USER MOD reduce.3.24.130724 H: found=0, std=0, add=1164, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1155 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: C 12 CYS SG : rot 152:sc= -3.69! USER MOD Set 1.2: C 15 CYS SG : rot 87:sc= -0.354! USER MOD Set 1.3: C 26 CYS SG : rot 156:sc= -0.86! USER MOD Set 1.4: C 29 CYS SG : rot -39:sc= 0.345! USER MOD Set 2.1: B 12 CYS SG : rot 160:sc= -3.57! USER MOD Set 2.2: B 15 CYS SG : rot 96:sc= -0.34! USER MOD Set 2.3: B 26 CYS SG : rot 156:sc= -1.36! USER MOD Set 2.4: B 29 CYS SG : rot -40:sc= -0.117! USER MOD Set 3.1: A 12 CYS SG : rot 151:sc= -3.14! USER MOD Set 3.2: A 15 CYS SG : rot -162:sc= -3.76! USER MOD Set 3.3: A 26 CYS SG : rot -170:sc= 0.577! USER MOD Set 3.4: A 29 CYS SG : rot -27:sc= -4.26! USER MOD Single : A 5 THR OG1 : rot 180:sc= 0.0372 USER MOD Single : A 14 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0699) USER MOD Single : A 24 THR OG1 : rot 84:sc= 0.00329 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 THR OG1 : rot 180:sc= -0.0764 USER MOD Single : A 39 GLN : amide:sc= -1.51 K(o=-1.5,f=-11!) USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot -172:sc= 0.314 USER MOD Single : A 48 GLN : amide:sc= -0.393 K(o=-0.39,f=-2.4!) USER MOD Single : A 49 LYS NZ :NH3+ -163:sc= 1.51 (180deg=1.27) USER MOD Single : A 50 HIS : no HD1:sc= -1.45 K(o=-1.5,f=-3.6!) USER MOD Single : A 52 ASN : amide:sc= -0.769 K(o=-0.77,f=-4.5!) USER MOD Single : A 53 LYS NZ :NH3+ -149:sc= 1.13 (180deg=0.954) USER MOD Single : B 5 THR OG1 : rot 180:sc= 0.0301 USER MOD Single : B 14 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0649) USER MOD Single : B 24 THR OG1 : rot 180:sc= 0 USER MOD Single : B 30 SER OG : rot -62:sc= 0.124 USER MOD Single : B 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 37 THR OG1 : rot 180:sc= -0.0302 USER MOD Single : B 39 GLN : amide:sc= -1.44 K(o=-1.4,f=-11!) USER MOD Single : B 41 TYR OH : rot 180:sc= 0 USER MOD Single : B 42 THR OG1 : rot 73:sc= 0.447 USER MOD Single : B 48 GLN : amide:sc= -0.366 K(o=-0.37,f=-2.4!) USER MOD Single : B 49 LYS NZ :NH3+ -163:sc= 1.32 (180deg=1.17) USER MOD Single : B 50 HIS : no HD1:sc= -1.34! C(o=-1.3!,f=-3.8!) USER MOD Single : B 52 ASN : amide:sc= -0.701 K(o=-0.7,f=-4.3!) USER MOD Single : B 53 LYS NZ :NH3+ -158:sc= 1.23 (180deg=0.942) USER MOD Single : C 5 THR OG1 : rot 180:sc= 0.00519 USER MOD Single : C 14 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0473) USER MOD Single : C 24 THR OG1 : rot 85:sc= 0.0083 USER MOD Single : C 30 SER OG : rot 180:sc= 0 USER MOD Single : C 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 37 THR OG1 : rot 180:sc= -0.0525 USER MOD Single : C 39 GLN : amide:sc= -1.47 K(o=-1.5,f=-11!) USER MOD Single : C 41 TYR OH : rot 180:sc= 0 USER MOD Single : C 42 THR OG1 : rot -171:sc= 0.274 USER MOD Single : C 48 GLN : amide:sc= -0.355 K(o=-0.36,f=-2.2!) USER MOD Single : C 49 LYS NZ :NH3+ -163:sc= 1.41 (180deg=1.19) USER MOD Single : C 50 HIS : no HD1:sc= -1.52 K(o=-1.5,f=-3.7!) USER MOD Single : C 52 ASN : amide:sc= -0.738 K(o=-0.74,f=-4.5!) USER MOD Single : C 53 LYS NZ :NH3+ -150:sc= 1.23 (180deg=0.938) USER MOD ----------------------------------------------------------------- ATOM 21 N VAL A 2 -0.097 -9.292 13.635 1.00 0.00 N ATOM 22 CA VAL A 2 -0.644 -8.264 14.512 1.00 0.00 C ATOM 23 C VAL A 2 -1.687 -7.420 13.774 1.00 0.00 C ATOM 24 O VAL A 2 -2.219 -6.446 14.305 1.00 0.00 O ATOM 25 CB VAL A 2 0.491 -7.364 15.067 1.00 0.00 C ATOM 26 CG1 VAL A 2 1.081 -6.485 13.971 1.00 0.00 C ATOM 27 CG2 VAL A 2 0.011 -6.525 16.244 1.00 0.00 C ATOM 0 HA VAL A 2 -1.136 -8.757 15.351 1.00 0.00 H new ATOM 0 HB VAL A 2 1.281 -8.020 15.432 1.00 0.00 H new ATOM 0 HG11 VAL A 2 1.874 -5.865 14.389 1.00 0.00 H new ATOM 0 HG12 VAL A 2 1.491 -7.114 13.181 1.00 0.00 H new ATOM 0 HG13 VAL A 2 0.301 -5.846 13.558 1.00 0.00 H new ATOM 0 HG21 VAL A 2 0.831 -5.906 16.608 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -0.811 -5.885 15.923 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -0.331 -7.182 17.044 1.00 0.00 H new ATOM 37 N ILE A 3 -1.992 -7.821 12.552 1.00 0.00 N ATOM 38 CA ILE A 3 -3.018 -7.156 11.769 1.00 0.00 C ATOM 39 C ILE A 3 -3.713 -8.170 10.872 1.00 0.00 C ATOM 40 O ILE A 3 -3.070 -9.058 10.315 1.00 0.00 O ATOM 41 CB ILE A 3 -2.444 -5.989 10.920 1.00 0.00 C ATOM 42 CG1 ILE A 3 -3.584 -5.151 10.329 1.00 0.00 C ATOM 43 CG2 ILE A 3 -1.534 -6.508 9.809 1.00 0.00 C ATOM 44 CD1 ILE A 3 -3.111 -3.914 9.595 1.00 0.00 C ATOM 0 H ILE A 3 -1.542 -8.606 12.080 1.00 0.00 H new ATOM 0 HA ILE A 3 -3.738 -6.722 12.463 1.00 0.00 H new ATOM 0 HB ILE A 3 -1.845 -5.358 11.576 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -4.162 -5.771 9.644 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -4.257 -4.851 11.132 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -1.148 -5.667 9.232 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -0.702 -7.060 10.248 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -2.101 -7.168 9.153 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -3.972 -3.371 9.204 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -2.559 -3.272 10.282 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -2.462 -4.207 8.770 1.00 0.00 H new ATOM 56 N ALA A 4 -5.027 -8.072 10.786 1.00 0.00 N ATOM 57 CA ALA A 4 -5.794 -8.941 9.917 1.00 0.00 C ATOM 58 C ALA A 4 -6.562 -8.119 8.897 1.00 0.00 C ATOM 59 O ALA A 4 -6.776 -6.920 9.085 1.00 0.00 O ATOM 60 CB ALA A 4 -6.740 -9.805 10.734 1.00 0.00 C ATOM 0 H ALA A 4 -5.585 -7.397 11.309 1.00 0.00 H new ATOM 0 HA ALA A 4 -5.107 -9.598 9.383 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -7.309 -10.452 10.067 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -6.165 -10.416 11.430 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -7.425 -9.167 11.292 1.00 0.00 H new ATOM 66 N THR A 5 -6.975 -8.773 7.819 1.00 0.00 N ATOM 67 CA THR A 5 -7.698 -8.116 6.739 1.00 0.00 C ATOM 68 C THR A 5 -9.042 -7.578 7.227 1.00 0.00 C ATOM 69 O THR A 5 -9.643 -6.715 6.597 1.00 0.00 O ATOM 70 CB THR A 5 -7.936 -9.103 5.582 1.00 0.00 C ATOM 71 OG1 THR A 5 -6.799 -9.969 5.445 1.00 0.00 O ATOM 72 CG2 THR A 5 -8.170 -8.365 4.272 1.00 0.00 C ATOM 0 H THR A 5 -6.819 -9.770 7.669 1.00 0.00 H new ATOM 0 HA THR A 5 -7.091 -7.281 6.390 1.00 0.00 H new ATOM 0 HB THR A 5 -8.825 -9.690 5.812 1.00 0.00 H new ATOM 0 HG1 THR A 5 -6.953 -10.598 4.709 1.00 0.00 H new ATOM 0 HG21 THR A 5 -8.335 -9.087 3.472 1.00 0.00 H new ATOM 0 HG22 THR A 5 -9.045 -7.723 4.368 1.00 0.00 H new ATOM 0 HG23 THR A 5 -7.297 -7.756 4.036 1.00 0.00 H new ATOM 80 N ASP A 6 -9.475 -8.064 8.382 1.00 0.00 N ATOM 81 CA ASP A 6 -10.780 -7.723 8.931 1.00 0.00 C ATOM 82 C ASP A 6 -10.732 -6.375 9.640 1.00 0.00 C ATOM 83 O ASP A 6 -11.763 -5.843 10.058 1.00 0.00 O ATOM 84 CB ASP A 6 -11.235 -8.803 9.920 1.00 0.00 C ATOM 85 CG ASP A 6 -11.241 -10.195 9.316 1.00 0.00 C ATOM 86 OD1 ASP A 6 -10.148 -10.727 9.024 1.00 0.00 O ATOM 87 OD2 ASP A 6 -12.333 -10.777 9.154 1.00 0.00 O ATOM 0 H ASP A 6 -8.934 -8.704 8.963 1.00 0.00 H new ATOM 0 HA ASP A 6 -11.490 -7.662 8.106 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -10.577 -8.793 10.789 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -12.237 -8.563 10.276 1.00 0.00 H new ATOM 92 N ASP A 7 -9.530 -5.829 9.793 1.00 0.00 N ATOM 93 CA ASP A 7 -9.364 -4.504 10.384 1.00 0.00 C ATOM 94 C ASP A 7 -9.066 -3.473 9.305 1.00 0.00 C ATOM 95 O ASP A 7 -8.825 -2.301 9.598 1.00 0.00 O ATOM 96 CB ASP A 7 -8.220 -4.506 11.407 1.00 0.00 C ATOM 97 CG ASP A 7 -8.425 -5.496 12.537 1.00 0.00 C ATOM 98 OD1 ASP A 7 -9.071 -5.136 13.544 1.00 0.00 O ATOM 99 OD2 ASP A 7 -7.931 -6.638 12.427 1.00 0.00 O ATOM 0 H ASP A 7 -8.658 -6.281 9.517 1.00 0.00 H new ATOM 0 HA ASP A 7 -10.295 -4.244 10.887 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -7.286 -4.738 10.896 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -8.115 -3.505 11.825 1.00 0.00 H new ATOM 104 N LEU A 8 -9.084 -3.915 8.054 1.00 0.00 N ATOM 105 CA LEU A 8 -8.824 -3.035 6.921 1.00 0.00 C ATOM 106 C LEU A 8 -9.972 -3.095 5.926 1.00 0.00 C ATOM 107 O LEU A 8 -10.332 -2.091 5.302 1.00 0.00 O ATOM 108 CB LEU A 8 -7.521 -3.433 6.225 1.00 0.00 C ATOM 109 CG LEU A 8 -6.273 -3.377 7.101 1.00 0.00 C ATOM 110 CD1 LEU A 8 -5.063 -3.885 6.336 1.00 0.00 C ATOM 111 CD2 LEU A 8 -6.031 -1.961 7.590 1.00 0.00 C ATOM 0 H LEU A 8 -9.277 -4.883 7.797 1.00 0.00 H new ATOM 0 HA LEU A 8 -8.732 -2.016 7.296 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -7.629 -4.447 5.839 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -7.372 -2.779 5.366 1.00 0.00 H new ATOM 0 HG LEU A 8 -6.431 -4.021 7.966 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -4.182 -3.838 6.976 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -5.234 -4.917 6.029 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -4.904 -3.265 5.454 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -5.137 -1.939 8.213 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -5.893 -1.299 6.735 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -6.889 -1.626 8.174 1.00 0.00 H new ATOM 123 N GLU A 9 -10.560 -4.274 5.810 1.00 0.00 N ATOM 124 CA GLU A 9 -11.630 -4.518 4.865 1.00 0.00 C ATOM 125 C GLU A 9 -12.749 -5.288 5.543 1.00 0.00 C ATOM 126 O GLU A 9 -12.506 -6.143 6.393 1.00 0.00 O ATOM 127 CB GLU A 9 -11.127 -5.306 3.650 1.00 0.00 C ATOM 128 CG GLU A 9 -10.079 -4.573 2.830 1.00 0.00 C ATOM 129 CD GLU A 9 -9.621 -5.366 1.624 1.00 0.00 C ATOM 130 OE1 GLU A 9 -9.400 -6.587 1.748 1.00 0.00 O ATOM 131 OE2 GLU A 9 -9.495 -4.768 0.539 1.00 0.00 O ATOM 0 H GLU A 9 -10.307 -5.088 6.370 1.00 0.00 H new ATOM 0 HA GLU A 9 -12.003 -3.554 4.518 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -10.709 -6.253 3.991 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -11.975 -5.544 3.008 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -10.486 -3.618 2.498 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -9.219 -4.351 3.462 1.00 0.00 H new ATOM 138 N VAL A 10 -13.969 -4.969 5.175 1.00 0.00 N ATOM 139 CA VAL A 10 -15.130 -5.655 5.693 1.00 0.00 C ATOM 140 C VAL A 10 -16.005 -6.102 4.531 1.00 0.00 C ATOM 141 O VAL A 10 -16.138 -5.392 3.531 1.00 0.00 O ATOM 142 CB VAL A 10 -15.926 -4.753 6.669 1.00 0.00 C ATOM 143 CG1 VAL A 10 -16.316 -3.437 6.010 1.00 0.00 C ATOM 144 CG2 VAL A 10 -17.157 -5.475 7.198 1.00 0.00 C ATOM 0 H VAL A 10 -14.184 -4.227 4.509 1.00 0.00 H new ATOM 0 HA VAL A 10 -14.804 -6.529 6.256 1.00 0.00 H new ATOM 0 HB VAL A 10 -15.275 -4.526 7.513 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -16.873 -2.826 6.720 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -15.417 -2.905 5.700 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -16.938 -3.637 5.137 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -17.698 -4.820 7.881 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -17.806 -5.746 6.365 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -16.850 -6.377 7.728 1.00 0.00 H new ATOM 154 N ALA A 11 -16.568 -7.293 4.642 1.00 0.00 N ATOM 155 CA ALA A 11 -17.406 -7.831 3.591 1.00 0.00 C ATOM 156 C ALA A 11 -18.661 -6.989 3.424 1.00 0.00 C ATOM 157 O ALA A 11 -19.296 -6.591 4.400 1.00 0.00 O ATOM 158 CB ALA A 11 -17.759 -9.275 3.909 1.00 0.00 C ATOM 0 H ALA A 11 -16.458 -7.904 5.451 1.00 0.00 H new ATOM 0 HA ALA A 11 -16.859 -7.803 2.649 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -18.390 -9.678 3.117 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -16.846 -9.865 3.981 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -18.295 -9.318 4.857 1.00 0.00 H new ATOM 164 N CYS A 12 -18.986 -6.713 2.168 1.00 0.00 N ATOM 165 CA CYS A 12 -20.030 -5.772 1.789 1.00 0.00 C ATOM 166 C CYS A 12 -21.432 -6.196 2.262 1.00 0.00 C ATOM 167 O CYS A 12 -21.623 -7.327 2.701 1.00 0.00 O ATOM 168 CB CYS A 12 -20.016 -5.676 0.267 1.00 0.00 C ATOM 169 SG CYS A 12 -20.024 -4.000 -0.390 1.00 0.00 S ATOM 0 H CYS A 12 -18.522 -7.146 1.369 1.00 0.00 H new ATOM 0 HA CYS A 12 -19.824 -4.815 2.268 1.00 0.00 H new ATOM 0 HB2 CYS A 12 -19.132 -6.192 -0.106 1.00 0.00 H new ATOM 0 HB3 CYS A 12 -20.884 -6.207 -0.124 1.00 0.00 H new ATOM 0 HG CYS A 12 -19.419 -3.982 -1.540 1.00 0.00 H new ATOM 174 N PRO A 13 -22.438 -5.297 2.161 1.00 0.00 N ATOM 175 CA PRO A 13 -23.828 -5.610 2.533 1.00 0.00 C ATOM 176 C PRO A 13 -24.392 -6.866 1.860 1.00 0.00 C ATOM 177 O PRO A 13 -25.194 -7.587 2.452 1.00 0.00 O ATOM 178 CB PRO A 13 -24.590 -4.384 2.025 1.00 0.00 C ATOM 179 CG PRO A 13 -23.622 -3.269 2.138 1.00 0.00 C ATOM 180 CD PRO A 13 -22.303 -3.877 1.744 1.00 0.00 C ATOM 0 HA PRO A 13 -23.909 -5.813 3.601 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -24.919 -4.521 0.995 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -25.482 -4.196 2.622 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -23.890 -2.442 1.481 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -23.589 -2.872 3.153 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -22.124 -3.789 0.672 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -21.469 -3.388 2.248 1.00 0.00 H new ATOM 188 N LYS A 14 -23.958 -7.130 0.627 1.00 0.00 N ATOM 189 CA LYS A 14 -24.657 -8.096 -0.216 1.00 0.00 C ATOM 190 C LYS A 14 -23.740 -8.805 -1.223 1.00 0.00 C ATOM 191 O LYS A 14 -23.984 -9.959 -1.571 1.00 0.00 O ATOM 192 CB LYS A 14 -25.799 -7.360 -0.942 1.00 0.00 C ATOM 193 CG LYS A 14 -26.782 -8.246 -1.710 1.00 0.00 C ATOM 194 CD LYS A 14 -26.262 -8.646 -3.089 1.00 0.00 C ATOM 195 CE LYS A 14 -27.331 -9.350 -3.913 1.00 0.00 C ATOM 196 NZ LYS A 14 -27.841 -10.569 -3.238 1.00 0.00 N ATOM 0 H LYS A 14 -23.141 -6.697 0.197 1.00 0.00 H new ATOM 0 HA LYS A 14 -25.047 -8.886 0.425 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -26.359 -6.782 -0.206 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -25.360 -6.647 -1.640 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -26.985 -9.145 -1.128 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -27.729 -7.718 -1.822 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -25.920 -7.758 -3.620 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -25.399 -9.302 -2.976 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -28.158 -8.664 -4.096 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -26.920 -9.620 -4.886 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -28.451 -11.099 -3.893 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -27.040 -11.167 -2.950 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -28.390 -10.297 -2.398 1.00 0.00 H new ATOM 210 N CYS A 15 -22.681 -8.155 -1.707 1.00 0.00 N ATOM 211 CA CYS A 15 -21.955 -8.726 -2.847 1.00 0.00 C ATOM 212 C CYS A 15 -20.510 -9.116 -2.535 1.00 0.00 C ATOM 213 O CYS A 15 -19.624 -8.979 -3.383 1.00 0.00 O ATOM 214 CB CYS A 15 -21.933 -7.667 -3.945 1.00 0.00 C ATOM 215 SG CYS A 15 -20.921 -6.223 -3.533 1.00 0.00 S ATOM 0 H CYS A 15 -22.317 -7.272 -1.349 1.00 0.00 H new ATOM 0 HA CYS A 15 -22.469 -9.643 -3.136 1.00 0.00 H new ATOM 0 HB2 CYS A 15 -21.556 -8.115 -4.864 1.00 0.00 H new ATOM 0 HB3 CYS A 15 -22.954 -7.341 -4.145 1.00 0.00 H new ATOM 0 HG CYS A 15 -21.242 -5.232 -4.311 1.00 0.00 H new ATOM 220 N GLU A 16 -20.303 -9.725 -1.389 1.00 0.00 N ATOM 221 CA GLU A 16 -18.970 -10.074 -0.913 1.00 0.00 C ATOM 222 C GLU A 16 -18.604 -11.464 -1.378 1.00 0.00 C ATOM 223 O GLU A 16 -17.815 -12.160 -0.744 1.00 0.00 O ATOM 224 CB GLU A 16 -18.945 -10.064 0.616 1.00 0.00 C ATOM 225 CG GLU A 16 -20.203 -9.528 1.269 1.00 0.00 C ATOM 226 CD GLU A 16 -21.296 -10.580 1.354 1.00 0.00 C ATOM 227 OE1 GLU A 16 -22.001 -10.793 0.349 1.00 0.00 O ATOM 228 OE2 GLU A 16 -21.443 -11.209 2.420 1.00 0.00 O ATOM 0 H GLU A 16 -21.053 -9.996 -0.753 1.00 0.00 H new ATOM 0 HA GLU A 16 -18.262 -9.346 -1.308 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -18.774 -11.081 0.969 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -18.097 -9.465 0.948 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -19.966 -9.170 2.271 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -20.568 -8.671 0.702 1.00 0.00 H new ATOM 235 N ARG A 17 -19.185 -11.861 -2.491 1.00 0.00 N ATOM 236 CA ARG A 17 -19.162 -13.235 -2.921 1.00 0.00 C ATOM 237 C ARG A 17 -19.172 -13.246 -4.446 1.00 0.00 C ATOM 238 O ARG A 17 -18.696 -14.179 -5.085 1.00 0.00 O ATOM 239 CB ARG A 17 -20.359 -13.993 -2.335 1.00 0.00 C ATOM 240 CG ARG A 17 -21.707 -13.354 -2.642 1.00 0.00 C ATOM 241 CD ARG A 17 -22.784 -13.849 -1.687 1.00 0.00 C ATOM 242 NE ARG A 17 -22.536 -13.409 -0.311 1.00 0.00 N ATOM 243 CZ ARG A 17 -22.665 -14.191 0.761 1.00 0.00 C ATOM 244 NH1 ARG A 17 -23.061 -15.451 0.626 1.00 0.00 N ATOM 245 NH2 ARG A 17 -22.411 -13.707 1.972 1.00 0.00 N ATOM 0 H ARG A 17 -19.686 -11.235 -3.121 1.00 0.00 H new ATOM 0 HA ARG A 17 -18.265 -13.741 -2.564 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -20.355 -15.012 -2.721 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -20.239 -14.062 -1.254 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -21.623 -12.270 -2.568 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -21.995 -13.582 -3.668 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -23.757 -13.484 -2.016 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -22.825 -14.938 -1.719 1.00 0.00 H new ATOM 0 HE ARG A 17 -22.246 -12.442 -0.164 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -23.268 -15.824 -0.301 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -23.158 -16.046 1.449 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -22.117 -12.736 2.082 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -22.510 -14.306 2.792 1.00 0.00 H new ATOM 259 N ALA A 18 -19.712 -12.159 -5.015 1.00 0.00 N ATOM 260 CA ALA A 18 -19.871 -12.057 -6.464 1.00 0.00 C ATOM 261 C ALA A 18 -19.250 -10.780 -7.021 1.00 0.00 C ATOM 262 O ALA A 18 -18.748 -10.762 -8.142 1.00 0.00 O ATOM 263 CB ALA A 18 -21.342 -12.143 -6.846 1.00 0.00 C ATOM 0 H ALA A 18 -20.042 -11.346 -4.495 1.00 0.00 H new ATOM 0 HA ALA A 18 -19.338 -12.898 -6.908 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -21.442 -12.065 -7.929 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -21.750 -13.097 -6.512 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -21.889 -11.328 -6.372 1.00 0.00 H new ATOM 269 N GLY A 19 -19.270 -9.715 -6.225 1.00 0.00 N ATOM 270 CA GLY A 19 -18.692 -8.457 -6.656 1.00 0.00 C ATOM 271 C GLY A 19 -19.649 -7.614 -7.478 1.00 0.00 C ATOM 272 O GLY A 19 -19.216 -6.768 -8.255 1.00 0.00 O ATOM 0 H GLY A 19 -19.676 -9.702 -5.290 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -18.377 -7.889 -5.780 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -17.797 -8.658 -7.244 1.00 0.00 H new ATOM 276 N GLU A 20 -20.946 -7.811 -7.282 1.00 0.00 N ATOM 277 CA GLU A 20 -21.949 -7.105 -8.070 1.00 0.00 C ATOM 278 C GLU A 20 -23.242 -6.913 -7.284 1.00 0.00 C ATOM 279 O GLU A 20 -23.504 -7.625 -6.316 1.00 0.00 O ATOM 280 CB GLU A 20 -22.255 -7.875 -9.350 1.00 0.00 C ATOM 281 CG GLU A 20 -22.786 -9.270 -9.086 1.00 0.00 C ATOM 282 CD GLU A 20 -23.630 -9.789 -10.223 1.00 0.00 C ATOM 283 OE1 GLU A 20 -23.063 -10.231 -11.243 1.00 0.00 O ATOM 284 OE2 GLU A 20 -24.872 -9.754 -10.099 1.00 0.00 O ATOM 0 H GLU A 20 -21.328 -8.452 -6.586 1.00 0.00 H new ATOM 0 HA GLU A 20 -21.540 -6.125 -8.316 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -22.986 -7.319 -9.937 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -21.349 -7.944 -9.952 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -21.949 -9.949 -8.919 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -23.378 -9.263 -8.171 1.00 0.00 H new ATOM 291 N ILE A 21 -24.045 -5.957 -7.717 1.00 0.00 N ATOM 292 CA ILE A 21 -25.362 -5.719 -7.144 1.00 0.00 C ATOM 293 C ILE A 21 -26.366 -5.640 -8.283 1.00 0.00 C ATOM 294 O ILE A 21 -26.345 -4.686 -9.053 1.00 0.00 O ATOM 295 CB ILE A 21 -25.431 -4.400 -6.327 1.00 0.00 C ATOM 296 CG1 ILE A 21 -24.462 -4.420 -5.138 1.00 0.00 C ATOM 297 CG2 ILE A 21 -26.852 -4.145 -5.841 1.00 0.00 C ATOM 298 CD1 ILE A 21 -24.828 -5.399 -4.041 1.00 0.00 C ATOM 0 H ILE A 21 -23.803 -5.322 -8.477 1.00 0.00 H new ATOM 0 HA ILE A 21 -25.584 -6.538 -6.460 1.00 0.00 H new ATOM 0 HB ILE A 21 -25.131 -3.589 -6.990 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -23.464 -4.661 -5.504 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -24.411 -3.418 -4.711 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -26.880 -3.217 -5.271 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -27.521 -4.065 -6.698 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -27.173 -4.971 -5.206 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -24.088 -5.344 -3.243 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -25.811 -5.148 -3.642 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -24.849 -6.410 -4.448 1.00 0.00 H new ATOM 310 N GLU A 22 -27.228 -6.645 -8.394 1.00 0.00 N ATOM 311 CA GLU A 22 -28.216 -6.702 -9.476 1.00 0.00 C ATOM 312 C GLU A 22 -27.536 -6.733 -10.845 1.00 0.00 C ATOM 313 O GLU A 22 -27.931 -6.000 -11.753 1.00 0.00 O ATOM 314 CB GLU A 22 -29.125 -5.471 -9.398 1.00 0.00 C ATOM 315 CG GLU A 22 -30.600 -5.748 -9.618 1.00 0.00 C ATOM 316 CD GLU A 22 -30.914 -6.335 -10.978 1.00 0.00 C ATOM 317 OE1 GLU A 22 -30.717 -7.548 -11.168 1.00 0.00 O ATOM 318 OE2 GLU A 22 -31.379 -5.584 -11.859 1.00 0.00 O ATOM 0 H GLU A 22 -27.266 -7.434 -7.749 1.00 0.00 H new ATOM 0 HA GLU A 22 -28.799 -7.615 -9.358 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -29.000 -5.007 -8.420 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -28.793 -4.745 -10.140 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -30.951 -6.434 -8.847 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -31.157 -4.819 -9.496 1.00 0.00 H new ATOM 325 N GLY A 23 -26.500 -7.554 -11.003 1.00 0.00 N ATOM 326 CA GLY A 23 -25.761 -7.570 -12.258 1.00 0.00 C ATOM 327 C GLY A 23 -25.117 -6.238 -12.569 1.00 0.00 C ATOM 328 O GLY A 23 -24.563 -6.028 -13.647 1.00 0.00 O ATOM 0 H GLY A 23 -26.160 -8.203 -10.293 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -24.991 -8.340 -12.212 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -26.436 -7.842 -13.070 1.00 0.00 H new ATOM 332 N THR A 24 -25.187 -5.358 -11.608 1.00 0.00 N ATOM 333 CA THR A 24 -24.831 -3.976 -11.773 1.00 0.00 C ATOM 334 C THR A 24 -23.677 -3.610 -10.828 1.00 0.00 C ATOM 335 O THR A 24 -23.572 -4.170 -9.733 1.00 0.00 O ATOM 336 CB THR A 24 -26.121 -3.187 -11.480 1.00 0.00 C ATOM 337 OG1 THR A 24 -26.915 -3.095 -12.667 1.00 0.00 O ATOM 338 CG2 THR A 24 -25.888 -1.805 -10.892 1.00 0.00 C ATOM 0 H THR A 24 -25.501 -5.588 -10.665 1.00 0.00 H new ATOM 0 HA THR A 24 -24.468 -3.746 -12.775 1.00 0.00 H new ATOM 0 HB THR A 24 -26.651 -3.748 -10.710 1.00 0.00 H new ATOM 0 HG1 THR A 24 -27.451 -3.909 -12.766 1.00 0.00 H new ATOM 0 HG21 THR A 24 -26.847 -1.318 -10.716 1.00 0.00 H new ATOM 0 HG22 THR A 24 -25.349 -1.897 -9.949 1.00 0.00 H new ATOM 0 HG23 THR A 24 -25.300 -1.208 -11.589 1.00 0.00 H new ATOM 346 N PRO A 25 -22.768 -2.708 -11.261 1.00 0.00 N ATOM 347 CA PRO A 25 -21.587 -2.318 -10.476 1.00 0.00 C ATOM 348 C PRO A 25 -21.964 -1.825 -9.086 1.00 0.00 C ATOM 349 O PRO A 25 -22.877 -1.016 -8.927 1.00 0.00 O ATOM 350 CB PRO A 25 -20.944 -1.196 -11.304 1.00 0.00 C ATOM 351 CG PRO A 25 -22.020 -0.743 -12.229 1.00 0.00 C ATOM 352 CD PRO A 25 -22.821 -1.978 -12.537 1.00 0.00 C ATOM 0 HA PRO A 25 -20.914 -3.158 -10.306 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -20.601 -0.381 -10.667 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -20.076 -1.558 -11.854 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -22.641 0.024 -11.765 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -21.602 -0.308 -13.137 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -23.844 -1.738 -12.827 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -22.385 -2.553 -13.354 1.00 0.00 H new ATOM 360 N CYS A 26 -21.259 -2.324 -8.084 1.00 0.00 N ATOM 361 CA CYS A 26 -21.626 -2.089 -6.701 1.00 0.00 C ATOM 362 C CYS A 26 -21.088 -0.762 -6.153 1.00 0.00 C ATOM 363 O CYS A 26 -19.928 -0.420 -6.369 1.00 0.00 O ATOM 364 CB CYS A 26 -21.133 -3.250 -5.850 1.00 0.00 C ATOM 365 SG CYS A 26 -21.564 -3.100 -4.091 1.00 0.00 S ATOM 0 H CYS A 26 -20.424 -2.898 -8.206 1.00 0.00 H new ATOM 0 HA CYS A 26 -22.713 -2.019 -6.658 1.00 0.00 H new ATOM 0 HB2 CYS A 26 -21.551 -4.178 -6.240 1.00 0.00 H new ATOM 0 HB3 CYS A 26 -20.050 -3.324 -5.945 1.00 0.00 H new ATOM 0 HG CYS A 26 -20.926 -4.004 -3.409 1.00 0.00 H new ATOM 370 N PRO A 27 -21.955 -0.034 -5.401 1.00 0.00 N ATOM 371 CA PRO A 27 -21.697 1.295 -4.817 1.00 0.00 C ATOM 372 C PRO A 27 -20.239 1.605 -4.472 1.00 0.00 C ATOM 373 O PRO A 27 -19.693 2.620 -4.900 1.00 0.00 O ATOM 374 CB PRO A 27 -22.513 1.223 -3.529 1.00 0.00 C ATOM 375 CG PRO A 27 -23.704 0.385 -3.859 1.00 0.00 C ATOM 376 CD PRO A 27 -23.329 -0.465 -5.063 1.00 0.00 C ATOM 0 HA PRO A 27 -21.954 2.081 -5.527 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -21.932 0.779 -2.721 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -22.812 2.217 -3.198 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -23.979 -0.245 -3.013 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -24.567 1.012 -4.083 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -23.365 -1.528 -4.826 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -24.014 -0.300 -5.895 1.00 0.00 H new ATOM 384 N ALA A 28 -19.613 0.719 -3.709 1.00 0.00 N ATOM 385 CA ALA A 28 -18.305 1.008 -3.132 1.00 0.00 C ATOM 386 C ALA A 28 -17.304 -0.106 -3.409 1.00 0.00 C ATOM 387 O ALA A 28 -16.120 0.010 -3.098 1.00 0.00 O ATOM 388 CB ALA A 28 -18.439 1.236 -1.634 1.00 0.00 C ATOM 0 H ALA A 28 -19.986 -0.201 -3.476 1.00 0.00 H new ATOM 0 HA ALA A 28 -17.925 1.913 -3.605 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -17.458 1.451 -1.210 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -19.106 2.079 -1.452 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -18.849 0.341 -1.165 1.00 0.00 H new ATOM 394 N CYS A 29 -17.778 -1.193 -3.991 1.00 0.00 N ATOM 395 CA CYS A 29 -16.908 -2.318 -4.284 1.00 0.00 C ATOM 396 C CYS A 29 -17.128 -2.796 -5.715 1.00 0.00 C ATOM 397 O CYS A 29 -17.959 -3.668 -5.969 1.00 0.00 O ATOM 398 CB CYS A 29 -17.143 -3.455 -3.279 1.00 0.00 C ATOM 399 SG CYS A 29 -18.779 -4.221 -3.374 1.00 0.00 S ATOM 0 H CYS A 29 -18.751 -1.321 -4.268 1.00 0.00 H new ATOM 0 HA CYS A 29 -15.871 -1.995 -4.189 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -16.387 -4.224 -3.438 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -16.996 -3.067 -2.271 1.00 0.00 H new ATOM 0 HG CYS A 29 -19.634 -3.362 -3.845 1.00 0.00 H new ATOM 404 N SER A 30 -16.392 -2.216 -6.649 1.00 0.00 N ATOM 405 CA SER A 30 -16.553 -2.540 -8.060 1.00 0.00 C ATOM 406 C SER A 30 -15.905 -3.887 -8.406 1.00 0.00 C ATOM 407 O SER A 30 -14.985 -3.956 -9.218 1.00 0.00 O ATOM 408 CB SER A 30 -15.955 -1.421 -8.923 1.00 0.00 C ATOM 409 OG SER A 30 -16.314 -1.567 -10.288 1.00 0.00 O ATOM 0 H SER A 30 -15.675 -1.516 -6.456 1.00 0.00 H new ATOM 0 HA SER A 30 -17.619 -2.625 -8.269 1.00 0.00 H new ATOM 0 HB2 SER A 30 -16.300 -0.454 -8.557 1.00 0.00 H new ATOM 0 HB3 SER A 30 -14.869 -1.429 -8.829 1.00 0.00 H new ATOM 0 HG SER A 30 -15.919 -0.838 -10.810 1.00 0.00 H new ATOM 415 N GLY A 31 -16.374 -4.951 -7.764 1.00 0.00 N ATOM 416 CA GLY A 31 -15.951 -6.283 -8.140 1.00 0.00 C ATOM 417 C GLY A 31 -14.798 -6.788 -7.308 1.00 0.00 C ATOM 418 O GLY A 31 -13.834 -7.334 -7.845 1.00 0.00 O ATOM 0 H GLY A 31 -17.039 -4.913 -6.991 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -16.793 -6.968 -8.040 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -15.662 -6.284 -9.191 1.00 0.00 H new ATOM 422 N LYS A 32 -14.889 -6.615 -5.995 1.00 0.00 N ATOM 423 CA LYS A 32 -13.865 -7.103 -5.086 1.00 0.00 C ATOM 424 C LYS A 32 -14.504 -7.977 -4.013 1.00 0.00 C ATOM 425 O LYS A 32 -13.915 -8.959 -3.562 1.00 0.00 O ATOM 426 CB LYS A 32 -13.122 -5.930 -4.432 1.00 0.00 C ATOM 427 CG LYS A 32 -12.235 -5.165 -5.401 1.00 0.00 C ATOM 428 CD LYS A 32 -12.726 -3.745 -5.647 1.00 0.00 C ATOM 429 CE LYS A 32 -12.485 -2.840 -4.447 1.00 0.00 C ATOM 430 NZ LYS A 32 -12.648 -1.405 -4.803 1.00 0.00 N ATOM 0 H LYS A 32 -15.666 -6.138 -5.537 1.00 0.00 H new ATOM 0 HA LYS A 32 -13.146 -7.695 -5.653 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -13.850 -5.245 -3.998 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -12.511 -6.308 -3.612 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -11.219 -5.131 -5.008 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -12.193 -5.700 -6.349 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -12.219 -3.333 -6.519 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -13.791 -3.765 -5.877 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -13.181 -3.099 -3.649 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -11.480 -3.008 -4.060 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -12.477 -0.817 -3.962 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -11.967 -1.152 -5.547 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -13.615 -1.241 -5.149 1.00 0.00 H new ATOM 444 N GLY A 33 -15.709 -7.598 -3.585 1.00 0.00 N ATOM 445 CA GLY A 33 -16.427 -8.355 -2.601 1.00 0.00 C ATOM 446 C GLY A 33 -16.485 -7.607 -1.292 1.00 0.00 C ATOM 447 O GLY A 33 -17.523 -7.563 -0.636 1.00 0.00 O ATOM 0 H GLY A 33 -16.196 -6.765 -3.916 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -17.438 -8.556 -2.956 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -15.943 -9.320 -2.453 1.00 0.00 H new ATOM 451 N VAL A 34 -15.389 -6.953 -0.942 1.00 0.00 N ATOM 452 CA VAL A 34 -15.298 -6.260 0.335 1.00 0.00 C ATOM 453 C VAL A 34 -15.163 -4.752 0.152 1.00 0.00 C ATOM 454 O VAL A 34 -14.888 -4.266 -0.951 1.00 0.00 O ATOM 455 CB VAL A 34 -14.089 -6.770 1.154 1.00 0.00 C ATOM 456 CG1 VAL A 34 -14.228 -8.252 1.462 1.00 0.00 C ATOM 457 CG2 VAL A 34 -12.785 -6.499 0.415 1.00 0.00 C ATOM 0 H VAL A 34 -14.552 -6.887 -1.521 1.00 0.00 H new ATOM 0 HA VAL A 34 -16.224 -6.470 0.871 1.00 0.00 H new ATOM 0 HB VAL A 34 -14.069 -6.226 2.099 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -13.365 -8.586 2.039 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -15.137 -8.420 2.039 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -14.281 -8.814 0.530 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -11.947 -6.866 1.009 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -12.799 -7.011 -0.547 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -12.674 -5.427 0.254 1.00 0.00 H new ATOM 467 N ILE A 35 -15.389 -4.028 1.239 1.00 0.00 N ATOM 468 CA ILE A 35 -15.189 -2.588 1.270 1.00 0.00 C ATOM 469 C ILE A 35 -14.294 -2.199 2.442 1.00 0.00 C ATOM 470 O ILE A 35 -14.096 -2.981 3.370 1.00 0.00 O ATOM 471 CB ILE A 35 -16.528 -1.824 1.367 1.00 0.00 C ATOM 472 CG1 ILE A 35 -17.398 -2.414 2.478 1.00 0.00 C ATOM 473 CG2 ILE A 35 -17.259 -1.860 0.033 1.00 0.00 C ATOM 474 CD1 ILE A 35 -18.688 -1.658 2.718 1.00 0.00 C ATOM 0 H ILE A 35 -15.715 -4.422 2.122 1.00 0.00 H new ATOM 0 HA ILE A 35 -14.706 -2.310 0.333 1.00 0.00 H new ATOM 0 HB ILE A 35 -16.318 -0.783 1.612 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -17.636 -3.448 2.228 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -16.823 -2.434 3.404 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -18.200 -1.317 0.119 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -16.640 -1.394 -0.734 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -17.461 -2.895 -0.243 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -19.248 -2.139 3.520 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -18.460 -0.630 3.000 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -19.286 -1.660 1.807 1.00 0.00 H new ATOM 486 N LEU A 36 -13.750 -0.991 2.386 1.00 0.00 N ATOM 487 CA LEU A 36 -12.749 -0.555 3.354 1.00 0.00 C ATOM 488 C LEU A 36 -13.366 0.072 4.595 1.00 0.00 C ATOM 489 O LEU A 36 -14.499 0.557 4.576 1.00 0.00 O ATOM 490 CB LEU A 36 -11.798 0.462 2.713 1.00 0.00 C ATOM 491 CG LEU A 36 -11.198 0.038 1.373 1.00 0.00 C ATOM 492 CD1 LEU A 36 -12.001 0.609 0.212 1.00 0.00 C ATOM 493 CD2 LEU A 36 -9.748 0.464 1.289 1.00 0.00 C ATOM 0 H LEU A 36 -13.985 -0.293 1.680 1.00 0.00 H new ATOM 0 HA LEU A 36 -12.206 -1.449 3.660 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -12.336 1.399 2.572 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -10.984 0.664 3.410 1.00 0.00 H new ATOM 0 HG LEU A 36 -11.242 -1.049 1.304 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -11.554 0.293 -0.730 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -13.027 0.246 0.266 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -11.998 1.698 0.268 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -9.333 0.156 0.329 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -9.681 1.548 1.382 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -9.184 -0.004 2.095 1.00 0.00 H new ATOM 505 N THR A 37 -12.593 0.049 5.672 1.00 0.00 N ATOM 506 CA THR A 37 -12.921 0.774 6.888 1.00 0.00 C ATOM 507 C THR A 37 -11.980 1.975 7.008 1.00 0.00 C ATOM 508 O THR A 37 -11.082 2.122 6.183 1.00 0.00 O ATOM 509 CB THR A 37 -12.803 -0.132 8.139 1.00 0.00 C ATOM 510 OG1 THR A 37 -13.138 0.598 9.326 1.00 0.00 O ATOM 511 CG2 THR A 37 -11.398 -0.702 8.274 1.00 0.00 C ATOM 0 H THR A 37 -11.719 -0.475 5.725 1.00 0.00 H new ATOM 0 HA THR A 37 -13.956 1.112 6.832 1.00 0.00 H new ATOM 0 HB THR A 37 -13.505 -0.956 8.014 1.00 0.00 H new ATOM 0 HG1 THR A 37 -13.059 0.009 10.105 1.00 0.00 H new ATOM 0 HG21 THR A 37 -11.345 -1.334 9.161 1.00 0.00 H new ATOM 0 HG22 THR A 37 -11.160 -1.295 7.391 1.00 0.00 H new ATOM 0 HG23 THR A 37 -10.682 0.114 8.367 1.00 0.00 H new ATOM 519 N ALA A 38 -12.170 2.815 8.020 1.00 0.00 N ATOM 520 CA ALA A 38 -11.418 4.070 8.143 1.00 0.00 C ATOM 521 C ALA A 38 -9.906 3.854 8.091 1.00 0.00 C ATOM 522 O ALA A 38 -9.193 4.608 7.424 1.00 0.00 O ATOM 523 CB ALA A 38 -11.805 4.797 9.416 1.00 0.00 C ATOM 0 H ALA A 38 -12.840 2.653 8.772 1.00 0.00 H new ATOM 0 HA ALA A 38 -11.682 4.685 7.283 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -11.238 5.725 9.492 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -12.871 5.023 9.396 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -11.584 4.166 10.277 1.00 0.00 H new ATOM 529 N GLN A 39 -9.418 2.846 8.809 1.00 0.00 N ATOM 530 CA GLN A 39 -8.004 2.482 8.746 1.00 0.00 C ATOM 531 C GLN A 39 -7.599 2.234 7.292 1.00 0.00 C ATOM 532 O GLN A 39 -6.660 2.850 6.786 1.00 0.00 O ATOM 533 CB GLN A 39 -7.744 1.231 9.601 1.00 0.00 C ATOM 534 CG GLN A 39 -6.422 1.250 10.370 1.00 0.00 C ATOM 535 CD GLN A 39 -5.228 0.797 9.559 1.00 0.00 C ATOM 536 OE1 GLN A 39 -5.178 0.972 8.353 1.00 0.00 O ATOM 537 NE2 GLN A 39 -4.252 0.201 10.228 1.00 0.00 N ATOM 0 H GLN A 39 -9.976 2.269 9.438 1.00 0.00 H new ATOM 0 HA GLN A 39 -7.403 3.301 9.142 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -8.562 1.117 10.313 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -7.760 0.354 8.953 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -6.239 2.262 10.732 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -6.515 0.610 11.247 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -4.330 0.072 11.237 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -3.423 -0.129 9.734 1.00 0.00 H new ATOM 546 N GLY A 40 -8.350 1.371 6.616 1.00 0.00 N ATOM 547 CA GLY A 40 -8.064 1.046 5.233 1.00 0.00 C ATOM 548 C GLY A 40 -8.255 2.227 4.298 1.00 0.00 C ATOM 549 O GLY A 40 -7.604 2.312 3.261 1.00 0.00 O ATOM 0 H GLY A 40 -9.159 0.888 7.007 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -7.037 0.688 5.154 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -8.712 0.229 4.915 1.00 0.00 H new ATOM 553 N TYR A 41 -9.137 3.146 4.663 1.00 0.00 N ATOM 554 CA TYR A 41 -9.342 4.348 3.867 1.00 0.00 C ATOM 555 C TYR A 41 -8.124 5.259 3.935 1.00 0.00 C ATOM 556 O TYR A 41 -7.769 5.904 2.947 1.00 0.00 O ATOM 557 CB TYR A 41 -10.586 5.097 4.361 1.00 0.00 C ATOM 558 CG TYR A 41 -11.881 4.664 3.708 1.00 0.00 C ATOM 559 CD1 TYR A 41 -12.174 5.026 2.399 1.00 0.00 C ATOM 560 CD2 TYR A 41 -12.809 3.901 4.398 1.00 0.00 C ATOM 561 CE1 TYR A 41 -13.356 4.638 1.799 1.00 0.00 C ATOM 562 CE2 TYR A 41 -13.994 3.510 3.806 1.00 0.00 C ATOM 563 CZ TYR A 41 -14.262 3.878 2.506 1.00 0.00 C ATOM 564 OH TYR A 41 -15.442 3.490 1.913 1.00 0.00 O ATOM 0 H TYR A 41 -9.718 3.084 5.499 1.00 0.00 H new ATOM 0 HA TYR A 41 -9.489 4.051 2.829 1.00 0.00 H new ATOM 0 HB2 TYR A 41 -10.673 4.959 5.439 1.00 0.00 H new ATOM 0 HB3 TYR A 41 -10.445 6.164 4.187 1.00 0.00 H new ATOM 0 HD1 TYR A 41 -11.466 5.621 1.841 1.00 0.00 H new ATOM 0 HD2 TYR A 41 -12.602 3.607 5.416 1.00 0.00 H new ATOM 0 HE1 TYR A 41 -13.569 4.929 0.781 1.00 0.00 H new ATOM 0 HE2 TYR A 41 -14.708 2.918 4.360 1.00 0.00 H new ATOM 0 HH TYR A 41 -15.968 2.959 2.547 1.00 0.00 H new ATOM 574 N THR A 42 -7.461 5.281 5.079 1.00 0.00 N ATOM 575 CA THR A 42 -6.216 6.020 5.215 1.00 0.00 C ATOM 576 C THR A 42 -5.099 5.337 4.425 1.00 0.00 C ATOM 577 O THR A 42 -4.212 5.991 3.866 1.00 0.00 O ATOM 578 CB THR A 42 -5.802 6.110 6.693 1.00 0.00 C ATOM 579 OG1 THR A 42 -6.924 6.516 7.485 1.00 0.00 O ATOM 580 CG2 THR A 42 -4.660 7.096 6.884 1.00 0.00 C ATOM 0 H THR A 42 -7.762 4.797 5.925 1.00 0.00 H new ATOM 0 HA THR A 42 -6.377 7.024 4.822 1.00 0.00 H new ATOM 0 HB THR A 42 -5.462 5.125 7.012 1.00 0.00 H new ATOM 0 HG1 THR A 42 -6.628 6.700 8.401 1.00 0.00 H new ATOM 0 HG21 THR A 42 -4.389 7.139 7.939 1.00 0.00 H new ATOM 0 HG22 THR A 42 -3.798 6.772 6.300 1.00 0.00 H new ATOM 0 HG23 THR A 42 -4.973 8.085 6.550 1.00 0.00 H new ATOM 588 N LEU A 43 -5.184 4.018 4.332 1.00 0.00 N ATOM 589 CA LEU A 43 -4.132 3.231 3.709 1.00 0.00 C ATOM 590 C LEU A 43 -4.331 3.146 2.199 1.00 0.00 C ATOM 591 O LEU A 43 -3.368 2.950 1.465 1.00 0.00 O ATOM 592 CB LEU A 43 -4.073 1.819 4.319 1.00 0.00 C ATOM 593 CG LEU A 43 -3.077 1.614 5.480 1.00 0.00 C ATOM 594 CD1 LEU A 43 -3.270 2.671 6.556 1.00 0.00 C ATOM 595 CD2 LEU A 43 -3.242 0.223 6.068 1.00 0.00 C ATOM 0 H LEU A 43 -5.971 3.471 4.680 1.00 0.00 H new ATOM 0 HA LEU A 43 -3.184 3.733 3.901 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -5.070 1.558 4.674 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -3.823 1.114 3.526 1.00 0.00 H new ATOM 0 HG LEU A 43 -2.065 1.715 5.087 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -2.556 2.504 7.362 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -3.108 3.660 6.128 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -4.284 2.608 6.950 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -2.535 0.088 6.886 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -4.259 0.105 6.443 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -3.051 -0.523 5.297 1.00 0.00 H new ATOM 607 N LEU A 44 -5.559 3.333 1.714 1.00 0.00 N ATOM 608 CA LEU A 44 -5.802 3.247 0.281 1.00 0.00 C ATOM 609 C LEU A 44 -5.337 4.524 -0.407 1.00 0.00 C ATOM 610 O LEU A 44 -4.740 4.472 -1.475 1.00 0.00 O ATOM 611 CB LEU A 44 -7.292 2.960 -0.033 1.00 0.00 C ATOM 612 CG LEU A 44 -8.245 4.170 -0.111 1.00 0.00 C ATOM 613 CD1 LEU A 44 -8.187 4.835 -1.483 1.00 0.00 C ATOM 614 CD2 LEU A 44 -9.671 3.748 0.186 1.00 0.00 C ATOM 0 H LEU A 44 -6.382 3.540 2.281 1.00 0.00 H new ATOM 0 HA LEU A 44 -5.225 2.408 -0.108 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -7.340 2.431 -0.985 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -7.672 2.280 0.729 1.00 0.00 H new ATOM 0 HG LEU A 44 -7.918 4.890 0.639 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -8.870 5.684 -1.505 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -7.172 5.181 -1.677 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -8.478 4.116 -2.249 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -10.327 4.616 0.126 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -9.989 3.002 -0.542 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -9.723 3.322 1.188 1.00 0.00 H new ATOM 626 N ASP A 45 -5.588 5.671 0.217 1.00 0.00 N ATOM 627 CA ASP A 45 -5.238 6.948 -0.395 1.00 0.00 C ATOM 628 C ASP A 45 -3.731 7.133 -0.414 1.00 0.00 C ATOM 629 O ASP A 45 -3.187 7.820 -1.277 1.00 0.00 O ATOM 630 CB ASP A 45 -5.898 8.106 0.355 1.00 0.00 C ATOM 631 CG ASP A 45 -5.646 9.444 -0.314 1.00 0.00 C ATOM 632 OD1 ASP A 45 -6.132 9.639 -1.445 1.00 0.00 O ATOM 633 OD2 ASP A 45 -4.976 10.309 0.293 1.00 0.00 O ATOM 0 H ASP A 45 -6.027 5.743 1.135 1.00 0.00 H new ATOM 0 HA ASP A 45 -5.605 6.944 -1.421 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -6.972 7.930 0.418 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -5.520 8.136 1.377 1.00 0.00 H new ATOM 638 N PHE A 46 -3.057 6.469 0.506 1.00 0.00 N ATOM 639 CA PHE A 46 -1.608 6.486 0.547 1.00 0.00 C ATOM 640 C PHE A 46 -1.030 5.611 -0.548 1.00 0.00 C ATOM 641 O PHE A 46 -0.041 5.974 -1.186 1.00 0.00 O ATOM 642 CB PHE A 46 -1.158 5.955 1.901 1.00 0.00 C ATOM 643 CG PHE A 46 0.318 6.013 2.127 1.00 0.00 C ATOM 644 CD1 PHE A 46 0.898 7.146 2.665 1.00 0.00 C ATOM 645 CD2 PHE A 46 1.121 4.931 1.812 1.00 0.00 C ATOM 646 CE1 PHE A 46 2.255 7.201 2.885 1.00 0.00 C ATOM 647 CE2 PHE A 46 2.479 4.981 2.027 1.00 0.00 C ATOM 648 CZ PHE A 46 3.045 6.117 2.565 1.00 0.00 C ATOM 0 H PHE A 46 -3.493 5.909 1.238 1.00 0.00 H new ATOM 0 HA PHE A 46 -1.257 7.507 0.396 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -1.656 6.525 2.685 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -1.488 4.921 2.000 1.00 0.00 H new ATOM 0 HD1 PHE A 46 0.280 7.996 2.915 1.00 0.00 H new ATOM 0 HD2 PHE A 46 0.678 4.039 1.394 1.00 0.00 H new ATOM 0 HE1 PHE A 46 2.700 8.090 3.307 1.00 0.00 H new ATOM 0 HE2 PHE A 46 3.099 4.133 1.775 1.00 0.00 H new ATOM 0 HZ PHE A 46 4.111 6.158 2.736 1.00 0.00 H new ATOM 658 N ILE A 47 -1.652 4.477 -0.797 1.00 0.00 N ATOM 659 CA ILE A 47 -1.126 3.592 -1.810 1.00 0.00 C ATOM 660 C ILE A 47 -1.499 4.109 -3.190 1.00 0.00 C ATOM 661 O ILE A 47 -0.719 3.993 -4.135 1.00 0.00 O ATOM 662 CB ILE A 47 -1.593 2.131 -1.632 1.00 0.00 C ATOM 663 CG1 ILE A 47 -3.099 2.000 -1.876 1.00 0.00 C ATOM 664 CG2 ILE A 47 -1.239 1.653 -0.234 1.00 0.00 C ATOM 665 CD1 ILE A 47 -3.622 0.584 -1.777 1.00 0.00 C ATOM 0 H ILE A 47 -2.498 4.154 -0.327 1.00 0.00 H new ATOM 0 HA ILE A 47 -0.041 3.584 -1.702 1.00 0.00 H new ATOM 0 HB ILE A 47 -1.083 1.509 -2.367 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -3.628 2.622 -1.154 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -3.331 2.393 -2.866 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -1.568 0.622 -0.108 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -0.160 1.709 -0.093 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -1.735 2.285 0.503 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -4.696 0.579 -1.963 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -3.123 -0.041 -2.517 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -3.425 0.192 -0.779 1.00 0.00 H new ATOM 677 N GLN A 48 -2.678 4.721 -3.279 1.00 0.00 N ATOM 678 CA GLN A 48 -3.083 5.456 -4.465 1.00 0.00 C ATOM 679 C GLN A 48 -1.996 6.451 -4.838 1.00 0.00 C ATOM 680 O GLN A 48 -1.314 6.302 -5.832 1.00 0.00 O ATOM 681 CB GLN A 48 -4.373 6.239 -4.194 1.00 0.00 C ATOM 682 CG GLN A 48 -5.647 5.407 -4.160 1.00 0.00 C ATOM 683 CD GLN A 48 -6.157 5.061 -5.544 1.00 0.00 C ATOM 684 OE1 GLN A 48 -5.913 5.787 -6.505 1.00 0.00 O ATOM 685 NE2 GLN A 48 -6.893 3.965 -5.649 1.00 0.00 N ATOM 0 H GLN A 48 -3.373 4.719 -2.533 1.00 0.00 H new ATOM 0 HA GLN A 48 -3.248 4.743 -5.273 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -4.271 6.755 -3.239 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -4.480 7.006 -4.961 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -5.461 4.487 -3.606 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -6.419 5.954 -3.619 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -7.072 3.390 -4.826 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -7.281 3.696 -6.553 1.00 0.00 H new ATOM 694 N LYS A 49 -1.762 7.367 -3.928 1.00 0.00 N ATOM 695 CA LYS A 49 -1.064 8.615 -4.203 1.00 0.00 C ATOM 696 C LYS A 49 0.453 8.438 -4.300 1.00 0.00 C ATOM 697 O LYS A 49 1.179 9.399 -4.553 1.00 0.00 O ATOM 698 CB LYS A 49 -1.421 9.583 -3.074 1.00 0.00 C ATOM 699 CG LYS A 49 -0.949 11.016 -3.247 1.00 0.00 C ATOM 700 CD LYS A 49 -1.123 11.795 -1.947 1.00 0.00 C ATOM 701 CE LYS A 49 -2.513 11.591 -1.353 1.00 0.00 C ATOM 702 NZ LYS A 49 -2.637 12.171 0.010 1.00 0.00 N ATOM 0 H LYS A 49 -2.054 7.270 -2.956 1.00 0.00 H new ATOM 0 HA LYS A 49 -1.377 8.997 -5.175 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -2.505 9.591 -2.959 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -1.004 9.195 -2.145 1.00 0.00 H new ATOM 0 HG2 LYS A 49 0.099 11.027 -3.547 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -1.514 11.498 -4.045 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -0.369 11.477 -1.227 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -0.958 12.856 -2.133 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -3.256 12.047 -2.008 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -2.735 10.525 -1.313 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -3.473 11.771 0.483 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -1.785 11.945 0.562 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -2.740 13.204 -0.060 1.00 0.00 H new ATOM 716 N HIS A 50 0.960 7.235 -4.064 1.00 0.00 N ATOM 717 CA HIS A 50 2.367 7.028 -4.377 1.00 0.00 C ATOM 718 C HIS A 50 2.614 5.978 -5.461 1.00 0.00 C ATOM 719 O HIS A 50 3.762 5.778 -5.855 1.00 0.00 O ATOM 720 CB HIS A 50 3.130 6.669 -3.099 1.00 0.00 C ATOM 721 CG HIS A 50 2.951 7.692 -2.019 1.00 0.00 C ATOM 722 ND1 HIS A 50 3.429 8.972 -2.126 1.00 0.00 N ATOM 723 CD2 HIS A 50 2.289 7.641 -0.842 1.00 0.00 C ATOM 724 CE1 HIS A 50 3.073 9.664 -1.066 1.00 0.00 C ATOM 725 NE2 HIS A 50 2.374 8.885 -0.267 1.00 0.00 N ATOM 0 H HIS A 50 0.457 6.434 -3.682 1.00 0.00 H new ATOM 0 HA HIS A 50 2.737 7.967 -4.788 1.00 0.00 H new ATOM 0 HB2 HIS A 50 2.790 5.699 -2.737 1.00 0.00 H new ATOM 0 HB3 HIS A 50 4.191 6.569 -3.329 1.00 0.00 H new ATOM 0 HD2 HIS A 50 1.785 6.779 -0.429 1.00 0.00 H new ATOM 0 HE1 HIS A 50 3.314 10.700 -0.881 1.00 0.00 H new ATOM 0 HE2 HIS A 50 1.965 9.159 0.627 1.00 0.00 H new ATOM 734 N LEU A 51 1.566 5.328 -5.970 1.00 0.00 N ATOM 735 CA LEU A 51 1.741 4.401 -7.098 1.00 0.00 C ATOM 736 C LEU A 51 0.804 4.725 -8.260 1.00 0.00 C ATOM 737 O LEU A 51 1.229 4.768 -9.415 1.00 0.00 O ATOM 738 CB LEU A 51 1.532 2.931 -6.692 1.00 0.00 C ATOM 739 CG LEU A 51 2.580 2.333 -5.741 1.00 0.00 C ATOM 740 CD1 LEU A 51 2.540 0.811 -5.774 1.00 0.00 C ATOM 741 CD2 LEU A 51 3.968 2.814 -6.098 1.00 0.00 C ATOM 0 H LEU A 51 0.608 5.420 -5.632 1.00 0.00 H new ATOM 0 HA LEU A 51 2.774 4.535 -7.419 1.00 0.00 H new ATOM 0 HB2 LEU A 51 0.553 2.842 -6.222 1.00 0.00 H new ATOM 0 HB3 LEU A 51 1.507 2.326 -7.598 1.00 0.00 H new ATOM 0 HG LEU A 51 2.339 2.669 -4.732 1.00 0.00 H new ATOM 0 HD11 LEU A 51 3.291 0.412 -5.092 1.00 0.00 H new ATOM 0 HD12 LEU A 51 1.552 0.466 -5.467 1.00 0.00 H new ATOM 0 HD13 LEU A 51 2.748 0.463 -6.786 1.00 0.00 H new ATOM 0 HD21 LEU A 51 4.692 2.377 -5.411 1.00 0.00 H new ATOM 0 HD22 LEU A 51 4.207 2.511 -7.118 1.00 0.00 H new ATOM 0 HD23 LEU A 51 4.007 3.901 -6.023 1.00 0.00 H new ATOM 753 N ASN A 52 -0.462 4.950 -7.955 1.00 0.00 N ATOM 754 CA ASN A 52 -1.488 5.111 -8.984 1.00 0.00 C ATOM 755 C ASN A 52 -1.938 6.561 -9.125 1.00 0.00 C ATOM 756 O ASN A 52 -2.407 6.976 -10.185 1.00 0.00 O ATOM 757 CB ASN A 52 -2.686 4.216 -8.668 1.00 0.00 C ATOM 758 CG ASN A 52 -2.670 2.942 -9.486 1.00 0.00 C ATOM 759 OD1 ASN A 52 -2.080 1.938 -9.091 1.00 0.00 O ATOM 760 ND2 ASN A 52 -3.322 2.979 -10.635 1.00 0.00 N ATOM 0 H ASN A 52 -0.811 5.027 -6.999 1.00 0.00 H new ATOM 0 HA ASN A 52 -1.049 4.814 -9.936 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -2.683 3.966 -7.607 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -3.609 4.762 -8.864 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -3.349 2.153 -11.233 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -3.798 3.834 -10.924 1.00 0.00 H new ATOM 767 N LYS A 53 -1.789 7.326 -8.065 1.00 0.00 N ATOM 768 CA LYS A 53 -2.131 8.729 -8.071 1.00 0.00 C ATOM 769 C LYS A 53 -0.861 9.570 -8.024 1.00 0.00 C ATOM 770 O LYS A 53 -0.405 10.014 -9.100 1.00 0.00 O ATOM 771 CB LYS A 53 -3.029 9.049 -6.874 1.00 0.00 C ATOM 772 CG LYS A 53 -4.498 9.188 -7.231 1.00 0.00 C ATOM 773 CD LYS A 53 -5.228 10.084 -6.239 1.00 0.00 C ATOM 774 CE LYS A 53 -5.356 9.446 -4.866 1.00 0.00 C ATOM 775 NZ LYS A 53 -6.091 10.328 -3.921 1.00 0.00 N ATOM 776 OXT LYS A 53 -0.310 9.761 -6.931 1.00 0.00 O ATOM 0 H LYS A 53 -1.426 6.990 -7.173 1.00 0.00 H new ATOM 0 HA LYS A 53 -2.673 8.965 -8.987 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -2.919 8.262 -6.128 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -2.687 9.976 -6.413 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -4.593 9.601 -8.235 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -4.965 8.203 -7.246 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -4.695 11.030 -6.148 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -6.222 10.313 -6.624 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -5.876 8.492 -4.954 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -4.364 9.233 -4.469 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -5.739 10.171 -2.955 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -5.942 11.322 -4.187 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -7.107 10.108 -3.959 1.00 0.00 H new ATOM 811 N VAL B 2 8.090 4.342 13.620 1.00 0.00 N ATOM 812 CA VAL B 2 7.481 3.341 14.490 1.00 0.00 C ATOM 813 C VAL B 2 7.260 2.028 13.731 1.00 0.00 C ATOM 814 O VAL B 2 6.645 1.085 14.233 1.00 0.00 O ATOM 815 CB VAL B 2 6.143 3.864 15.072 1.00 0.00 C ATOM 816 CG1 VAL B 2 5.079 3.971 13.991 1.00 0.00 C ATOM 817 CG2 VAL B 2 5.662 3.000 16.232 1.00 0.00 C ATOM 0 HA VAL B 2 8.163 3.148 15.318 1.00 0.00 H new ATOM 0 HB VAL B 2 6.326 4.865 15.463 1.00 0.00 H new ATOM 0 HG11 VAL B 2 4.152 4.340 14.429 1.00 0.00 H new ATOM 0 HG12 VAL B 2 5.415 4.661 13.217 1.00 0.00 H new ATOM 0 HG13 VAL B 2 4.907 2.989 13.552 1.00 0.00 H new ATOM 0 HG21 VAL B 2 4.722 3.396 16.615 1.00 0.00 H new ATOM 0 HG22 VAL B 2 5.511 1.978 15.886 1.00 0.00 H new ATOM 0 HG23 VAL B 2 6.409 3.008 17.026 1.00 0.00 H new ATOM 827 N ILE B 3 7.786 1.968 12.521 1.00 0.00 N ATOM 828 CA ILE B 3 7.726 0.757 11.724 1.00 0.00 C ATOM 829 C ILE B 3 8.950 0.677 10.825 1.00 0.00 C ATOM 830 O ILE B 3 9.391 1.688 10.280 1.00 0.00 O ATOM 831 CB ILE B 3 6.427 0.680 10.876 1.00 0.00 C ATOM 832 CG1 ILE B 3 6.276 -0.713 10.259 1.00 0.00 C ATOM 833 CG2 ILE B 3 6.412 1.749 9.789 1.00 0.00 C ATOM 834 CD1 ILE B 3 4.967 -0.913 9.525 1.00 0.00 C ATOM 0 H ILE B 3 8.262 2.748 12.067 1.00 0.00 H new ATOM 0 HA ILE B 3 7.715 -0.093 12.406 1.00 0.00 H new ATOM 0 HB ILE B 3 5.581 0.865 11.538 1.00 0.00 H new ATOM 0 HG12 ILE B 3 7.101 -0.886 9.568 1.00 0.00 H new ATOM 0 HG13 ILE B 3 6.359 -1.461 11.047 1.00 0.00 H new ATOM 0 HG21 ILE B 3 5.490 1.669 9.213 1.00 0.00 H new ATOM 0 HG22 ILE B 3 6.468 2.736 10.248 1.00 0.00 H new ATOM 0 HG23 ILE B 3 7.267 1.607 9.128 1.00 0.00 H new ATOM 0 HD11 ILE B 3 4.931 -1.922 9.115 1.00 0.00 H new ATOM 0 HD12 ILE B 3 4.137 -0.772 10.217 1.00 0.00 H new ATOM 0 HD13 ILE B 3 4.890 -0.189 8.714 1.00 0.00 H new ATOM 846 N ALA B 4 9.528 -0.505 10.723 1.00 0.00 N ATOM 847 CA ALA B 4 10.667 -0.716 9.852 1.00 0.00 C ATOM 848 C ALA B 4 10.349 -1.784 8.820 1.00 0.00 C ATOM 849 O ALA B 4 9.441 -2.597 9.010 1.00 0.00 O ATOM 850 CB ALA B 4 11.891 -1.105 10.665 1.00 0.00 C ATOM 0 H ALA B 4 9.226 -1.335 11.234 1.00 0.00 H new ATOM 0 HA ALA B 4 10.885 0.216 9.329 1.00 0.00 H new ATOM 0 HB1 ALA B 4 12.738 -1.260 9.996 1.00 0.00 H new ATOM 0 HB2 ALA B 4 12.127 -0.309 11.371 1.00 0.00 H new ATOM 0 HB3 ALA B 4 11.687 -2.026 11.212 1.00 0.00 H new ATOM 856 N THR B 5 11.107 -1.777 7.731 1.00 0.00 N ATOM 857 CA THR B 5 10.905 -2.711 6.632 1.00 0.00 C ATOM 858 C THR B 5 11.138 -4.151 7.088 1.00 0.00 C ATOM 859 O THR B 5 10.699 -5.099 6.445 1.00 0.00 O ATOM 860 CB THR B 5 11.865 -2.381 5.477 1.00 0.00 C ATOM 861 OG1 THR B 5 12.009 -0.958 5.369 1.00 0.00 O ATOM 862 CG2 THR B 5 11.349 -2.941 4.159 1.00 0.00 C ATOM 0 H THR B 5 11.878 -1.125 7.585 1.00 0.00 H new ATOM 0 HA THR B 5 9.874 -2.614 6.292 1.00 0.00 H new ATOM 0 HB THR B 5 12.831 -2.839 5.690 1.00 0.00 H new ATOM 0 HG1 THR B 5 12.622 -0.746 4.634 1.00 0.00 H new ATOM 0 HG21 THR B 5 12.047 -2.693 3.360 1.00 0.00 H new ATOM 0 HG22 THR B 5 11.255 -4.024 4.236 1.00 0.00 H new ATOM 0 HG23 THR B 5 10.374 -2.508 3.936 1.00 0.00 H new ATOM 870 N ASP B 6 11.785 -4.294 8.236 1.00 0.00 N ATOM 871 CA ASP B 6 12.156 -5.601 8.758 1.00 0.00 C ATOM 872 C ASP B 6 10.972 -6.255 9.457 1.00 0.00 C ATOM 873 O ASP B 6 11.025 -7.429 9.822 1.00 0.00 O ATOM 874 CB ASP B 6 13.323 -5.464 9.744 1.00 0.00 C ATOM 875 CG ASP B 6 14.524 -4.757 9.143 1.00 0.00 C ATOM 876 OD1 ASP B 6 14.444 -3.532 8.917 1.00 0.00 O ATOM 877 OD2 ASP B 6 15.561 -5.415 8.915 1.00 0.00 O ATOM 0 H ASP B 6 12.066 -3.513 8.828 1.00 0.00 H new ATOM 0 HA ASP B 6 12.462 -6.229 7.921 1.00 0.00 H new ATOM 0 HB2 ASP B 6 12.987 -4.914 10.623 1.00 0.00 H new ATOM 0 HB3 ASP B 6 13.624 -6.455 10.083 1.00 0.00 H new ATOM 882 N ASP B 7 9.896 -5.495 9.637 1.00 0.00 N ATOM 883 CA ASP B 7 8.676 -6.034 10.234 1.00 0.00 C ATOM 884 C ASP B 7 7.624 -6.291 9.164 1.00 0.00 C ATOM 885 O ASP B 7 6.509 -6.718 9.465 1.00 0.00 O ATOM 886 CB ASP B 7 8.102 -5.061 11.272 1.00 0.00 C ATOM 887 CG ASP B 7 9.059 -4.760 12.408 1.00 0.00 C ATOM 888 OD1 ASP B 7 9.234 -5.625 13.292 1.00 0.00 O ATOM 889 OD2 ASP B 7 9.624 -3.646 12.436 1.00 0.00 O ATOM 0 H ASP B 7 9.843 -4.509 9.380 1.00 0.00 H new ATOM 0 HA ASP B 7 8.935 -6.973 10.723 1.00 0.00 H new ATOM 0 HB2 ASP B 7 7.834 -4.128 10.776 1.00 0.00 H new ATOM 0 HB3 ASP B 7 7.183 -5.479 11.682 1.00 0.00 H new ATOM 894 N LEU B 8 7.986 -6.030 7.914 1.00 0.00 N ATOM 895 CA LEU B 8 7.080 -6.248 6.789 1.00 0.00 C ATOM 896 C LEU B 8 7.698 -7.204 5.781 1.00 0.00 C ATOM 897 O LEU B 8 7.006 -8.013 5.156 1.00 0.00 O ATOM 898 CB LEU B 8 6.759 -4.921 6.105 1.00 0.00 C ATOM 899 CG LEU B 8 6.090 -3.877 6.994 1.00 0.00 C ATOM 900 CD1 LEU B 8 5.919 -2.567 6.245 1.00 0.00 C ATOM 901 CD2 LEU B 8 4.746 -4.385 7.485 1.00 0.00 C ATOM 0 H LEU B 8 8.902 -5.666 7.652 1.00 0.00 H new ATOM 0 HA LEU B 8 6.159 -6.687 7.173 1.00 0.00 H new ATOM 0 HB2 LEU B 8 7.684 -4.500 5.711 1.00 0.00 H new ATOM 0 HB3 LEU B 8 6.110 -5.118 5.252 1.00 0.00 H new ATOM 0 HG LEU B 8 6.731 -3.698 7.857 1.00 0.00 H new ATOM 0 HD11 LEU B 8 5.440 -1.836 6.896 1.00 0.00 H new ATOM 0 HD12 LEU B 8 6.896 -2.194 5.937 1.00 0.00 H new ATOM 0 HD13 LEU B 8 5.298 -2.730 5.364 1.00 0.00 H new ATOM 0 HD21 LEU B 8 4.281 -3.629 8.118 1.00 0.00 H new ATOM 0 HD22 LEU B 8 4.101 -4.591 6.631 1.00 0.00 H new ATOM 0 HD23 LEU B 8 4.891 -5.300 8.059 1.00 0.00 H new ATOM 913 N GLU B 9 9.013 -7.122 5.658 1.00 0.00 N ATOM 914 CA GLU B 9 9.753 -7.914 4.697 1.00 0.00 C ATOM 915 C GLU B 9 10.982 -8.510 5.361 1.00 0.00 C ATOM 916 O GLU B 9 11.564 -7.916 6.270 1.00 0.00 O ATOM 917 CB GLU B 9 10.171 -7.065 3.494 1.00 0.00 C ATOM 918 CG GLU B 9 9.000 -6.518 2.695 1.00 0.00 C ATOM 919 CD GLU B 9 9.438 -5.690 1.507 1.00 0.00 C ATOM 920 OE1 GLU B 9 10.313 -4.819 1.667 1.00 0.00 O ATOM 921 OE2 GLU B 9 8.912 -5.919 0.402 1.00 0.00 O ATOM 0 H GLU B 9 9.595 -6.503 6.223 1.00 0.00 H new ATOM 0 HA GLU B 9 9.106 -8.716 4.341 1.00 0.00 H new ATOM 0 HB2 GLU B 9 10.782 -6.232 3.843 1.00 0.00 H new ATOM 0 HB3 GLU B 9 10.798 -7.667 2.836 1.00 0.00 H new ATOM 0 HG2 GLU B 9 8.384 -7.347 2.347 1.00 0.00 H new ATOM 0 HG3 GLU B 9 8.374 -5.908 3.347 1.00 0.00 H new ATOM 928 N VAL B 10 11.340 -9.700 4.939 1.00 0.00 N ATOM 929 CA VAL B 10 12.531 -10.365 5.424 1.00 0.00 C ATOM 930 C VAL B 10 13.336 -10.881 4.239 1.00 0.00 C ATOM 931 O VAL B 10 12.768 -11.328 3.241 1.00 0.00 O ATOM 932 CB VAL B 10 12.168 -11.518 6.395 1.00 0.00 C ATOM 933 CG1 VAL B 10 11.208 -12.503 5.743 1.00 0.00 C ATOM 934 CG2 VAL B 10 13.415 -12.233 6.897 1.00 0.00 C ATOM 0 H VAL B 10 10.814 -10.237 4.249 1.00 0.00 H new ATOM 0 HA VAL B 10 13.136 -9.651 5.982 1.00 0.00 H new ATOM 0 HB VAL B 10 11.667 -11.075 7.256 1.00 0.00 H new ATOM 0 HG11 VAL B 10 10.971 -13.301 6.447 1.00 0.00 H new ATOM 0 HG12 VAL B 10 10.292 -11.985 5.460 1.00 0.00 H new ATOM 0 HG13 VAL B 10 11.673 -12.930 4.854 1.00 0.00 H new ATOM 0 HG21 VAL B 10 13.126 -13.036 7.575 1.00 0.00 H new ATOM 0 HG22 VAL B 10 13.960 -12.652 6.051 1.00 0.00 H new ATOM 0 HG23 VAL B 10 14.053 -11.524 7.425 1.00 0.00 H new ATOM 944 N ALA B 11 14.654 -10.776 4.332 1.00 0.00 N ATOM 945 CA ALA B 11 15.529 -11.201 3.253 1.00 0.00 C ATOM 946 C ALA B 11 15.426 -12.706 3.033 1.00 0.00 C ATOM 947 O ALA B 11 15.402 -13.485 3.985 1.00 0.00 O ATOM 948 CB ALA B 11 16.960 -10.791 3.580 1.00 0.00 C ATOM 0 H ALA B 11 15.140 -10.399 5.146 1.00 0.00 H new ATOM 0 HA ALA B 11 15.222 -10.716 2.326 1.00 0.00 H new ATOM 0 HB1 ALA B 11 17.622 -11.107 2.774 1.00 0.00 H new ATOM 0 HB2 ALA B 11 17.012 -9.708 3.689 1.00 0.00 H new ATOM 0 HB3 ALA B 11 17.270 -11.265 4.511 1.00 0.00 H new ATOM 954 N CYS B 12 15.349 -13.098 1.760 1.00 0.00 N ATOM 955 CA CYS B 12 15.072 -14.471 1.358 1.00 0.00 C ATOM 956 C CYS B 12 16.141 -15.459 1.851 1.00 0.00 C ATOM 957 O CYS B 12 17.208 -15.046 2.285 1.00 0.00 O ATOM 958 CB CYS B 12 15.017 -14.506 -0.166 1.00 0.00 C ATOM 959 SG CYS B 12 13.675 -15.499 -0.846 1.00 0.00 S ATOM 0 H CYS B 12 15.479 -12.462 0.974 1.00 0.00 H new ATOM 0 HA CYS B 12 14.127 -14.778 1.806 1.00 0.00 H new ATOM 0 HB2 CYS B 12 14.920 -13.485 -0.536 1.00 0.00 H new ATOM 0 HB3 CYS B 12 15.964 -14.893 -0.542 1.00 0.00 H new ATOM 0 HG CYS B 12 13.447 -15.137 -2.074 1.00 0.00 H new ATOM 964 N PRO B 13 15.880 -16.780 1.779 1.00 0.00 N ATOM 965 CA PRO B 13 16.865 -17.805 2.162 1.00 0.00 C ATOM 966 C PRO B 13 18.236 -17.642 1.499 1.00 0.00 C ATOM 967 O PRO B 13 19.263 -17.976 2.091 1.00 0.00 O ATOM 968 CB PRO B 13 16.214 -19.089 1.656 1.00 0.00 C ATOM 969 CG PRO B 13 14.760 -18.840 1.774 1.00 0.00 C ATOM 970 CD PRO B 13 14.590 -17.395 1.387 1.00 0.00 C ATOM 0 HA PRO B 13 17.074 -17.765 3.231 1.00 0.00 H new ATOM 0 HB2 PRO B 13 16.498 -19.298 0.625 1.00 0.00 H new ATOM 0 HB3 PRO B 13 16.519 -19.950 2.251 1.00 0.00 H new ATOM 0 HG2 PRO B 13 14.191 -19.496 1.116 1.00 0.00 H new ATOM 0 HG3 PRO B 13 14.408 -19.023 2.789 1.00 0.00 H new ATOM 0 HD2 PRO B 13 14.400 -17.285 0.319 1.00 0.00 H new ATOM 0 HD3 PRO B 13 13.751 -16.935 1.909 1.00 0.00 H new ATOM 978 N LYS B 14 18.255 -17.113 0.273 1.00 0.00 N ATOM 979 CA LYS B 14 19.449 -17.228 -0.557 1.00 0.00 C ATOM 980 C LYS B 14 19.618 -16.071 -1.553 1.00 0.00 C ATOM 981 O LYS B 14 20.743 -15.718 -1.902 1.00 0.00 O ATOM 982 CB LYS B 14 19.391 -18.583 -1.297 1.00 0.00 C ATOM 983 CG LYS B 14 20.645 -18.958 -2.094 1.00 0.00 C ATOM 984 CD LYS B 14 20.681 -18.302 -3.477 1.00 0.00 C ATOM 985 CE LYS B 14 21.826 -18.836 -4.328 1.00 0.00 C ATOM 986 NZ LYS B 14 23.147 -18.638 -3.681 1.00 0.00 N ATOM 0 H LYS B 14 17.476 -16.613 -0.156 1.00 0.00 H new ATOM 0 HA LYS B 14 20.321 -17.176 0.095 1.00 0.00 H new ATOM 0 HB2 LYS B 14 19.199 -19.368 -0.565 1.00 0.00 H new ATOM 0 HB3 LYS B 14 18.540 -18.568 -1.979 1.00 0.00 H new ATOM 0 HG2 LYS B 14 21.531 -18.661 -1.532 1.00 0.00 H new ATOM 0 HG3 LYS B 14 20.688 -20.041 -2.208 1.00 0.00 H new ATOM 0 HD2 LYS B 14 19.735 -18.480 -3.988 1.00 0.00 H new ATOM 0 HD3 LYS B 14 20.785 -17.223 -3.365 1.00 0.00 H new ATOM 0 HE2 LYS B 14 21.671 -19.898 -4.516 1.00 0.00 H new ATOM 0 HE3 LYS B 14 21.820 -18.337 -5.297 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 23.902 -18.891 -4.350 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 23.251 -17.642 -3.402 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 23.215 -19.243 -2.838 1.00 0.00 H new ATOM 1000 N CYS B 15 18.525 -15.471 -2.033 1.00 0.00 N ATOM 1001 CA CYS B 15 18.644 -14.539 -3.162 1.00 0.00 C ATOM 1002 C CYS B 15 18.228 -13.109 -2.828 1.00 0.00 C ATOM 1003 O CYS B 15 17.639 -12.414 -3.660 1.00 0.00 O ATOM 1004 CB CYS B 15 17.738 -15.059 -4.266 1.00 0.00 C ATOM 1005 SG CYS B 15 16.038 -15.335 -3.712 1.00 0.00 S ATOM 0 H CYS B 15 17.579 -15.605 -1.675 1.00 0.00 H new ATOM 0 HA CYS B 15 19.694 -14.495 -3.451 1.00 0.00 H new ATOM 0 HB2 CYS B 15 17.734 -14.347 -5.091 1.00 0.00 H new ATOM 0 HB3 CYS B 15 18.145 -15.993 -4.653 1.00 0.00 H new ATOM 0 HG CYS B 15 15.313 -14.296 -4.003 1.00 0.00 H new ATOM 1010 N GLU B 16 18.651 -12.637 -1.680 1.00 0.00 N ATOM 1011 CA GLU B 16 18.276 -11.321 -1.180 1.00 0.00 C ATOM 1012 C GLU B 16 19.286 -10.293 -1.631 1.00 0.00 C ATOM 1013 O GLU B 16 19.488 -9.272 -0.978 1.00 0.00 O ATOM 1014 CB GLU B 16 18.258 -11.330 0.352 1.00 0.00 C ATOM 1015 CG GLU B 16 18.433 -12.697 0.982 1.00 0.00 C ATOM 1016 CD GLU B 16 19.894 -13.114 1.054 1.00 0.00 C ATOM 1017 OE1 GLU B 16 20.439 -13.569 0.026 1.00 0.00 O ATOM 1018 OE2 GLU B 16 20.510 -12.964 2.128 1.00 0.00 O ATOM 0 H GLU B 16 19.270 -13.154 -1.056 1.00 0.00 H new ATOM 0 HA GLU B 16 17.287 -11.074 -1.567 1.00 0.00 H new ATOM 0 HB2 GLU B 16 19.050 -10.674 0.714 1.00 0.00 H new ATOM 0 HB3 GLU B 16 17.313 -10.907 0.693 1.00 0.00 H new ATOM 0 HG2 GLU B 16 18.009 -12.689 1.986 1.00 0.00 H new ATOM 0 HG3 GLU B 16 17.874 -13.435 0.406 1.00 0.00 H new ATOM 1025 N ARG B 17 19.917 -10.573 -2.751 1.00 0.00 N ATOM 1026 CA ARG B 17 21.097 -9.852 -3.173 1.00 0.00 C ATOM 1027 C ARG B 17 21.110 -9.833 -4.701 1.00 0.00 C ATOM 1028 O ARG B 17 21.709 -8.963 -5.331 1.00 0.00 O ATOM 1029 CB ARG B 17 22.355 -10.519 -2.612 1.00 0.00 C ATOM 1030 CG ARG B 17 22.482 -11.993 -2.970 1.00 0.00 C ATOM 1031 CD ARG B 17 23.445 -12.707 -2.039 1.00 0.00 C ATOM 1032 NE ARG B 17 22.949 -12.743 -0.663 1.00 0.00 N ATOM 1033 CZ ARG B 17 23.685 -12.454 0.409 1.00 0.00 C ATOM 1034 NH1 ARG B 17 24.955 -12.093 0.274 1.00 0.00 N ATOM 1035 NH2 ARG B 17 23.140 -12.516 1.616 1.00 0.00 N ATOM 0 H ARG B 17 19.625 -11.308 -3.395 1.00 0.00 H new ATOM 0 HA ARG B 17 21.081 -8.830 -2.795 1.00 0.00 H new ATOM 0 HB2 ARG B 17 23.232 -9.988 -2.982 1.00 0.00 H new ATOM 0 HB3 ARG B 17 22.355 -10.417 -1.527 1.00 0.00 H new ATOM 0 HG2 ARG B 17 21.502 -12.468 -2.917 1.00 0.00 H new ATOM 0 HG3 ARG B 17 22.828 -12.091 -3.999 1.00 0.00 H new ATOM 0 HD2 ARG B 17 23.605 -13.725 -2.394 1.00 0.00 H new ATOM 0 HD3 ARG B 17 24.412 -12.205 -2.063 1.00 0.00 H new ATOM 0 HE ARG B 17 21.975 -13.007 -0.515 1.00 0.00 H new ATOM 0 HH11 ARG B 17 25.373 -12.036 -0.655 1.00 0.00 H new ATOM 0 HH12 ARG B 17 25.513 -11.873 1.099 1.00 0.00 H new ATOM 0 HH21 ARG B 17 22.161 -12.784 1.721 1.00 0.00 H new ATOM 0 HH22 ARG B 17 23.699 -12.296 2.440 1.00 0.00 H new ATOM 1049 N ALA B 18 20.423 -10.829 -5.283 1.00 0.00 N ATOM 1050 CA ALA B 18 20.416 -11.008 -6.732 1.00 0.00 C ATOM 1051 C ALA B 18 18.999 -11.123 -7.286 1.00 0.00 C ATOM 1052 O ALA B 18 18.727 -10.677 -8.400 1.00 0.00 O ATOM 1053 CB ALA B 18 21.239 -12.227 -7.125 1.00 0.00 C ATOM 0 H ALA B 18 19.870 -11.516 -4.770 1.00 0.00 H new ATOM 0 HA ALA B 18 20.869 -10.118 -7.170 1.00 0.00 H new ATOM 0 HB1 ALA B 18 21.222 -12.344 -8.209 1.00 0.00 H new ATOM 0 HB2 ALA B 18 22.268 -12.094 -6.791 1.00 0.00 H new ATOM 0 HB3 ALA B 18 20.817 -13.117 -6.657 1.00 0.00 H new ATOM 1059 N GLY B 19 18.098 -11.707 -6.498 1.00 0.00 N ATOM 1060 CA GLY B 19 16.714 -11.841 -6.922 1.00 0.00 C ATOM 1061 C GLY B 19 16.452 -13.092 -7.742 1.00 0.00 C ATOM 1062 O GLY B 19 15.461 -13.163 -8.465 1.00 0.00 O ATOM 0 H GLY B 19 18.302 -12.089 -5.575 1.00 0.00 H new ATOM 0 HA2 GLY B 19 16.072 -11.852 -6.041 1.00 0.00 H new ATOM 0 HA3 GLY B 19 16.435 -10.966 -7.509 1.00 0.00 H new ATOM 1066 N GLU B 20 17.297 -14.103 -7.589 1.00 0.00 N ATOM 1067 CA GLU B 20 17.191 -15.307 -8.404 1.00 0.00 C ATOM 1068 C GLU B 20 17.675 -16.534 -7.638 1.00 0.00 C ATOM 1069 O GLU B 20 18.417 -16.418 -6.666 1.00 0.00 O ATOM 1070 CB GLU B 20 18.012 -15.162 -9.680 1.00 0.00 C ATOM 1071 CG GLU B 20 19.492 -14.971 -9.411 1.00 0.00 C ATOM 1072 CD GLU B 20 20.351 -15.325 -10.600 1.00 0.00 C ATOM 1073 OE1 GLU B 20 20.333 -14.573 -11.594 1.00 0.00 O ATOM 1074 OE2 GLU B 20 21.061 -16.352 -10.540 1.00 0.00 O ATOM 0 H GLU B 20 18.060 -14.114 -6.912 1.00 0.00 H new ATOM 0 HA GLU B 20 16.139 -15.439 -8.658 1.00 0.00 H new ATOM 0 HB2 GLU B 20 17.872 -16.048 -10.299 1.00 0.00 H new ATOM 0 HB3 GLU B 20 17.639 -14.312 -10.251 1.00 0.00 H new ATOM 0 HG2 GLU B 20 19.675 -13.933 -9.132 1.00 0.00 H new ATOM 0 HG3 GLU B 20 19.785 -15.587 -8.560 1.00 0.00 H new ATOM 1081 N ILE B 21 17.250 -17.700 -8.091 1.00 0.00 N ATOM 1082 CA ILE B 21 17.704 -18.968 -7.534 1.00 0.00 C ATOM 1083 C ILE B 21 18.140 -19.870 -8.681 1.00 0.00 C ATOM 1084 O ILE B 21 17.301 -20.345 -9.441 1.00 0.00 O ATOM 1085 CB ILE B 21 16.596 -19.692 -6.723 1.00 0.00 C ATOM 1086 CG1 ILE B 21 16.129 -18.852 -5.525 1.00 0.00 C ATOM 1087 CG2 ILE B 21 17.084 -21.055 -6.249 1.00 0.00 C ATOM 1088 CD1 ILE B 21 17.154 -18.698 -4.417 1.00 0.00 C ATOM 0 H ILE B 21 16.581 -17.798 -8.855 1.00 0.00 H new ATOM 0 HA ILE B 21 18.527 -18.758 -6.851 1.00 0.00 H new ATOM 0 HB ILE B 21 15.743 -19.831 -7.387 1.00 0.00 H new ATOM 0 HG12 ILE B 21 15.849 -17.861 -5.882 1.00 0.00 H new ATOM 0 HG13 ILE B 21 15.230 -19.307 -5.109 1.00 0.00 H new ATOM 0 HG21 ILE B 21 16.294 -21.548 -5.682 1.00 0.00 H new ATOM 0 HG22 ILE B 21 17.348 -21.667 -7.111 1.00 0.00 H new ATOM 0 HG23 ILE B 21 17.960 -20.927 -5.614 1.00 0.00 H new ATOM 0 HD11 ILE B 21 16.735 -18.090 -3.615 1.00 0.00 H new ATOM 0 HD12 ILE B 21 17.418 -19.681 -4.027 1.00 0.00 H new ATOM 0 HD13 ILE B 21 18.046 -18.212 -4.812 1.00 0.00 H new ATOM 1100 N GLU B 22 19.443 -20.096 -8.799 1.00 0.00 N ATOM 1101 CA GLU B 22 19.993 -20.897 -9.894 1.00 0.00 C ATOM 1102 C GLU B 22 19.658 -20.276 -11.248 1.00 0.00 C ATOM 1103 O GLU B 22 19.212 -20.974 -12.157 1.00 0.00 O ATOM 1104 CB GLU B 22 19.404 -22.308 -9.840 1.00 0.00 C ATOM 1105 CG GLU B 22 20.390 -23.423 -10.136 1.00 0.00 C ATOM 1106 CD GLU B 22 21.030 -23.314 -11.505 1.00 0.00 C ATOM 1107 OE1 GLU B 22 22.037 -22.587 -11.644 1.00 0.00 O ATOM 1108 OE2 GLU B 22 20.537 -23.964 -12.447 1.00 0.00 O ATOM 0 H GLU B 22 20.143 -19.736 -8.150 1.00 0.00 H new ATOM 0 HA GLU B 22 21.076 -20.932 -9.780 1.00 0.00 H new ATOM 0 HB2 GLU B 22 18.980 -22.471 -8.849 1.00 0.00 H new ATOM 0 HB3 GLU B 22 18.582 -22.371 -10.553 1.00 0.00 H new ATOM 0 HG2 GLU B 22 21.172 -23.418 -9.376 1.00 0.00 H new ATOM 0 HG3 GLU B 22 19.877 -24.382 -10.058 1.00 0.00 H new ATOM 1115 N GLY B 23 19.842 -18.964 -11.387 1.00 0.00 N ATOM 1116 CA GLY B 23 19.476 -18.295 -12.629 1.00 0.00 C ATOM 1117 C GLY B 23 18.005 -18.422 -12.949 1.00 0.00 C ATOM 1118 O GLY B 23 17.548 -18.054 -14.030 1.00 0.00 O ATOM 0 H GLY B 23 20.235 -18.355 -10.669 1.00 0.00 H new ATOM 0 HA2 GLY B 23 19.738 -17.239 -12.559 1.00 0.00 H new ATOM 0 HA3 GLY B 23 20.059 -18.715 -13.448 1.00 0.00 H new ATOM 1122 N THR B 24 17.280 -18.938 -11.993 1.00 0.00 N ATOM 1123 CA THR B 24 15.907 -19.319 -12.162 1.00 0.00 C ATOM 1124 C THR B 24 15.013 -18.528 -11.192 1.00 0.00 C ATOM 1125 O THR B 24 15.446 -18.189 -10.086 1.00 0.00 O ATOM 1126 CB THR B 24 15.872 -20.836 -11.915 1.00 0.00 C ATOM 1127 OG1 THR B 24 16.153 -21.533 -13.133 1.00 0.00 O ATOM 1128 CG2 THR B 24 14.573 -21.332 -11.308 1.00 0.00 C ATOM 0 H THR B 24 17.638 -19.108 -11.053 1.00 0.00 H new ATOM 0 HA THR B 24 15.521 -19.093 -13.156 1.00 0.00 H new ATOM 0 HB THR B 24 16.644 -21.045 -11.174 1.00 0.00 H new ATOM 0 HG1 THR B 24 16.131 -22.499 -12.970 1.00 0.00 H new ATOM 0 HG21 THR B 24 14.627 -22.411 -11.165 1.00 0.00 H new ATOM 0 HG22 THR B 24 14.412 -20.846 -10.346 1.00 0.00 H new ATOM 0 HG23 THR B 24 13.745 -21.096 -11.977 1.00 0.00 H new ATOM 1136 N PRO B 25 13.775 -18.182 -11.616 1.00 0.00 N ATOM 1137 CA PRO B 25 12.850 -17.367 -10.816 1.00 0.00 C ATOM 1138 C PRO B 25 12.628 -17.961 -9.433 1.00 0.00 C ATOM 1139 O PRO B 25 12.402 -19.162 -9.287 1.00 0.00 O ATOM 1140 CB PRO B 25 11.548 -17.366 -11.636 1.00 0.00 C ATOM 1141 CG PRO B 25 11.696 -18.502 -12.587 1.00 0.00 C ATOM 1142 CD PRO B 25 13.166 -18.565 -12.898 1.00 0.00 C ATOM 0 HA PRO B 25 13.235 -16.363 -10.637 1.00 0.00 H new ATOM 0 HB2 PRO B 25 10.677 -17.498 -10.995 1.00 0.00 H new ATOM 0 HB3 PRO B 25 11.414 -16.422 -12.165 1.00 0.00 H new ATOM 0 HG2 PRO B 25 11.347 -19.435 -12.144 1.00 0.00 H new ATOM 0 HG3 PRO B 25 11.109 -18.339 -13.491 1.00 0.00 H new ATOM 0 HD2 PRO B 25 13.473 -19.563 -13.212 1.00 0.00 H new ATOM 0 HD3 PRO B 25 13.442 -17.880 -13.700 1.00 0.00 H new ATOM 1150 N CYS B 26 12.704 -17.117 -8.417 1.00 0.00 N ATOM 1151 CA CYS B 26 12.705 -17.582 -7.044 1.00 0.00 C ATOM 1152 C CYS B 26 11.287 -17.808 -6.493 1.00 0.00 C ATOM 1153 O CYS B 26 10.406 -16.971 -6.688 1.00 0.00 O ATOM 1154 CB CYS B 26 13.461 -16.584 -6.183 1.00 0.00 C ATOM 1155 SG CYS B 26 13.534 -17.042 -4.422 1.00 0.00 S ATOM 0 H CYS B 26 12.766 -16.104 -8.520 1.00 0.00 H new ATOM 0 HA CYS B 26 13.201 -18.552 -7.018 1.00 0.00 H new ATOM 0 HB2 CYS B 26 14.477 -16.484 -6.565 1.00 0.00 H new ATOM 0 HB3 CYS B 26 12.988 -15.606 -6.276 1.00 0.00 H new ATOM 0 HG CYS B 26 14.564 -16.474 -3.868 1.00 0.00 H new ATOM 1160 N PRO B 27 11.101 -18.935 -5.753 1.00 0.00 N ATOM 1161 CA PRO B 27 9.825 -19.388 -5.163 1.00 0.00 C ATOM 1162 C PRO B 27 8.829 -18.285 -4.793 1.00 0.00 C ATOM 1163 O PRO B 27 7.671 -18.317 -5.204 1.00 0.00 O ATOM 1164 CB PRO B 27 10.309 -20.077 -3.889 1.00 0.00 C ATOM 1165 CG PRO B 27 11.634 -20.678 -4.235 1.00 0.00 C ATOM 1166 CD PRO B 27 12.164 -19.916 -5.440 1.00 0.00 C ATOM 0 HA PRO B 27 9.266 -19.995 -5.876 1.00 0.00 H new ATOM 0 HB2 PRO B 27 10.404 -19.364 -3.070 1.00 0.00 H new ATOM 0 HB3 PRO B 27 9.604 -20.843 -3.565 1.00 0.00 H new ATOM 0 HG2 PRO B 27 12.324 -20.600 -3.395 1.00 0.00 H new ATOM 0 HG3 PRO B 27 11.529 -21.738 -4.464 1.00 0.00 H new ATOM 0 HD2 PRO B 27 13.108 -19.420 -5.213 1.00 0.00 H new ATOM 0 HD3 PRO B 27 12.349 -20.583 -6.282 1.00 0.00 H new ATOM 1174 N ALA B 28 9.292 -17.306 -4.027 1.00 0.00 N ATOM 1175 CA ALA B 28 8.394 -16.322 -3.431 1.00 0.00 C ATOM 1176 C ALA B 28 8.876 -14.893 -3.666 1.00 0.00 C ATOM 1177 O ALA B 28 8.212 -13.932 -3.284 1.00 0.00 O ATOM 1178 CB ALA B 28 8.242 -16.587 -1.940 1.00 0.00 C ATOM 0 H ALA B 28 10.278 -17.171 -3.804 1.00 0.00 H new ATOM 0 HA ALA B 28 7.424 -16.425 -3.918 1.00 0.00 H new ATOM 0 HB1 ALA B 28 7.570 -15.847 -1.506 1.00 0.00 H new ATOM 0 HB2 ALA B 28 7.830 -17.585 -1.788 1.00 0.00 H new ATOM 0 HB3 ALA B 28 9.217 -16.519 -1.457 1.00 0.00 H new ATOM 1184 N CYS B 29 10.038 -14.747 -4.284 1.00 0.00 N ATOM 1185 CA CYS B 29 10.565 -13.422 -4.576 1.00 0.00 C ATOM 1186 C CYS B 29 11.055 -13.365 -6.019 1.00 0.00 C ATOM 1187 O CYS B 29 12.210 -13.675 -6.310 1.00 0.00 O ATOM 1188 CB CYS B 29 11.681 -13.041 -3.577 1.00 0.00 C ATOM 1189 SG CYS B 29 13.251 -13.934 -3.769 1.00 0.00 S ATOM 0 H CYS B 29 10.629 -15.520 -4.590 1.00 0.00 H new ATOM 0 HA CYS B 29 9.767 -12.688 -4.460 1.00 0.00 H new ATOM 0 HB2 CYS B 29 11.878 -11.973 -3.671 1.00 0.00 H new ATOM 0 HB3 CYS B 29 11.310 -13.209 -2.566 1.00 0.00 H new ATOM 0 HG CYS B 29 13.010 -15.184 -4.031 1.00 0.00 H new ATOM 1194 N SER B 30 10.168 -12.985 -6.928 1.00 0.00 N ATOM 1195 CA SER B 30 10.501 -12.947 -8.344 1.00 0.00 C ATOM 1196 C SER B 30 11.343 -11.714 -8.684 1.00 0.00 C ATOM 1197 O SER B 30 10.966 -10.904 -9.526 1.00 0.00 O ATOM 1198 CB SER B 30 9.216 -12.970 -9.179 1.00 0.00 C ATOM 1199 OG SER B 30 9.495 -13.123 -10.561 1.00 0.00 O ATOM 0 H SER B 30 9.213 -12.699 -6.710 1.00 0.00 H new ATOM 0 HA SER B 30 11.097 -13.828 -8.582 1.00 0.00 H new ATOM 0 HB2 SER B 30 8.578 -13.787 -8.843 1.00 0.00 H new ATOM 0 HB3 SER B 30 8.661 -12.046 -9.019 1.00 0.00 H new ATOM 0 HG SER B 30 10.024 -12.360 -10.874 1.00 0.00 H new ATOM 1205 N GLY B 31 12.481 -11.578 -8.011 1.00 0.00 N ATOM 1206 CA GLY B 31 13.417 -10.530 -8.349 1.00 0.00 C ATOM 1207 C GLY B 31 13.241 -9.292 -7.507 1.00 0.00 C ATOM 1208 O GLY B 31 13.150 -8.185 -8.029 1.00 0.00 O ATOM 0 H GLY B 31 12.769 -12.177 -7.237 1.00 0.00 H new ATOM 0 HA2 GLY B 31 14.433 -10.904 -8.227 1.00 0.00 H new ATOM 0 HA3 GLY B 31 13.297 -10.268 -9.400 1.00 0.00 H new ATOM 1212 N LYS B 32 13.186 -9.476 -6.196 1.00 0.00 N ATOM 1213 CA LYS B 32 13.104 -8.357 -5.275 1.00 0.00 C ATOM 1214 C LYS B 32 14.194 -8.484 -4.217 1.00 0.00 C ATOM 1215 O LYS B 32 14.762 -7.491 -3.771 1.00 0.00 O ATOM 1216 CB LYS B 32 11.722 -8.302 -4.614 1.00 0.00 C ATOM 1217 CG LYS B 32 10.613 -7.916 -5.580 1.00 0.00 C ATOM 1218 CD LYS B 32 9.646 -9.061 -5.850 1.00 0.00 C ATOM 1219 CE LYS B 32 8.736 -9.329 -4.659 1.00 0.00 C ATOM 1220 NZ LYS B 32 7.538 -10.117 -5.054 1.00 0.00 N ATOM 0 H LYS B 32 13.197 -10.392 -5.748 1.00 0.00 H new ATOM 0 HA LYS B 32 13.251 -7.431 -5.831 1.00 0.00 H new ATOM 0 HB2 LYS B 32 11.495 -9.276 -4.180 1.00 0.00 H new ATOM 0 HB3 LYS B 32 11.747 -7.585 -3.793 1.00 0.00 H new ATOM 0 HG2 LYS B 32 10.062 -7.068 -5.174 1.00 0.00 H new ATOM 0 HG3 LYS B 32 11.054 -7.588 -6.521 1.00 0.00 H new ATOM 0 HD2 LYS B 32 9.039 -8.825 -6.724 1.00 0.00 H new ATOM 0 HD3 LYS B 32 10.209 -9.964 -6.087 1.00 0.00 H new ATOM 0 HE2 LYS B 32 9.290 -9.868 -3.891 1.00 0.00 H new ATOM 0 HE3 LYS B 32 8.421 -8.382 -4.220 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 6.940 -10.282 -4.219 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 6.997 -9.591 -5.769 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 7.838 -11.030 -5.450 1.00 0.00 H new ATOM 1234 N GLY B 33 14.470 -9.722 -3.808 1.00 0.00 N ATOM 1235 CA GLY B 33 15.490 -9.979 -2.833 1.00 0.00 C ATOM 1236 C GLY B 33 14.874 -10.431 -1.534 1.00 0.00 C ATOM 1237 O GLY B 33 15.354 -11.369 -0.901 1.00 0.00 O ATOM 0 H GLY B 33 13.990 -10.556 -4.148 1.00 0.00 H new ATOM 0 HA2 GLY B 33 16.173 -10.743 -3.204 1.00 0.00 H new ATOM 0 HA3 GLY B 33 16.080 -9.077 -2.669 1.00 0.00 H new ATOM 1241 N VAL B 34 13.757 -9.817 -1.175 1.00 0.00 N ATOM 1242 CA VAL B 34 13.107 -10.105 0.094 1.00 0.00 C ATOM 1243 C VAL B 34 11.736 -10.746 -0.103 1.00 0.00 C ATOM 1244 O VAL B 34 11.182 -10.747 -1.208 1.00 0.00 O ATOM 1245 CB VAL B 34 12.935 -8.816 0.933 1.00 0.00 C ATOM 1246 CG1 VAL B 34 14.284 -8.186 1.246 1.00 0.00 C ATOM 1247 CG2 VAL B 34 12.040 -7.819 0.211 1.00 0.00 C ATOM 0 H VAL B 34 13.282 -9.116 -1.744 1.00 0.00 H new ATOM 0 HA VAL B 34 13.753 -10.807 0.622 1.00 0.00 H new ATOM 0 HB VAL B 34 12.459 -9.090 1.875 1.00 0.00 H new ATOM 0 HG11 VAL B 34 14.135 -7.282 1.836 1.00 0.00 H new ATOM 0 HG12 VAL B 34 14.893 -8.892 1.811 1.00 0.00 H new ATOM 0 HG13 VAL B 34 14.792 -7.932 0.315 1.00 0.00 H new ATOM 0 HG21 VAL B 34 11.932 -6.920 0.818 1.00 0.00 H new ATOM 0 HG22 VAL B 34 12.487 -7.557 -0.748 1.00 0.00 H new ATOM 0 HG23 VAL B 34 11.059 -8.264 0.045 1.00 0.00 H new ATOM 1257 N ILE B 35 11.223 -11.318 0.977 1.00 0.00 N ATOM 1258 CA ILE B 35 9.880 -11.876 1.006 1.00 0.00 C ATOM 1259 C ILE B 35 9.096 -11.319 2.193 1.00 0.00 C ATOM 1260 O ILE B 35 9.676 -10.776 3.131 1.00 0.00 O ATOM 1261 CB ILE B 35 9.905 -13.419 1.080 1.00 0.00 C ATOM 1262 CG1 ILE B 35 10.852 -13.885 2.189 1.00 0.00 C ATOM 1263 CG2 ILE B 35 10.316 -14.009 -0.261 1.00 0.00 C ATOM 1264 CD1 ILE B 35 10.875 -15.387 2.394 1.00 0.00 C ATOM 0 H ILE B 35 11.728 -11.408 1.859 1.00 0.00 H new ATOM 0 HA ILE B 35 9.388 -11.587 0.077 1.00 0.00 H new ATOM 0 HB ILE B 35 8.901 -13.772 1.316 1.00 0.00 H new ATOM 0 HG12 ILE B 35 11.861 -13.546 1.956 1.00 0.00 H new ATOM 0 HG13 ILE B 35 10.562 -13.406 3.124 1.00 0.00 H new ATOM 0 HG21 ILE B 35 10.329 -15.097 -0.191 1.00 0.00 H new ATOM 0 HG22 ILE B 35 9.604 -13.703 -1.027 1.00 0.00 H new ATOM 0 HG23 ILE B 35 11.311 -13.651 -0.527 1.00 0.00 H new ATOM 0 HD11 ILE B 35 11.570 -15.634 3.197 1.00 0.00 H new ATOM 0 HD12 ILE B 35 9.876 -15.733 2.660 1.00 0.00 H new ATOM 0 HD13 ILE B 35 11.195 -15.875 1.474 1.00 0.00 H new ATOM 1276 N LEU B 36 7.779 -11.453 2.142 1.00 0.00 N ATOM 1277 CA LEU B 36 6.903 -10.824 3.128 1.00 0.00 C ATOM 1278 C LEU B 36 6.679 -11.694 4.355 1.00 0.00 C ATOM 1279 O LEU B 36 6.840 -12.913 4.314 1.00 0.00 O ATOM 1280 CB LEU B 36 5.540 -10.507 2.505 1.00 0.00 C ATOM 1281 CG LEU B 36 5.591 -9.758 1.177 1.00 0.00 C ATOM 1282 CD1 LEU B 36 5.493 -10.723 0.006 1.00 0.00 C ATOM 1283 CD2 LEU B 36 4.489 -8.720 1.117 1.00 0.00 C ATOM 0 H LEU B 36 7.290 -11.992 1.428 1.00 0.00 H new ATOM 0 HA LEU B 36 7.406 -9.910 3.444 1.00 0.00 H new ATOM 0 HB2 LEU B 36 5.000 -11.442 2.356 1.00 0.00 H new ATOM 0 HB3 LEU B 36 4.962 -9.916 3.215 1.00 0.00 H new ATOM 0 HG LEU B 36 6.551 -9.246 1.106 1.00 0.00 H new ATOM 0 HD11 LEU B 36 5.532 -10.165 -0.930 1.00 0.00 H new ATOM 0 HD12 LEU B 36 6.325 -11.426 0.044 1.00 0.00 H new ATOM 0 HD13 LEU B 36 4.552 -11.270 0.063 1.00 0.00 H new ATOM 0 HD21 LEU B 36 4.537 -8.193 0.164 1.00 0.00 H new ATOM 0 HD22 LEU B 36 3.521 -9.211 1.211 1.00 0.00 H new ATOM 0 HD23 LEU B 36 4.615 -8.008 1.932 1.00 0.00 H new ATOM 1295 N THR B 37 6.306 -11.038 5.445 1.00 0.00 N ATOM 1296 CA THR B 37 5.851 -11.713 6.650 1.00 0.00 C ATOM 1297 C THR B 37 4.339 -11.504 6.783 1.00 0.00 C ATOM 1298 O THR B 37 3.756 -10.789 5.975 1.00 0.00 O ATOM 1299 CB THR B 37 6.586 -11.186 7.906 1.00 0.00 C ATOM 1300 OG1 THR B 37 6.153 -11.891 9.077 1.00 0.00 O ATOM 1301 CG2 THR B 37 6.353 -9.693 8.091 1.00 0.00 C ATOM 0 H THR B 37 6.311 -10.021 5.518 1.00 0.00 H new ATOM 0 HA THR B 37 6.076 -12.777 6.571 1.00 0.00 H new ATOM 0 HB THR B 37 7.653 -11.356 7.761 1.00 0.00 H new ATOM 0 HG1 THR B 37 6.629 -11.546 9.861 1.00 0.00 H new ATOM 0 HG21 THR B 37 6.881 -9.350 8.981 1.00 0.00 H new ATOM 0 HG22 THR B 37 6.725 -9.156 7.219 1.00 0.00 H new ATOM 0 HG23 THR B 37 5.286 -9.503 8.206 1.00 0.00 H new ATOM 1309 N ALA B 38 3.713 -12.106 7.793 1.00 0.00 N ATOM 1310 CA ALA B 38 2.249 -12.084 7.932 1.00 0.00 C ATOM 1311 C ALA B 38 1.677 -10.669 7.898 1.00 0.00 C ATOM 1312 O ALA B 38 0.663 -10.422 7.239 1.00 0.00 O ATOM 1313 CB ALA B 38 1.826 -12.791 9.206 1.00 0.00 C ATOM 0 H ALA B 38 4.195 -12.618 8.532 1.00 0.00 H new ATOM 0 HA ALA B 38 1.842 -12.615 7.071 1.00 0.00 H new ATOM 0 HB1 ALA B 38 0.740 -12.765 9.293 1.00 0.00 H new ATOM 0 HB2 ALA B 38 2.163 -13.827 9.176 1.00 0.00 H new ATOM 0 HB3 ALA B 38 2.271 -12.289 10.065 1.00 0.00 H new ATOM 1319 N GLN B 39 2.305 -9.750 8.623 1.00 0.00 N ATOM 1320 CA GLN B 39 1.907 -8.346 8.581 1.00 0.00 C ATOM 1321 C GLN B 39 1.911 -7.850 7.135 1.00 0.00 C ATOM 1322 O GLN B 39 0.906 -7.337 6.641 1.00 0.00 O ATOM 1323 CB GLN B 39 2.856 -7.504 9.446 1.00 0.00 C ATOM 1324 CG GLN B 39 2.173 -6.388 10.237 1.00 0.00 C ATOM 1325 CD GLN B 39 1.971 -5.112 9.450 1.00 0.00 C ATOM 1326 OE1 GLN B 39 1.795 -5.133 8.243 1.00 0.00 O ATOM 1327 NE2 GLN B 39 2.000 -3.982 10.141 1.00 0.00 N ATOM 0 H GLN B 39 3.089 -9.950 9.245 1.00 0.00 H new ATOM 0 HA GLN B 39 0.898 -8.246 8.981 1.00 0.00 H new ATOM 0 HB2 GLN B 39 3.372 -8.163 10.144 1.00 0.00 H new ATOM 0 HB3 GLN B 39 3.617 -7.062 8.803 1.00 0.00 H new ATOM 0 HG2 GLN B 39 1.204 -6.745 10.586 1.00 0.00 H new ATOM 0 HG3 GLN B 39 2.769 -6.166 11.122 1.00 0.00 H new ATOM 0 HE21 GLN B 39 2.150 -4.005 11.150 1.00 0.00 H new ATOM 0 HE22 GLN B 39 1.873 -3.089 9.664 1.00 0.00 H new ATOM 1336 N GLY B 40 3.029 -8.063 6.449 1.00 0.00 N ATOM 1337 CA GLY B 40 3.158 -7.638 5.069 1.00 0.00 C ATOM 1338 C GLY B 40 2.228 -8.386 4.131 1.00 0.00 C ATOM 1339 O GLY B 40 1.821 -7.856 3.100 1.00 0.00 O ATOM 0 H GLY B 40 3.854 -8.527 6.829 1.00 0.00 H new ATOM 0 HA2 GLY B 40 2.951 -6.570 5.002 1.00 0.00 H new ATOM 0 HA3 GLY B 40 4.188 -7.784 4.744 1.00 0.00 H new ATOM 1343 N TYR B 41 1.881 -9.615 4.481 1.00 0.00 N ATOM 1344 CA TYR B 41 0.940 -10.385 3.680 1.00 0.00 C ATOM 1345 C TYR B 41 -0.459 -9.791 3.760 1.00 0.00 C ATOM 1346 O TYR B 41 -1.202 -9.800 2.774 1.00 0.00 O ATOM 1347 CB TYR B 41 0.920 -11.840 4.162 1.00 0.00 C ATOM 1348 CG TYR B 41 1.946 -12.736 3.500 1.00 0.00 C ATOM 1349 CD1 TYR B 41 1.777 -13.179 2.194 1.00 0.00 C ATOM 1350 CD2 TYR B 41 3.079 -13.147 4.186 1.00 0.00 C ATOM 1351 CE1 TYR B 41 2.712 -14.003 1.594 1.00 0.00 C ATOM 1352 CE2 TYR B 41 4.014 -13.970 3.593 1.00 0.00 C ATOM 1353 CZ TYR B 41 3.827 -14.396 2.299 1.00 0.00 C ATOM 1354 OH TYR B 41 4.762 -15.221 1.715 1.00 0.00 O ATOM 0 H TYR B 41 2.233 -10.098 5.307 1.00 0.00 H new ATOM 0 HA TYR B 41 1.264 -10.351 2.640 1.00 0.00 H new ATOM 0 HB2 TYR B 41 1.085 -11.855 5.239 1.00 0.00 H new ATOM 0 HB3 TYR B 41 -0.073 -12.254 3.986 1.00 0.00 H new ATOM 0 HD1 TYR B 41 0.902 -12.875 1.639 1.00 0.00 H new ATOM 0 HD2 TYR B 41 3.232 -12.817 5.203 1.00 0.00 H new ATOM 0 HE1 TYR B 41 2.568 -14.337 0.577 1.00 0.00 H new ATOM 0 HE2 TYR B 41 4.890 -14.279 4.144 1.00 0.00 H new ATOM 0 HH TYR B 41 5.485 -15.399 2.352 1.00 0.00 H new ATOM 1364 N THR B 42 -0.805 -9.239 4.911 1.00 0.00 N ATOM 1365 CA THR B 42 -2.067 -8.534 5.063 1.00 0.00 C ATOM 1366 C THR B 42 -2.042 -7.214 4.288 1.00 0.00 C ATOM 1367 O THR B 42 -3.057 -6.770 3.742 1.00 0.00 O ATOM 1368 CB THR B 42 -2.347 -8.244 6.547 1.00 0.00 C ATOM 1369 OG1 THR B 42 -2.131 -9.432 7.316 1.00 0.00 O ATOM 1370 CG2 THR B 42 -3.773 -7.757 6.752 1.00 0.00 C ATOM 0 H THR B 42 -0.230 -9.265 5.753 1.00 0.00 H new ATOM 0 HA THR B 42 -2.857 -9.170 4.665 1.00 0.00 H new ATOM 0 HB THR B 42 -1.667 -7.459 6.877 1.00 0.00 H new ATOM 0 HG1 THR B 42 -1.170 -9.612 7.376 1.00 0.00 H new ATOM 0 HG21 THR B 42 -3.942 -7.560 7.811 1.00 0.00 H new ATOM 0 HG22 THR B 42 -3.930 -6.841 6.183 1.00 0.00 H new ATOM 0 HG23 THR B 42 -4.471 -8.521 6.409 1.00 0.00 H new ATOM 1378 N LEU B 43 -0.859 -6.622 4.199 1.00 0.00 N ATOM 1379 CA LEU B 43 -0.711 -5.308 3.596 1.00 0.00 C ATOM 1380 C LEU B 43 -0.542 -5.415 2.084 1.00 0.00 C ATOM 1381 O LEU B 43 -0.862 -4.473 1.365 1.00 0.00 O ATOM 1382 CB LEU B 43 0.482 -4.557 4.216 1.00 0.00 C ATOM 1383 CG LEU B 43 0.159 -3.609 5.391 1.00 0.00 C ATOM 1384 CD1 LEU B 43 -0.649 -4.324 6.463 1.00 0.00 C ATOM 1385 CD2 LEU B 43 1.445 -3.053 5.980 1.00 0.00 C ATOM 0 H LEU B 43 0.011 -7.032 4.537 1.00 0.00 H new ATOM 0 HA LEU B 43 -1.621 -4.743 3.798 1.00 0.00 H new ATOM 0 HB2 LEU B 43 1.208 -5.294 4.561 1.00 0.00 H new ATOM 0 HB3 LEU B 43 0.966 -3.976 3.431 1.00 0.00 H new ATOM 0 HG LEU B 43 -0.443 -2.784 5.010 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -0.863 -3.633 7.279 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -1.586 -4.681 6.035 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -0.078 -5.171 6.845 1.00 0.00 H new ATOM 0 HD21 LEU B 43 1.207 -2.385 6.808 1.00 0.00 H new ATOM 0 HD22 LEU B 43 2.064 -3.874 6.342 1.00 0.00 H new ATOM 0 HD23 LEU B 43 1.987 -2.500 5.213 1.00 0.00 H new ATOM 1397 N LEU B 44 -0.088 -6.563 1.580 1.00 0.00 N ATOM 1398 CA LEU B 44 0.102 -6.710 0.143 1.00 0.00 C ATOM 1399 C LEU B 44 -1.240 -6.942 -0.543 1.00 0.00 C ATOM 1400 O LEU B 44 -1.506 -6.373 -1.594 1.00 0.00 O ATOM 1401 CB LEU B 44 1.102 -7.846 -0.190 1.00 0.00 C ATOM 1402 CG LEU B 44 0.539 -9.278 -0.288 1.00 0.00 C ATOM 1403 CD1 LEU B 44 -0.062 -9.545 -1.664 1.00 0.00 C ATOM 1404 CD2 LEU B 44 1.624 -10.300 -0.004 1.00 0.00 C ATOM 0 H LEU B 44 0.150 -7.386 2.134 1.00 0.00 H new ATOM 0 HA LEU B 44 0.533 -5.784 -0.237 1.00 0.00 H new ATOM 0 HB2 LEU B 44 1.581 -7.606 -1.139 1.00 0.00 H new ATOM 0 HB3 LEU B 44 1.883 -7.842 0.571 1.00 0.00 H new ATOM 0 HG LEU B 44 -0.249 -9.370 0.460 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -0.450 -10.563 -1.700 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -0.873 -8.841 -1.850 1.00 0.00 H new ATOM 0 HD13 LEU B 44 0.707 -9.422 -2.427 1.00 0.00 H new ATOM 0 HD21 LEU B 44 1.206 -11.304 -0.078 1.00 0.00 H new ATOM 0 HD22 LEU B 44 2.429 -10.187 -0.730 1.00 0.00 H new ATOM 0 HD23 LEU B 44 2.017 -10.144 1.001 1.00 0.00 H new ATOM 1416 N ASP B 45 -2.099 -7.753 0.070 1.00 0.00 N ATOM 1417 CA ASP B 45 -3.382 -8.091 -0.546 1.00 0.00 C ATOM 1418 C ASP B 45 -4.311 -6.888 -0.532 1.00 0.00 C ATOM 1419 O ASP B 45 -5.195 -6.760 -1.378 1.00 0.00 O ATOM 1420 CB ASP B 45 -4.032 -9.271 0.181 1.00 0.00 C ATOM 1421 CG ASP B 45 -5.282 -9.767 -0.520 1.00 0.00 C ATOM 1422 OD1 ASP B 45 -5.154 -10.348 -1.619 1.00 0.00 O ATOM 1423 OD2 ASP B 45 -6.394 -9.592 0.023 1.00 0.00 O ATOM 0 H ASP B 45 -1.935 -8.184 0.980 1.00 0.00 H new ATOM 0 HA ASP B 45 -3.200 -8.379 -1.581 1.00 0.00 H new ATOM 0 HB2 ASP B 45 -3.314 -10.087 0.257 1.00 0.00 H new ATOM 0 HB3 ASP B 45 -4.284 -8.973 1.199 1.00 0.00 H new ATOM 1428 N PHE B 46 -4.068 -5.979 0.396 1.00 0.00 N ATOM 1429 CA PHE B 46 -4.809 -4.731 0.456 1.00 0.00 C ATOM 1430 C PHE B 46 -4.349 -3.781 -0.631 1.00 0.00 C ATOM 1431 O PHE B 46 -5.164 -3.113 -1.268 1.00 0.00 O ATOM 1432 CB PHE B 46 -4.566 -4.087 1.816 1.00 0.00 C ATOM 1433 CG PHE B 46 -5.356 -2.842 2.066 1.00 0.00 C ATOM 1434 CD1 PHE B 46 -6.627 -2.916 2.606 1.00 0.00 C ATOM 1435 CD2 PHE B 46 -4.823 -1.598 1.770 1.00 0.00 C ATOM 1436 CE1 PHE B 46 -7.352 -1.770 2.849 1.00 0.00 C ATOM 1437 CE2 PHE B 46 -5.545 -0.450 2.009 1.00 0.00 C ATOM 1438 CZ PHE B 46 -6.811 -0.537 2.548 1.00 0.00 C ATOM 0 H PHE B 46 -3.359 -6.083 1.122 1.00 0.00 H new ATOM 0 HA PHE B 46 -5.869 -4.938 0.311 1.00 0.00 H new ATOM 0 HB2 PHE B 46 -4.801 -4.813 2.594 1.00 0.00 H new ATOM 0 HB3 PHE B 46 -3.505 -3.853 1.908 1.00 0.00 H new ATOM 0 HD1 PHE B 46 -7.055 -3.880 2.839 1.00 0.00 H new ATOM 0 HD2 PHE B 46 -3.831 -1.528 1.348 1.00 0.00 H new ATOM 0 HE1 PHE B 46 -8.342 -1.837 3.274 1.00 0.00 H new ATOM 0 HE2 PHE B 46 -5.121 0.515 1.775 1.00 0.00 H new ATOM 0 HZ PHE B 46 -7.380 0.362 2.735 1.00 0.00 H new ATOM 1448 N ILE B 47 -3.057 -3.738 -0.882 1.00 0.00 N ATOM 1449 CA ILE B 47 -2.566 -2.820 -1.881 1.00 0.00 C ATOM 1450 C ILE B 47 -2.830 -3.384 -3.268 1.00 0.00 C ATOM 1451 O ILE B 47 -3.139 -2.641 -4.198 1.00 0.00 O ATOM 1452 CB ILE B 47 -1.066 -2.488 -1.709 1.00 0.00 C ATOM 1453 CG1 ILE B 47 -0.195 -3.718 -1.976 1.00 0.00 C ATOM 1454 CG2 ILE B 47 -0.823 -1.957 -0.307 1.00 0.00 C ATOM 1455 CD1 ILE B 47 1.291 -3.459 -1.873 1.00 0.00 C ATOM 0 H ILE B 47 -2.349 -4.310 -0.423 1.00 0.00 H new ATOM 0 HA ILE B 47 -3.106 -1.882 -1.752 1.00 0.00 H new ATOM 0 HB ILE B 47 -0.791 -1.725 -2.437 1.00 0.00 H new ATOM 0 HG12 ILE B 47 -0.466 -4.502 -1.268 1.00 0.00 H new ATOM 0 HG13 ILE B 47 -0.418 -4.098 -2.973 1.00 0.00 H new ATOM 0 HG21 ILE B 47 0.234 -1.723 -0.185 1.00 0.00 H new ATOM 0 HG22 ILE B 47 -1.415 -1.055 -0.152 1.00 0.00 H new ATOM 0 HG23 ILE B 47 -1.114 -2.712 0.423 1.00 0.00 H new ATOM 0 HD11 ILE B 47 1.836 -4.381 -2.076 1.00 0.00 H new ATOM 0 HD12 ILE B 47 1.579 -2.699 -2.600 1.00 0.00 H new ATOM 0 HD13 ILE B 47 1.531 -3.110 -0.869 1.00 0.00 H new ATOM 1467 N GLN B 48 -2.753 -4.710 -3.380 1.00 0.00 N ATOM 1468 CA GLN B 48 -3.183 -5.414 -4.577 1.00 0.00 C ATOM 1469 C GLN B 48 -4.586 -4.969 -4.951 1.00 0.00 C ATOM 1470 O GLN B 48 -4.795 -4.289 -5.936 1.00 0.00 O ATOM 1471 CB GLN B 48 -3.210 -6.927 -4.325 1.00 0.00 C ATOM 1472 CG GLN B 48 -1.852 -7.615 -4.306 1.00 0.00 C ATOM 1473 CD GLN B 48 -1.284 -7.842 -5.694 1.00 0.00 C ATOM 1474 OE1 GLN B 48 -2.022 -7.947 -6.673 1.00 0.00 O ATOM 1475 NE2 GLN B 48 0.032 -7.950 -5.784 1.00 0.00 N ATOM 0 H GLN B 48 -2.392 -5.319 -2.645 1.00 0.00 H new ATOM 0 HA GLN B 48 -2.483 -5.187 -5.381 1.00 0.00 H new ATOM 0 HB2 GLN B 48 -3.703 -7.109 -3.370 1.00 0.00 H new ATOM 0 HB3 GLN B 48 -3.823 -7.395 -5.095 1.00 0.00 H new ATOM 0 HG2 GLN B 48 -1.153 -7.011 -3.727 1.00 0.00 H new ATOM 0 HG3 GLN B 48 -1.943 -8.574 -3.795 1.00 0.00 H new ATOM 0 HE21 GLN B 48 0.610 -7.857 -4.949 1.00 0.00 H new ATOM 0 HE22 GLN B 48 0.469 -8.127 -6.689 1.00 0.00 H new ATOM 1484 N LYS B 49 -5.500 -5.235 -4.047 1.00 0.00 N ATOM 1485 CA LYS B 49 -6.930 -5.247 -4.323 1.00 0.00 C ATOM 1486 C LYS B 49 -7.533 -3.843 -4.408 1.00 0.00 C ATOM 1487 O LYS B 49 -8.723 -3.690 -4.685 1.00 0.00 O ATOM 1488 CB LYS B 49 -7.588 -6.046 -3.199 1.00 0.00 C ATOM 1489 CG LYS B 49 -9.067 -6.340 -3.365 1.00 0.00 C ATOM 1490 CD LYS B 49 -9.649 -6.883 -2.067 1.00 0.00 C ATOM 1491 CE LYS B 49 -8.778 -7.990 -1.487 1.00 0.00 C ATOM 1492 NZ LYS B 49 -9.240 -8.431 -0.144 1.00 0.00 N ATOM 0 H LYS B 49 -5.272 -5.454 -3.077 1.00 0.00 H new ATOM 0 HA LYS B 49 -7.106 -5.699 -5.299 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -7.059 -6.994 -3.097 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -7.449 -5.502 -2.265 1.00 0.00 H new ATOM 0 HG2 LYS B 49 -9.595 -5.431 -3.656 1.00 0.00 H new ATOM 0 HG3 LYS B 49 -9.213 -7.064 -4.167 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -9.743 -6.074 -1.342 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -10.653 -7.266 -2.249 1.00 0.00 H new ATOM 0 HE2 LYS B 49 -8.779 -8.842 -2.166 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -7.748 -7.639 -1.417 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 -8.479 -8.959 0.329 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 -9.490 -7.599 0.427 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 -10.074 -9.044 -0.248 1.00 0.00 H new ATOM 1506 N HIS B 50 -6.749 -2.805 -4.143 1.00 0.00 N ATOM 1507 CA HIS B 50 -7.274 -1.476 -4.426 1.00 0.00 C ATOM 1508 C HIS B 50 -6.492 -0.718 -5.498 1.00 0.00 C ATOM 1509 O HIS B 50 -6.894 0.382 -5.867 1.00 0.00 O ATOM 1510 CB HIS B 50 -7.332 -0.660 -3.131 1.00 0.00 C ATOM 1511 CG HIS B 50 -8.127 -1.338 -2.056 1.00 0.00 C ATOM 1512 ND1 HIS B 50 -9.477 -1.544 -2.152 1.00 0.00 N ATOM 1513 CD2 HIS B 50 -7.749 -1.909 -0.892 1.00 0.00 C ATOM 1514 CE1 HIS B 50 -9.898 -2.209 -1.100 1.00 0.00 C ATOM 1515 NE2 HIS B 50 -8.871 -2.451 -0.314 1.00 0.00 N ATOM 0 H HIS B 50 -5.806 -2.847 -3.757 1.00 0.00 H new ATOM 0 HA HIS B 50 -8.276 -1.616 -4.832 1.00 0.00 H new ATOM 0 HB2 HIS B 50 -6.318 -0.484 -2.771 1.00 0.00 H new ATOM 0 HB3 HIS B 50 -7.770 0.316 -3.340 1.00 0.00 H new ATOM 0 HD2 HIS B 50 -6.747 -1.935 -0.489 1.00 0.00 H new ATOM 0 HE1 HIS B 50 -10.919 -2.508 -0.912 1.00 0.00 H new ATOM 0 HE2 HIS B 50 -8.903 -2.955 0.572 1.00 0.00 H new ATOM 1524 N LEU B 51 -5.407 -1.290 -6.021 1.00 0.00 N ATOM 1525 CA LEU B 51 -4.695 -0.653 -7.141 1.00 0.00 C ATOM 1526 C LEU B 51 -4.498 -1.607 -8.317 1.00 0.00 C ATOM 1527 O LEU B 51 -4.734 -1.242 -9.468 1.00 0.00 O ATOM 1528 CB LEU B 51 -3.325 -0.092 -6.722 1.00 0.00 C ATOM 1529 CG LEU B 51 -3.345 1.096 -5.750 1.00 0.00 C ATOM 1530 CD1 LEU B 51 -2.013 1.834 -5.764 1.00 0.00 C ATOM 1531 CD2 LEU B 51 -4.463 2.055 -6.093 1.00 0.00 C ATOM 0 H LEU B 51 -5.006 -2.171 -5.701 1.00 0.00 H new ATOM 0 HA LEU B 51 -5.334 0.173 -7.455 1.00 0.00 H new ATOM 0 HB2 LEU B 51 -2.750 -0.898 -6.265 1.00 0.00 H new ATOM 0 HB3 LEU B 51 -2.790 0.211 -7.622 1.00 0.00 H new ATOM 0 HG LEU B 51 -3.516 0.699 -4.749 1.00 0.00 H new ATOM 0 HD11 LEU B 51 -2.053 2.671 -5.067 1.00 0.00 H new ATOM 0 HD12 LEU B 51 -1.216 1.152 -5.467 1.00 0.00 H new ATOM 0 HD13 LEU B 51 -1.815 2.208 -6.769 1.00 0.00 H new ATOM 0 HD21 LEU B 51 -4.456 2.888 -5.390 1.00 0.00 H new ATOM 0 HD22 LEU B 51 -4.320 2.433 -7.105 1.00 0.00 H new ATOM 0 HD23 LEU B 51 -5.419 1.536 -6.031 1.00 0.00 H new ATOM 1543 N ASN B 52 -4.069 -2.825 -8.029 1.00 0.00 N ATOM 1544 CA ASN B 52 -3.691 -3.779 -9.073 1.00 0.00 C ATOM 1545 C ASN B 52 -4.712 -4.903 -9.232 1.00 0.00 C ATOM 1546 O ASN B 52 -4.820 -5.507 -10.296 1.00 0.00 O ATOM 1547 CB ASN B 52 -2.311 -4.365 -8.769 1.00 0.00 C ATOM 1548 CG ASN B 52 -1.211 -3.688 -9.564 1.00 0.00 C ATOM 1549 OD1 ASN B 52 -0.639 -2.688 -9.135 1.00 0.00 O ATOM 1550 ND2 ASN B 52 -0.902 -4.237 -10.729 1.00 0.00 N ATOM 0 H ASN B 52 -3.972 -3.183 -7.079 1.00 0.00 H new ATOM 0 HA ASN B 52 -3.662 -3.233 -10.016 1.00 0.00 H new ATOM 0 HB2 ASN B 52 -2.102 -4.263 -7.704 1.00 0.00 H new ATOM 0 HB3 ASN B 52 -2.314 -5.432 -8.993 1.00 0.00 H new ATOM 0 HD21 ASN B 52 -0.166 -3.830 -11.305 1.00 0.00 H new ATOM 0 HD22 ASN B 52 -1.400 -5.067 -11.050 1.00 0.00 H new ATOM 1557 N LYS B 53 -5.451 -5.183 -8.175 1.00 0.00 N ATOM 1558 CA LYS B 53 -6.469 -6.213 -8.194 1.00 0.00 C ATOM 1559 C LYS B 53 -7.855 -5.589 -8.141 1.00 0.00 C ATOM 1560 O LYS B 53 -8.465 -5.397 -9.213 1.00 0.00 O ATOM 1561 CB LYS B 53 -6.282 -7.153 -7.004 1.00 0.00 C ATOM 1562 CG LYS B 53 -5.655 -8.483 -7.373 1.00 0.00 C ATOM 1563 CD LYS B 53 -6.079 -9.576 -6.403 1.00 0.00 C ATOM 1564 CE LYS B 53 -5.470 -9.397 -5.026 1.00 0.00 C ATOM 1565 NZ LYS B 53 -5.871 -10.495 -4.110 1.00 0.00 N ATOM 1566 OXT LYS B 53 -8.333 -5.296 -7.032 1.00 0.00 O ATOM 0 H LYS B 53 -5.361 -4.702 -7.280 1.00 0.00 H new ATOM 0 HA LYS B 53 -6.373 -6.780 -9.120 1.00 0.00 H new ATOM 0 HB2 LYS B 53 -5.658 -6.661 -6.258 1.00 0.00 H new ATOM 0 HB3 LYS B 53 -7.251 -7.334 -6.539 1.00 0.00 H new ATOM 0 HG2 LYS B 53 -5.948 -8.758 -8.386 1.00 0.00 H new ATOM 0 HG3 LYS B 53 -4.569 -8.390 -7.369 1.00 0.00 H new ATOM 0 HD2 LYS B 53 -7.166 -9.581 -6.318 1.00 0.00 H new ATOM 0 HD3 LYS B 53 -5.786 -10.547 -6.803 1.00 0.00 H new ATOM 0 HE2 LYS B 53 -4.383 -9.368 -5.108 1.00 0.00 H new ATOM 0 HE3 LYS B 53 -5.784 -8.440 -4.609 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 -5.770 -10.179 -3.124 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 -6.862 -10.754 -4.291 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 -5.262 -11.322 -4.272 1.00 0.00 H new ATOM 1601 N VAL C 2 -7.816 4.585 13.727 1.00 0.00 N ATOM 1602 CA VAL C 2 -6.643 4.556 14.595 1.00 0.00 C ATOM 1603 C VAL C 2 -5.401 5.038 13.839 1.00 0.00 C ATOM 1604 O VAL C 2 -4.277 4.976 14.339 1.00 0.00 O ATOM 1605 CB VAL C 2 -6.418 3.128 15.155 1.00 0.00 C ATOM 1606 CG1 VAL C 2 -5.963 2.172 14.060 1.00 0.00 C ATOM 1607 CG2 VAL C 2 -5.436 3.137 16.320 1.00 0.00 C ATOM 0 HA VAL C 2 -6.818 5.232 15.432 1.00 0.00 H new ATOM 0 HB VAL C 2 -7.375 2.769 15.533 1.00 0.00 H new ATOM 0 HG11 VAL C 2 -5.813 1.179 14.483 1.00 0.00 H new ATOM 0 HG12 VAL C 2 -6.723 2.124 13.280 1.00 0.00 H new ATOM 0 HG13 VAL C 2 -5.026 2.529 13.632 1.00 0.00 H new ATOM 0 HG21 VAL C 2 -5.300 2.121 16.689 1.00 0.00 H new ATOM 0 HG22 VAL C 2 -4.477 3.532 15.985 1.00 0.00 H new ATOM 0 HG23 VAL C 2 -5.827 3.765 17.121 1.00 0.00 H new ATOM 1617 N ILE C 3 -5.616 5.535 12.633 1.00 0.00 N ATOM 1618 CA ILE C 3 -4.538 6.095 11.840 1.00 0.00 C ATOM 1619 C ILE C 3 -5.082 7.206 10.955 1.00 0.00 C ATOM 1620 O ILE C 3 -6.182 7.092 10.412 1.00 0.00 O ATOM 1621 CB ILE C 3 -3.822 5.018 10.981 1.00 0.00 C ATOM 1622 CG1 ILE C 3 -2.536 5.588 10.375 1.00 0.00 C ATOM 1623 CG2 ILE C 3 -4.740 4.488 9.883 1.00 0.00 C ATOM 1624 CD1 ILE C 3 -1.711 4.564 9.625 1.00 0.00 C ATOM 0 H ILE C 3 -6.530 5.562 12.182 1.00 0.00 H new ATOM 0 HA ILE C 3 -3.794 6.501 12.525 1.00 0.00 H new ATOM 0 HB ILE C 3 -3.563 4.184 11.633 1.00 0.00 H new ATOM 0 HG12 ILE C 3 -2.794 6.401 9.697 1.00 0.00 H new ATOM 0 HG13 ILE C 3 -1.929 6.018 11.172 1.00 0.00 H new ATOM 0 HG21 ILE C 3 -4.211 3.736 9.298 1.00 0.00 H new ATOM 0 HG22 ILE C 3 -5.626 4.040 10.334 1.00 0.00 H new ATOM 0 HG23 ILE C 3 -5.040 5.309 9.232 1.00 0.00 H new ATOM 0 HD11 ILE C 3 -0.816 5.040 9.224 1.00 0.00 H new ATOM 0 HD12 ILE C 3 -1.422 3.762 10.304 1.00 0.00 H new ATOM 0 HD13 ILE C 3 -2.300 4.151 8.806 1.00 0.00 H new ATOM 1636 N ALA C 4 -4.345 8.297 10.867 1.00 0.00 N ATOM 1637 CA ALA C 4 -4.726 9.405 10.014 1.00 0.00 C ATOM 1638 C ALA C 4 -3.648 9.659 8.974 1.00 0.00 C ATOM 1639 O ALA C 4 -2.494 9.259 9.148 1.00 0.00 O ATOM 1640 CB ALA C 4 -4.974 10.650 10.852 1.00 0.00 C ATOM 0 H ALA C 4 -3.474 8.439 11.379 1.00 0.00 H new ATOM 0 HA ALA C 4 -5.650 9.152 9.494 1.00 0.00 H new ATOM 0 HB1 ALA C 4 -5.260 11.476 10.201 1.00 0.00 H new ATOM 0 HB2 ALA C 4 -5.776 10.455 11.564 1.00 0.00 H new ATOM 0 HB3 ALA C 4 -4.064 10.912 11.393 1.00 0.00 H new ATOM 1646 N THR C 5 -4.030 10.330 7.895 1.00 0.00 N ATOM 1647 CA THR C 5 -3.126 10.614 6.791 1.00 0.00 C ATOM 1648 C THR C 5 -2.001 11.542 7.241 1.00 0.00 C ATOM 1649 O THR C 5 -0.969 11.656 6.587 1.00 0.00 O ATOM 1650 CB THR C 5 -3.895 11.266 5.626 1.00 0.00 C ATOM 1651 OG1 THR C 5 -5.169 10.625 5.480 1.00 0.00 O ATOM 1652 CG2 THR C 5 -3.121 11.149 4.322 1.00 0.00 C ATOM 0 H THR C 5 -4.974 10.692 7.762 1.00 0.00 H new ATOM 0 HA THR C 5 -2.694 9.671 6.456 1.00 0.00 H new ATOM 0 HB THR C 5 -4.028 12.324 5.853 1.00 0.00 H new ATOM 0 HG1 THR C 5 -5.661 11.039 4.740 1.00 0.00 H new ATOM 0 HG21 THR C 5 -3.689 11.618 3.518 1.00 0.00 H new ATOM 0 HG22 THR C 5 -2.157 11.648 4.425 1.00 0.00 H new ATOM 0 HG23 THR C 5 -2.961 10.097 4.087 1.00 0.00 H new ATOM 1660 N ASP C 6 -2.194 12.158 8.399 1.00 0.00 N ATOM 1661 CA ASP C 6 -1.243 13.118 8.932 1.00 0.00 C ATOM 1662 C ASP C 6 -0.092 12.408 9.632 1.00 0.00 C ATOM 1663 O ASP C 6 0.886 13.035 10.033 1.00 0.00 O ATOM 1664 CB ASP C 6 -1.942 14.061 9.914 1.00 0.00 C ATOM 1665 CG ASP C 6 -3.085 14.823 9.276 1.00 0.00 C ATOM 1666 OD1 ASP C 6 -4.225 14.309 9.277 1.00 0.00 O ATOM 1667 OD2 ASP C 6 -2.851 15.941 8.771 1.00 0.00 O ATOM 0 H ASP C 6 -3.010 12.006 8.991 1.00 0.00 H new ATOM 0 HA ASP C 6 -0.840 13.696 8.101 1.00 0.00 H new ATOM 0 HB2 ASP C 6 -2.321 13.485 10.758 1.00 0.00 H new ATOM 0 HB3 ASP C 6 -1.215 14.769 10.312 1.00 0.00 H new ATOM 1672 N ASP C 7 -0.213 11.094 9.788 1.00 0.00 N ATOM 1673 CA ASP C 7 0.865 10.302 10.369 1.00 0.00 C ATOM 1674 C ASP C 7 1.606 9.527 9.289 1.00 0.00 C ATOM 1675 O ASP C 7 2.513 8.746 9.580 1.00 0.00 O ATOM 1676 CB ASP C 7 0.311 9.322 11.408 1.00 0.00 C ATOM 1677 CG ASP C 7 -0.392 10.019 12.552 1.00 0.00 C ATOM 1678 OD1 ASP C 7 0.302 10.537 13.454 1.00 0.00 O ATOM 1679 OD2 ASP C 7 -1.639 10.053 12.556 1.00 0.00 O ATOM 0 H ASP C 7 -1.040 10.558 9.523 1.00 0.00 H new ATOM 0 HA ASP C 7 1.559 10.987 10.855 1.00 0.00 H new ATOM 0 HB2 ASP C 7 -0.385 8.639 10.922 1.00 0.00 H new ATOM 0 HB3 ASP C 7 1.128 8.718 11.803 1.00 0.00 H new ATOM 1684 N LEU C 8 1.219 9.750 8.042 1.00 0.00 N ATOM 1685 CA LEU C 8 1.855 9.089 6.908 1.00 0.00 C ATOM 1686 C LEU C 8 2.365 10.119 5.914 1.00 0.00 C ATOM 1687 O LEU C 8 3.407 9.932 5.278 1.00 0.00 O ATOM 1688 CB LEU C 8 0.861 8.156 6.217 1.00 0.00 C ATOM 1689 CG LEU C 8 0.298 7.044 7.098 1.00 0.00 C ATOM 1690 CD1 LEU C 8 -0.755 6.251 6.343 1.00 0.00 C ATOM 1691 CD2 LEU C 8 1.412 6.129 7.572 1.00 0.00 C ATOM 0 H LEU C 8 0.464 10.387 7.787 1.00 0.00 H new ATOM 0 HA LEU C 8 2.698 8.505 7.277 1.00 0.00 H new ATOM 0 HB2 LEU C 8 0.032 8.752 5.836 1.00 0.00 H new ATOM 0 HB3 LEU C 8 1.350 7.703 5.355 1.00 0.00 H new ATOM 0 HG LEU C 8 -0.171 7.498 7.971 1.00 0.00 H new ATOM 0 HD11 LEU C 8 -1.146 5.462 6.985 1.00 0.00 H new ATOM 0 HD12 LEU C 8 -1.568 6.915 6.047 1.00 0.00 H new ATOM 0 HD13 LEU C 8 -0.308 5.807 5.454 1.00 0.00 H new ATOM 0 HD21 LEU C 8 0.994 5.341 8.199 1.00 0.00 H new ATOM 0 HD22 LEU C 8 1.907 5.682 6.710 1.00 0.00 H new ATOM 0 HD23 LEU C 8 2.136 6.705 8.148 1.00 0.00 H new ATOM 1703 N GLU C 9 1.637 11.220 5.814 1.00 0.00 N ATOM 1704 CA GLU C 9 1.947 12.272 4.866 1.00 0.00 C ATOM 1705 C GLU C 9 1.832 13.630 5.540 1.00 0.00 C ATOM 1706 O GLU C 9 0.979 13.842 6.403 1.00 0.00 O ATOM 1707 CB GLU C 9 1.006 12.219 3.660 1.00 0.00 C ATOM 1708 CG GLU C 9 1.117 10.940 2.851 1.00 0.00 C ATOM 1709 CD GLU C 9 0.187 10.926 1.658 1.00 0.00 C ATOM 1710 OE1 GLU C 9 -1.004 11.252 1.818 1.00 0.00 O ATOM 1711 OE2 GLU C 9 0.652 10.601 0.551 1.00 0.00 O ATOM 0 H GLU C 9 0.815 11.407 6.389 1.00 0.00 H new ATOM 0 HA GLU C 9 2.969 12.122 4.517 1.00 0.00 H new ATOM 0 HB2 GLU C 9 -0.021 12.330 4.008 1.00 0.00 H new ATOM 0 HB3 GLU C 9 1.216 13.068 3.010 1.00 0.00 H new ATOM 0 HG2 GLU C 9 2.145 10.819 2.508 1.00 0.00 H new ATOM 0 HG3 GLU C 9 0.893 10.088 3.492 1.00 0.00 H new ATOM 1718 N VAL C 10 2.699 14.536 5.150 1.00 0.00 N ATOM 1719 CA VAL C 10 2.678 15.889 5.660 1.00 0.00 C ATOM 1720 C VAL C 10 2.719 16.864 4.492 1.00 0.00 C ATOM 1721 O VAL C 10 3.402 16.620 3.495 1.00 0.00 O ATOM 1722 CB VAL C 10 3.860 16.142 6.630 1.00 0.00 C ATOM 1723 CG1 VAL C 10 5.192 15.810 5.970 1.00 0.00 C ATOM 1724 CG2 VAL C 10 3.854 17.577 7.140 1.00 0.00 C ATOM 0 H VAL C 10 3.438 14.357 4.471 1.00 0.00 H new ATOM 0 HA VAL C 10 1.758 16.040 6.225 1.00 0.00 H new ATOM 0 HB VAL C 10 3.733 15.479 7.486 1.00 0.00 H new ATOM 0 HG11 VAL C 10 6.003 15.997 6.674 1.00 0.00 H new ATOM 0 HG12 VAL C 10 5.201 14.760 5.676 1.00 0.00 H new ATOM 0 HG13 VAL C 10 5.326 16.435 5.087 1.00 0.00 H new ATOM 0 HG21 VAL C 10 4.694 17.726 7.818 1.00 0.00 H new ATOM 0 HG22 VAL C 10 3.942 18.263 6.297 1.00 0.00 H new ATOM 0 HG23 VAL C 10 2.921 17.771 7.670 1.00 0.00 H new ATOM 1734 N ALA C 11 1.967 17.947 4.597 1.00 0.00 N ATOM 1735 CA ALA C 11 1.899 18.929 3.532 1.00 0.00 C ATOM 1736 C ALA C 11 3.252 19.600 3.325 1.00 0.00 C ATOM 1737 O ALA C 11 3.920 19.980 4.288 1.00 0.00 O ATOM 1738 CB ALA C 11 0.831 19.961 3.869 1.00 0.00 C ATOM 0 H ALA C 11 1.394 18.167 5.412 1.00 0.00 H new ATOM 0 HA ALA C 11 1.634 18.428 2.601 1.00 0.00 H new ATOM 0 HB1 ALA C 11 0.776 20.702 3.071 1.00 0.00 H new ATOM 0 HB2 ALA C 11 -0.134 19.465 3.971 1.00 0.00 H new ATOM 0 HB3 ALA C 11 1.086 20.456 4.806 1.00 0.00 H new ATOM 1744 N CYS C 12 3.640 19.728 2.053 1.00 0.00 N ATOM 1745 CA CYS C 12 4.967 20.191 1.648 1.00 0.00 C ATOM 1746 C CYS C 12 5.298 21.605 2.176 1.00 0.00 C ATOM 1747 O CYS C 12 4.411 22.314 2.645 1.00 0.00 O ATOM 1748 CB CYS C 12 5.005 20.200 0.120 1.00 0.00 C ATOM 1749 SG CYS C 12 6.540 19.581 -0.597 1.00 0.00 S ATOM 0 H CYS C 12 3.031 19.509 1.265 1.00 0.00 H new ATOM 0 HA CYS C 12 5.712 19.518 2.073 1.00 0.00 H new ATOM 0 HB2 CYS C 12 4.176 19.599 -0.254 1.00 0.00 H new ATOM 0 HB3 CYS C 12 4.842 21.220 -0.228 1.00 0.00 H new ATOM 0 HG CYS C 12 6.297 19.069 -1.767 1.00 0.00 H new ATOM 1754 N PRO C 13 6.576 22.045 2.092 1.00 0.00 N ATOM 1755 CA PRO C 13 6.982 23.408 2.497 1.00 0.00 C ATOM 1756 C PRO C 13 6.156 24.527 1.847 1.00 0.00 C ATOM 1757 O PRO C 13 5.917 25.570 2.458 1.00 0.00 O ATOM 1758 CB PRO C 13 8.422 23.481 1.984 1.00 0.00 C ATOM 1759 CG PRO C 13 8.923 22.091 2.070 1.00 0.00 C ATOM 1760 CD PRO C 13 7.747 21.245 1.659 1.00 0.00 C ATOM 0 HA PRO C 13 6.849 23.559 3.568 1.00 0.00 H new ATOM 0 HB2 PRO C 13 8.459 23.853 0.960 1.00 0.00 H new ATOM 0 HB3 PRO C 13 9.025 24.157 2.590 1.00 0.00 H new ATOM 0 HG2 PRO C 13 9.776 21.934 1.410 1.00 0.00 H new ATOM 0 HG3 PRO C 13 9.253 21.849 3.080 1.00 0.00 H new ATOM 0 HD2 PRO C 13 7.736 21.068 0.584 1.00 0.00 H new ATOM 0 HD3 PRO C 13 7.767 20.268 2.143 1.00 0.00 H new ATOM 1768 N LYS C 14 5.700 24.297 0.614 1.00 0.00 N ATOM 1769 CA LYS C 14 5.185 25.388 -0.208 1.00 0.00 C ATOM 1770 C LYS C 14 4.079 24.957 -1.184 1.00 0.00 C ATOM 1771 O LYS C 14 3.171 25.737 -1.462 1.00 0.00 O ATOM 1772 CB LYS C 14 6.366 26.021 -0.967 1.00 0.00 C ATOM 1773 CG LYS C 14 6.046 27.303 -1.737 1.00 0.00 C ATOM 1774 CD LYS C 14 5.440 27.019 -3.110 1.00 0.00 C ATOM 1775 CE LYS C 14 5.367 28.273 -3.971 1.00 0.00 C ATOM 1776 NZ LYS C 14 4.577 29.351 -3.321 1.00 0.00 N ATOM 0 H LYS C 14 5.677 23.379 0.170 1.00 0.00 H new ATOM 0 HA LYS C 14 4.715 26.113 0.456 1.00 0.00 H new ATOM 0 HB2 LYS C 14 7.160 26.236 -0.252 1.00 0.00 H new ATOM 0 HB3 LYS C 14 6.760 25.286 -1.669 1.00 0.00 H new ATOM 0 HG2 LYS C 14 5.353 27.910 -1.155 1.00 0.00 H new ATOM 0 HG3 LYS C 14 6.958 27.888 -1.859 1.00 0.00 H new ATOM 0 HD2 LYS C 14 6.037 26.263 -3.620 1.00 0.00 H new ATOM 0 HD3 LYS C 14 4.439 26.605 -2.986 1.00 0.00 H new ATOM 0 HE2 LYS C 14 6.376 28.634 -4.172 1.00 0.00 H new ATOM 0 HE3 LYS C 14 4.919 28.026 -4.934 1.00 0.00 H new ATOM 0 HZ1 LYS C 14 4.467 30.147 -3.981 1.00 0.00 H new ATOM 0 HZ2 LYS C 14 3.639 28.985 -3.060 1.00 0.00 H new ATOM 0 HZ3 LYS C 14 5.072 29.676 -2.466 1.00 0.00 H new ATOM 1790 N CYS C 15 4.125 23.731 -1.708 1.00 0.00 N ATOM 1791 CA CYS C 15 3.251 23.386 -2.835 1.00 0.00 C ATOM 1792 C CYS C 15 2.235 22.289 -2.522 1.00 0.00 C ATOM 1793 O CYS C 15 1.952 21.434 -3.363 1.00 0.00 O ATOM 1794 CB CYS C 15 4.150 22.893 -3.959 1.00 0.00 C ATOM 1795 SG CYS C 15 5.203 21.509 -3.462 1.00 0.00 S ATOM 0 H CYS C 15 4.736 22.981 -1.385 1.00 0.00 H new ATOM 0 HA CYS C 15 2.676 24.275 -3.093 1.00 0.00 H new ATOM 0 HB2 CYS C 15 3.533 22.588 -4.804 1.00 0.00 H new ATOM 0 HB3 CYS C 15 4.777 23.715 -4.303 1.00 0.00 H new ATOM 0 HG CYS C 15 4.560 20.392 -3.631 1.00 0.00 H new ATOM 1800 N GLU C 16 1.600 22.396 -1.373 1.00 0.00 N ATOM 1801 CA GLU C 16 0.652 21.392 -0.899 1.00 0.00 C ATOM 1802 C GLU C 16 -0.747 21.747 -1.351 1.00 0.00 C ATOM 1803 O GLU C 16 -1.734 21.357 -0.734 1.00 0.00 O ATOM 1804 CB GLU C 16 0.657 21.358 0.630 1.00 0.00 C ATOM 1805 CG GLU C 16 1.750 22.183 1.282 1.00 0.00 C ATOM 1806 CD GLU C 16 1.378 23.650 1.384 1.00 0.00 C ATOM 1807 OE1 GLU C 16 1.491 24.368 0.371 1.00 0.00 O ATOM 1808 OE2 GLU C 16 0.957 24.091 2.473 1.00 0.00 O ATOM 0 H GLU C 16 1.723 23.182 -0.735 1.00 0.00 H new ATOM 0 HA GLU C 16 0.945 20.423 -1.304 1.00 0.00 H new ATOM 0 HB2 GLU C 16 -0.309 21.711 0.990 1.00 0.00 H new ATOM 0 HB3 GLU C 16 0.759 20.323 0.956 1.00 0.00 H new ATOM 0 HG2 GLU C 16 1.953 21.791 2.279 1.00 0.00 H new ATOM 0 HG3 GLU C 16 2.670 22.083 0.707 1.00 0.00 H new ATOM 1815 N ARG C 17 -0.819 22.474 -2.448 1.00 0.00 N ATOM 1816 CA ARG C 17 -2.030 23.143 -2.851 1.00 0.00 C ATOM 1817 C ARG C 17 -2.054 23.178 -4.374 1.00 0.00 C ATOM 1818 O ARG C 17 -3.104 23.321 -4.998 1.00 0.00 O ATOM 1819 CB ARG C 17 -2.079 24.553 -2.257 1.00 0.00 C ATOM 1820 CG ARG C 17 -0.875 25.418 -2.607 1.00 0.00 C ATOM 1821 CD ARG C 17 -0.761 26.606 -1.666 1.00 0.00 C ATOM 1822 NE ARG C 17 -0.445 26.192 -0.296 1.00 0.00 N ATOM 1823 CZ ARG C 17 -1.058 26.668 0.786 1.00 0.00 C ATOM 1824 NH1 ARG C 17 -2.009 27.586 0.664 1.00 0.00 N ATOM 1825 NH2 ARG C 17 -0.715 26.228 1.992 1.00 0.00 N ATOM 0 H ARG C 17 -0.034 22.615 -3.084 1.00 0.00 H new ATOM 0 HA ARG C 17 -2.908 22.612 -2.483 1.00 0.00 H new ATOM 0 HB2 ARG C 17 -2.984 25.051 -2.605 1.00 0.00 H new ATOM 0 HB3 ARG C 17 -2.155 24.476 -1.172 1.00 0.00 H new ATOM 0 HG2 ARG C 17 0.034 24.819 -2.553 1.00 0.00 H new ATOM 0 HG3 ARG C 17 -0.964 25.771 -3.634 1.00 0.00 H new ATOM 0 HD2 ARG C 17 0.013 27.283 -2.028 1.00 0.00 H new ATOM 0 HD3 ARG C 17 -1.698 27.163 -1.670 1.00 0.00 H new ATOM 0 HE ARG C 17 0.289 25.497 -0.163 1.00 0.00 H new ATOM 0 HH11 ARG C 17 -2.272 27.928 -0.260 1.00 0.00 H new ATOM 0 HH12 ARG C 17 -2.477 27.949 1.494 1.00 0.00 H new ATOM 0 HH21 ARG C 17 0.018 25.525 2.089 1.00 0.00 H new ATOM 0 HH22 ARG C 17 -1.185 26.593 2.821 1.00 0.00 H new ATOM 1839 N ALA C 18 -0.855 23.049 -4.964 1.00 0.00 N ATOM 1840 CA ALA C 18 -0.706 23.138 -6.413 1.00 0.00 C ATOM 1841 C ALA C 18 0.105 21.977 -6.979 1.00 0.00 C ATOM 1842 O ALA C 18 -0.141 21.527 -8.095 1.00 0.00 O ATOM 1843 CB ALA C 18 -0.071 24.465 -6.799 1.00 0.00 C ATOM 0 H ALA C 18 0.015 22.884 -4.459 1.00 0.00 H new ATOM 0 HA ALA C 18 -1.704 23.079 -6.847 1.00 0.00 H new ATOM 0 HB1 ALA C 18 0.034 24.517 -7.883 1.00 0.00 H new ATOM 0 HB2 ALA C 18 -0.703 25.284 -6.456 1.00 0.00 H new ATOM 0 HB3 ALA C 18 0.912 24.546 -6.335 1.00 0.00 H new ATOM 1849 N GLY C 19 1.062 21.488 -6.195 1.00 0.00 N ATOM 1850 CA GLY C 19 1.880 20.371 -6.632 1.00 0.00 C ATOM 1851 C GLY C 19 3.100 20.792 -7.431 1.00 0.00 C ATOM 1852 O GLY C 19 3.698 19.971 -8.122 1.00 0.00 O ATOM 0 H GLY C 19 1.285 21.845 -5.266 1.00 0.00 H new ATOM 0 HA2 GLY C 19 2.205 19.805 -5.759 1.00 0.00 H new ATOM 0 HA3 GLY C 19 1.271 19.700 -7.239 1.00 0.00 H new ATOM 1856 N GLU C 20 3.519 22.042 -7.285 1.00 0.00 N ATOM 1857 CA GLU C 20 4.603 22.571 -8.106 1.00 0.00 C ATOM 1858 C GLU C 20 5.430 23.595 -7.333 1.00 0.00 C ATOM 1859 O GLU C 20 4.963 24.174 -6.357 1.00 0.00 O ATOM 1860 CB GLU C 20 4.050 23.220 -9.375 1.00 0.00 C ATOM 1861 CG GLU C 20 3.121 24.384 -9.082 1.00 0.00 C ATOM 1862 CD GLU C 20 3.081 25.403 -10.199 1.00 0.00 C ATOM 1863 OE1 GLU C 20 2.474 25.123 -11.252 1.00 0.00 O ATOM 1864 OE2 GLU C 20 3.648 26.502 -10.017 1.00 0.00 O ATOM 0 H GLU C 20 3.130 22.704 -6.613 1.00 0.00 H new ATOM 0 HA GLU C 20 5.246 21.734 -8.379 1.00 0.00 H new ATOM 0 HB2 GLU C 20 4.879 23.569 -9.991 1.00 0.00 H new ATOM 0 HB3 GLU C 20 3.514 22.471 -9.957 1.00 0.00 H new ATOM 0 HG2 GLU C 20 2.114 24.004 -8.908 1.00 0.00 H new ATOM 0 HG3 GLU C 20 3.440 24.874 -8.162 1.00 0.00 H new ATOM 1871 N ILE C 21 6.655 23.810 -7.779 1.00 0.00 N ATOM 1872 CA ILE C 21 7.530 24.828 -7.212 1.00 0.00 C ATOM 1873 C ILE C 21 8.086 25.670 -8.353 1.00 0.00 C ATOM 1874 O ILE C 21 8.891 25.180 -9.138 1.00 0.00 O ATOM 1875 CB ILE C 21 8.718 24.224 -6.413 1.00 0.00 C ATOM 1876 CG1 ILE C 21 8.235 23.385 -5.223 1.00 0.00 C ATOM 1877 CG2 ILE C 21 9.652 25.326 -5.926 1.00 0.00 C ATOM 1878 CD1 ILE C 21 7.599 24.187 -4.101 1.00 0.00 C ATOM 0 H ILE C 21 7.074 23.284 -8.546 1.00 0.00 H new ATOM 0 HA ILE C 21 6.940 25.424 -6.516 1.00 0.00 H new ATOM 0 HB ILE C 21 9.262 23.566 -7.090 1.00 0.00 H new ATOM 0 HG12 ILE C 21 7.513 22.651 -5.582 1.00 0.00 H new ATOM 0 HG13 ILE C 21 9.081 22.829 -4.820 1.00 0.00 H new ATOM 0 HG21 ILE C 21 10.478 24.883 -5.369 1.00 0.00 H new ATOM 0 HG22 ILE C 21 10.045 25.875 -6.782 1.00 0.00 H new ATOM 0 HG23 ILE C 21 9.102 26.009 -5.279 1.00 0.00 H new ATOM 0 HD11 ILE C 21 7.288 23.513 -3.303 1.00 0.00 H new ATOM 0 HD12 ILE C 21 8.322 24.903 -3.710 1.00 0.00 H new ATOM 0 HD13 ILE C 21 6.730 24.722 -4.484 1.00 0.00 H new ATOM 1890 N GLU C 22 7.648 26.920 -8.448 1.00 0.00 N ATOM 1891 CA GLU C 22 8.064 27.799 -9.544 1.00 0.00 C ATOM 1892 C GLU C 22 7.690 27.196 -10.897 1.00 0.00 C ATOM 1893 O GLU C 22 8.519 27.150 -11.807 1.00 0.00 O ATOM 1894 CB GLU C 22 9.580 28.000 -9.496 1.00 0.00 C ATOM 1895 CG GLU C 22 10.038 29.416 -9.792 1.00 0.00 C ATOM 1896 CD GLU C 22 9.580 29.926 -11.146 1.00 0.00 C ATOM 1897 OE1 GLU C 22 8.418 30.375 -11.257 1.00 0.00 O ATOM 1898 OE2 GLU C 22 10.382 29.891 -12.105 1.00 0.00 O ATOM 0 H GLU C 22 7.006 27.351 -7.783 1.00 0.00 H new ATOM 0 HA GLU C 22 7.553 28.754 -9.426 1.00 0.00 H new ATOM 0 HB2 GLU C 22 9.940 27.715 -8.508 1.00 0.00 H new ATOM 0 HB3 GLU C 22 10.046 27.324 -10.213 1.00 0.00 H new ATOM 0 HG2 GLU C 22 9.662 30.082 -9.015 1.00 0.00 H new ATOM 0 HG3 GLU C 22 11.126 29.455 -9.746 1.00 0.00 H new ATOM 1905 N GLY C 23 6.460 26.701 -11.030 1.00 0.00 N ATOM 1906 CA GLY C 23 6.054 26.049 -12.271 1.00 0.00 C ATOM 1907 C GLY C 23 6.904 24.848 -12.606 1.00 0.00 C ATOM 1908 O GLY C 23 6.815 24.274 -13.692 1.00 0.00 O ATOM 0 H GLY C 23 5.741 26.738 -10.308 1.00 0.00 H new ATOM 0 HA2 GLY C 23 5.012 25.740 -12.189 1.00 0.00 H new ATOM 0 HA3 GLY C 23 6.110 26.768 -13.089 1.00 0.00 H new ATOM 1912 N THR C 24 7.717 24.475 -11.657 1.00 0.00 N ATOM 1913 CA THR C 24 8.740 23.489 -11.842 1.00 0.00 C ATOM 1914 C THR C 24 8.509 22.305 -10.893 1.00 0.00 C ATOM 1915 O THR C 24 8.002 22.491 -9.783 1.00 0.00 O ATOM 1916 CB THR C 24 10.064 24.226 -11.578 1.00 0.00 C ATOM 1917 OG1 THR C 24 10.507 24.864 -12.778 1.00 0.00 O ATOM 1918 CG2 THR C 24 11.163 23.347 -11.010 1.00 0.00 C ATOM 0 H THR C 24 7.684 24.858 -10.712 1.00 0.00 H new ATOM 0 HA THR C 24 8.744 23.058 -12.843 1.00 0.00 H new ATOM 0 HB THR C 24 9.854 24.967 -10.807 1.00 0.00 H new ATOM 0 HG1 THR C 24 10.074 25.739 -12.862 1.00 0.00 H new ATOM 0 HG21 THR C 24 12.062 23.944 -10.853 1.00 0.00 H new ATOM 0 HG22 THR C 24 10.837 22.926 -10.059 1.00 0.00 H new ATOM 0 HG23 THR C 24 11.381 22.540 -11.709 1.00 0.00 H new ATOM 1926 N PRO C 25 8.833 21.068 -11.334 1.00 0.00 N ATOM 1927 CA PRO C 25 8.588 19.854 -10.546 1.00 0.00 C ATOM 1928 C PRO C 25 9.217 19.946 -9.161 1.00 0.00 C ATOM 1929 O PRO C 25 10.374 20.338 -9.013 1.00 0.00 O ATOM 1930 CB PRO C 25 9.232 18.732 -11.377 1.00 0.00 C ATOM 1931 CG PRO C 25 10.145 19.433 -12.323 1.00 0.00 C ATOM 1932 CD PRO C 25 9.478 20.749 -12.617 1.00 0.00 C ATOM 0 HA PRO C 25 7.526 19.686 -10.367 1.00 0.00 H new ATOM 0 HB2 PRO C 25 9.779 18.035 -10.743 1.00 0.00 H new ATOM 0 HB3 PRO C 25 8.478 18.153 -11.911 1.00 0.00 H new ATOM 0 HG2 PRO C 25 11.130 19.582 -11.881 1.00 0.00 H new ATOM 0 HG3 PRO C 25 10.288 18.852 -13.234 1.00 0.00 H new ATOM 0 HD2 PRO C 25 10.198 21.513 -12.911 1.00 0.00 H new ATOM 0 HD3 PRO C 25 8.753 20.665 -13.427 1.00 0.00 H new ATOM 1940 N CYS C 26 8.436 19.601 -8.149 1.00 0.00 N ATOM 1941 CA CYS C 26 8.840 19.804 -6.770 1.00 0.00 C ATOM 1942 C CYS C 26 9.746 18.682 -6.243 1.00 0.00 C ATOM 1943 O CYS C 26 9.485 17.502 -6.484 1.00 0.00 O ATOM 1944 CB CYS C 26 7.593 19.931 -5.904 1.00 0.00 C ATOM 1945 SG CYS C 26 7.934 20.197 -4.131 1.00 0.00 S ATOM 0 H CYS C 26 7.515 19.177 -8.260 1.00 0.00 H new ATOM 0 HA CYS C 26 9.430 20.720 -6.725 1.00 0.00 H new ATOM 0 HB2 CYS C 26 6.990 20.760 -6.275 1.00 0.00 H new ATOM 0 HB3 CYS C 26 6.994 19.027 -6.015 1.00 0.00 H new ATOM 0 HG CYS C 26 6.915 20.783 -3.576 1.00 0.00 H new ATOM 1950 N PRO C 27 10.803 19.074 -5.485 1.00 0.00 N ATOM 1951 CA PRO C 27 11.826 18.188 -4.903 1.00 0.00 C ATOM 1952 C PRO C 27 11.362 16.771 -4.550 1.00 0.00 C ATOM 1953 O PRO C 27 11.958 15.789 -4.993 1.00 0.00 O ATOM 1954 CB PRO C 27 12.186 18.936 -3.622 1.00 0.00 C ATOM 1955 CG PRO C 27 12.049 20.385 -3.954 1.00 0.00 C ATOM 1956 CD PRO C 27 11.114 20.481 -5.150 1.00 0.00 C ATOM 0 HA PRO C 27 12.631 18.012 -5.616 1.00 0.00 H new ATOM 0 HB2 PRO C 27 11.522 18.656 -2.804 1.00 0.00 H new ATOM 0 HB3 PRO C 27 13.201 18.701 -3.302 1.00 0.00 H new ATOM 0 HG2 PRO C 27 11.648 20.939 -3.105 1.00 0.00 H new ATOM 0 HG3 PRO C 27 13.020 20.821 -4.188 1.00 0.00 H new ATOM 0 HD2 PRO C 27 10.211 21.040 -4.905 1.00 0.00 H new ATOM 0 HD3 PRO C 27 11.589 20.993 -5.986 1.00 0.00 H new ATOM 1964 N ALA C 28 10.290 16.674 -3.769 1.00 0.00 N ATOM 1965 CA ALA C 28 9.892 15.393 -3.188 1.00 0.00 C ATOM 1966 C ALA C 28 8.414 15.096 -3.408 1.00 0.00 C ATOM 1967 O ALA C 28 7.919 14.039 -3.020 1.00 0.00 O ATOM 1968 CB ALA C 28 10.217 15.368 -1.703 1.00 0.00 C ATOM 0 H ALA C 28 9.685 17.458 -3.525 1.00 0.00 H new ATOM 0 HA ALA C 28 10.459 14.614 -3.698 1.00 0.00 H new ATOM 0 HB1 ALA C 28 9.916 14.409 -1.281 1.00 0.00 H new ATOM 0 HB2 ALA C 28 11.289 15.506 -1.563 1.00 0.00 H new ATOM 0 HB3 ALA C 28 9.679 16.171 -1.199 1.00 0.00 H new ATOM 1974 N CYS C 29 7.701 16.030 -4.018 1.00 0.00 N ATOM 1975 CA CYS C 29 6.294 15.812 -4.321 1.00 0.00 C ATOM 1976 C CYS C 29 6.000 16.234 -5.759 1.00 0.00 C ATOM 1977 O CYS C 29 5.700 17.399 -6.030 1.00 0.00 O ATOM 1978 CB CYS C 29 5.393 16.556 -3.311 1.00 0.00 C ATOM 1979 SG CYS C 29 5.335 18.365 -3.488 1.00 0.00 S ATOM 0 H CYS C 29 8.067 16.936 -4.310 1.00 0.00 H new ATOM 0 HA CYS C 29 6.071 14.749 -4.228 1.00 0.00 H new ATOM 0 HB2 CYS C 29 4.379 16.168 -3.403 1.00 0.00 H new ATOM 0 HB3 CYS C 29 5.735 16.319 -2.304 1.00 0.00 H new ATOM 0 HG CYS C 29 6.520 18.810 -3.784 1.00 0.00 H new ATOM 1984 N SER C 30 6.117 15.291 -6.683 1.00 0.00 N ATOM 1985 CA SER C 30 5.908 15.568 -8.097 1.00 0.00 C ATOM 1986 C SER C 30 4.417 15.682 -8.428 1.00 0.00 C ATOM 1987 O SER C 30 3.889 14.932 -9.249 1.00 0.00 O ATOM 1988 CB SER C 30 6.563 14.469 -8.941 1.00 0.00 C ATOM 1989 OG SER C 30 6.697 14.859 -10.299 1.00 0.00 O ATOM 0 H SER C 30 6.357 14.321 -6.477 1.00 0.00 H new ATOM 0 HA SER C 30 6.371 16.526 -8.332 1.00 0.00 H new ATOM 0 HB2 SER C 30 7.545 14.233 -8.532 1.00 0.00 H new ATOM 0 HB3 SER C 30 5.965 13.559 -8.881 1.00 0.00 H new ATOM 0 HG SER C 30 7.120 14.135 -10.807 1.00 0.00 H new ATOM 1995 N GLY C 31 3.743 16.612 -7.763 1.00 0.00 N ATOM 1996 CA GLY C 31 2.375 16.927 -8.108 1.00 0.00 C ATOM 1997 C GLY C 31 1.371 16.173 -7.276 1.00 0.00 C ATOM 1998 O GLY C 31 0.419 15.602 -7.806 1.00 0.00 O ATOM 0 H GLY C 31 4.124 17.155 -6.988 1.00 0.00 H new ATOM 0 HA2 GLY C 31 2.212 17.997 -7.983 1.00 0.00 H new ATOM 0 HA3 GLY C 31 2.210 16.700 -9.161 1.00 0.00 H new ATOM 2002 N LYS C 32 1.574 16.163 -5.968 1.00 0.00 N ATOM 2003 CA LYS C 32 0.635 15.534 -5.057 1.00 0.00 C ATOM 2004 C LYS C 32 0.210 16.533 -3.988 1.00 0.00 C ATOM 2005 O LYS C 32 -0.941 16.548 -3.557 1.00 0.00 O ATOM 2006 CB LYS C 32 1.262 14.295 -4.406 1.00 0.00 C ATOM 2007 CG LYS C 32 1.495 13.158 -5.384 1.00 0.00 C ATOM 2008 CD LYS C 32 2.972 12.929 -5.672 1.00 0.00 C ATOM 2009 CE LYS C 32 3.677 12.230 -4.519 1.00 0.00 C ATOM 2010 NZ LYS C 32 4.947 11.597 -4.965 1.00 0.00 N ATOM 0 H LYS C 32 2.384 16.585 -5.514 1.00 0.00 H new ATOM 0 HA LYS C 32 -0.243 15.216 -5.620 1.00 0.00 H new ATOM 0 HB2 LYS C 32 2.212 14.574 -3.950 1.00 0.00 H new ATOM 0 HB3 LYS C 32 0.613 13.947 -3.603 1.00 0.00 H new ATOM 0 HG2 LYS C 32 1.061 12.243 -4.982 1.00 0.00 H new ATOM 0 HG3 LYS C 32 0.976 13.374 -6.318 1.00 0.00 H new ATOM 0 HD2 LYS C 32 3.076 12.330 -6.577 1.00 0.00 H new ATOM 0 HD3 LYS C 32 3.456 13.886 -5.866 1.00 0.00 H new ATOM 0 HE2 LYS C 32 3.886 12.950 -3.728 1.00 0.00 H new ATOM 0 HE3 LYS C 32 3.020 11.471 -4.095 1.00 0.00 H new ATOM 0 HZ1 LYS C 32 5.404 11.129 -4.157 1.00 0.00 H new ATOM 0 HZ2 LYS C 32 4.744 10.893 -5.703 1.00 0.00 H new ATOM 0 HZ3 LYS C 32 5.583 12.326 -5.347 1.00 0.00 H new ATOM 2024 N GLY C 33 1.156 17.366 -3.557 1.00 0.00 N ATOM 2025 CA GLY C 33 0.879 18.363 -2.565 1.00 0.00 C ATOM 2026 C GLY C 33 1.576 18.031 -1.270 1.00 0.00 C ATOM 2027 O GLY C 33 2.159 18.903 -0.625 1.00 0.00 O ATOM 0 H GLY C 33 2.120 17.357 -3.891 1.00 0.00 H new ATOM 0 HA2 GLY C 33 1.208 19.339 -2.921 1.00 0.00 H new ATOM 0 HA3 GLY C 33 -0.196 18.430 -2.399 1.00 0.00 H new ATOM 2031 N VAL C 34 1.593 16.754 -0.926 1.00 0.00 N ATOM 2032 CA VAL C 34 2.167 16.319 0.340 1.00 0.00 C ATOM 2033 C VAL C 34 3.407 15.459 0.131 1.00 0.00 C ATOM 2034 O VAL C 34 3.679 14.991 -0.981 1.00 0.00 O ATOM 2035 CB VAL C 34 1.137 15.516 1.166 1.00 0.00 C ATOM 2036 CG1 VAL C 34 -0.082 16.367 1.489 1.00 0.00 C ATOM 2037 CG2 VAL C 34 0.722 14.253 0.425 1.00 0.00 C ATOM 0 H VAL C 34 1.218 16.001 -1.503 1.00 0.00 H new ATOM 0 HA VAL C 34 2.450 17.221 0.882 1.00 0.00 H new ATOM 0 HB VAL C 34 1.610 15.227 2.105 1.00 0.00 H new ATOM 0 HG11 VAL C 34 -0.792 15.779 2.071 1.00 0.00 H new ATOM 0 HG12 VAL C 34 0.226 17.239 2.066 1.00 0.00 H new ATOM 0 HG13 VAL C 34 -0.554 16.693 0.562 1.00 0.00 H new ATOM 0 HG21 VAL C 34 -0.003 13.702 1.023 1.00 0.00 H new ATOM 0 HG22 VAL C 34 0.274 14.523 -0.531 1.00 0.00 H new ATOM 0 HG23 VAL C 34 1.598 13.628 0.251 1.00 0.00 H new ATOM 2047 N ILE C 35 4.165 15.288 1.204 1.00 0.00 N ATOM 2048 CA ILE C 35 5.322 14.407 1.216 1.00 0.00 C ATOM 2049 C ILE C 35 5.241 13.436 2.391 1.00 0.00 C ATOM 2050 O ILE C 35 4.487 13.655 3.336 1.00 0.00 O ATOM 2051 CB ILE C 35 6.643 15.202 1.295 1.00 0.00 C ATOM 2052 CG1 ILE C 35 6.574 16.234 2.424 1.00 0.00 C ATOM 2053 CG2 ILE C 35 6.939 15.879 -0.035 1.00 0.00 C ATOM 2054 CD1 ILE C 35 7.868 16.987 2.646 1.00 0.00 C ATOM 0 H ILE C 35 3.994 15.758 2.093 1.00 0.00 H new ATOM 0 HA ILE C 35 5.314 13.849 0.280 1.00 0.00 H new ATOM 0 HB ILE C 35 7.455 14.508 1.511 1.00 0.00 H new ATOM 0 HG12 ILE C 35 5.782 16.949 2.201 1.00 0.00 H new ATOM 0 HG13 ILE C 35 6.296 15.728 3.349 1.00 0.00 H new ATOM 0 HG21 ILE C 35 7.874 16.435 0.040 1.00 0.00 H new ATOM 0 HG22 ILE C 35 7.027 15.124 -0.816 1.00 0.00 H new ATOM 0 HG23 ILE C 35 6.128 16.564 -0.283 1.00 0.00 H new ATOM 0 HD11 ILE C 35 7.739 17.699 3.461 1.00 0.00 H new ATOM 0 HD12 ILE C 35 8.660 16.283 2.901 1.00 0.00 H new ATOM 0 HD13 ILE C 35 8.138 17.522 1.736 1.00 0.00 H new ATOM 2066 N LEU C 36 6.020 12.365 2.322 1.00 0.00 N ATOM 2067 CA LEU C 36 5.919 11.279 3.294 1.00 0.00 C ATOM 2068 C LEU C 36 6.784 11.503 4.524 1.00 0.00 C ATOM 2069 O LEU C 36 7.759 12.254 4.501 1.00 0.00 O ATOM 2070 CB LEU C 36 6.322 9.947 2.651 1.00 0.00 C ATOM 2071 CG LEU C 36 5.639 9.633 1.322 1.00 0.00 C ATOM 2072 CD1 LEU C 36 6.515 10.046 0.150 1.00 0.00 C ATOM 2073 CD2 LEU C 36 5.291 8.162 1.244 1.00 0.00 C ATOM 0 H LEU C 36 6.730 12.223 1.604 1.00 0.00 H new ATOM 0 HA LEU C 36 4.877 11.254 3.613 1.00 0.00 H new ATOM 0 HB2 LEU C 36 7.401 9.949 2.495 1.00 0.00 H new ATOM 0 HB3 LEU C 36 6.103 9.142 3.353 1.00 0.00 H new ATOM 0 HG LEU C 36 4.715 10.209 1.266 1.00 0.00 H new ATOM 0 HD11 LEU C 36 6.006 9.812 -0.785 1.00 0.00 H new ATOM 0 HD12 LEU C 36 6.708 11.118 0.200 1.00 0.00 H new ATOM 0 HD13 LEU C 36 7.460 9.505 0.194 1.00 0.00 H new ATOM 0 HD21 LEU C 36 4.805 7.953 0.291 1.00 0.00 H new ATOM 0 HD22 LEU C 36 6.201 7.568 1.325 1.00 0.00 H new ATOM 0 HD23 LEU C 36 4.616 7.904 2.060 1.00 0.00 H new ATOM 2085 N THR C 37 6.396 10.837 5.602 1.00 0.00 N ATOM 2086 CA THR C 37 7.204 10.761 6.808 1.00 0.00 C ATOM 2087 C THR C 37 7.771 9.344 6.924 1.00 0.00 C ATOM 2088 O THR C 37 7.436 8.491 6.108 1.00 0.00 O ATOM 2089 CB THR C 37 6.375 11.128 8.062 1.00 0.00 C ATOM 2090 OG1 THR C 37 7.201 11.111 9.236 1.00 0.00 O ATOM 2091 CG2 THR C 37 5.201 10.175 8.244 1.00 0.00 C ATOM 0 H THR C 37 5.511 10.334 5.664 1.00 0.00 H new ATOM 0 HA THR C 37 8.020 11.481 6.744 1.00 0.00 H new ATOM 0 HB THR C 37 5.983 12.135 7.916 1.00 0.00 H new ATOM 0 HG1 THR C 37 6.661 11.347 10.019 1.00 0.00 H new ATOM 0 HG21 THR C 37 4.637 10.458 9.133 1.00 0.00 H new ATOM 0 HG22 THR C 37 4.551 10.227 7.370 1.00 0.00 H new ATOM 0 HG23 THR C 37 5.573 9.157 8.359 1.00 0.00 H new ATOM 2099 N ALA C 38 8.607 9.089 7.929 1.00 0.00 N ATOM 2100 CA ALA C 38 9.323 7.810 8.044 1.00 0.00 C ATOM 2101 C ALA C 38 8.385 6.609 7.996 1.00 0.00 C ATOM 2102 O ALA C 38 8.678 5.619 7.321 1.00 0.00 O ATOM 2103 CB ALA C 38 10.155 7.781 9.313 1.00 0.00 C ATOM 0 H ALA C 38 8.809 9.750 8.679 1.00 0.00 H new ATOM 0 HA ALA C 38 9.982 7.735 7.179 1.00 0.00 H new ATOM 0 HB1 ALA C 38 10.679 6.828 9.383 1.00 0.00 H new ATOM 0 HB2 ALA C 38 10.882 8.593 9.290 1.00 0.00 H new ATOM 0 HB3 ALA C 38 9.503 7.901 10.178 1.00 0.00 H new ATOM 2109 N GLN C 39 7.276 6.681 8.728 1.00 0.00 N ATOM 2110 CA GLN C 39 6.262 5.631 8.674 1.00 0.00 C ATOM 2111 C GLN C 39 5.832 5.404 7.223 1.00 0.00 C ATOM 2112 O GLN C 39 5.899 4.286 6.712 1.00 0.00 O ATOM 2113 CB GLN C 39 5.055 6.019 9.542 1.00 0.00 C ATOM 2114 CG GLN C 39 4.432 4.859 10.317 1.00 0.00 C ATOM 2115 CD GLN C 39 3.430 4.052 9.520 1.00 0.00 C ATOM 2116 OE1 GLN C 39 3.538 3.930 8.310 1.00 0.00 O ATOM 2117 NE2 GLN C 39 2.441 3.495 10.202 1.00 0.00 N ATOM 0 H GLN C 39 7.057 7.450 9.362 1.00 0.00 H new ATOM 0 HA GLN C 39 6.682 4.704 9.064 1.00 0.00 H new ATOM 0 HB2 GLN C 39 5.365 6.787 10.250 1.00 0.00 H new ATOM 0 HB3 GLN C 39 4.292 6.464 8.903 1.00 0.00 H new ATOM 0 HG2 GLN C 39 5.227 4.196 10.659 1.00 0.00 H new ATOM 0 HG3 GLN C 39 3.940 5.253 11.207 1.00 0.00 H new ATOM 0 HE21 GLN C 39 2.385 3.620 11.213 1.00 0.00 H new ATOM 0 HE22 GLN C 39 1.735 2.941 9.717 1.00 0.00 H new ATOM 2126 N GLY C 40 5.449 6.486 6.554 1.00 0.00 N ATOM 2127 CA GLY C 40 5.011 6.403 5.176 1.00 0.00 C ATOM 2128 C GLY C 40 6.122 5.989 4.224 1.00 0.00 C ATOM 2129 O GLY C 40 5.862 5.386 3.188 1.00 0.00 O ATOM 0 H GLY C 40 5.435 7.427 6.948 1.00 0.00 H new ATOM 0 HA2 GLY C 40 4.192 5.687 5.103 1.00 0.00 H new ATOM 0 HA3 GLY C 40 4.617 7.371 4.867 1.00 0.00 H new ATOM 2133 N TYR C 41 7.360 6.299 4.573 1.00 0.00 N ATOM 2134 CA TYR C 41 8.493 5.882 3.759 1.00 0.00 C ATOM 2135 C TYR C 41 8.678 4.371 3.820 1.00 0.00 C ATOM 2136 O TYR C 41 9.054 3.743 2.825 1.00 0.00 O ATOM 2137 CB TYR C 41 9.766 6.584 4.243 1.00 0.00 C ATOM 2138 CG TYR C 41 10.027 7.928 3.597 1.00 0.00 C ATOM 2139 CD1 TYR C 41 10.499 8.014 2.293 1.00 0.00 C ATOM 2140 CD2 TYR C 41 9.818 9.108 4.295 1.00 0.00 C ATOM 2141 CE1 TYR C 41 10.749 9.240 1.704 1.00 0.00 C ATOM 2142 CE2 TYR C 41 10.068 10.334 3.716 1.00 0.00 C ATOM 2143 CZ TYR C 41 10.532 10.396 2.422 1.00 0.00 C ATOM 2144 OH TYR C 41 10.787 11.622 1.848 1.00 0.00 O ATOM 0 H TYR C 41 7.606 6.833 5.406 1.00 0.00 H new ATOM 0 HA TYR C 41 8.296 6.162 2.724 1.00 0.00 H new ATOM 0 HB2 TYR C 41 9.702 6.720 5.323 1.00 0.00 H new ATOM 0 HB3 TYR C 41 10.619 5.933 4.054 1.00 0.00 H new ATOM 0 HD1 TYR C 41 10.673 7.109 1.730 1.00 0.00 H new ATOM 0 HD2 TYR C 41 9.453 9.066 5.311 1.00 0.00 H new ATOM 0 HE1 TYR C 41 11.112 9.291 0.688 1.00 0.00 H new ATOM 0 HE2 TYR C 41 9.900 11.242 4.276 1.00 0.00 H new ATOM 0 HH TYR C 41 10.580 12.333 2.490 1.00 0.00 H new ATOM 2154 N THR C 42 8.378 3.783 4.965 1.00 0.00 N ATOM 2155 CA THR C 42 8.400 2.335 5.099 1.00 0.00 C ATOM 2156 C THR C 42 7.244 1.707 4.319 1.00 0.00 C ATOM 2157 O THR C 42 7.369 0.616 3.753 1.00 0.00 O ATOM 2158 CB THR C 42 8.288 1.929 6.580 1.00 0.00 C ATOM 2159 OG1 THR C 42 9.202 2.704 7.362 1.00 0.00 O ATOM 2160 CG2 THR C 42 8.587 0.449 6.764 1.00 0.00 C ATOM 0 H THR C 42 8.117 4.284 5.814 1.00 0.00 H new ATOM 0 HA THR C 42 9.346 1.975 4.696 1.00 0.00 H new ATOM 0 HB THR C 42 7.267 2.118 6.911 1.00 0.00 H new ATOM 0 HG1 THR C 42 9.231 2.352 8.276 1.00 0.00 H new ATOM 0 HG21 THR C 42 8.501 0.189 7.819 1.00 0.00 H new ATOM 0 HG22 THR C 42 7.876 -0.141 6.186 1.00 0.00 H new ATOM 0 HG23 THR C 42 9.599 0.237 6.419 1.00 0.00 H new ATOM 2168 N LEU C 43 6.139 2.434 4.243 1.00 0.00 N ATOM 2169 CA LEU C 43 4.927 1.913 3.635 1.00 0.00 C ATOM 2170 C LEU C 43 4.930 2.131 2.127 1.00 0.00 C ATOM 2171 O LEU C 43 4.271 1.395 1.399 1.00 0.00 O ATOM 2172 CB LEU C 43 3.681 2.563 4.267 1.00 0.00 C ATOM 2173 CG LEU C 43 3.023 1.795 5.432 1.00 0.00 C ATOM 2174 CD1 LEU C 43 4.051 1.438 6.496 1.00 0.00 C ATOM 2175 CD2 LEU C 43 1.902 2.625 6.035 1.00 0.00 C ATOM 0 H LEU C 43 6.058 3.388 4.596 1.00 0.00 H new ATOM 0 HA LEU C 43 4.895 0.840 3.822 1.00 0.00 H new ATOM 0 HB2 LEU C 43 3.957 3.555 4.625 1.00 0.00 H new ATOM 0 HB3 LEU C 43 2.935 2.703 3.485 1.00 0.00 H new ATOM 0 HG LEU C 43 2.605 0.867 5.041 1.00 0.00 H new ATOM 0 HD11 LEU C 43 3.563 0.897 7.307 1.00 0.00 H new ATOM 0 HD12 LEU C 43 4.827 0.811 6.057 1.00 0.00 H new ATOM 0 HD13 LEU C 43 4.501 2.350 6.888 1.00 0.00 H new ATOM 0 HD21 LEU C 43 1.443 2.075 6.857 1.00 0.00 H new ATOM 0 HD22 LEU C 43 2.306 3.566 6.409 1.00 0.00 H new ATOM 0 HD23 LEU C 43 1.151 2.831 5.272 1.00 0.00 H new ATOM 2187 N LEU C 44 5.696 3.105 1.633 1.00 0.00 N ATOM 2188 CA LEU C 44 5.719 3.364 0.199 1.00 0.00 C ATOM 2189 C LEU C 44 6.587 2.330 -0.505 1.00 0.00 C ATOM 2190 O LEU C 44 6.231 1.841 -1.571 1.00 0.00 O ATOM 2191 CB LEU C 44 6.206 4.800 -0.115 1.00 0.00 C ATOM 2192 CG LEU C 44 7.729 5.026 -0.212 1.00 0.00 C ATOM 2193 CD1 LEU C 44 8.260 4.652 -1.593 1.00 0.00 C ATOM 2194 CD2 LEU C 44 8.078 6.471 0.086 1.00 0.00 C ATOM 0 H LEU C 44 6.294 3.713 2.192 1.00 0.00 H new ATOM 0 HA LEU C 44 4.699 3.281 -0.175 1.00 0.00 H new ATOM 0 HB2 LEU C 44 5.758 5.109 -1.060 1.00 0.00 H new ATOM 0 HB3 LEU C 44 5.815 5.465 0.655 1.00 0.00 H new ATOM 0 HG LEU C 44 8.199 4.381 0.530 1.00 0.00 H new ATOM 0 HD11 LEU C 44 9.336 4.823 -1.628 1.00 0.00 H new ATOM 0 HD12 LEU C 44 8.053 3.600 -1.790 1.00 0.00 H new ATOM 0 HD13 LEU C 44 7.771 5.265 -2.349 1.00 0.00 H new ATOM 0 HD21 LEU C 44 9.157 6.607 0.012 1.00 0.00 H new ATOM 0 HD22 LEU C 44 7.580 7.121 -0.633 1.00 0.00 H new ATOM 0 HD23 LEU C 44 7.749 6.724 1.094 1.00 0.00 H new ATOM 2206 N ASP C 45 7.717 1.980 0.099 1.00 0.00 N ATOM 2207 CA ASP C 45 8.648 1.048 -0.530 1.00 0.00 C ATOM 2208 C ASP C 45 8.072 -0.359 -0.535 1.00 0.00 C ATOM 2209 O ASP C 45 8.403 -1.175 -1.392 1.00 0.00 O ATOM 2210 CB ASP C 45 9.994 1.067 0.195 1.00 0.00 C ATOM 2211 CG ASP C 45 11.031 0.183 -0.473 1.00 0.00 C ATOM 2212 OD1 ASP C 45 11.377 0.453 -1.639 1.00 0.00 O ATOM 2213 OD2 ASP C 45 11.527 -0.762 0.177 1.00 0.00 O ATOM 0 H ASP C 45 8.010 2.323 1.014 1.00 0.00 H new ATOM 0 HA ASP C 45 8.804 1.362 -1.562 1.00 0.00 H new ATOM 0 HB2 ASP C 45 10.366 2.091 0.235 1.00 0.00 H new ATOM 0 HB3 ASP C 45 9.852 0.739 1.225 1.00 0.00 H new ATOM 2218 N PHE C 46 7.169 -0.616 0.393 1.00 0.00 N ATOM 2219 CA PHE C 46 6.463 -1.884 0.436 1.00 0.00 C ATOM 2220 C PHE C 46 5.407 -1.946 -0.647 1.00 0.00 C ATOM 2221 O PHE C 46 5.226 -2.980 -1.291 1.00 0.00 O ATOM 2222 CB PHE C 46 5.791 -2.014 1.799 1.00 0.00 C ATOM 2223 CG PHE C 46 5.111 -3.325 2.032 1.00 0.00 C ATOM 2224 CD1 PHE C 46 5.813 -4.393 2.556 1.00 0.00 C ATOM 2225 CD2 PHE C 46 3.769 -3.484 1.733 1.00 0.00 C ATOM 2226 CE1 PHE C 46 5.188 -5.599 2.783 1.00 0.00 C ATOM 2227 CE2 PHE C 46 3.140 -4.688 1.954 1.00 0.00 C ATOM 2228 CZ PHE C 46 3.851 -5.746 2.479 1.00 0.00 C ATOM 0 H PHE C 46 6.906 0.039 1.130 1.00 0.00 H new ATOM 0 HA PHE C 46 7.172 -2.696 0.274 1.00 0.00 H new ATOM 0 HB2 PHE C 46 6.541 -1.865 2.576 1.00 0.00 H new ATOM 0 HB3 PHE C 46 5.058 -1.215 1.906 1.00 0.00 H new ATOM 0 HD1 PHE C 46 6.861 -4.281 2.790 1.00 0.00 H new ATOM 0 HD2 PHE C 46 3.210 -2.656 1.323 1.00 0.00 H new ATOM 0 HE1 PHE C 46 5.743 -6.427 3.198 1.00 0.00 H new ATOM 0 HE2 PHE C 46 2.093 -4.804 1.717 1.00 0.00 H new ATOM 0 HZ PHE C 46 3.360 -6.692 2.653 1.00 0.00 H new ATOM 2238 N ILE C 47 4.728 -0.842 -0.887 1.00 0.00 N ATOM 2239 CA ILE C 47 3.689 -0.857 -1.888 1.00 0.00 C ATOM 2240 C ILE C 47 4.310 -0.782 -3.276 1.00 0.00 C ATOM 2241 O ILE C 47 3.815 -1.401 -4.218 1.00 0.00 O ATOM 2242 CB ILE C 47 2.652 0.270 -1.695 1.00 0.00 C ATOM 2243 CG1 ILE C 47 3.279 1.644 -1.941 1.00 0.00 C ATOM 2244 CG2 ILE C 47 2.077 0.193 -0.290 1.00 0.00 C ATOM 2245 CD1 ILE C 47 2.308 2.797 -1.825 1.00 0.00 C ATOM 0 H ILE C 47 4.873 0.051 -0.416 1.00 0.00 H new ATOM 0 HA ILE C 47 3.147 -1.796 -1.778 1.00 0.00 H new ATOM 0 HB ILE C 47 1.851 0.137 -2.422 1.00 0.00 H new ATOM 0 HG12 ILE C 47 4.090 1.794 -1.229 1.00 0.00 H new ATOM 0 HG13 ILE C 47 3.723 1.656 -2.937 1.00 0.00 H new ATOM 0 HG21 ILE C 47 1.345 0.988 -0.153 1.00 0.00 H new ATOM 0 HG22 ILE C 47 1.594 -0.774 -0.147 1.00 0.00 H new ATOM 0 HG23 ILE C 47 2.880 0.309 0.438 1.00 0.00 H new ATOM 0 HD11 ILE C 47 2.832 3.734 -2.013 1.00 0.00 H new ATOM 0 HD12 ILE C 47 1.509 2.675 -2.556 1.00 0.00 H new ATOM 0 HD13 ILE C 47 1.882 2.815 -0.822 1.00 0.00 H new ATOM 2257 N GLN C 48 5.421 -0.055 -3.376 1.00 0.00 N ATOM 2258 CA GLN C 48 6.247 -0.065 -4.572 1.00 0.00 C ATOM 2259 C GLN C 48 6.560 -1.499 -4.954 1.00 0.00 C ATOM 2260 O GLN C 48 6.068 -2.013 -5.938 1.00 0.00 O ATOM 2261 CB GLN C 48 7.571 0.664 -4.314 1.00 0.00 C ATOM 2262 CG GLN C 48 7.484 2.183 -4.283 1.00 0.00 C ATOM 2263 CD GLN C 48 7.426 2.801 -5.666 1.00 0.00 C ATOM 2264 OE1 GLN C 48 7.935 2.239 -6.637 1.00 0.00 O ATOM 2265 NE2 GLN C 48 6.830 3.978 -5.762 1.00 0.00 N ATOM 0 H GLN C 48 5.768 0.552 -2.634 1.00 0.00 H new ATOM 0 HA GLN C 48 5.704 0.437 -5.373 1.00 0.00 H new ATOM 0 HB2 GLN C 48 7.976 0.321 -3.362 1.00 0.00 H new ATOM 0 HB3 GLN C 48 8.283 0.373 -5.087 1.00 0.00 H new ATOM 0 HG2 GLN C 48 6.598 2.479 -3.721 1.00 0.00 H new ATOM 0 HG3 GLN C 48 8.348 2.580 -3.749 1.00 0.00 H new ATOM 0 HE21 GLN C 48 6.420 4.411 -4.934 1.00 0.00 H new ATOM 0 HE22 GLN C 48 6.780 4.452 -6.664 1.00 0.00 H new ATOM 2274 N LYS C 49 7.249 -2.163 -4.056 1.00 0.00 N ATOM 2275 CA LYS C 49 7.977 -3.390 -4.346 1.00 0.00 C ATOM 2276 C LYS C 49 7.060 -4.608 -4.450 1.00 0.00 C ATOM 2277 O LYS C 49 7.517 -5.711 -4.755 1.00 0.00 O ATOM 2278 CB LYS C 49 8.994 -3.575 -3.218 1.00 0.00 C ATOM 2279 CG LYS C 49 10.002 -4.697 -3.403 1.00 0.00 C ATOM 2280 CD LYS C 49 10.773 -4.940 -2.109 1.00 0.00 C ATOM 2281 CE LYS C 49 11.287 -3.634 -1.510 1.00 0.00 C ATOM 2282 NZ LYS C 49 11.879 -3.818 -0.159 1.00 0.00 N ATOM 0 H LYS C 49 7.325 -1.865 -3.083 1.00 0.00 H new ATOM 0 HA LYS C 49 8.464 -3.306 -5.317 1.00 0.00 H new ATOM 0 HB2 LYS C 49 9.541 -2.640 -3.092 1.00 0.00 H new ATOM 0 HB3 LYS C 49 8.449 -3.753 -2.291 1.00 0.00 H new ATOM 0 HG2 LYS C 49 9.488 -5.610 -3.704 1.00 0.00 H new ATOM 0 HG3 LYS C 49 10.696 -4.443 -4.204 1.00 0.00 H new ATOM 0 HD2 LYS C 49 10.128 -5.443 -1.389 1.00 0.00 H new ATOM 0 HD3 LYS C 49 11.613 -5.607 -2.304 1.00 0.00 H new ATOM 0 HE2 LYS C 49 12.036 -3.204 -2.175 1.00 0.00 H new ATOM 0 HE3 LYS C 49 10.466 -2.919 -1.449 1.00 0.00 H new ATOM 0 HZ1 LYS C 49 11.947 -2.897 0.319 1.00 0.00 H new ATOM 0 HZ2 LYS C 49 11.276 -4.454 0.400 1.00 0.00 H new ATOM 0 HZ3 LYS C 49 12.829 -4.232 -0.250 1.00 0.00 H new ATOM 2296 N HIS C 50 5.771 -4.447 -4.178 1.00 0.00 N ATOM 2297 CA HIS C 50 4.877 -5.559 -4.470 1.00 0.00 C ATOM 2298 C HIS C 50 3.824 -5.248 -5.536 1.00 0.00 C ATOM 2299 O HIS C 50 3.072 -6.141 -5.914 1.00 0.00 O ATOM 2300 CB HIS C 50 4.206 -6.027 -3.175 1.00 0.00 C ATOM 2301 CG HIS C 50 5.200 -6.413 -2.123 1.00 0.00 C ATOM 2302 ND1 HIS C 50 6.031 -7.494 -2.248 1.00 0.00 N ATOM 2303 CD2 HIS C 50 5.542 -5.816 -0.960 1.00 0.00 C ATOM 2304 CE1 HIS C 50 6.843 -7.549 -1.213 1.00 0.00 C ATOM 2305 NE2 HIS C 50 6.572 -6.539 -0.412 1.00 0.00 N ATOM 0 H HIS C 50 5.341 -3.612 -3.780 1.00 0.00 H new ATOM 0 HA HIS C 50 5.493 -6.354 -4.890 1.00 0.00 H new ATOM 0 HB2 HIS C 50 3.567 -5.231 -2.792 1.00 0.00 H new ATOM 0 HB3 HIS C 50 3.561 -6.878 -3.391 1.00 0.00 H new ATOM 0 HD2 HIS C 50 5.088 -4.931 -0.539 1.00 0.00 H new ATOM 0 HE1 HIS C 50 7.604 -8.297 -1.048 1.00 0.00 H new ATOM 0 HE2 HIS C 50 7.047 -6.330 0.466 1.00 0.00 H new ATOM 2314 N LEU C 51 3.777 -4.017 -6.045 1.00 0.00 N ATOM 2315 CA LEU C 51 2.870 -3.707 -7.159 1.00 0.00 C ATOM 2316 C LEU C 51 3.595 -3.048 -8.332 1.00 0.00 C ATOM 2317 O LEU C 51 3.384 -3.419 -9.484 1.00 0.00 O ATOM 2318 CB LEU C 51 1.704 -2.803 -6.731 1.00 0.00 C ATOM 2319 CG LEU C 51 0.683 -3.420 -5.769 1.00 0.00 C ATOM 2320 CD1 LEU C 51 -0.618 -2.634 -5.784 1.00 0.00 C ATOM 2321 CD2 LEU C 51 0.413 -4.866 -6.124 1.00 0.00 C ATOM 0 H LEU C 51 4.340 -3.233 -5.716 1.00 0.00 H new ATOM 0 HA LEU C 51 2.474 -4.670 -7.480 1.00 0.00 H new ATOM 0 HB2 LEU C 51 2.118 -1.910 -6.263 1.00 0.00 H new ATOM 0 HB3 LEU C 51 1.176 -2.478 -7.628 1.00 0.00 H new ATOM 0 HG LEU C 51 1.106 -3.379 -4.765 1.00 0.00 H new ATOM 0 HD11 LEU C 51 -1.327 -3.091 -5.094 1.00 0.00 H new ATOM 0 HD12 LEU C 51 -0.425 -1.606 -5.479 1.00 0.00 H new ATOM 0 HD13 LEU C 51 -1.036 -2.641 -6.791 1.00 0.00 H new ATOM 0 HD21 LEU C 51 -0.315 -5.282 -5.427 1.00 0.00 H new ATOM 0 HD22 LEU C 51 0.018 -4.924 -7.138 1.00 0.00 H new ATOM 0 HD23 LEU C 51 1.341 -5.435 -6.063 1.00 0.00 H new ATOM 2333 N ASN C 52 4.436 -2.073 -8.036 1.00 0.00 N ATOM 2334 CA ASN C 52 5.074 -1.265 -9.074 1.00 0.00 C ATOM 2335 C ASN C 52 6.558 -1.590 -9.227 1.00 0.00 C ATOM 2336 O ASN C 52 7.148 -1.362 -10.281 1.00 0.00 O ATOM 2337 CB ASN C 52 4.887 0.221 -8.765 1.00 0.00 C ATOM 2338 CG ASN C 52 3.741 0.825 -9.552 1.00 0.00 C ATOM 2339 OD1 ASN C 52 2.593 0.827 -9.109 1.00 0.00 O ATOM 2340 ND2 ASN C 52 4.044 1.342 -10.732 1.00 0.00 N ATOM 0 H ASN C 52 4.697 -1.817 -7.084 1.00 0.00 H new ATOM 0 HA ASN C 52 4.592 -1.506 -10.021 1.00 0.00 H new ATOM 0 HB2 ASN C 52 4.701 0.349 -7.699 1.00 0.00 H new ATOM 0 HB3 ASN C 52 5.807 0.758 -8.995 1.00 0.00 H new ATOM 0 HD21 ASN C 52 3.314 1.761 -11.308 1.00 0.00 H new ATOM 0 HD22 ASN C 52 5.008 1.322 -11.065 1.00 0.00 H new ATOM 2347 N LYS C 53 7.156 -2.112 -8.179 1.00 0.00 N ATOM 2348 CA LYS C 53 8.544 -2.515 -8.205 1.00 0.00 C ATOM 2349 C LYS C 53 8.649 -4.033 -8.162 1.00 0.00 C ATOM 2350 O LYS C 53 8.524 -4.667 -9.231 1.00 0.00 O ATOM 2351 CB LYS C 53 9.284 -1.900 -7.016 1.00 0.00 C ATOM 2352 CG LYS C 53 10.138 -0.703 -7.385 1.00 0.00 C ATOM 2353 CD LYS C 53 11.302 -0.540 -6.419 1.00 0.00 C ATOM 2354 CE LYS C 53 10.853 -0.099 -5.039 1.00 0.00 C ATOM 2355 NZ LYS C 53 12.013 0.121 -4.134 1.00 0.00 N ATOM 2356 OXT LYS C 53 8.854 -4.588 -7.071 1.00 0.00 O ATOM 0 H LYS C 53 6.693 -2.269 -7.284 1.00 0.00 H new ATOM 0 HA LYS C 53 9.001 -2.160 -9.129 1.00 0.00 H new ATOM 0 HB2 LYS C 53 8.556 -1.598 -6.263 1.00 0.00 H new ATOM 0 HB3 LYS C 53 9.918 -2.661 -6.560 1.00 0.00 H new ATOM 0 HG2 LYS C 53 10.518 -0.823 -8.400 1.00 0.00 H new ATOM 0 HG3 LYS C 53 9.527 0.199 -7.378 1.00 0.00 H new ATOM 0 HD2 LYS C 53 11.838 -1.485 -6.338 1.00 0.00 H new ATOM 0 HD3 LYS C 53 12.004 0.191 -6.820 1.00 0.00 H new ATOM 0 HE2 LYS C 53 10.274 0.821 -5.120 1.00 0.00 H new ATOM 0 HE3 LYS C 53 10.194 -0.854 -4.611 1.00 0.00 H new ATOM 0 HZ1 LYS C 53 11.731 -0.080 -3.153 1.00 0.00 H new ATOM 0 HZ2 LYS C 53 12.792 -0.512 -4.407 1.00 0.00 H new ATOM 0 HZ3 LYS C 53 12.328 1.109 -4.208 1.00 0.00 H new