251 -50.729 1.00 0.00 H new ATOM 0 HB2 MET B 48 -0.977 8.414 -49.774 1.00 0.00 H new ATOM 0 HB3 MET B 48 0.564 8.750 -50.539 1.00 0.00 H new ATOM 0 HG2 MET B 48 -0.161 7.656 -52.599 1.00 0.00 H new ATOM 0 HG3 MET B 48 -1.656 7.139 -51.843 1.00 0.00 H new ATOM 0 HE1 MET B 48 -0.275 11.395 -52.277 1.00 0.00 H new ATOM 0 HE2 MET B 48 0.643 9.900 -52.579 1.00 0.00 H new ATOM 0 HE3 MET B 48 -0.295 10.650 -53.893 1.00 0.00 H new ATOM 915 N GLU B 49 0.517 7.099 -47.580 1.00 0.00 N ATOM 916 CA GLU B 49 1.225 7.242 -46.314 1.00 0.00 C ATOM 917 C GLU B 49 2.060 6.005 -46.007 1.00 0.00 C ATOM 918 O GLU B 49 3.209 6.112 -45.578 1.00 0.00 O ATOM 919 CB GLU B 49 0.236 7.497 -45.174 1.00 0.00 C ATOM 920 CG GLU B 49 -0.463 8.847 -45.239 1.00 0.00 C ATOM 921 CD GLU B 49 -1.541 8.998 -44.203 1.00 0.00 C ATOM 922 OE1 GLU B 49 -1.742 8.080 -43.444 1.00 0.00 O ATOM 923 OE2 GLU B 49 -2.165 10.032 -44.170 1.00 0.00 O ATOM 0 H GLU B 49 -0.499 7.132 -47.500 1.00 0.00 H new ATOM 0 HA GLU B 49 1.896 8.096 -46.403 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -0.518 6.710 -45.181 1.00 0.00 H new ATOM 0 HB3 GLU B 49 0.767 7.422 -44.225 1.00 0.00 H new ATOM 0 HG2 GLU B 49 0.274 9.639 -45.107 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -0.898 8.978 -46.230 1.00 0.00 H new ATOM 930 N VAL B 50 1.476 4.833 -46.230 1.00 0.00 N ATOM 931 CA VAL B 50 2.177 3.574 -46.008 1.00 0.00 C ATOM 932 C VAL B 50 3.421 3.475 -46.880 1.00 0.00 C ATOM 933 O VAL B 50 4.464 2.992 -46.438 1.00 0.00 O ATOM 934 CB VAL B 50 1.245 2.384 -46.310 1.00 0.00 C ATOM 935 CG1 VAL B 50 2.036 1.085 -46.345 1.00 0.00 C ATOM 936 CG2 VAL B 50 0.139 2.315 -45.269 1.00 0.00 C ATOM 0 H VAL B 50 0.518 4.729 -46.565 1.00 0.00 H new ATOM 0 HA VAL B 50 2.482 3.544 -44.962 1.00 0.00 H new ATOM 0 HB VAL B 50 0.791 2.529 -47.290 1.00 0.00 H new ATOM 0 HG11 VAL B 50 1.363 0.255 -46.559 1.00 0.00 H new ATOM 0 HG12 VAL B 50 2.798 1.144 -47.122 1.00 0.00 H new ATOM 0 HG13 VAL B 50 2.514 0.924 -45.379 1.00 0.00 H new ATOM 0 HG21 VAL B 50 -0.516 1.472 -45.489 1.00 0.00 H new ATOM 0 HG22 VAL B 50 0.578 2.185 -44.280 1.00 0.00 H new ATOM 0 HG23 VAL B 50 -0.439 3.239 -45.291 1.00 0.00 H new ATOM 946 N LEU B 51 3.307 3.935 -48.121 1.00 0.00 N ATOM 947 CA LEU B 51 4.424 3.899 -49.058 1.00 0.00 C ATOM 948 C LEU B 51 5.529 4.856 -48.633 1.00 0.00 C ATOM 949 O LEU B 51 6.714 4.548 -48.766 1.00 0.00 O ATOM 950 CB LEU B 51 3.943 4.258 -50.470 1.00 0.00 C ATOM 951 CG LEU B 51 3.013 3.237 -51.136 1.00 0.00 C ATOM 952 CD1 LEU B 51 2.329 3.878 -52.336 1.00 0.00 C ATOM 953 CD2 LEU B 51 3.816 2.014 -51.552 1.00 0.00 C ATOM 0 H LEU B 51 2.451 4.338 -48.502 1.00 0.00 H new ATOM 0 HA LEU B 51 4.827 2.886 -49.060 1.00 0.00 H new ATOM 0 HB2 LEU B 51 3.427 5.217 -50.425 1.00 0.00 H new ATOM 0 HB3 LEU B 51 4.817 4.396 -51.107 1.00 0.00 H new ATOM 0 HG LEU B 51 2.244 2.920 -50.432 1.00 0.00 H new ATOM 0 HD11 LEU B 51 1.668 3.152 -52.809 1.00 0.00 H new ATOM 0 HD12 LEU B 51 1.746 4.738 -52.006 1.00 0.00 H new ATOM 0 HD13 LEU B 51 3.082 4.204 -53.053 1.00 0.00 H new ATOM 0 HD21 LEU B 51 3.155 1.288 -52.025 1.00 0.00 H new ATOM 0 HD22 LEU B 51 4.593 2.311 -52.257 1.00 0.00 H new ATOM 0 HD23 LEU B 51 4.277 1.565 -50.672 1.00 0.00 H new ATOM 965 N SER B 52 5.137 6.018 -48.121 1.00 0.00 N ATOM 966 CA SER B 52 6.095 7.015 -47.661 1.00 0.00 C ATOM 967 C SER B 52 6.834 6.536 -46.419 1.00 0.00 C ATOM 968 O SER B 52 7.905 7.046 -46.087 1.00 0.00 O ATOM 969 CB SER B 52 5.386 8.322 -47.365 1.00 0.00 C ATOM 970 OG SER B 52 4.588 8.212 -46.218 1.00 0.00 O ATOM 0 H SER B 52 4.160 6.292 -48.014 1.00 0.00 H new ATOM 0 HA SER B 52 6.825 7.171 -48.455 1.00 0.00 H new ATOM 0 HB2 SER B 52 6.121 9.115 -47.226 1.00 0.00 H new ATOM 0 HB3 SER B 52 4.768 8.605 -48.217 1.00 0.00 H new ATOM 0 HG SER B 52 4.167 7.327 -46.196 1.00 0.00 H new ATOM 976 N LYS B 53 6.258 5.554 -45.735 1.00 0.00 N ATOM 977 CA LYS B 53 6.900 4.950 -44.573 1.00 0.00 C ATOM 978 C LYS B 53 7.782 3.776 -44.980 1.00 0.00 C ATOM 979 O LYS B 53 8.850 3.561 -44.404 1.00 0.00 O ATOM 980 CB LYS B 53 5.850 4.491 -43.560 1.00 0.00 C ATOM 981 CG LYS B 53 5.108 5.626 -42.866 1.00 0.00 C ATOM 982 CD LYS B 53 4.063 5.092 -41.897 1.00 0.00 C ATOM 983 CE LYS B 53 3.319 6.224 -41.205 1.00 0.00 C ATOM 984 NZ LYS B 53 2.278 5.717 -40.271 1.00 0.00 N ATOM 0 H LYS B 53 5.346 5.159 -45.965 1.00 0.00 H new ATOM 0 HA LYS B 53 7.532 5.707 -44.110 1.00 0.00 H new ATOM 0 HB2 LYS B 53 5.125 3.856 -44.069 1.00 0.00 H new ATOM 0 HB3 LYS B 53 6.337 3.875 -42.804 1.00 0.00 H new ATOM 0 HG2 LYS B 53 5.819 6.253 -42.328 1.00 0.00 H new ATOM 0 HG3 LYS B 53 4.626 6.258 -43.612 1.00 0.00 H new ATOM 0 HD2 LYS B 53 3.353 4.463 -42.435 1.00 0.00 H new ATOM 0 HD3 LYS B 53 4.545 4.461 -41.150 1.00 0.00 H new ATOM 0 HE2 LYS B 53 4.029 6.842 -40.656 1.00 0.00 H new ATOM 0 HE3 LYS B 53 2.853 6.863 -41.955 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 1.795 6.520 -39.821 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 1.586 5.148 -40.799 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 2.725 5.128 -39.540 1.00 0.00 H new ATOM 998 N TYR B 54 7.332 3.020 -45.975 1.00 0.00 N ATOM 999 CA TYR B 54 8.032 1.813 -46.398 1.00 0.00 C ATOM 1000 C TYR B 54 9.298 2.155 -47.174 1.00 0.00 C ATOM 1001 O TYR B 54 10.408 1.852 -46.735 1.00 0.00 O ATOM 1002 CB TYR B 54 7.113 0.930 -47.245 1.00 0.00 C ATOM 1003 CG TYR B 54 6.109 0.140 -46.434 1.00 0.00 C ATOM 1004 CD1 TYR B 54 6.010 0.342 -45.065 1.00 0.00 C ATOM 1005 CD2 TYR B 54 5.289 -0.787 -47.059 1.00 0.00 C ATOM 1006 CE1 TYR B 54 5.094 -0.379 -44.325 1.00 0.00 C ATOM 1007 CE2 TYR B 54 4.373 -1.508 -46.319 1.00 0.00 C ATOM 1008 CZ TYR B 54 4.273 -1.307 -44.958 1.00 0.00 C ATOM 1009 OH TYR B 54 3.360 -2.025 -44.220 1.00 0.00 O ATOM 0 H TYR B 54 6.484 3.222 -46.505 1.00 0.00 H new ATOM 0 HA TYR B 54 8.321 1.262 -45.503 1.00 0.00 H new ATOM 0 HB2 TYR B 54 6.578 1.557 -47.958 1.00 0.00 H new ATOM 0 HB3 TYR B 54 7.723 0.238 -47.825 1.00 0.00 H new ATOM 0 HD1 TYR B 54 6.650 1.063 -44.578 1.00 0.00 H new ATOM 0 HD2 TYR B 54 5.367 -0.945 -48.125 1.00 0.00 H new ATOM 0 HE1 TYR B 54 5.015 -0.223 -43.259 1.00 0.00 H new ATOM 0 HE2 TYR B 54 3.734 -2.230 -46.806 1.00 0.00 H new ATOM 0 HH TYR B 54 2.864 -2.629 -44.811 1.00 0.00 H new ATOM 1019 N VAL B 55 9.125 2.787 -48.330 1.00 0.00 N ATOM 1020 CA VAL B 55 10.235 3.032 -49.243 1.00 0.00 C ATOM 1021 C VAL B 55 10.677 4.488 -49.195 1.00 0.00 C ATOM 1022 O VAL B 55 11.544 4.910 -49.960 1.00 0.00 O ATOM 1023 CB VAL B 55 9.831 2.668 -50.684 1.00 0.00 C ATOM 1024 CG1 VAL B 55 9.493 1.189 -50.786 1.00 0.00 C ATOM 1025 CG2 VAL B 55 8.651 3.522 -51.123 1.00 0.00 C ATOM 0 H VAL B 55 8.225 3.139 -48.657 1.00 0.00 H new ATOM 0 HA VAL B 55 11.068 2.405 -48.927 1.00 0.00 H new ATOM 0 HB VAL B 55 10.672 2.868 -51.347 1.00 0.00 H new ATOM 0 HG11 VAL B 55 9.210 0.950 -51.811 1.00 0.00 H new ATOM 0 HG12 VAL B 55 10.363 0.597 -50.503 1.00 0.00 H new ATOM 0 HG13 VAL B 55 8.664 0.958 -50.118 1.00 0.00 H new ATOM 0 HG21 VAL B 55 8.371 3.259 -52.143 1.00 0.00 H new ATOM 0 HG22 VAL B 55 7.806 3.345 -50.458 1.00 0.00 H new ATOM 0 HG23 VAL B 55 8.929 4.575 -51.083 1.00 0.00 H new ATOM 1035 N ASN B 56 10.077 5.254 -48.290 1.00 0.00 N ATOM 1036 CA ASN B 56 10.487 6.634 -48.060 1.00 0.00 C ATOM 1037 C ASN B 56 10.291 7.483 -49.310 1.00 0.00 C ATOM 1038 O ASN B 56 11.024 8.444 -49.540 1.00 0.00 O ATOM 1039 CB ASN B 56 11.930 6.692 -47.596 1.00 0.00 C ATOM 1040 CG ASN B 56 12.137 6.022 -46.266 1.00 0.00 C ATOM 1041 OD1 ASN B 56 11.327 6.182 -45.344 1.00 0.00 O ATOM 1042 ND2 ASN B 56 13.205 5.276 -46.147 1.00 0.00 N ATOM 0 H ASN B 56 9.304 4.941 -47.703 1.00 0.00 H new ATOM 0 HA ASN B 56 9.854 7.045 -47.274 1.00 0.00 H new ATOM 0 HB2 ASN B 56 12.567 6.216 -48.342 1.00 0.00 H new ATOM 0 HB3 ASN B 56 12.244 7.734 -47.527 1.00 0.00 H new ATOM 0 HD21 ASN B 56 13.397 4.797 -45.267 1.00 0.00 H new ATOM 0 HD22 ASN B 56 13.845 5.173 -46.934 1.00 0.00 H new ATOM 1049 N VAL B 57 9.299 7.120 -50.116 1.00 0.00 N ATOM 1050 CA VAL B 57 8.956 7.891 -51.305 1.00 0.00 C ATOM 1051 C VAL B 57 8.138 9.124 -50.946 1.00 0.00 C ATOM 1052 O VAL B 57 7.473 9.159 -49.910 1.00 0.00 O ATOM 1053 CB VAL B 57 8.161 7.020 -52.296 1.00 0.00 C ATOM 1054 CG1 VAL B 57 6.785 6.698 -51.735 1.00 0.00 C ATOM 1055 CG2 VAL B 57 8.044 7.734 -53.634 1.00 0.00 C ATOM 0 H VAL B 57 8.718 6.295 -49.967 1.00 0.00 H new ATOM 0 HA VAL B 57 9.887 8.215 -51.769 1.00 0.00 H new ATOM 0 HB VAL B 57 8.693 6.081 -52.447 1.00 0.00 H new ATOM 0 HG11 VAL B 57 6.237 6.082 -52.448 1.00 0.00 H new ATOM 0 HG12 VAL B 57 6.893 6.157 -50.795 1.00 0.00 H new ATOM 0 HG13 VAL B 57 6.238 7.624 -51.559 1.00 0.00 H new ATOM 0 HG21 VAL B 57 7.481 7.112 -54.330 1.00 0.00 H new ATOM 0 HG22 VAL B 57 7.527 8.684 -53.496 1.00 0.00 H new ATOM 0 HG23 VAL B 57 9.040 7.918 -54.036 1.00 0.00 H new ATOM 1065 N SER B 58 8.190 10.134 -51.807 1.00 0.00 N ATOM 1066 CA SER B 58 7.423 11.357 -51.601 1.00 0.00 C ATOM 1067 C SER B 58 6.034 11.246 -52.218 1.00 0.00 C ATOM 1068 O SER B 58 5.842 10.557 -53.219 1.00 0.00 O ATOM 1069 CB SER B 58 8.157 12.541 -52.197 1.00 0.00 C ATOM 1070 OG SER B 58 7.385 13.707 -52.111 1.00 0.00 O ATOM 0 H SER B 58 8.756 10.130 -52.655 1.00 0.00 H new ATOM 0 HA SER B 58 7.310 11.506 -50.527 1.00 0.00 H new ATOM 0 HB2 SER B 58 9.102 12.687 -51.675 1.00 0.00 H new ATOM 0 HB3 SER B 58 8.398 12.336 -53.240 1.00 0.00 H new ATOM 0 HG SER B 58 7.881 14.457 -52.501 1.00 0.00 H new ATOM 1076 N LEU B 59 5.067 11.929 -51.614 1.00 0.00 N ATOM 1077 CA LEU B 59 3.677 11.831 -52.042 1.00 0.00 C ATOM 1078 C LEU B 59 3.515 12.265 -53.493 1.00 0.00 C ATOM 1079 O LEU B 59 2.726 11.686 -54.239 1.00 0.00 O ATOM 1080 CB LEU B 59 2.784 12.693 -51.141 1.00 0.00 C ATOM 1081 CG LEU B 59 2.685 12.246 -49.677 1.00 0.00 C ATOM 1082 CD1 LEU B 59 1.887 13.272 -48.885 1.00 0.00 C ATOM 1083 CD2 LEU B 59 2.033 10.873 -49.608 1.00 0.00 C ATOM 0 H LEU B 59 5.221 12.557 -50.825 1.00 0.00 H new ATOM 0 HA LEU B 59 3.374 10.787 -51.960 1.00 0.00 H new ATOM 0 HB2 LEU B 59 3.157 13.717 -51.164 1.00 0.00 H new ATOM 0 HB3 LEU B 59 1.780 12.710 -51.565 1.00 0.00 H new ATOM 0 HG LEU B 59 3.681 12.175 -49.241 1.00 0.00 H new ATOM 0 HD11 LEU B 59 1.817 12.954 -47.845 1.00 0.00 H new ATOM 0 HD12 LEU B 59 2.386 14.240 -48.936 1.00 0.00 H new ATOM 0 HD13 LEU B 59 0.885 13.358 -49.306 1.00 0.00 H new ATOM 0 HD21 LEU B 59 1.963 10.555 -48.568 1.00 0.00 H new ATOM 0 HD22 LEU B 59 1.034 10.923 -50.041 1.00 0.00 H new ATOM 0 HD23 LEU B 59 2.635 10.156 -50.166 1.00 0.00 H new ATOM 1095 N ASP B 60 4.268 13.285 -53.888 1.00 0.00 N ATOM 1096 CA ASP B 60 4.212 13.798 -55.252 1.00 0.00 C ATOM 1097 C ASP B 60 4.765 12.783 -56.244 1.00 0.00 C ATOM 1098 O ASP B 60 4.553 12.903 -57.451 1.00 0.00 O ATOM 1099 CB ASP B 60 4.992 15.109 -55.365 1.00 0.00 C ATOM 1100 CG ASP B 60 4.302 16.271 -54.663 1.00 0.00 C ATOM 1101 OD1 ASP B 60 3.137 16.155 -54.368 1.00 0.00 O ATOM 1102 OD2 ASP B 60 4.948 17.265 -54.428 1.00 0.00 O ATOM 0 H ASP B 60 4.926 13.774 -53.281 1.00 0.00 H new ATOM 0 HA ASP B 60 3.165 13.983 -55.493 1.00 0.00 H new ATOM 0 HB2 ASP B 60 5.986 14.972 -54.939 1.00 0.00 H new ATOM 0 HB3 ASP B 60 5.127 15.356 -56.418 1.00 0.00 H new ATOM 1107 N ASN B 61 5.475 11.785 -55.729 1.00 0.00 N ATOM 1108 CA ASN B 61 6.068 10.753 -56.570 1.00 0.00 C ATOM 1109 C ASN B 61 5.212 9.494 -56.583 1.00 0.00 C ATOM 1110 O ASN B 61 5.652 8.436 -57.036 1.00 0.00 O ATOM 1111 CB ASN B 61 7.479 10.435 -56.110 1.00 0.00 C ATOM 1112 CG ASN B 61 8.443 11.555 -56.387 1.00 0.00 C ATOM 1113 OD1 ASN B 61 8.266 12.321 -57.341 1.00 0.00 O ATOM 1114 ND2 ASN B 61 9.460 11.665 -55.570 1.00 0.00 N ATOM 0 H ASN B 61 5.654 11.669 -54.731 1.00 0.00 H new ATOM 0 HA ASN B 61 6.114 11.137 -57.589 1.00 0.00 H new ATOM 0 HB2 ASN B 61 7.470 10.224 -55.041 1.00 0.00 H new ATOM 0 HB3 ASN B 61 7.825 9.530 -56.610 1.00 0.00 H new ATOM 0 HD21 ASN B 61 10.147 12.406 -55.708 1.00 0.00 H new ATOM 0 HD22 ASN B 61 9.565 11.009 -54.796 1.00 0.00 H new ATOM 1121 N ILE B 62 3.986 9.612 -56.083 1.00 0.00 N ATOM 1122 CA ILE B 62 3.033 8.509 -56.122 1.00 0.00 C ATOM 1123 C ILE B 62 1.847 8.840 -57.019 1.00 0.00 C ATOM 1124 O ILE B 62 1.252 9.911 -56.910 1.00 0.00 O ATOM 1125 CB ILE B 62 2.528 8.169 -54.708 1.00 0.00 C ATOM 1126 CG1 ILE B 62 3.703 7.807 -53.795 1.00 0.00 C ATOM 1127 CG2 ILE B 62 1.523 7.030 -54.762 1.00 0.00 C ATOM 1128 CD1 ILE B 62 3.331 7.700 -52.334 1.00 0.00 C ATOM 0 H ILE B 62 3.629 10.462 -55.646 1.00 0.00 H new ATOM 0 HA ILE B 62 3.554 7.644 -56.532 1.00 0.00 H new ATOM 0 HB ILE B 62 2.030 9.047 -54.297 1.00 0.00 H new ATOM 0 HG12 ILE B 62 4.126 6.858 -54.123 1.00 0.00 H new ATOM 0 HG13 ILE B 62 4.483 8.560 -53.907 1.00 0.00 H new ATOM 0 HG21 ILE B 62 1.176 6.803 -53.754 1.00 0.00 H new ATOM 0 HG22 ILE B 62 0.674 7.323 -55.380 1.00 0.00 H new ATOM 0 HG23 ILE B 62 1.997 6.147 -55.191 1.00 0.00 H new ATOM 0 HD11 ILE B 62 4.215 7.441 -51.751 1.00 0.00 H new ATOM 0 HD12 ILE B 62 2.936 8.655 -51.988 1.00 0.00 H new ATOM 0 HD13 ILE B 62 2.573 6.927 -52.207 1.00 0.00 H new ATOM 1140 N ARG B 63 1.506 7.911 -57.907 1.00 0.00 N ATOM 1141 CA ARG B 63 0.343 8.067 -58.771 1.00 0.00 C ATOM 1142 C ARG B 63 -0.734 7.043 -58.434 1.00 0.00 C ATOM 1143 O ARG B 63 -0.496 5.837 -58.484 1.00 0.00 O ATOM 1144 CB ARG B 63 0.738 7.920 -60.233 1.00 0.00 C ATOM 1145 CG ARG B 63 1.722 8.964 -60.737 1.00 0.00 C ATOM 1146 CD ARG B 63 1.099 10.310 -60.823 1.00 0.00 C ATOM 1147 NE ARG B 63 2.032 11.308 -61.320 1.00 0.00 N ATOM 1148 CZ ARG B 63 2.892 12.003 -60.550 1.00 0.00 C ATOM 1149 NH1 ARG B 63 2.926 11.796 -59.252 1.00 0.00 N ATOM 1150 NH2 ARG B 63 3.702 12.891 -61.099 1.00 0.00 N ATOM 0 H ARG B 63 2.020 7.041 -58.046 1.00 0.00 H new ATOM 0 HA ARG B 63 -0.058 9.067 -58.603 1.00 0.00 H new ATOM 0 HB2 ARG B 63 1.173 6.931 -60.379 1.00 0.00 H new ATOM 0 HB3 ARG B 63 -0.163 7.966 -60.844 1.00 0.00 H new ATOM 0 HG2 ARG B 63 2.584 9.004 -60.071 1.00 0.00 H new ATOM 0 HG3 ARG B 63 2.092 8.671 -61.719 1.00 0.00 H new ATOM 0 HD2 ARG B 63 0.230 10.267 -61.479 1.00 0.00 H new ATOM 0 HD3 ARG B 63 0.740 10.607 -59.838 1.00 0.00 H new ATOM 0 HE ARG B 63 2.036 11.495 -62.323 1.00 0.00 H new ATOM 0 HH11 ARG B 63 2.302 11.110 -58.828 1.00 0.00 H new ATOM 0 HH12 ARG B 63 3.577 12.322 -58.669 1.00 0.00 H new ATOM 0 HH21 ARG B 63 3.676 13.051 -62.106 1.00 0.00 H new ATOM 0 HH22 ARG B 63 4.353 13.417 -60.516 1.00 0.00 H new ATOM 1164 N ILE B 64 -1.921 7.533 -58.090 1.00 0.00 N ATOM 1165 CA ILE B 64 -3.045 6.661 -57.769 1.00 0.00 C ATOM 1166 C ILE B 64 -4.142 6.768 -58.820 1.00 0.00 C ATOM 1167 O ILE B 64 -4.581 7.866 -59.165 1.00 0.00 O ATOM 1168 CB ILE B 64 -3.625 7.001 -56.384 1.00 0.00 C ATOM 1169 CG1 ILE B 64 -2.515 7.012 -55.329 1.00 0.00 C ATOM 1170 CG2 ILE B 64 -4.713 6.008 -56.005 1.00 0.00 C ATOM 1171 CD1 ILE B 64 -1.841 5.673 -55.136 1.00 0.00 C ATOM 0 H ILE B 64 -2.129 8.530 -58.026 1.00 0.00 H new ATOM 0 HA ILE B 64 -2.669 5.638 -57.757 1.00 0.00 H new ATOM 0 HB ILE B 64 -4.068 7.996 -56.428 1.00 0.00 H new ATOM 0 HG12 ILE B 64 -1.764 7.748 -55.614 1.00 0.00 H new ATOM 0 HG13 ILE B 64 -2.935 7.337 -54.377 1.00 0.00 H new ATOM 0 HG21 ILE B 64 -5.112 6.263 -55.023 1.00 0.00 H new ATOM 0 HG22 ILE B 64 -5.514 6.046 -56.743 1.00 0.00 H new ATOM 0 HG23 ILE B 64 -4.294 5.002 -55.976 1.00 0.00 H new ATOM 0 HD11 ILE B 64 -1.067 5.762 -54.374 1.00 0.00 H new ATOM 0 HD12 ILE B 64 -2.579 4.936 -54.820 1.00 0.00 H new ATOM 0 HD13 ILE B 64 -1.390 5.354 -56.076 1.00 0.00 H new ATOM 1183 N SER B 65 -4.583 5.622 -59.326 1.00 0.00 N ATOM 1184 CA SER B 65 -5.619 5.585 -60.352 1.00 0.00 C ATOM 1185 C SER B 65 -6.519 4.367 -60.182 1.00 0.00 C ATOM 1186 O SER B 65 -6.088 3.330 -59.679 1.00 0.00 O ATOM 1187 CB SER B 65 -4.989 5.570 -61.731 1.00 0.00 C ATOM 1188 OG SER B 65 -5.969 5.522 -62.731 1.00 0.00 O ATOM 0 H SER B 65 -4.239 4.705 -59.042 1.00 0.00 H new ATOM 0 HA SER B 65 -6.231 6.481 -60.244 1.00 0.00 H new ATOM 0 HB2 SER B 65 -4.373 6.460 -61.863 1.00 0.00 H new ATOM 0 HB3 SER B 65 -4.328 4.708 -61.823 1.00 0.00 H new ATOM 0 HG SER B 65 -5.538 5.515 -63.611 1.00 0.00 H new ATOM 1194 N GLN B 66 -7.772 4.501 -60.604 1.00 0.00 N ATOM 1195 CA GLN B 66 -8.699 3.376 -60.621 1.00 0.00 C ATOM 1196 C GLN B 66 -9.405 3.264 -61.965 1.00 0.00 C ATOM 1197 O GLN B 66 -9.883 4.258 -62.511 1.00 0.00 O ATOM 1198 CB GLN B 66 -9.730 3.514 -59.498 1.00 0.00 C ATOM 1199 CG GLN B 66 -10.718 2.364 -59.414 1.00 0.00 C ATOM 1200 CD GLN B 66 -11.689 2.517 -58.258 1.00 0.00 C ATOM 1201 OE1 GLN B 66 -11.406 3.214 -57.280 1.00 0.00 O ATOM 1202 NE2 GLN B 66 -12.841 1.864 -58.364 1.00 0.00 N ATOM 0 H GLN B 66 -8.169 5.379 -60.939 1.00 0.00 H new ATOM 0 HA GLN B 66 -8.120 2.466 -60.462 1.00 0.00 H new ATOM 0 HB2 GLN B 66 -9.205 3.597 -58.546 1.00 0.00 H new ATOM 0 HB3 GLN B 66 -10.282 4.443 -59.639 1.00 0.00 H new ATOM 0 HG2 GLN B 66 -11.277 2.300 -60.348 1.00 0.00 H new ATOM 0 HG3 GLN B 66 -10.172 1.427 -59.304 1.00 0.00 H new ATOM 0 HE21 GLN B 66 -13.033 1.299 -59.191 1.00 0.00 H new ATOM 0 HE22 GLN B 66 -13.534 1.928 -57.618 1.00 0.00 H new ATOM 1211 N GLU B 67 -9.470 2.046 -62.495 1.00 0.00 N ATOM 1212 CA GLU B 67 -10.030 1.817 -63.821 1.00 0.00 C ATOM 1213 C GLU B 67 -11.008 0.650 -63.812 1.00 0.00 C ATOM 1214 O GLU B 67 -10.785 -0.354 -63.134 1.00 0.00 O ATOM 1215 CB GLU B 67 -8.912 1.550 -64.833 1.00 0.00 C ATOM 1216 CG GLU B 67 -9.392 1.367 -66.266 1.00 0.00 C ATOM 1217 CD GLU B 67 -8.264 1.185 -67.242 1.00 0.00 C ATOM 1218 OE1 GLU B 67 -7.135 1.149 -66.815 1.00 0.00 O ATOM 1219 OE2 GLU B 67 -8.531 1.083 -68.416 1.00 0.00 O ATOM 0 H GLU B 67 -9.141 1.202 -62.025 1.00 0.00 H new ATOM 0 HA GLU B 67 -10.572 2.716 -64.114 1.00 0.00 H new ATOM 0 HB2 GLU B 67 -8.205 2.379 -64.802 1.00 0.00 H new ATOM 0 HB3 GLU B 67 -8.368 0.656 -64.528 1.00 0.00 H new ATOM 0 HG2 GLU B 67 -10.051 0.501 -66.315 1.00 0.00 H new ATOM 0 HG3 GLU B 67 -9.983 2.235 -66.559 1.00 0.00 H new ATOM 1226 N LYS B 68 -12.092 0.786 -64.568 1.00 0.00 N ATOM 1227 CA LYS B 68 -13.056 -0.296 -64.728 1.00 0.00 C ATOM 1228 C LYS B 68 -12.807 -1.068 -66.017 1.00 0.00 C ATOM 1229 O LYS B 68 -12.975 -0.535 -67.114 1.00 0.00 O ATOM 1230 CB LYS B 68 -14.483 0.252 -64.710 1.00 0.00 C ATOM 1231 CG LYS B 68 -15.567 -0.818 -64.681 1.00 0.00 C ATOM 1232 CD LYS B 68 -16.955 -0.202 -64.777 1.00 0.00 C ATOM 1233 CE LYS B 68 -17.253 0.683 -63.575 1.00 0.00 C ATOM 1234 NZ LYS B 68 -17.354 -0.105 -62.317 1.00 0.00 N ATOM 0 H LYS B 68 -12.325 1.637 -65.080 1.00 0.00 H new ATOM 0 HA LYS B 68 -12.930 -0.982 -63.890 1.00 0.00 H new ATOM 0 HB2 LYS B 68 -14.601 0.896 -63.838 1.00 0.00 H new ATOM 0 HB3 LYS B 68 -14.630 0.878 -65.590 1.00 0.00 H new ATOM 0 HG2 LYS B 68 -15.417 -1.513 -65.507 1.00 0.00 H new ATOM 0 HG3 LYS B 68 -15.486 -1.396 -63.760 1.00 0.00 H new ATOM 0 HD2 LYS B 68 -17.032 0.386 -65.692 1.00 0.00 H new ATOM 0 HD3 LYS B 68 -17.702 -0.993 -64.843 1.00 0.00 H new ATOM 0 HE2 LYS B 68 -16.468 1.432 -63.472 1.00 0.00 H new ATOM 0 HE3 LYS B 68 -18.186 1.221 -63.743 1.00 0.00 H new ATOM 0 HZ1 LYS B 68 -17.919 0.423 -61.621 1.00 0.00 H new ATOM 0 HZ2 LYS B 68 -17.812 -1.017 -62.515 1.00 0.00 H new ATOM 0 HZ3 LYS B 68 -16.401 -0.272 -61.934 1.00 0.00 H new ATOM 1248 N GLN B 69 -12.407 -2.327 -65.878 1.00 0.00 N ATOM 1249 CA GLN B 69 -12.004 -3.135 -67.024 1.00 0.00 C ATOM 1250 C GLN B 69 -12.488 -4.572 -66.884 1.00 0.00 C ATOM 1251 O GLN B 69 -12.240 -5.224 -65.869 1.00 0.00 O ATOM 1252 CB GLN B 69 -10.482 -3.109 -67.189 1.00 0.00 C ATOM 1253 CG GLN B 69 -9.969 -3.931 -68.359 1.00 0.00 C ATOM 1254 CD GLN B 69 -10.332 -3.318 -69.699 1.00 0.00 C ATOM 1255 OE1 GLN B 69 -10.034 -2.150 -69.965 1.00 0.00 O ATOM 1256 NE2 GLN B 69 -10.979 -4.105 -70.552 1.00 0.00 N ATOM 0 H GLN B 69 -12.353 -2.811 -64.982 1.00 0.00 H new ATOM 0 HA GLN B 69 -12.466 -2.705 -67.913 1.00 0.00 H new ATOM 0 HB2 GLN B 69 -10.159 -2.076 -67.316 1.00 0.00 H new ATOM 0 HB3 GLN B 69 -10.022 -3.476 -66.272 1.00 0.00 H new ATOM 0 HG2 GLN B 69 -8.885 -4.024 -68.287 1.00 0.00 H new ATOM 0 HG3 GLN B 69 -10.380 -4.939 -68.300 1.00 0.00 H new ATOM 0 HE21 GLN B 69 -11.205 -5.064 -70.290 1.00 0.00 H new ATOM 0 HE22 GLN B 69 -11.250 -3.750 -71.469 1.00 0.00 H new ATOM 1265 N ASP B 70 -13.179 -5.061 -67.908 1.00 0.00 N ATOM 1266 CA ASP B 70 -13.680 -6.431 -67.910 1.00 0.00 C ATOM 1267 C ASP B 70 -14.657 -6.662 -66.764 1.00 0.00 C ATOM 1268 O ASP B 70 -14.803 -7.782 -66.277 1.00 0.00 O ATOM 1269 CB ASP B 70 -12.521 -7.425 -67.808 1.00 0.00 C ATOM 1270 CG ASP B 70 -11.552 -7.328 -68.978 1.00 0.00 C ATOM 1271 OD1 ASP B 70 -11.941 -6.827 -70.006 1.00 0.00 O ATOM 1272 OD2 ASP B 70 -10.432 -7.756 -68.833 1.00 0.00 O ATOM 0 H ASP B 70 -13.405 -4.529 -68.748 1.00 0.00 H new ATOM 0 HA ASP B 70 -14.207 -6.589 -68.851 1.00 0.00 H new ATOM 0 HB2 ASP B 70 -11.979 -7.249 -66.879 1.00 0.00 H new ATOM 0 HB3 ASP B 70 -12.921 -8.438 -67.757 1.00 0.00 H new ATOM 1277 N GLY B 71 -15.325 -5.595 -66.339 1.00 0.00 N ATOM 1278 CA GLY B 71 -16.381 -5.700 -65.339 1.00 0.00 C ATOM 1279 C GLY B 71 -15.845 -5.418 -63.941 1.00 0.00 C ATOM 1280 O GLY B 71 -16.610 -5.145 -63.016 1.00 0.00 O ATOM 0 H GLY B 71 -15.153 -4.646 -66.672 1.00 0.00 H new ATOM 0 HA2 GLY B 71 -17.180 -4.996 -65.574 1.00 0.00 H new ATOM 0 HA3 GLY B 71 -16.817 -6.699 -65.370 1.00 0.00 H new ATOM 1284 N MET B 72 -14.526 -5.485 -63.793 1.00 0.00 N ATOM 1285 CA MET B 72 -13.896 -5.380 -62.483 1.00 0.00 C ATOM 1286 C MET B 72 -13.289 -3.999 -62.272 1.00 0.00 C ATOM 1287 O MET B 72 -12.898 -3.330 -63.229 1.00 0.00 O ATOM 1288 CB MET B 72 -12.829 -6.462 -62.322 1.00 0.00 C ATOM 1289 CG MET B 72 -13.321 -7.877 -62.594 1.00 0.00 C ATOM 1290 SD MET B 72 -14.602 -8.401 -61.437 1.00 0.00 S ATOM 1291 CE MET B 72 -13.643 -8.603 -59.939 1.00 0.00 C ATOM 0 H MET B 72 -13.872 -5.612 -64.566 1.00 0.00 H new ATOM 0 HA MET B 72 -14.665 -5.526 -61.725 1.00 0.00 H new ATOM 0 HB2 MET B 72 -12.002 -6.242 -62.997 1.00 0.00 H new ATOM 0 HB3 MET B 72 -12.433 -6.417 -61.307 1.00 0.00 H new ATOM 0 HG2 MET B 72 -13.710 -7.933 -63.611 1.00 0.00 H new ATOM 0 HG3 MET B 72 -12.480 -8.568 -62.536 1.00 0.00 H new ATOM 0 HE1 MET B 72 -14.264 -9.060 -59.168 1.00 0.00 H new ATOM 0 HE2 MET B 72 -12.785 -9.244 -60.140 1.00 0.00 H new ATOM 0 HE3 MET B 72 -13.296 -7.629 -59.595 1.00 0.00 H new ATOM 1301 N ASP B 73 -13.213 -3.577 -61.015 1.00 0.00 N ATOM 1302 CA ASP B 73 -12.587 -2.307 -60.669 1.00 0.00 C ATOM 1303 C ASP B 73 -11.176 -2.515 -60.133 1.00 0.00 C ATOM 1304 O ASP B 73 -10.980 -3.184 -59.118 1.00 0.00 O ATOM 1305 CB ASP B 73 -13.428 -1.558 -59.633 1.00 0.00 C ATOM 1306 CG ASP B 73 -14.747 -1.048 -60.197 1.00 0.00 C ATOM 1307 OD1 ASP B 73 -14.872 -0.982 -61.397 1.00 0.00 O ATOM 1308 OD2 ASP B 73 -15.617 -0.730 -59.422 1.00 0.00 O ATOM 0 H ASP B 73 -13.578 -4.097 -60.217 1.00 0.00 H new ATOM 0 HA ASP B 73 -12.526 -1.711 -61.579 1.00 0.00 H new ATOM 0 HB2 ASP B 73 -13.630 -2.219 -58.790 1.00 0.00 H new ATOM 0 HB3 ASP B 73 -12.854 -0.716 -59.247 1.00 0.00 H new ATOM 1313 N VAL B 74 -10.196 -1.939 -60.820 1.00 0.00 N ATOM 1314 CA VAL B 74 -8.793 -2.175 -60.499 1.00 0.00 C ATOM 1315 C VAL B 74 -8.127 -0.909 -59.976 1.00 0.00 C ATOM 1316 O VAL B 74 -8.076 0.108 -60.667 1.00 0.00 O ATOM 1317 CB VAL B 74 -8.036 -2.672 -61.745 1.00 0.00 C ATOM 1318 CG1 VAL B 74 -6.566 -2.889 -61.424 1.00 0.00 C ATOM 1319 CG2 VAL B 74 -8.671 -3.956 -62.258 1.00 0.00 C ATOM 0 H VAL B 74 -10.347 -1.304 -61.604 1.00 0.00 H new ATOM 0 HA VAL B 74 -8.755 -2.937 -59.720 1.00 0.00 H new ATOM 0 HB VAL B 74 -8.102 -1.914 -62.525 1.00 0.00 H new ATOM 0 HG11 VAL B 74 -6.047 -3.240 -62.316 1.00 0.00 H new ATOM 0 HG12 VAL B 74 -6.123 -1.950 -61.093 1.00 0.00 H new ATOM 0 HG13 VAL B 74 -6.472 -3.633 -60.633 1.00 0.00 H new ATOM 0 HG21 VAL B 74 -8.131 -4.302 -63.139 1.00 0.00 H new ATOM 0 HG22 VAL B 74 -8.626 -4.720 -61.482 1.00 0.00 H new ATOM 0 HG23 VAL B 74 -9.712 -3.767 -62.521 1.00 0.00 H new ATOM 1329 N LEU B 75 -7.619 -0.977 -58.750 1.00 0.00 N ATOM 1330 CA LEU B 75 -6.790 0.090 -58.204 1.00 0.00 C ATOM 1331 C LEU B 75 -5.355 -0.015 -58.706 1.00 0.00 C ATOM 1332 O LEU B 75 -4.826 -1.113 -58.880 1.00 0.00 O ATOM 1333 CB LEU B 75 -6.807 0.042 -56.671 1.00 0.00 C ATOM 1334 CG LEU B 75 -8.181 0.225 -56.015 1.00 0.00 C ATOM 1335 CD1 LEU B 75 -8.069 -0.037 -54.519 1.00 0.00 C ATOM 1336 CD2 LEU B 75 -8.690 1.633 -56.287 1.00 0.00 C ATOM 0 H LEU B 75 -7.768 -1.761 -58.115 1.00 0.00 H new ATOM 0 HA LEU B 75 -7.203 1.041 -58.541 1.00 0.00 H new ATOM 0 HB2 LEU B 75 -6.397 -0.916 -56.351 1.00 0.00 H new ATOM 0 HB3 LEU B 75 -6.139 0.816 -56.294 1.00 0.00 H new ATOM 0 HG LEU B 75 -8.893 -0.485 -56.436 1.00 0.00 H new ATOM 0 HD11 LEU B 75 -9.046 0.093 -54.053 1.00 0.00 H new ATOM 0 HD12 LEU B 75 -7.721 -1.056 -54.353 1.00 0.00 H new ATOM 0 HD13 LEU B 75 -7.360 0.665 -54.079 1.00 0.00 H new ATOM 0 HD21 LEU B 75 -9.667 1.763 -55.821 1.00 0.00 H new ATOM 0 HD22 LEU B 75 -7.990 2.359 -55.873 1.00 0.00 H new ATOM 0 HD23 LEU B 75 -8.778 1.787 -57.363 1.00 0.00 H new ATOM 1348 N GLU B 76 -4.729 1.134 -58.937 1.00 0.00 N ATOM 1349 CA GLU B 76 -3.371 1.174 -59.464 1.00 0.00 C ATOM 1350 C GLU B 76 -2.499 2.137 -58.668 1.00 0.00 C ATOM 1351 O GLU B 76 -2.843 3.307 -58.502 1.00 0.00 O ATOM 1352 CB GLU B 76 -3.381 1.580 -60.939 1.00 0.00 C ATOM 1353 CG GLU B 76 -2.004 1.655 -61.581 1.00 0.00 C ATOM 1354 CD GLU B 76 -2.057 2.011 -63.041 1.00 0.00 C ATOM 1355 OE1 GLU B 76 -3.046 1.719 -63.668 1.00 0.00 O ATOM 1356 OE2 GLU B 76 -1.107 2.577 -63.529 1.00 0.00 O ATOM 0 H GLU B 76 -5.142 2.051 -58.767 1.00 0.00 H new ATOM 0 HA GLU B 76 -2.950 0.173 -59.372 1.00 0.00 H new ATOM 0 HB2 GLU B 76 -3.989 0.867 -61.495 1.00 0.00 H new ATOM 0 HB3 GLU B 76 -3.865 2.552 -61.032 1.00 0.00 H new ATOM 0 HG2 GLU B 76 -1.403 2.395 -61.053 1.00 0.00 H new ATOM 0 HG3 GLU B 76 -1.502 0.695 -61.464 1.00 0.00 H new ATOM 1363 N LEU B 77 -1.369 1.639 -58.179 1.00 0.00 N ATOM 1364 CA LEU B 77 -0.391 2.481 -57.501 1.00 0.00 C ATOM 1365 C LEU B 77 0.953 2.449 -58.217 1.00 0.00 C ATOM 1366 O LEU B 77 1.492 1.380 -58.500 1.00 0.00 O ATOM 1367 CB LEU B 77 -0.213 2.024 -56.048 1.00 0.00 C ATOM 1368 CG LEU B 77 -1.450 2.166 -55.150 1.00 0.00 C ATOM 1369 CD1 LEU B 77 -2.284 0.895 -55.229 1.00 0.00 C ATOM 1370 CD2 LEU B 77 -1.009 2.444 -53.720 1.00 0.00 C ATOM 0 H LEU B 77 -1.107 0.655 -58.240 1.00 0.00 H new ATOM 0 HA LEU B 77 -0.765 3.505 -57.515 1.00 0.00 H new ATOM 0 HB2 LEU B 77 0.094 0.978 -56.050 1.00 0.00 H new ATOM 0 HB3 LEU B 77 0.603 2.594 -55.604 1.00 0.00 H new ATOM 0 HG LEU B 77 -2.064 3.001 -55.489 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -3.162 0.996 -54.591 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -2.600 0.731 -56.259 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -1.687 0.047 -54.893 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -1.887 2.545 -53.082 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -0.393 1.619 -53.362 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -0.431 3.368 -53.691 1.00 0.00 H new ATOM 1382 N ASN B 78 1.492 3.630 -58.508 1.00 0.00 N ATOM 1383 CA ASN B 78 2.808 3.740 -59.125 1.00 0.00 C ATOM 1384 C ASN B 78 3.758 4.551 -58.253 1.00 0.00 C ATOM 1385 O ASN B 78 3.482 5.704 -57.923 1.00 0.00 O ATOM 1386 CB ASN B 78 2.699 4.353 -60.509 1.00 0.00 C ATOM 1387 CG ASN B 78 1.911 3.495 -61.460 1.00 0.00 C ATOM 1388 OD1 ASN B 78 2.310 2.369 -61.776 1.00 0.00 O ATOM 1389 ND2 ASN B 78 0.799 4.008 -61.924 1.00 0.00 N ATOM 0 H ASN B 78 1.036 4.524 -58.326 1.00 0.00 H new ATOM 0 HA ASN B 78 3.218 2.735 -59.223 1.00 0.00 H new ATOM 0 HB2 ASN B 78 2.227 5.332 -60.433 1.00 0.00 H new ATOM 0 HB3 ASN B 78 3.699 4.512 -60.912 1.00 0.00 H new ATOM 0 HD21 ASN B 78 0.223 3.473 -62.574 1.00 0.00 H new ATOM 0 HD22 ASN B 78 0.509 4.942 -61.635 1.00 0.00 H new ATOM 1396 N ILE B 79 4.879 3.941 -57.883 1.00 0.00 N ATOM 1397 CA ILE B 79 5.820 4.562 -56.958 1.00 0.00 C ATOM 1398 C ILE B 79 7.182 4.760 -57.610 1.00 0.00 C ATOM 1399 O ILE B 79 7.897 3.796 -57.883 1.00 0.00 O ATOM 1400 CB ILE B 79 5.978 3.712 -55.683 1.00 0.00 C ATOM 1401 CG1 ILE B 79 4.618 3.492 -55.016 1.00 0.00 C ATOM 1402 CG2 ILE B 79 6.947 4.378 -54.718 1.00 0.00 C ATOM 1403 CD1 ILE B 79 3.923 2.223 -55.453 1.00 0.00 C ATOM 0 H ILE B 79 5.158 3.016 -58.210 1.00 0.00 H new ATOM 0 HA ILE B 79 5.415 5.537 -56.688 1.00 0.00 H new ATOM 0 HB ILE B 79 6.385 2.740 -55.962 1.00 0.00 H new ATOM 0 HG12 ILE B 79 4.754 3.467 -53.935 1.00 0.00 H new ATOM 0 HG13 ILE B 79 3.973 4.343 -55.237 1.00 0.00 H new ATOM 0 HG21 ILE B 79 7.048 3.765 -53.822 1.00 0.00 H new ATOM 0 HG22 ILE B 79 7.921 4.485 -55.196 1.00 0.00 H new ATOM 0 HG23 ILE B 79 6.568 5.362 -54.443 1.00 0.00 H new ATOM 0 HD11 ILE B 79 2.966 2.136 -54.938 1.00 0.00 H new ATOM 0 HD12 ILE B 79 3.754 2.253 -56.529 1.00 0.00 H new ATOM 0 HD13 ILE B 79 4.547 1.363 -55.207 1.00 0.00 H new ATOM 1415 N THR B 80 7.537 6.017 -57.856 1.00 0.00 N ATOM 1416 CA THR B 80 8.800 6.342 -58.507 1.00 0.00 C ATOM 1417 C THR B 80 9.932 6.447 -57.493 1.00 0.00 C ATOM 1418 O THR B 80 9.917 7.311 -56.617 1.00 0.00 O ATOM 1419 CB THR B 80 8.693 7.659 -59.299 1.00 0.00 C ATOM 1420 OG1 THR B 80 7.681 7.532 -60.307 1.00 0.00 O ATOM 1421 CG2 THR B 80 10.021 7.995 -59.958 1.00 0.00 C ATOM 0 H THR B 80 6.967 6.827 -57.614 1.00 0.00 H new ATOM 0 HA THR B 80 9.023 5.530 -59.200 1.00 0.00 H new ATOM 0 HB THR B 80 8.430 8.460 -58.609 1.00 0.00 H new ATOM 0 HG1 THR B 80 7.612 8.371 -60.809 1.00 0.00 H new ATOM 0 HG21 THR B 80 9.926 8.928 -60.513 1.00 0.00 H new ATOM 0 HG22 THR B 80 10.790 8.104 -59.193 1.00 0.00 H new ATOM 0 HG23 THR B 80 10.301 7.193 -60.642 1.00 0.00 H new ATOM 1429 N LEU B 81 10.913 5.560 -57.617 1.00 0.00 N ATOM 1430 CA LEU B 81 12.055 5.548 -56.710 1.00 0.00 C ATOM 1431 C LEU B 81 13.351 5.848 -57.453 1.00 0.00 C ATOM 1432 O LEU B 81 14.013 6.801 -57.146 1.00 0.00 O ATOM 1433 CB LEU B 81 12.162 4.188 -56.009 1.00 0.00 C ATOM 1434 CG LEU B 81 10.947 3.776 -55.170 1.00 0.00 C ATOM 1435 CD1 LEU B 81 11.152 2.362 -54.640 1.00 0.00 C ATOM 1436 CD2 LEU B 81 10.757 4.764 -54.030 1.00 0.00 C ATOM 0 H LEU B 81 10.940 4.839 -58.338 1.00 0.00 H new ATOM 0 HA LEU B 81 11.898 6.327 -55.964 1.00 0.00 H new ATOM 0 HB2 LEU B 81 12.335 3.422 -56.765 1.00 0.00 H new ATOM 0 HB3 LEU B 81 13.039 4.201 -55.363 1.00 0.00 H new ATOM 0 HG LEU B 81 10.048 3.786 -55.787 1.00 0.00 H new ATOM 0 HD11 LEU B 81 10.288 2.068 -54.043 1.00 0.00 H new ATOM 0 HD12 LEU B 81 11.266 1.673 -55.477 1.00 0.00 H new ATOM 0 HD13 LEU B 81 12.048 2.332 -54.020 1.00 0.00 H new ATOM 0 HD21 LEU B 81 9.893 4.470 -53.434 1.00 0.00 H new ATOM 0 HD22 LEU B 81 11.647 4.769 -53.401 1.00 0.00 H new ATOM 0 HD23 LEU B 81 10.595 5.762 -54.437 1.00 0.00 H new