USER MOD reduce.3.24.130724 H: found=0, std=0, add=771, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 769 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 6 SER OG : rot 106:sc= 0.734 USER MOD Set 1.2: A 83 SER OG : rot -166:sc= 0.596 USER MOD Set 2.1: A 43 HIS : no HD1:sc= -0.138 X(o=-1.2,f=-0.97) USER MOD Set 2.2: A 49 THR OG1 : rot 180:sc= -0.782 USER MOD Set 2.3: A 73 ASN : amide:sc= -0.258 X(o=-1.2,f=-1.1) USER MOD Set 3.1: A 20 THR OG1 : rot 44:sc= 1.18 USER MOD Set 3.2: A 23 THR OG1 : rot 9:sc= 0.049 USER MOD Set 4.1: A 3 SER OG : rot 180:sc= 0.0985 USER MOD Set 4.2: A 5 SER OG : rot 86:sc= 0.103 USER MOD Single : A 1 GLY N :NH3+ -114:sc= 0.0882 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 THR OG1 : rot 154:sc= 0.0924 USER MOD Single : A 38 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot 180:sc= -1.36 USER MOD Single : A 48 GLN : amide:sc= -0.16 K(o=-0.16,f=-2.3!) USER MOD Single : A 50 GLN : amide:sc= -0.065 X(o=-0.065,f=0) USER MOD Single : A 59 THR OG1 : rot 10:sc= 0.576 USER MOD Single : A 60 SER OG : rot -74:sc= 1.24 USER MOD Single : A 61 HIS : no HD1:sc= -0.505 X(o=-0.5,f=-0.84) USER MOD Single : A 62 GLN : amide:sc= -1.95! K(o=-1.9!,f=-0.9) USER MOD Single : A 69 SER OG : rot -55:sc= 0.698 USER MOD Single : A 70 THR OG1 : rot -130:sc= -1.27 USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 72 TYR OH : rot -64:sc= 0.81 USER MOD Single : A 77 GLN : amide:sc= -0.392 K(o=-0.39,f=-2.4!) USER MOD Single : A 79 MET CE :methyl -161:sc= -0.0279 (180deg=-0.323) USER MOD Single : A 82 GLN : amide:sc= 0 K(o=0,f=-0.86) USER MOD Single : A 89 SER OG : rot 20:sc= 0.441 USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 SER OG : rot 31:sc= 0.0407 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot -145:sc= 1.04 USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 25.489 -9.989 -18.030 1.00 0.00 N ATOM 2 CA GLY A 1 24.432 -10.857 -17.544 1.00 0.00 C ATOM 3 C GLY A 1 23.448 -11.238 -18.632 1.00 0.00 C ATOM 4 O GLY A 1 23.524 -10.733 -19.752 1.00 0.00 O ATOM 0 H1 GLY A 1 26.399 -10.489 -17.980 1.00 0.00 H new ATOM 0 H2 GLY A 1 25.294 -9.723 -19.016 1.00 0.00 H new ATOM 0 H3 GLY A 1 25.532 -9.132 -17.442 1.00 0.00 H new ATOM 0 HA2 GLY A 1 24.873 -11.761 -17.124 1.00 0.00 H new ATOM 0 HA3 GLY A 1 23.899 -10.357 -16.735 1.00 0.00 H new ATOM 8 N SER A 2 22.523 -12.134 -18.303 1.00 0.00 N ATOM 9 CA SER A 2 21.523 -12.587 -19.263 1.00 0.00 C ATOM 10 C SER A 2 20.547 -11.464 -19.602 1.00 0.00 C ATOM 11 O SER A 2 20.239 -11.227 -20.770 1.00 0.00 O ATOM 12 CB SER A 2 20.759 -13.790 -18.707 1.00 0.00 C ATOM 13 OG SER A 2 19.633 -14.097 -19.511 1.00 0.00 O ATOM 0 H SER A 2 22.445 -12.560 -17.380 1.00 0.00 H new ATOM 0 HA SER A 2 22.040 -12.884 -20.175 1.00 0.00 H new ATOM 0 HB2 SER A 2 21.421 -14.654 -18.659 1.00 0.00 H new ATOM 0 HB3 SER A 2 20.435 -13.579 -17.688 1.00 0.00 H new ATOM 0 HG SER A 2 19.163 -14.870 -19.135 1.00 0.00 H new ATOM 19 N SER A 3 20.065 -10.776 -18.572 1.00 0.00 N ATOM 20 CA SER A 3 19.121 -9.680 -18.759 1.00 0.00 C ATOM 21 C SER A 3 19.628 -8.407 -18.088 1.00 0.00 C ATOM 22 O SER A 3 20.325 -8.460 -17.076 1.00 0.00 O ATOM 23 CB SER A 3 17.751 -10.058 -18.194 1.00 0.00 C ATOM 24 OG SER A 3 16.829 -8.990 -18.336 1.00 0.00 O ATOM 0 H SER A 3 20.313 -10.958 -17.599 1.00 0.00 H new ATOM 0 HA SER A 3 19.025 -9.493 -19.829 1.00 0.00 H new ATOM 0 HB2 SER A 3 17.372 -10.941 -18.709 1.00 0.00 H new ATOM 0 HB3 SER A 3 17.848 -10.321 -17.141 1.00 0.00 H new ATOM 0 HG SER A 3 15.960 -9.257 -17.969 1.00 0.00 H new ATOM 30 N GLY A 4 19.271 -7.261 -18.661 1.00 0.00 N ATOM 31 CA GLY A 4 19.697 -5.990 -18.106 1.00 0.00 C ATOM 32 C GLY A 4 18.678 -5.405 -17.149 1.00 0.00 C ATOM 33 O GLY A 4 18.314 -4.234 -17.259 1.00 0.00 O ATOM 0 H GLY A 4 18.694 -7.191 -19.499 1.00 0.00 H new ATOM 0 HA2 GLY A 4 20.645 -6.124 -17.585 1.00 0.00 H new ATOM 0 HA3 GLY A 4 19.876 -5.284 -18.917 1.00 0.00 H new ATOM 37 N SER A 5 18.216 -6.221 -16.207 1.00 0.00 N ATOM 38 CA SER A 5 17.229 -5.779 -15.229 1.00 0.00 C ATOM 39 C SER A 5 17.845 -5.691 -13.836 1.00 0.00 C ATOM 40 O SER A 5 18.642 -6.543 -13.443 1.00 0.00 O ATOM 41 CB SER A 5 16.034 -6.734 -15.211 1.00 0.00 C ATOM 42 OG SER A 5 15.409 -6.793 -16.482 1.00 0.00 O ATOM 0 H SER A 5 18.510 -7.192 -16.100 1.00 0.00 H new ATOM 0 HA SER A 5 16.887 -4.786 -15.519 1.00 0.00 H new ATOM 0 HB2 SER A 5 16.365 -7.730 -14.919 1.00 0.00 H new ATOM 0 HB3 SER A 5 15.313 -6.405 -14.463 1.00 0.00 H new ATOM 0 HG SER A 5 15.866 -7.456 -17.041 1.00 0.00 H new ATOM 48 N SER A 6 17.470 -4.655 -13.094 1.00 0.00 N ATOM 49 CA SER A 6 17.988 -4.452 -11.746 1.00 0.00 C ATOM 50 C SER A 6 17.953 -5.753 -10.949 1.00 0.00 C ATOM 51 O SER A 6 17.386 -6.751 -11.393 1.00 0.00 O ATOM 52 CB SER A 6 17.177 -3.375 -11.022 1.00 0.00 C ATOM 53 OG SER A 6 17.124 -2.180 -11.781 1.00 0.00 O ATOM 0 H SER A 6 16.809 -3.942 -13.403 1.00 0.00 H new ATOM 0 HA SER A 6 19.024 -4.123 -11.827 1.00 0.00 H new ATOM 0 HB2 SER A 6 16.166 -3.738 -10.839 1.00 0.00 H new ATOM 0 HB3 SER A 6 17.624 -3.172 -10.049 1.00 0.00 H new ATOM 0 HG SER A 6 16.232 -2.083 -12.176 1.00 0.00 H new ATOM 59 N GLY A 7 18.563 -5.733 -9.768 1.00 0.00 N ATOM 60 CA GLY A 7 18.591 -6.916 -8.928 1.00 0.00 C ATOM 61 C GLY A 7 18.511 -6.580 -7.452 1.00 0.00 C ATOM 62 O GLY A 7 19.319 -7.058 -6.654 1.00 0.00 O ATOM 0 H GLY A 7 19.038 -4.919 -9.378 1.00 0.00 H new ATOM 0 HA2 GLY A 7 17.759 -7.567 -9.195 1.00 0.00 H new ATOM 0 HA3 GLY A 7 19.507 -7.474 -9.122 1.00 0.00 H new ATOM 66 N LEU A 8 17.536 -5.755 -7.086 1.00 0.00 N ATOM 67 CA LEU A 8 17.355 -5.354 -5.696 1.00 0.00 C ATOM 68 C LEU A 8 16.178 -6.092 -5.065 1.00 0.00 C ATOM 69 O LEU A 8 15.551 -6.938 -5.702 1.00 0.00 O ATOM 70 CB LEU A 8 17.131 -3.843 -5.605 1.00 0.00 C ATOM 71 CG LEU A 8 18.223 -2.966 -6.218 1.00 0.00 C ATOM 72 CD1 LEU A 8 18.003 -2.807 -7.715 1.00 0.00 C ATOM 73 CD2 LEU A 8 18.260 -1.606 -5.536 1.00 0.00 C ATOM 0 H LEU A 8 16.859 -5.351 -7.733 1.00 0.00 H new ATOM 0 HA LEU A 8 18.260 -5.615 -5.148 1.00 0.00 H new ATOM 0 HB2 LEU A 8 16.186 -3.606 -6.093 1.00 0.00 H new ATOM 0 HB3 LEU A 8 17.024 -3.574 -4.554 1.00 0.00 H new ATOM 0 HG LEU A 8 19.185 -3.455 -6.063 1.00 0.00 H new ATOM 0 HD11 LEU A 8 18.790 -2.180 -8.134 1.00 0.00 H new ATOM 0 HD12 LEU A 8 18.027 -3.787 -8.192 1.00 0.00 H new ATOM 0 HD13 LEU A 8 17.034 -2.341 -7.893 1.00 0.00 H new ATOM 0 HD21 LEU A 8 19.043 -0.995 -5.985 1.00 0.00 H new ATOM 0 HD22 LEU A 8 17.297 -1.110 -5.660 1.00 0.00 H new ATOM 0 HD23 LEU A 8 18.466 -1.737 -4.474 1.00 0.00 H new ATOM 85 N GLU A 9 15.884 -5.764 -3.811 1.00 0.00 N ATOM 86 CA GLU A 9 14.781 -6.396 -3.096 1.00 0.00 C ATOM 87 C GLU A 9 13.618 -5.424 -2.922 1.00 0.00 C ATOM 88 O GLU A 9 13.811 -4.270 -2.542 1.00 0.00 O ATOM 89 CB GLU A 9 15.251 -6.896 -1.728 1.00 0.00 C ATOM 90 CG GLU A 9 15.855 -8.290 -1.765 1.00 0.00 C ATOM 91 CD GLU A 9 14.889 -9.331 -2.297 1.00 0.00 C ATOM 92 OE1 GLU A 9 14.825 -9.502 -3.532 1.00 0.00 O ATOM 93 OE2 GLU A 9 14.198 -9.973 -1.479 1.00 0.00 O ATOM 0 H GLU A 9 16.393 -5.065 -3.270 1.00 0.00 H new ATOM 0 HA GLU A 9 14.437 -7.245 -3.687 1.00 0.00 H new ATOM 0 HB2 GLU A 9 15.989 -6.200 -1.330 1.00 0.00 H new ATOM 0 HB3 GLU A 9 14.406 -6.893 -1.039 1.00 0.00 H new ATOM 0 HG2 GLU A 9 16.749 -8.278 -2.388 1.00 0.00 H new ATOM 0 HG3 GLU A 9 16.170 -8.572 -0.760 1.00 0.00 H new ATOM 100 N ALA A 10 12.409 -5.900 -3.204 1.00 0.00 N ATOM 101 CA ALA A 10 11.214 -5.075 -3.077 1.00 0.00 C ATOM 102 C ALA A 10 10.571 -5.247 -1.705 1.00 0.00 C ATOM 103 O ALA A 10 10.909 -6.153 -0.944 1.00 0.00 O ATOM 104 CB ALA A 10 10.218 -5.416 -4.176 1.00 0.00 C ATOM 0 H ALA A 10 12.232 -6.853 -3.522 1.00 0.00 H new ATOM 0 HA ALA A 10 11.510 -4.031 -3.182 1.00 0.00 H new ATOM 0 HB1 ALA A 10 9.330 -4.792 -4.069 1.00 0.00 H new ATOM 0 HB2 ALA A 10 10.674 -5.234 -5.149 1.00 0.00 H new ATOM 0 HB3 ALA A 10 9.935 -6.466 -4.098 1.00 0.00 H new ATOM 110 N PRO A 11 9.622 -4.357 -1.380 1.00 0.00 N ATOM 111 CA PRO A 11 8.912 -4.389 -0.098 1.00 0.00 C ATOM 112 C PRO A 11 7.968 -5.583 0.011 1.00 0.00 C ATOM 113 O PRO A 11 7.393 -6.025 -0.983 1.00 0.00 O ATOM 114 CB PRO A 11 8.119 -3.080 -0.098 1.00 0.00 C ATOM 115 CG PRO A 11 7.936 -2.748 -1.539 1.00 0.00 C ATOM 116 CD PRO A 11 9.168 -3.250 -2.240 1.00 0.00 C ATOM 0 HA PRO A 11 9.596 -4.488 0.745 1.00 0.00 H new ATOM 0 HB2 PRO A 11 7.160 -3.198 0.406 1.00 0.00 H new ATOM 0 HB3 PRO A 11 8.659 -2.290 0.425 1.00 0.00 H new ATOM 0 HG2 PRO A 11 7.039 -3.223 -1.938 1.00 0.00 H new ATOM 0 HG3 PRO A 11 7.817 -1.674 -1.680 1.00 0.00 H new ATOM 0 HD2 PRO A 11 8.944 -3.592 -3.251 1.00 0.00 H new ATOM 0 HD3 PRO A 11 9.926 -2.472 -2.327 1.00 0.00 H new ATOM 124 N ARG A 12 7.814 -6.099 1.226 1.00 0.00 N ATOM 125 CA ARG A 12 6.941 -7.242 1.465 1.00 0.00 C ATOM 126 C ARG A 12 6.132 -7.049 2.745 1.00 0.00 C ATOM 127 O ARG A 12 6.271 -6.038 3.433 1.00 0.00 O ATOM 128 CB ARG A 12 7.763 -8.528 1.557 1.00 0.00 C ATOM 129 CG ARG A 12 8.826 -8.495 2.643 1.00 0.00 C ATOM 130 CD ARG A 12 9.345 -9.890 2.957 1.00 0.00 C ATOM 131 NE ARG A 12 10.727 -9.866 3.429 1.00 0.00 N ATOM 132 CZ ARG A 12 11.389 -10.949 3.821 1.00 0.00 C ATOM 133 NH1 ARG A 12 10.797 -12.136 3.797 1.00 0.00 N ATOM 134 NH2 ARG A 12 12.644 -10.847 4.237 1.00 0.00 N ATOM 0 H ARG A 12 8.282 -5.744 2.060 1.00 0.00 H new ATOM 0 HA ARG A 12 6.249 -7.321 0.627 1.00 0.00 H new ATOM 0 HB2 ARG A 12 7.091 -9.366 1.743 1.00 0.00 H new ATOM 0 HB3 ARG A 12 8.243 -8.712 0.596 1.00 0.00 H new ATOM 0 HG2 ARG A 12 9.653 -7.861 2.325 1.00 0.00 H new ATOM 0 HG3 ARG A 12 8.411 -8.048 3.546 1.00 0.00 H new ATOM 0 HD2 ARG A 12 8.711 -10.351 3.715 1.00 0.00 H new ATOM 0 HD3 ARG A 12 9.278 -10.511 2.064 1.00 0.00 H new ATOM 0 HE ARG A 12 11.210 -8.968 3.459 1.00 0.00 H new ATOM 0 HH11 ARG A 12 9.832 -12.218 3.477 1.00 0.00 H new ATOM 0 HH12 ARG A 12 11.307 -12.966 4.098 1.00 0.00 H new ATOM 0 HH21 ARG A 12 13.102 -9.936 4.256 1.00 0.00 H new ATOM 0 HH22 ARG A 12 13.151 -11.680 4.538 1.00 0.00 H new ATOM 148 N ASP A 13 5.287 -8.026 3.057 1.00 0.00 N ATOM 149 CA ASP A 13 4.456 -7.965 4.254 1.00 0.00 C ATOM 150 C ASP A 13 3.548 -6.740 4.223 1.00 0.00 C ATOM 151 O ASP A 13 3.308 -6.106 5.252 1.00 0.00 O ATOM 152 CB ASP A 13 5.332 -7.935 5.507 1.00 0.00 C ATOM 153 CG ASP A 13 6.027 -9.259 5.760 1.00 0.00 C ATOM 154 OD1 ASP A 13 5.507 -10.299 5.303 1.00 0.00 O ATOM 155 OD2 ASP A 13 7.091 -9.255 6.413 1.00 0.00 O ATOM 0 H ASP A 13 5.160 -8.869 2.498 1.00 0.00 H new ATOM 0 HA ASP A 13 3.831 -8.857 4.279 1.00 0.00 H new ATOM 0 HB2 ASP A 13 6.080 -7.149 5.405 1.00 0.00 H new ATOM 0 HB3 ASP A 13 4.717 -7.680 6.370 1.00 0.00 H new ATOM 160 N LEU A 14 3.047 -6.411 3.038 1.00 0.00 N ATOM 161 CA LEU A 14 2.166 -5.260 2.872 1.00 0.00 C ATOM 162 C LEU A 14 0.724 -5.625 3.213 1.00 0.00 C ATOM 163 O LEU A 14 0.043 -6.290 2.434 1.00 0.00 O ATOM 164 CB LEU A 14 2.246 -4.733 1.439 1.00 0.00 C ATOM 165 CG LEU A 14 1.183 -3.710 1.039 1.00 0.00 C ATOM 166 CD1 LEU A 14 1.620 -2.306 1.429 1.00 0.00 C ATOM 167 CD2 LEU A 14 0.902 -3.787 -0.455 1.00 0.00 C ATOM 0 H LEU A 14 3.236 -6.925 2.177 1.00 0.00 H new ATOM 0 HA LEU A 14 2.496 -4.479 3.557 1.00 0.00 H new ATOM 0 HB2 LEU A 14 3.228 -4.283 1.293 1.00 0.00 H new ATOM 0 HB3 LEU A 14 2.180 -5.581 0.757 1.00 0.00 H new ATOM 0 HG LEU A 14 0.262 -3.944 1.574 1.00 0.00 H new ATOM 0 HD11 LEU A 14 0.851 -1.591 1.136 1.00 0.00 H new ATOM 0 HD12 LEU A 14 1.769 -2.258 2.508 1.00 0.00 H new ATOM 0 HD13 LEU A 14 2.554 -2.062 0.923 1.00 0.00 H new ATOM 0 HD21 LEU A 14 0.143 -3.051 -0.721 1.00 0.00 H new ATOM 0 HD22 LEU A 14 1.818 -3.580 -1.009 1.00 0.00 H new ATOM 0 HD23 LEU A 14 0.544 -4.785 -0.707 1.00 0.00 H new ATOM 179 N GLU A 15 0.267 -5.183 4.380 1.00 0.00 N ATOM 180 CA GLU A 15 -1.094 -5.462 4.822 1.00 0.00 C ATOM 181 C GLU A 15 -1.732 -4.220 5.437 1.00 0.00 C ATOM 182 O GLU A 15 -1.038 -3.338 5.941 1.00 0.00 O ATOM 183 CB GLU A 15 -1.100 -6.608 5.836 1.00 0.00 C ATOM 184 CG GLU A 15 -2.493 -7.107 6.181 1.00 0.00 C ATOM 185 CD GLU A 15 -3.037 -8.079 5.151 1.00 0.00 C ATOM 186 OE1 GLU A 15 -2.322 -9.043 4.809 1.00 0.00 O ATOM 187 OE2 GLU A 15 -4.178 -7.873 4.688 1.00 0.00 O ATOM 0 H GLU A 15 0.819 -4.631 5.036 1.00 0.00 H new ATOM 0 HA GLU A 15 -1.679 -5.755 3.950 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -0.514 -7.437 5.439 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -0.605 -6.277 6.749 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -2.470 -7.593 7.156 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -3.169 -6.256 6.265 1.00 0.00 H new ATOM 194 N ALA A 16 -3.059 -4.159 5.392 1.00 0.00 N ATOM 195 CA ALA A 16 -3.791 -3.027 5.946 1.00 0.00 C ATOM 196 C ALA A 16 -4.167 -3.276 7.402 1.00 0.00 C ATOM 197 O ALA A 16 -4.914 -4.205 7.712 1.00 0.00 O ATOM 198 CB ALA A 16 -5.037 -2.747 5.118 1.00 0.00 C ATOM 0 H ALA A 16 -3.649 -4.881 4.977 1.00 0.00 H new ATOM 0 HA ALA A 16 -3.140 -2.153 5.910 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -5.574 -1.899 5.544 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -4.748 -2.516 4.093 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -5.683 -3.625 5.124 1.00 0.00 H new ATOM 204 N LYS A 17 -3.645 -2.441 8.294 1.00 0.00 N ATOM 205 CA LYS A 17 -3.925 -2.570 9.720 1.00 0.00 C ATOM 206 C LYS A 17 -4.843 -1.449 10.197 1.00 0.00 C ATOM 207 O LYS A 17 -4.974 -0.419 9.536 1.00 0.00 O ATOM 208 CB LYS A 17 -2.622 -2.552 10.521 1.00 0.00 C ATOM 209 CG LYS A 17 -1.668 -3.676 10.154 1.00 0.00 C ATOM 210 CD LYS A 17 -0.764 -4.043 11.320 1.00 0.00 C ATOM 211 CE LYS A 17 0.052 -5.291 11.021 1.00 0.00 C ATOM 212 NZ LYS A 17 1.118 -5.513 12.037 1.00 0.00 N ATOM 0 H LYS A 17 -3.025 -1.667 8.055 1.00 0.00 H new ATOM 0 HA LYS A 17 -4.429 -3.523 9.881 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -2.122 -1.596 10.364 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -2.857 -2.618 11.583 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -2.238 -4.552 9.845 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -1.059 -3.374 9.301 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -0.093 -3.212 11.537 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -1.368 -4.207 12.212 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -0.608 -6.158 10.992 1.00 0.00 H new ATOM 0 HE3 LYS A 17 0.504 -5.201 10.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 1.652 -6.373 11.798 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 1.763 -4.697 12.048 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 0.685 -5.624 12.976 1.00 0.00 H new ATOM 226 N GLU A 18 -5.473 -1.656 11.349 1.00 0.00 N ATOM 227 CA GLU A 18 -6.378 -0.661 11.913 1.00 0.00 C ATOM 228 C GLU A 18 -7.309 -0.102 10.842 1.00 0.00 C ATOM 229 O GLU A 18 -7.475 1.112 10.718 1.00 0.00 O ATOM 230 CB GLU A 18 -5.582 0.477 12.557 1.00 0.00 C ATOM 231 CG GLU A 18 -4.453 -0.001 13.453 1.00 0.00 C ATOM 232 CD GLU A 18 -4.927 -0.962 14.527 1.00 0.00 C ATOM 233 OE1 GLU A 18 -5.941 -0.657 15.189 1.00 0.00 O ATOM 234 OE2 GLU A 18 -4.284 -2.017 14.705 1.00 0.00 O ATOM 0 H GLU A 18 -5.374 -2.502 11.909 1.00 0.00 H new ATOM 0 HA GLU A 18 -6.984 -1.150 12.676 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -5.168 1.109 11.772 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -6.261 1.098 13.142 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -3.693 -0.489 12.844 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -3.979 0.860 13.925 1.00 0.00 H new ATOM 241 N VAL A 19 -7.916 -0.997 10.068 1.00 0.00 N ATOM 242 CA VAL A 19 -8.832 -0.595 9.007 1.00 0.00 C ATOM 243 C VAL A 19 -10.141 -0.067 9.582 1.00 0.00 C ATOM 244 O VAL A 19 -10.883 -0.798 10.240 1.00 0.00 O ATOM 245 CB VAL A 19 -9.137 -1.767 8.055 1.00 0.00 C ATOM 246 CG1 VAL A 19 -10.190 -1.365 7.034 1.00 0.00 C ATOM 247 CG2 VAL A 19 -7.865 -2.236 7.364 1.00 0.00 C ATOM 0 H VAL A 19 -7.790 -2.005 10.156 1.00 0.00 H new ATOM 0 HA VAL A 19 -8.339 0.199 8.447 1.00 0.00 H new ATOM 0 HB VAL A 19 -9.532 -2.596 8.642 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -10.393 -2.205 6.370 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -11.107 -1.081 7.550 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -9.826 -0.520 6.449 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -8.099 -3.064 6.695 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -7.439 -1.414 6.789 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -7.145 -2.566 8.113 1.00 0.00 H new ATOM 257 N THR A 20 -10.421 1.208 9.330 1.00 0.00 N ATOM 258 CA THR A 20 -11.641 1.834 9.822 1.00 0.00 C ATOM 259 C THR A 20 -12.399 2.524 8.694 1.00 0.00 C ATOM 260 O THR A 20 -11.842 2.844 7.644 1.00 0.00 O ATOM 261 CB THR A 20 -11.337 2.865 10.926 1.00 0.00 C ATOM 262 OG1 THR A 20 -10.041 3.438 10.718 1.00 0.00 O ATOM 263 CG2 THR A 20 -11.396 2.218 12.302 1.00 0.00 C ATOM 0 H THR A 20 -9.819 1.827 8.788 1.00 0.00 H new ATOM 0 HA THR A 20 -12.259 1.038 10.238 1.00 0.00 H new ATOM 0 HB THR A 20 -12.093 3.649 10.878 1.00 0.00 H new ATOM 0 HG1 THR A 20 -9.927 3.654 9.769 1.00 0.00 H new ATOM 0 HG21 THR A 20 -11.178 2.965 13.065 1.00 0.00 H new ATOM 0 HG22 THR A 20 -12.392 1.809 12.469 1.00 0.00 H new ATOM 0 HG23 THR A 20 -10.660 1.416 12.359 1.00 0.00 H new ATOM 271 N PRO A 21 -13.701 2.760 8.913 1.00 0.00 N ATOM 272 CA PRO A 21 -14.564 3.416 7.925 1.00 0.00 C ATOM 273 C PRO A 21 -14.225 4.892 7.749 1.00 0.00 C ATOM 274 O PRO A 21 -14.712 5.545 6.826 1.00 0.00 O ATOM 275 CB PRO A 21 -15.966 3.256 8.517 1.00 0.00 C ATOM 276 CG PRO A 21 -15.745 3.122 9.984 1.00 0.00 C ATOM 277 CD PRO A 21 -14.432 2.406 10.141 1.00 0.00 C ATOM 0 HA PRO A 21 -14.453 2.979 6.933 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -16.593 4.118 8.288 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -16.469 2.379 8.111 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -15.716 4.100 10.465 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -16.554 2.560 10.451 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -13.900 2.734 11.034 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -14.570 1.328 10.230 1.00 0.00 H new ATOM 285 N ARG A 22 -13.387 5.413 8.640 1.00 0.00 N ATOM 286 CA ARG A 22 -12.984 6.813 8.583 1.00 0.00 C ATOM 287 C ARG A 22 -11.551 6.946 8.078 1.00 0.00 C ATOM 288 O ARG A 22 -11.177 7.965 7.497 1.00 0.00 O ATOM 289 CB ARG A 22 -13.112 7.459 9.964 1.00 0.00 C ATOM 290 CG ARG A 22 -14.504 7.991 10.261 1.00 0.00 C ATOM 291 CD ARG A 22 -14.776 9.288 9.515 1.00 0.00 C ATOM 292 NE ARG A 22 -16.153 9.741 9.690 1.00 0.00 N ATOM 293 CZ ARG A 22 -16.682 10.759 9.020 1.00 0.00 C ATOM 294 NH1 ARG A 22 -15.954 11.425 8.135 1.00 0.00 N ATOM 295 NH2 ARG A 22 -17.943 11.112 9.234 1.00 0.00 N ATOM 0 H ARG A 22 -12.974 4.886 9.410 1.00 0.00 H new ATOM 0 HA ARG A 22 -13.645 7.328 7.886 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -12.842 6.726 10.725 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -12.396 8.277 10.041 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -15.247 7.245 9.979 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -14.610 8.158 11.333 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -14.093 10.060 9.869 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -14.573 9.145 8.454 1.00 0.00 H new ATOM 0 HE ARG A 22 -16.741 9.249 10.363 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -14.985 11.156 7.967 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -16.363 12.206 7.622 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -18.507 10.602 9.913 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -18.348 11.894 8.719 1.00 0.00 H new ATOM 309 N THR A 23 -10.750 5.908 8.303 1.00 0.00 N ATOM 310 CA THR A 23 -9.358 5.909 7.873 1.00 0.00 C ATOM 311 C THR A 23 -8.813 4.489 7.770 1.00 0.00 C ATOM 312 O THR A 23 -9.466 3.532 8.186 1.00 0.00 O ATOM 313 CB THR A 23 -8.472 6.718 8.839 1.00 0.00 C ATOM 314 OG1 THR A 23 -8.678 6.270 10.184 1.00 0.00 O ATOM 315 CG2 THR A 23 -8.780 8.204 8.741 1.00 0.00 C ATOM 0 H THR A 23 -11.043 5.056 8.781 1.00 0.00 H new ATOM 0 HA THR A 23 -9.332 6.377 6.889 1.00 0.00 H new ATOM 0 HB THR A 23 -7.430 6.561 8.559 1.00 0.00 H new ATOM 0 HG1 THR A 23 -9.231 5.461 10.178 1.00 0.00 H new ATOM 0 HG21 THR A 23 -8.142 8.754 9.432 1.00 0.00 H new ATOM 0 HG22 THR A 23 -8.594 8.548 7.724 1.00 0.00 H new ATOM 0 HG23 THR A 23 -9.825 8.377 8.997 1.00 0.00 H new ATOM 323 N ALA A 24 -7.613 4.359 7.214 1.00 0.00 N ATOM 324 CA ALA A 24 -6.980 3.056 7.059 1.00 0.00 C ATOM 325 C ALA A 24 -5.460 3.177 7.088 1.00 0.00 C ATOM 326 O ALA A 24 -4.871 3.922 6.303 1.00 0.00 O ATOM 327 CB ALA A 24 -7.434 2.399 5.764 1.00 0.00 C ATOM 0 H ALA A 24 -7.060 5.141 6.863 1.00 0.00 H new ATOM 0 HA ALA A 24 -7.285 2.430 7.898 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -6.953 1.426 5.661 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -8.516 2.269 5.782 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -7.159 3.031 4.919 1.00 0.00 H new ATOM 333 N LEU A 25 -4.830 2.442 7.997 1.00 0.00 N ATOM 334 CA LEU A 25 -3.377 2.467 8.129 1.00 0.00 C ATOM 335 C LEU A 25 -2.749 1.241 7.473 1.00 0.00 C ATOM 336 O LEU A 25 -3.151 0.108 7.738 1.00 0.00 O ATOM 337 CB LEU A 25 -2.980 2.529 9.605 1.00 0.00 C ATOM 338 CG LEU A 25 -1.510 2.247 9.917 1.00 0.00 C ATOM 339 CD1 LEU A 25 -0.692 3.526 9.838 1.00 0.00 C ATOM 340 CD2 LEU A 25 -1.370 1.606 11.290 1.00 0.00 C ATOM 0 H LEU A 25 -5.302 1.821 8.654 1.00 0.00 H new ATOM 0 HA LEU A 25 -3.006 3.358 7.622 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -3.228 3.520 9.986 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -3.591 1.814 10.155 1.00 0.00 H new ATOM 0 HG LEU A 25 -1.128 1.550 9.172 1.00 0.00 H new ATOM 0 HD11 LEU A 25 0.351 3.305 10.063 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -0.766 3.944 8.834 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -1.074 4.247 10.560 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -0.317 1.412 11.495 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -1.770 2.279 12.048 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -1.923 0.667 11.311 1.00 0.00 H new ATOM 352 N LEU A 26 -1.761 1.476 6.616 1.00 0.00 N ATOM 353 CA LEU A 26 -1.075 0.391 5.924 1.00 0.00 C ATOM 354 C LEU A 26 0.377 0.286 6.379 1.00 0.00 C ATOM 355 O LEU A 26 1.032 1.295 6.641 1.00 0.00 O ATOM 356 CB LEU A 26 -1.132 0.609 4.410 1.00 0.00 C ATOM 357 CG LEU A 26 -2.414 0.151 3.714 1.00 0.00 C ATOM 358 CD1 LEU A 26 -2.690 1.006 2.487 1.00 0.00 C ATOM 359 CD2 LEU A 26 -2.317 -1.319 3.332 1.00 0.00 C ATOM 0 H LEU A 26 -1.417 2.408 6.384 1.00 0.00 H new ATOM 0 HA LEU A 26 -1.582 -0.542 6.171 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -0.994 1.672 4.211 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -0.290 0.087 3.956 1.00 0.00 H new ATOM 0 HG LEU A 26 -3.245 0.271 4.409 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -3.606 0.665 2.005 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -2.804 2.048 2.787 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -1.858 0.919 1.788 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -3.238 -1.628 2.838 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -1.475 -1.464 2.655 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -2.168 -1.919 4.230 1.00 0.00 H new ATOM 371 N THR A 27 0.875 -0.943 6.470 1.00 0.00 N ATOM 372 CA THR A 27 2.250 -1.181 6.893 1.00 0.00 C ATOM 373 C THR A 27 2.969 -2.114 5.925 1.00 0.00 C ATOM 374 O THR A 27 2.363 -3.024 5.360 1.00 0.00 O ATOM 375 CB THR A 27 2.306 -1.786 8.308 1.00 0.00 C ATOM 376 OG1 THR A 27 1.692 -3.080 8.313 1.00 0.00 O ATOM 377 CG2 THR A 27 1.604 -0.883 9.311 1.00 0.00 C ATOM 0 H THR A 27 0.347 -1.789 6.257 1.00 0.00 H new ATOM 0 HA THR A 27 2.750 -0.213 6.900 1.00 0.00 H new ATOM 0 HB THR A 27 3.353 -1.880 8.597 1.00 0.00 H new ATOM 0 HG1 THR A 27 1.733 -3.458 9.216 1.00 0.00 H new ATOM 0 HG21 THR A 27 1.657 -1.331 10.303 1.00 0.00 H new ATOM 0 HG22 THR A 27 2.092 0.092 9.327 1.00 0.00 H new ATOM 0 HG23 THR A 27 0.560 -0.762 9.023 1.00 0.00 H new ATOM 385 N TRP A 28 4.263 -1.882 5.740 1.00 0.00 N ATOM 386 CA TRP A 28 5.066 -2.703 4.840 1.00 0.00 C ATOM 387 C TRP A 28 6.486 -2.863 5.370 1.00 0.00 C ATOM 388 O TRP A 28 6.957 -2.054 6.169 1.00 0.00 O ATOM 389 CB TRP A 28 5.097 -2.083 3.442 1.00 0.00 C ATOM 390 CG TRP A 28 5.858 -0.794 3.381 1.00 0.00 C ATOM 391 CD1 TRP A 28 7.172 -0.633 3.047 1.00 0.00 C ATOM 392 CD2 TRP A 28 5.351 0.515 3.663 1.00 0.00 C ATOM 393 NE1 TRP A 28 7.513 0.697 3.104 1.00 0.00 N ATOM 394 CE2 TRP A 28 6.413 1.422 3.479 1.00 0.00 C ATOM 395 CE3 TRP A 28 4.102 1.009 4.051 1.00 0.00 C ATOM 396 CZ2 TRP A 28 6.262 2.793 3.672 1.00 0.00 C ATOM 397 CZ3 TRP A 28 3.955 2.370 4.243 1.00 0.00 C ATOM 398 CH2 TRP A 28 5.029 3.249 4.052 1.00 0.00 C ATOM 0 H TRP A 28 4.779 -1.133 6.201 1.00 0.00 H new ATOM 0 HA TRP A 28 4.607 -3.690 4.782 1.00 0.00 H new ATOM 0 HB2 TRP A 28 5.544 -2.794 2.747 1.00 0.00 H new ATOM 0 HB3 TRP A 28 4.075 -1.909 3.107 1.00 0.00 H new ATOM 0 HD1 TRP A 28 7.845 -1.434 2.777 1.00 0.00 H new ATOM 0 HE1 TRP A 28 8.435 1.082 2.900 1.00 0.00 H new ATOM 0 HE3 TRP A 28 3.267 0.340 4.198 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 7.089 3.472 3.527 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 2.995 2.763 4.546 1.00 0.00 H new ATOM 0 HH2 TRP A 28 4.881 4.307 4.208 1.00 0.00 H new ATOM 409 N THR A 29 7.166 -3.913 4.920 1.00 0.00 N ATOM 410 CA THR A 29 8.533 -4.180 5.350 1.00 0.00 C ATOM 411 C THR A 29 9.541 -3.494 4.435 1.00 0.00 C ATOM 412 O THR A 29 9.362 -3.457 3.218 1.00 0.00 O ATOM 413 CB THR A 29 8.828 -5.691 5.379 1.00 0.00 C ATOM 414 OG1 THR A 29 8.194 -6.292 6.513 1.00 0.00 O ATOM 415 CG2 THR A 29 10.327 -5.949 5.434 1.00 0.00 C ATOM 0 H THR A 29 6.792 -4.593 4.258 1.00 0.00 H new ATOM 0 HA THR A 29 8.631 -3.779 6.359 1.00 0.00 H new ATOM 0 HB THR A 29 8.432 -6.134 4.465 1.00 0.00 H new ATOM 0 HG1 THR A 29 8.021 -7.239 6.328 1.00 0.00 H new ATOM 0 HG21 THR A 29 10.511 -7.023 5.454 1.00 0.00 H new ATOM 0 HG22 THR A 29 10.803 -5.515 4.555 1.00 0.00 H new ATOM 0 HG23 THR A 29 10.742 -5.493 6.333 1.00 0.00 H new ATOM 423 N GLU A 30 10.601 -2.954 5.028 1.00 0.00 N ATOM 424 CA GLU A 30 11.637 -2.269 4.264 1.00 0.00 C ATOM 425 C GLU A 30 12.747 -3.237 3.865 1.00 0.00 C ATOM 426 O GLU A 30 13.237 -4.028 4.672 1.00 0.00 O ATOM 427 CB GLU A 30 12.222 -1.113 5.077 1.00 0.00 C ATOM 428 CG GLU A 30 11.490 0.204 4.876 1.00 0.00 C ATOM 429 CD GLU A 30 12.324 1.403 5.284 1.00 0.00 C ATOM 430 OE1 GLU A 30 13.029 1.314 6.312 1.00 0.00 O ATOM 431 OE2 GLU A 30 12.273 2.429 4.575 1.00 0.00 O ATOM 0 H GLU A 30 10.765 -2.978 6.034 1.00 0.00 H new ATOM 0 HA GLU A 30 11.181 -1.871 3.357 1.00 0.00 H new ATOM 0 HB2 GLU A 30 12.198 -1.375 6.135 1.00 0.00 H new ATOM 0 HB3 GLU A 30 13.269 -0.982 4.805 1.00 0.00 H new ATOM 0 HG2 GLU A 30 11.208 0.302 3.828 1.00 0.00 H new ATOM 0 HG3 GLU A 30 10.567 0.194 5.455 1.00 0.00 H new ATOM 438 N PRO A 31 13.155 -3.175 2.588 1.00 0.00 N ATOM 439 CA PRO A 31 14.211 -4.039 2.052 1.00 0.00 C ATOM 440 C PRO A 31 15.586 -3.688 2.610 1.00 0.00 C ATOM 441 O PRO A 31 15.772 -2.665 3.270 1.00 0.00 O ATOM 442 CB PRO A 31 14.161 -3.767 0.546 1.00 0.00 C ATOM 443 CG PRO A 31 13.582 -2.399 0.427 1.00 0.00 C ATOM 444 CD PRO A 31 12.616 -2.257 1.571 1.00 0.00 C ATOM 0 HA PRO A 31 14.055 -5.085 2.316 1.00 0.00 H new ATOM 0 HB2 PRO A 31 15.155 -3.816 0.102 1.00 0.00 H new ATOM 0 HB3 PRO A 31 13.545 -4.504 0.031 1.00 0.00 H new ATOM 0 HG2 PRO A 31 14.362 -1.639 0.478 1.00 0.00 H new ATOM 0 HG3 PRO A 31 13.075 -2.272 -0.530 1.00 0.00 H new ATOM 0 HD2 PRO A 31 12.575 -1.231 1.937 1.00 0.00 H new ATOM 0 HD3 PRO A 31 11.603 -2.532 1.278 1.00 0.00 H new ATOM 452 N PRO A 32 16.574 -4.554 2.341 1.00 0.00 N ATOM 453 CA PRO A 32 17.950 -4.356 2.807 1.00 0.00 C ATOM 454 C PRO A 32 18.641 -3.196 2.098 1.00 0.00 C ATOM 455 O PRO A 32 19.795 -2.879 2.384 1.00 0.00 O ATOM 456 CB PRO A 32 18.636 -5.680 2.461 1.00 0.00 C ATOM 457 CG PRO A 32 17.844 -6.231 1.326 1.00 0.00 C ATOM 458 CD PRO A 32 16.424 -5.793 1.560 1.00 0.00 C ATOM 0 HA PRO A 32 17.989 -4.105 3.867 1.00 0.00 H new ATOM 0 HB2 PRO A 32 19.677 -5.525 2.179 1.00 0.00 H new ATOM 0 HB3 PRO A 32 18.635 -6.361 3.312 1.00 0.00 H new ATOM 0 HG2 PRO A 32 18.216 -5.856 0.372 1.00 0.00 H new ATOM 0 HG3 PRO A 32 17.916 -7.318 1.291 1.00 0.00 H new ATOM 0 HD2 PRO A 32 15.898 -5.616 0.622 1.00 0.00 H new ATOM 0 HD3 PRO A 32 15.856 -6.546 2.106 1.00 0.00 H new ATOM 466 N VAL A 33 17.927 -2.566 1.170 1.00 0.00 N ATOM 467 CA VAL A 33 18.471 -1.440 0.421 1.00 0.00 C ATOM 468 C VAL A 33 17.477 -0.285 0.365 1.00 0.00 C ATOM 469 O VAL A 33 16.875 -0.020 -0.675 1.00 0.00 O ATOM 470 CB VAL A 33 18.845 -1.850 -1.016 1.00 0.00 C ATOM 471 CG1 VAL A 33 19.347 -0.648 -1.801 1.00 0.00 C ATOM 472 CG2 VAL A 33 19.887 -2.958 -0.999 1.00 0.00 C ATOM 0 H VAL A 33 16.971 -2.817 0.919 1.00 0.00 H new ATOM 0 HA VAL A 33 19.370 -1.117 0.945 1.00 0.00 H new ATOM 0 HB VAL A 33 17.951 -2.230 -1.511 1.00 0.00 H new ATOM 0 HG11 VAL A 33 19.606 -0.957 -2.814 1.00 0.00 H new ATOM 0 HG12 VAL A 33 18.566 0.111 -1.842 1.00 0.00 H new ATOM 0 HG13 VAL A 33 20.229 -0.236 -1.311 1.00 0.00 H new ATOM 0 HG21 VAL A 33 20.140 -3.236 -2.022 1.00 0.00 H new ATOM 0 HG22 VAL A 33 20.783 -2.607 -0.486 1.00 0.00 H new ATOM 0 HG23 VAL A 33 19.486 -3.826 -0.476 1.00 0.00 H new ATOM 482 N ARG A 34 17.311 0.400 1.492 1.00 0.00 N ATOM 483 CA ARG A 34 16.390 1.527 1.572 1.00 0.00 C ATOM 484 C ARG A 34 16.430 2.355 0.291 1.00 0.00 C ATOM 485 O ARG A 34 17.447 2.956 -0.057 1.00 0.00 O ATOM 486 CB ARG A 34 16.733 2.410 2.773 1.00 0.00 C ATOM 487 CG ARG A 34 15.532 3.132 3.361 1.00 0.00 C ATOM 488 CD ARG A 34 15.930 4.007 4.540 1.00 0.00 C ATOM 489 NE ARG A 34 16.447 3.219 5.656 1.00 0.00 N ATOM 490 CZ ARG A 34 16.908 3.754 6.781 1.00 0.00 C ATOM 491 NH1 ARG A 34 16.917 5.070 6.939 1.00 0.00 N ATOM 492 NH2 ARG A 34 17.361 2.971 7.752 1.00 0.00 N ATOM 0 H ARG A 34 17.802 0.194 2.362 1.00 0.00 H new ATOM 0 HA ARG A 34 15.382 1.131 1.697 1.00 0.00 H new ATOM 0 HB2 ARG A 34 17.191 1.794 3.547 1.00 0.00 H new ATOM 0 HB3 ARG A 34 17.477 3.147 2.471 1.00 0.00 H new ATOM 0 HG2 ARG A 34 15.063 3.747 2.592 1.00 0.00 H new ATOM 0 HG3 ARG A 34 14.789 2.402 3.683 1.00 0.00 H new ATOM 0 HD2 ARG A 34 16.687 4.723 4.221 1.00 0.00 H new ATOM 0 HD3 ARG A 34 15.066 4.583 4.872 1.00 0.00 H new ATOM 0 HE ARG A 34 16.454 2.203 5.567 1.00 0.00 H new ATOM 0 HH11 ARG A 34 16.569 5.675 6.195 1.00 0.00 H new ATOM 0 HH12 ARG A 34 17.272 5.477 7.804 1.00 0.00 H new ATOM 0 HH21 ARG A 34 17.355 1.958 7.635 1.00 0.00 H new ATOM 0 HH22 ARG A 34 17.715 3.382 8.616 1.00 0.00 H new ATOM 506 N PRO A 35 15.299 2.387 -0.429 1.00 0.00 N ATOM 507 CA PRO A 35 15.180 3.138 -1.683 1.00 0.00 C ATOM 508 C PRO A 35 15.197 4.646 -1.460 1.00 0.00 C ATOM 509 O PRO A 35 15.107 5.116 -0.326 1.00 0.00 O ATOM 510 CB PRO A 35 13.823 2.694 -2.234 1.00 0.00 C ATOM 511 CG PRO A 35 13.046 2.272 -1.035 1.00 0.00 C ATOM 512 CD PRO A 35 14.049 1.695 -0.075 1.00 0.00 C ATOM 0 HA PRO A 35 16.014 2.942 -2.357 1.00 0.00 H new ATOM 0 HB2 PRO A 35 13.325 3.507 -2.762 1.00 0.00 H new ATOM 0 HB3 PRO A 35 13.933 1.874 -2.943 1.00 0.00 H new ATOM 0 HG2 PRO A 35 12.523 3.119 -0.591 1.00 0.00 H new ATOM 0 HG3 PRO A 35 12.290 1.533 -1.300 1.00 0.00 H new ATOM 0 HD2 PRO A 35 13.766 1.881 0.961 1.00 0.00 H new ATOM 0 HD3 PRO A 35 14.141 0.615 -0.191 1.00 0.00 H new ATOM 520 N ALA A 36 15.312 5.400 -2.548 1.00 0.00 N ATOM 521 CA ALA A 36 15.338 6.855 -2.471 1.00 0.00 C ATOM 522 C ALA A 36 14.039 7.397 -1.886 1.00 0.00 C ATOM 523 O ALA A 36 14.050 8.138 -0.904 1.00 0.00 O ATOM 524 CB ALA A 36 15.589 7.452 -3.847 1.00 0.00 C ATOM 0 H ALA A 36 15.389 5.027 -3.494 1.00 0.00 H new ATOM 0 HA ALA A 36 16.153 7.144 -1.808 1.00 0.00 H new ATOM 0 HB1 ALA A 36 15.606 8.539 -3.774 1.00 0.00 H new ATOM 0 HB2 ALA A 36 16.547 7.099 -4.227 1.00 0.00 H new ATOM 0 HB3 ALA A 36 14.794 7.146 -4.527 1.00 0.00 H new ATOM 530 N GLY A 37 12.918 7.022 -2.497 1.00 0.00 N ATOM 531 CA GLY A 37 11.626 7.481 -2.023 1.00 0.00 C ATOM 532 C GLY A 37 10.553 6.417 -2.144 1.00 0.00 C ATOM 533 O GLY A 37 10.854 5.244 -2.366 1.00 0.00 O ATOM 0 H GLY A 37 12.883 6.409 -3.311 1.00 0.00 H new ATOM 0 HA2 GLY A 37 11.713 7.788 -0.981 1.00 0.00 H new ATOM 0 HA3 GLY A 37 11.326 8.362 -2.591 1.00 0.00 H new ATOM 537 N TYR A 38 9.298 6.826 -1.996 1.00 0.00 N ATOM 538 CA TYR A 38 8.176 5.899 -2.086 1.00 0.00 C ATOM 539 C TYR A 38 6.982 6.554 -2.773 1.00 0.00 C ATOM 540 O TYR A 38 6.851 7.778 -2.785 1.00 0.00 O ATOM 541 CB TYR A 38 7.774 5.414 -0.692 1.00 0.00 C ATOM 542 CG TYR A 38 8.561 4.213 -0.218 1.00 0.00 C ATOM 543 CD1 TYR A 38 8.356 2.958 -0.779 1.00 0.00 C ATOM 544 CD2 TYR A 38 9.510 4.333 0.790 1.00 0.00 C ATOM 545 CE1 TYR A 38 9.072 1.858 -0.349 1.00 0.00 C ATOM 546 CE2 TYR A 38 10.231 3.238 1.225 1.00 0.00 C ATOM 547 CZ TYR A 38 10.009 2.003 0.653 1.00 0.00 C ATOM 548 OH TYR A 38 10.725 0.910 1.083 1.00 0.00 O ATOM 0 H TYR A 38 9.032 7.794 -1.813 1.00 0.00 H new ATOM 0 HA TYR A 38 8.492 5.044 -2.683 1.00 0.00 H new ATOM 0 HB2 TYR A 38 7.907 6.229 0.019 1.00 0.00 H new ATOM 0 HB3 TYR A 38 6.713 5.164 -0.695 1.00 0.00 H new ATOM 0 HD1 TYR A 38 7.624 2.841 -1.565 1.00 0.00 H new ATOM 0 HD2 TYR A 38 9.687 5.298 1.241 1.00 0.00 H new ATOM 0 HE1 TYR A 38 8.899 0.890 -0.795 1.00 0.00 H new ATOM 0 HE2 TYR A 38 10.965 3.349 2.009 1.00 0.00 H new ATOM 0 HH TYR A 38 11.344 1.183 1.792 1.00 0.00 H new ATOM 558 N LEU A 39 6.111 5.729 -3.344 1.00 0.00 N ATOM 559 CA LEU A 39 4.925 6.225 -4.033 1.00 0.00 C ATOM 560 C LEU A 39 3.719 5.336 -3.752 1.00 0.00 C ATOM 561 O LEU A 39 3.627 4.217 -4.259 1.00 0.00 O ATOM 562 CB LEU A 39 5.179 6.298 -5.540 1.00 0.00 C ATOM 563 CG LEU A 39 4.213 7.169 -6.343 1.00 0.00 C ATOM 564 CD1 LEU A 39 4.656 8.624 -6.313 1.00 0.00 C ATOM 565 CD2 LEU A 39 4.110 6.670 -7.777 1.00 0.00 C ATOM 0 H LEU A 39 6.204 4.713 -3.343 1.00 0.00 H new ATOM 0 HA LEU A 39 4.710 7.226 -3.658 1.00 0.00 H new ATOM 0 HB2 LEU A 39 6.191 6.671 -5.700 1.00 0.00 H new ATOM 0 HB3 LEU A 39 5.145 5.286 -5.943 1.00 0.00 H new ATOM 0 HG LEU A 39 3.226 7.101 -5.885 1.00 0.00 H new ATOM 0 HD11 LEU A 39 3.957 9.229 -6.890 1.00 0.00 H new ATOM 0 HD12 LEU A 39 4.677 8.977 -5.282 1.00 0.00 H new ATOM 0 HD13 LEU A 39 5.653 8.710 -6.746 1.00 0.00 H new ATOM 0 HD21 LEU A 39 3.418 7.302 -8.333 1.00 0.00 H new ATOM 0 HD22 LEU A 39 5.093 6.707 -8.247 1.00 0.00 H new ATOM 0 HD23 LEU A 39 3.745 5.643 -7.780 1.00 0.00 H new ATOM 577 N LEU A 40 2.794 5.840 -2.942 1.00 0.00 N ATOM 578 CA LEU A 40 1.591 5.092 -2.594 1.00 0.00 C ATOM 579 C LEU A 40 0.406 5.542 -3.442 1.00 0.00 C ATOM 580 O LEU A 40 -0.113 6.644 -3.266 1.00 0.00 O ATOM 581 CB LEU A 40 1.268 5.269 -1.110 1.00 0.00 C ATOM 582 CG LEU A 40 0.058 4.492 -0.589 1.00 0.00 C ATOM 583 CD1 LEU A 40 0.460 3.078 -0.198 1.00 0.00 C ATOM 584 CD2 LEU A 40 -0.572 5.215 0.592 1.00 0.00 C ATOM 0 H LEU A 40 2.854 6.764 -2.514 1.00 0.00 H new ATOM 0 HA LEU A 40 1.778 4.037 -2.795 1.00 0.00 H new ATOM 0 HB2 LEU A 40 2.142 4.972 -0.531 1.00 0.00 H new ATOM 0 HB3 LEU A 40 1.104 6.329 -0.918 1.00 0.00 H new ATOM 0 HG LEU A 40 -0.681 4.430 -1.388 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -0.414 2.540 0.170 1.00 0.00 H new ATOM 0 HD12 LEU A 40 0.864 2.561 -1.068 1.00 0.00 H new ATOM 0 HD13 LEU A 40 1.218 3.118 0.584 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -1.431 4.648 0.950 1.00 0.00 H new ATOM 0 HD22 LEU A 40 0.160 5.309 1.394 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -0.897 6.208 0.280 1.00 0.00 H new ATOM 596 N SER A 41 -0.019 4.681 -4.362 1.00 0.00 N ATOM 597 CA SER A 41 -1.142 4.991 -5.238 1.00 0.00 C ATOM 598 C SER A 41 -2.390 4.223 -4.814 1.00 0.00 C ATOM 599 O SER A 41 -2.465 3.004 -4.968 1.00 0.00 O ATOM 600 CB SER A 41 -0.792 4.656 -6.689 1.00 0.00 C ATOM 601 OG SER A 41 -1.943 4.698 -7.515 1.00 0.00 O ATOM 0 H SER A 41 0.398 3.764 -4.519 1.00 0.00 H new ATOM 0 HA SER A 41 -1.349 6.058 -5.159 1.00 0.00 H new ATOM 0 HB2 SER A 41 -0.049 5.362 -7.059 1.00 0.00 H new ATOM 0 HB3 SER A 41 -0.342 3.665 -6.738 1.00 0.00 H new ATOM 0 HG SER A 41 -1.692 4.482 -8.437 1.00 0.00 H new ATOM 607 N PHE A 42 -3.368 4.946 -4.278 1.00 0.00 N ATOM 608 CA PHE A 42 -4.614 4.334 -3.830 1.00 0.00 C ATOM 609 C PHE A 42 -5.791 4.816 -4.673 1.00 0.00 C ATOM 610 O PHE A 42 -6.068 6.014 -4.745 1.00 0.00 O ATOM 611 CB PHE A 42 -4.863 4.655 -2.355 1.00 0.00 C ATOM 612 CG PHE A 42 -5.322 6.065 -2.118 1.00 0.00 C ATOM 613 CD1 PHE A 42 -4.450 7.129 -2.283 1.00 0.00 C ATOM 614 CD2 PHE A 42 -6.626 6.327 -1.730 1.00 0.00 C ATOM 615 CE1 PHE A 42 -4.870 8.428 -2.065 1.00 0.00 C ATOM 616 CE2 PHE A 42 -7.052 7.623 -1.510 1.00 0.00 C ATOM 617 CZ PHE A 42 -6.173 8.675 -1.679 1.00 0.00 C ATOM 0 H PHE A 42 -3.322 5.956 -4.143 1.00 0.00 H new ATOM 0 HA PHE A 42 -4.523 3.254 -3.949 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -5.612 3.967 -1.963 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -3.945 4.481 -1.793 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -3.430 6.941 -2.585 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -7.318 5.508 -1.598 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -4.180 9.249 -2.196 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -8.071 7.813 -1.206 1.00 0.00 H new ATOM 0 HZ PHE A 42 -6.504 9.689 -1.510 1.00 0.00 H new ATOM 627 N HIS A 43 -6.480 3.875 -5.310 1.00 0.00 N ATOM 628 CA HIS A 43 -7.628 4.203 -6.148 1.00 0.00 C ATOM 629 C HIS A 43 -8.782 3.238 -5.891 1.00 0.00 C ATOM 630 O HIS A 43 -8.581 2.134 -5.384 1.00 0.00 O ATOM 631 CB HIS A 43 -7.235 4.164 -7.625 1.00 0.00 C ATOM 632 CG HIS A 43 -7.355 2.804 -8.242 1.00 0.00 C ATOM 633 ND1 HIS A 43 -6.566 1.736 -7.869 1.00 0.00 N ATOM 634 CD2 HIS A 43 -8.181 2.340 -9.209 1.00 0.00 C ATOM 635 CE1 HIS A 43 -6.899 0.675 -8.582 1.00 0.00 C ATOM 636 NE2 HIS A 43 -7.877 1.015 -9.402 1.00 0.00 N ATOM 0 H HIS A 43 -6.264 2.879 -5.262 1.00 0.00 H new ATOM 0 HA HIS A 43 -7.957 5.211 -5.893 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -7.864 4.862 -8.178 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -6.207 4.511 -7.728 1.00 0.00 H new ATOM 0 HD2 HIS A 43 -8.938 2.906 -9.731 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -6.448 -0.304 -8.507 1.00 0.00 H new ATOM 0 HE2 HIS A 43 -8.333 0.394 -10.070 1.00 0.00 H new ATOM 645 N THR A 44 -9.991 3.663 -6.243 1.00 0.00 N ATOM 646 CA THR A 44 -11.177 2.838 -6.049 1.00 0.00 C ATOM 647 C THR A 44 -11.501 2.036 -7.304 1.00 0.00 C ATOM 648 O THR A 44 -11.190 2.439 -8.425 1.00 0.00 O ATOM 649 CB THR A 44 -12.401 3.694 -5.671 1.00 0.00 C ATOM 650 OG1 THR A 44 -13.058 4.160 -6.855 1.00 0.00 O ATOM 651 CG2 THR A 44 -11.987 4.882 -4.815 1.00 0.00 C ATOM 0 H THR A 44 -10.175 4.574 -6.664 1.00 0.00 H new ATOM 0 HA THR A 44 -10.955 2.153 -5.231 1.00 0.00 H new ATOM 0 HB THR A 44 -13.087 3.072 -5.096 1.00 0.00 H new ATOM 0 HG1 THR A 44 -13.836 4.702 -6.606 1.00 0.00 H new ATOM 0 HG21 THR A 44 -12.868 5.472 -4.561 1.00 0.00 H new ATOM 0 HG22 THR A 44 -11.513 4.524 -3.901 1.00 0.00 H new ATOM 0 HG23 THR A 44 -11.283 5.502 -5.370 1.00 0.00 H new ATOM 659 N PRO A 45 -12.140 0.872 -7.115 1.00 0.00 N ATOM 660 CA PRO A 45 -12.521 -0.011 -8.221 1.00 0.00 C ATOM 661 C PRO A 45 -13.640 0.578 -9.074 1.00 0.00 C ATOM 662 O PRO A 45 -14.054 -0.016 -10.068 1.00 0.00 O ATOM 663 CB PRO A 45 -13.001 -1.280 -7.513 1.00 0.00 C ATOM 664 CG PRO A 45 -13.443 -0.819 -6.167 1.00 0.00 C ATOM 665 CD PRO A 45 -12.542 0.329 -5.806 1.00 0.00 C ATOM 0 HA PRO A 45 -11.695 -0.178 -8.912 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -13.819 -1.752 -8.058 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -12.202 -2.017 -7.436 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -14.487 -0.505 -6.185 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -13.364 -1.622 -5.434 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -13.062 1.074 -5.204 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -11.680 -0.003 -5.227 1.00 0.00 H new ATOM 673 N GLY A 46 -14.125 1.751 -8.678 1.00 0.00 N ATOM 674 CA GLY A 46 -15.191 2.401 -9.418 1.00 0.00 C ATOM 675 C GLY A 46 -15.105 3.913 -9.352 1.00 0.00 C ATOM 676 O GLY A 46 -16.125 4.600 -9.343 1.00 0.00 O ATOM 0 H GLY A 46 -13.799 2.263 -7.858 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -15.152 2.083 -10.460 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -16.154 2.077 -9.022 1.00 0.00 H new ATOM 680 N GLY A 47 -13.882 4.433 -9.305 1.00 0.00 N ATOM 681 CA GLY A 47 -13.689 5.870 -9.239 1.00 0.00 C ATOM 682 C GLY A 47 -12.430 6.319 -9.953 1.00 0.00 C ATOM 683 O GLY A 47 -12.162 5.895 -11.077 1.00 0.00 O ATOM 0 H GLY A 47 -13.022 3.885 -9.311 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -14.551 6.370 -9.680 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -13.641 6.179 -8.195 1.00 0.00 H new ATOM 687 N GLN A 48 -11.657 7.181 -9.300 1.00 0.00 N ATOM 688 CA GLN A 48 -10.420 7.690 -9.882 1.00 0.00 C ATOM 689 C GLN A 48 -9.209 7.216 -9.086 1.00 0.00 C ATOM 690 O GLN A 48 -9.343 6.472 -8.114 1.00 0.00 O ATOM 691 CB GLN A 48 -10.447 9.218 -9.932 1.00 0.00 C ATOM 692 CG GLN A 48 -10.565 9.870 -8.564 1.00 0.00 C ATOM 693 CD GLN A 48 -11.199 11.246 -8.625 1.00 0.00 C ATOM 694 OE1 GLN A 48 -11.828 11.608 -9.619 1.00 0.00 O ATOM 695 NE2 GLN A 48 -11.035 12.021 -7.560 1.00 0.00 N ATOM 0 H GLN A 48 -11.865 7.541 -8.369 1.00 0.00 H new ATOM 0 HA GLN A 48 -10.338 7.302 -10.897 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -9.538 9.573 -10.417 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -11.285 9.538 -10.551 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -11.158 9.230 -7.911 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -9.574 9.950 -8.118 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -10.506 11.680 -6.758 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -11.438 12.958 -7.544 1.00 0.00 H new ATOM 704 N THR A 49 -8.024 7.652 -9.505 1.00 0.00 N ATOM 705 CA THR A 49 -6.789 7.271 -8.833 1.00 0.00 C ATOM 706 C THR A 49 -6.034 8.498 -8.333 1.00 0.00 C ATOM 707 O THR A 49 -5.927 9.501 -9.037 1.00 0.00 O ATOM 708 CB THR A 49 -5.868 6.461 -9.765 1.00 0.00 C ATOM 709 OG1 THR A 49 -6.517 5.248 -10.162 1.00 0.00 O ATOM 710 CG2 THR A 49 -4.551 6.136 -9.076 1.00 0.00 C ATOM 0 H THR A 49 -7.895 8.269 -10.307 1.00 0.00 H new ATOM 0 HA THR A 49 -7.071 6.649 -7.983 1.00 0.00 H new ATOM 0 HB THR A 49 -5.658 7.066 -10.647 1.00 0.00 H new ATOM 0 HG1 THR A 49 -5.926 4.740 -10.755 1.00 0.00 H new ATOM 0 HG21 THR A 49 -3.917 5.564 -9.754 1.00 0.00 H new ATOM 0 HG22 THR A 49 -4.046 7.062 -8.802 1.00 0.00 H new ATOM 0 HG23 THR A 49 -4.745 5.549 -8.178 1.00 0.00 H new ATOM 718 N GLN A 50 -5.514 8.410 -7.113 1.00 0.00 N ATOM 719 CA GLN A 50 -4.769 9.514 -6.520 1.00 0.00 C ATOM 720 C GLN A 50 -3.350 9.084 -6.162 1.00 0.00 C ATOM 721 O GLN A 50 -3.115 7.935 -5.791 1.00 0.00 O ATOM 722 CB GLN A 50 -5.488 10.030 -5.272 1.00 0.00 C ATOM 723 CG GLN A 50 -4.840 11.261 -4.661 1.00 0.00 C ATOM 724 CD GLN A 50 -5.373 12.554 -5.247 1.00 0.00 C ATOM 725 OE1 GLN A 50 -4.632 13.324 -5.858 1.00 0.00 O ATOM 726 NE2 GLN A 50 -6.665 12.798 -5.064 1.00 0.00 N ATOM 0 H GLN A 50 -5.595 7.586 -6.517 1.00 0.00 H new ATOM 0 HA GLN A 50 -4.711 10.316 -7.256 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -6.521 10.263 -5.529 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -5.517 9.236 -4.525 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -5.008 11.258 -3.584 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -3.762 11.214 -4.816 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -7.242 12.132 -4.551 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -7.081 13.652 -5.436 1.00 0.00 H new ATOM 735 N GLU A 51 -2.408 10.016 -6.276 1.00 0.00 N ATOM 736 CA GLU A 51 -1.012 9.731 -5.966 1.00 0.00 C ATOM 737 C GLU A 51 -0.556 10.519 -4.741 1.00 0.00 C ATOM 738 O GLU A 51 -0.930 11.678 -4.561 1.00 0.00 O ATOM 739 CB GLU A 51 -0.122 10.068 -7.164 1.00 0.00 C ATOM 740 CG GLU A 51 -0.325 9.144 -8.353 1.00 0.00 C ATOM 741 CD GLU A 51 0.186 9.741 -9.650 1.00 0.00 C ATOM 742 OE1 GLU A 51 -0.480 10.652 -10.185 1.00 0.00 O ATOM 743 OE2 GLU A 51 1.250 9.297 -10.129 1.00 0.00 O ATOM 0 H GLU A 51 -2.586 10.973 -6.580 1.00 0.00 H new ATOM 0 HA GLU A 51 -0.924 8.667 -5.746 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -0.319 11.094 -7.475 1.00 0.00 H new ATOM 0 HB3 GLU A 51 0.922 10.023 -6.854 1.00 0.00 H new ATOM 0 HG2 GLU A 51 0.186 8.200 -8.166 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -1.386 8.917 -8.455 1.00 0.00 H new ATOM 750 N ILE A 52 0.254 9.881 -3.903 1.00 0.00 N ATOM 751 CA ILE A 52 0.762 10.521 -2.697 1.00 0.00 C ATOM 752 C ILE A 52 2.245 10.224 -2.499 1.00 0.00 C ATOM 753 O ILE A 52 2.688 9.086 -2.656 1.00 0.00 O ATOM 754 CB ILE A 52 -0.013 10.063 -1.447 1.00 0.00 C ATOM 755 CG1 ILE A 52 -1.499 10.393 -1.592 1.00 0.00 C ATOM 756 CG2 ILE A 52 0.561 10.716 -0.199 1.00 0.00 C ATOM 757 CD1 ILE A 52 -2.303 10.126 -0.339 1.00 0.00 C ATOM 0 H ILE A 52 0.572 8.921 -4.037 1.00 0.00 H new ATOM 0 HA ILE A 52 0.623 11.594 -2.828 1.00 0.00 H new ATOM 0 HB ILE A 52 0.092 8.983 -1.349 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -1.605 11.443 -1.865 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -1.914 9.807 -2.412 1.00 0.00 H new ATOM 0 HG21 ILE A 52 0.003 10.382 0.676 1.00 0.00 H new ATOM 0 HG22 ILE A 52 1.608 10.435 -0.090 1.00 0.00 H new ATOM 0 HG23 ILE A 52 0.484 11.800 -0.287 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -3.348 10.383 -0.515 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -2.228 9.071 -0.077 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -1.914 10.732 0.479 1.00 0.00 H new ATOM 769 N LEU A 53 3.008 11.255 -2.151 1.00 0.00 N ATOM 770 CA LEU A 53 4.442 11.105 -1.930 1.00 0.00 C ATOM 771 C LEU A 53 4.720 10.506 -0.555 1.00 0.00 C ATOM 772 O LEU A 53 4.344 11.075 0.470 1.00 0.00 O ATOM 773 CB LEU A 53 5.142 12.458 -2.060 1.00 0.00 C ATOM 774 CG LEU A 53 5.546 12.871 -3.476 1.00 0.00 C ATOM 775 CD1 LEU A 53 6.398 11.792 -4.125 1.00 0.00 C ATOM 776 CD2 LEU A 53 4.313 13.158 -4.320 1.00 0.00 C ATOM 0 H LEU A 53 2.657 12.203 -2.016 1.00 0.00 H new ATOM 0 HA LEU A 53 4.833 10.426 -2.688 1.00 0.00 H new ATOM 0 HB2 LEU A 53 4.484 13.226 -1.653 1.00 0.00 H new ATOM 0 HB3 LEU A 53 6.037 12.443 -1.438 1.00 0.00 H new ATOM 0 HG LEU A 53 6.139 13.783 -3.412 1.00 0.00 H new ATOM 0 HD11 LEU A 53 6.676 12.104 -5.132 1.00 0.00 H new ATOM 0 HD12 LEU A 53 7.299 11.635 -3.532 1.00 0.00 H new ATOM 0 HD13 LEU A 53 5.831 10.863 -4.177 1.00 0.00 H new ATOM 0 HD21 LEU A 53 4.620 13.450 -5.324 1.00 0.00 H new ATOM 0 HD22 LEU A 53 3.694 12.263 -4.376 1.00 0.00 H new ATOM 0 HD23 LEU A 53 3.741 13.967 -3.865 1.00 0.00 H new ATOM 788 N LEU A 54 5.384 9.355 -0.540 1.00 0.00 N ATOM 789 CA LEU A 54 5.716 8.679 0.709 1.00 0.00 C ATOM 790 C LEU A 54 7.216 8.745 0.982 1.00 0.00 C ATOM 791 O LEU A 54 8.042 8.419 0.129 1.00 0.00 O ATOM 792 CB LEU A 54 5.259 7.220 0.660 1.00 0.00 C ATOM 793 CG LEU A 54 3.795 6.963 1.019 1.00 0.00 C ATOM 794 CD1 LEU A 54 3.630 6.832 2.525 1.00 0.00 C ATOM 795 CD2 LEU A 54 2.910 8.077 0.479 1.00 0.00 C ATOM 0 H LEU A 54 5.703 8.871 -1.379 1.00 0.00 H new ATOM 0 HA LEU A 54 5.195 9.189 1.519 1.00 0.00 H new ATOM 0 HB2 LEU A 54 5.438 6.837 -0.345 1.00 0.00 H new ATOM 0 HB3 LEU A 54 5.886 6.641 1.338 1.00 0.00 H new ATOM 0 HG LEU A 54 3.487 6.025 0.557 1.00 0.00 H new ATOM 0 HD11 LEU A 54 2.582 6.649 2.762 1.00 0.00 H new ATOM 0 HD12 LEU A 54 4.234 6.000 2.886 1.00 0.00 H new ATOM 0 HD13 LEU A 54 3.956 7.753 3.008 1.00 0.00 H new ATOM 0 HD21 LEU A 54 1.872 7.878 0.744 1.00 0.00 H new ATOM 0 HD22 LEU A 54 3.218 9.029 0.912 1.00 0.00 H new ATOM 0 HD23 LEU A 54 3.005 8.124 -0.606 1.00 0.00 H new ATOM 807 N PRO A 55 7.577 9.175 2.200 1.00 0.00 N ATOM 808 CA PRO A 55 8.978 9.290 2.615 1.00 0.00 C ATOM 809 C PRO A 55 9.646 7.930 2.789 1.00 0.00 C ATOM 810 O PRO A 55 9.013 6.890 2.613 1.00 0.00 O ATOM 811 CB PRO A 55 8.892 10.019 3.958 1.00 0.00 C ATOM 812 CG PRO A 55 7.532 9.699 4.476 1.00 0.00 C ATOM 813 CD PRO A 55 6.646 9.580 3.266 1.00 0.00 C ATOM 0 HA PRO A 55 9.581 9.809 1.870 1.00 0.00 H new ATOM 0 HB2 PRO A 55 9.667 9.678 4.644 1.00 0.00 H new ATOM 0 HB3 PRO A 55 9.026 11.094 3.834 1.00 0.00 H new ATOM 0 HG2 PRO A 55 7.540 8.770 5.047 1.00 0.00 H new ATOM 0 HG3 PRO A 55 7.175 10.482 5.146 1.00 0.00 H new ATOM 0 HD2 PRO A 55 5.860 8.840 3.415 1.00 0.00 H new ATOM 0 HD3 PRO A 55 6.155 10.525 3.033 1.00 0.00 H new ATOM 821 N GLY A 56 10.929 7.946 3.137 1.00 0.00 N ATOM 822 CA GLY A 56 11.660 6.708 3.330 1.00 0.00 C ATOM 823 C GLY A 56 11.994 6.452 4.786 1.00 0.00 C ATOM 824 O GLY A 56 12.780 7.183 5.388 1.00 0.00 O ATOM 0 H GLY A 56 11.475 8.794 3.289 1.00 0.00 H new ATOM 0 HA2 GLY A 56 11.069 5.877 2.945 1.00 0.00 H new ATOM 0 HA3 GLY A 56 12.582 6.740 2.749 1.00 0.00 H new ATOM 828 N GLY A 57 11.394 5.411 5.356 1.00 0.00 N ATOM 829 CA GLY A 57 11.644 5.081 6.747 1.00 0.00 C ATOM 830 C GLY A 57 10.428 5.306 7.623 1.00 0.00 C ATOM 831 O GLY A 57 10.522 5.935 8.677 1.00 0.00 O ATOM 0 H GLY A 57 10.740 4.791 4.879 1.00 0.00 H new ATOM 0 HA2 GLY A 57 11.953 4.038 6.820 1.00 0.00 H new ATOM 0 HA3 GLY A 57 12.472 5.685 7.118 1.00 0.00 H new ATOM 835 N ILE A 58 9.283 4.792 7.187 1.00 0.00 N ATOM 836 CA ILE A 58 8.043 4.941 7.939 1.00 0.00 C ATOM 837 C ILE A 58 7.319 3.606 8.075 1.00 0.00 C ATOM 838 O ILE A 58 6.679 3.334 9.091 1.00 0.00 O ATOM 839 CB ILE A 58 7.099 5.959 7.273 1.00 0.00 C ATOM 840 CG1 ILE A 58 6.721 5.492 5.866 1.00 0.00 C ATOM 841 CG2 ILE A 58 7.751 7.332 7.223 1.00 0.00 C ATOM 842 CD1 ILE A 58 5.758 6.420 5.160 1.00 0.00 C ATOM 0 H ILE A 58 9.188 4.269 6.317 1.00 0.00 H new ATOM 0 HA ILE A 58 8.316 5.306 8.929 1.00 0.00 H new ATOM 0 HB ILE A 58 6.189 6.032 7.868 1.00 0.00 H new ATOM 0 HG12 ILE A 58 7.627 5.398 5.267 1.00 0.00 H new ATOM 0 HG13 ILE A 58 6.276 4.499 5.929 1.00 0.00 H new ATOM 0 HG21 ILE A 58 7.071 8.040 6.749 1.00 0.00 H new ATOM 0 HG22 ILE A 58 7.975 7.666 8.236 1.00 0.00 H new ATOM 0 HG23 ILE A 58 8.675 7.275 6.647 1.00 0.00 H new ATOM 0 HD11 ILE A 58 5.534 6.027 4.168 1.00 0.00 H new ATOM 0 HD12 ILE A 58 4.836 6.495 5.737 1.00 0.00 H new ATOM 0 HD13 ILE A 58 6.208 7.408 5.065 1.00 0.00 H new ATOM 854 N THR A 59 7.425 2.773 7.044 1.00 0.00 N ATOM 855 CA THR A 59 6.781 1.466 7.047 1.00 0.00 C ATOM 856 C THR A 59 5.375 1.547 7.632 1.00 0.00 C ATOM 857 O THR A 59 4.847 0.559 8.142 1.00 0.00 O ATOM 858 CB THR A 59 7.600 0.438 7.850 1.00 0.00 C ATOM 859 OG1 THR A 59 7.695 0.848 9.219 1.00 0.00 O ATOM 860 CG2 THR A 59 8.996 0.283 7.264 1.00 0.00 C ATOM 0 H THR A 59 7.952 2.981 6.196 1.00 0.00 H new ATOM 0 HA THR A 59 6.721 1.141 6.008 1.00 0.00 H new ATOM 0 HB THR A 59 7.090 -0.524 7.794 1.00 0.00 H new ATOM 0 HG1 THR A 59 7.095 1.607 9.376 1.00 0.00 H new ATOM 0 HG21 THR A 59 9.556 -0.448 7.847 1.00 0.00 H new ATOM 0 HG22 THR A 59 8.921 -0.057 6.231 1.00 0.00 H new ATOM 0 HG23 THR A 59 9.512 1.243 7.293 1.00 0.00 H new ATOM 868 N SER A 60 4.774 2.730 7.555 1.00 0.00 N ATOM 869 CA SER A 60 3.430 2.940 8.080 1.00 0.00 C ATOM 870 C SER A 60 2.920 4.334 7.725 1.00 0.00 C ATOM 871 O SER A 60 3.623 5.329 7.903 1.00 0.00 O ATOM 872 CB SER A 60 3.418 2.752 9.598 1.00 0.00 C ATOM 873 OG SER A 60 4.385 3.579 10.222 1.00 0.00 O ATOM 0 H SER A 60 5.197 3.558 7.134 1.00 0.00 H new ATOM 0 HA SER A 60 2.769 2.203 7.624 1.00 0.00 H new ATOM 0 HB2 SER A 60 2.428 2.986 9.989 1.00 0.00 H new ATOM 0 HB3 SER A 60 3.617 1.708 9.840 1.00 0.00 H new ATOM 0 HG SER A 60 5.280 3.214 10.062 1.00 0.00 H new ATOM 879 N HIS A 61 1.692 4.396 7.220 1.00 0.00 N ATOM 880 CA HIS A 61 1.086 5.667 6.839 1.00 0.00 C ATOM 881 C HIS A 61 -0.423 5.638 7.065 1.00 0.00 C ATOM 882 O HIS A 61 -1.058 4.592 6.940 1.00 0.00 O ATOM 883 CB HIS A 61 1.389 5.982 5.374 1.00 0.00 C ATOM 884 CG HIS A 61 1.504 7.448 5.088 1.00 0.00 C ATOM 885 ND1 HIS A 61 0.817 8.072 4.069 1.00 0.00 N ATOM 886 CD2 HIS A 61 2.232 8.414 5.697 1.00 0.00 C ATOM 887 CE1 HIS A 61 1.118 9.359 4.061 1.00 0.00 C ATOM 888 NE2 HIS A 61 1.974 9.592 5.039 1.00 0.00 N ATOM 0 H HIS A 61 1.097 3.582 7.065 1.00 0.00 H new ATOM 0 HA HIS A 61 1.515 6.449 7.466 1.00 0.00 H new ATOM 0 HB2 HIS A 61 2.320 5.491 5.090 1.00 0.00 H new ATOM 0 HB3 HIS A 61 0.602 5.559 4.750 1.00 0.00 H new ATOM 0 HD2 HIS A 61 2.892 8.283 6.542 1.00 0.00 H new ATOM 0 HE1 HIS A 61 0.730 10.095 3.372 1.00 0.00 H new ATOM 0 HE2 HIS A 61 2.378 10.500 5.269 1.00 0.00 H new ATOM 897 N GLN A 62 -0.989 6.794 7.396 1.00 0.00 N ATOM 898 CA GLN A 62 -2.423 6.900 7.640 1.00 0.00 C ATOM 899 C GLN A 62 -3.121 7.606 6.482 1.00 0.00 C ATOM 900 O GLN A 62 -2.873 8.783 6.218 1.00 0.00 O ATOM 901 CB GLN A 62 -2.686 7.653 8.945 1.00 0.00 C ATOM 902 CG GLN A 62 -4.161 7.888 9.226 1.00 0.00 C ATOM 903 CD GLN A 62 -4.847 6.664 9.800 1.00 0.00 C ATOM 904 OE1 GLN A 62 -4.928 6.497 11.018 1.00 0.00 O ATOM 905 NE2 GLN A 62 -5.347 5.800 8.925 1.00 0.00 N ATOM 0 H GLN A 62 -0.477 7.670 7.501 1.00 0.00 H new ATOM 0 HA GLN A 62 -2.827 5.891 7.724 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -2.252 7.091 9.772 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -2.174 8.615 8.909 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -4.266 8.719 9.923 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -4.661 8.181 8.303 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -5.257 5.978 7.925 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -5.821 4.958 9.253 1.00 0.00 H new ATOM 914 N LEU A 63 -3.995 6.880 5.794 1.00 0.00 N ATOM 915 CA LEU A 63 -4.730 7.436 4.664 1.00 0.00 C ATOM 916 C LEU A 63 -6.012 8.118 5.130 1.00 0.00 C ATOM 917 O LEU A 63 -6.850 7.504 5.792 1.00 0.00 O ATOM 918 CB LEU A 63 -5.063 6.335 3.655 1.00 0.00 C ATOM 919 CG LEU A 63 -3.885 5.785 2.849 1.00 0.00 C ATOM 920 CD1 LEU A 63 -4.264 4.474 2.178 1.00 0.00 C ATOM 921 CD2 LEU A 63 -3.425 6.802 1.815 1.00 0.00 C ATOM 0 H LEU A 63 -4.212 5.905 5.999 1.00 0.00 H new ATOM 0 HA LEU A 63 -4.097 8.182 4.183 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -5.529 5.508 4.191 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -5.806 6.722 2.957 1.00 0.00 H new ATOM 0 HG LEU A 63 -3.059 5.594 3.534 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -3.414 4.097 1.609 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -4.544 3.744 2.938 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -5.106 4.639 1.506 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -2.586 6.394 1.251 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -4.246 7.025 1.134 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -3.113 7.717 2.318 1.00 0.00 H new ATOM 933 N LEU A 64 -6.160 9.391 4.779 1.00 0.00 N ATOM 934 CA LEU A 64 -7.342 10.157 5.159 1.00 0.00 C ATOM 935 C LEU A 64 -8.264 10.366 3.963 1.00 0.00 C ATOM 936 O LEU A 64 -7.805 10.569 2.840 1.00 0.00 O ATOM 937 CB LEU A 64 -6.931 11.510 5.743 1.00 0.00 C ATOM 938 CG LEU A 64 -5.923 11.467 6.892 1.00 0.00 C ATOM 939 CD1 LEU A 64 -5.441 12.869 7.232 1.00 0.00 C ATOM 940 CD2 LEU A 64 -6.537 10.801 8.115 1.00 0.00 C ATOM 0 H LEU A 64 -5.476 9.914 4.232 1.00 0.00 H new ATOM 0 HA LEU A 64 -7.883 9.590 5.916 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -6.511 12.117 4.941 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -7.829 12.020 6.093 1.00 0.00 H new ATOM 0 HG LEU A 64 -5.064 10.877 6.574 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -4.724 12.819 8.052 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -4.962 13.311 6.358 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -6.291 13.484 7.530 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -5.806 10.779 8.923 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -7.414 11.364 8.434 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -6.832 9.782 7.865 1.00 0.00 H new ATOM 952 N GLY A 65 -9.570 10.316 4.212 1.00 0.00 N ATOM 953 CA GLY A 65 -10.536 10.504 3.146 1.00 0.00 C ATOM 954 C GLY A 65 -10.921 9.200 2.476 1.00 0.00 C ATOM 955 O GLY A 65 -10.634 8.990 1.296 1.00 0.00 O ATOM 0 H GLY A 65 -9.975 10.149 5.133 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -11.430 10.979 3.550 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -10.123 11.184 2.401 1.00 0.00 H new ATOM 959 N LEU A 66 -11.571 8.319 3.229 1.00 0.00 N ATOM 960 CA LEU A 66 -11.994 7.026 2.702 1.00 0.00 C ATOM 961 C LEU A 66 -13.510 6.874 2.787 1.00 0.00 C ATOM 962 O LEU A 66 -14.194 7.699 3.392 1.00 0.00 O ATOM 963 CB LEU A 66 -11.312 5.892 3.469 1.00 0.00 C ATOM 964 CG LEU A 66 -9.788 5.971 3.568 1.00 0.00 C ATOM 965 CD1 LEU A 66 -9.244 4.792 4.360 1.00 0.00 C ATOM 966 CD2 LEU A 66 -9.165 6.016 2.180 1.00 0.00 C ATOM 0 H LEU A 66 -11.817 8.477 4.206 1.00 0.00 H new ATOM 0 HA LEU A 66 -11.700 6.974 1.654 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -11.721 5.866 4.479 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -11.577 4.948 2.993 1.00 0.00 H new ATOM 0 HG LEU A 66 -9.524 6.889 4.093 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -8.158 4.864 4.420 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -9.665 4.804 5.365 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -9.519 3.862 3.863 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -8.080 6.072 2.270 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -9.437 5.116 1.630 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -9.531 6.893 1.645 1.00 0.00 H new ATOM 978 N PHE A 67 -14.027 5.812 2.178 1.00 0.00 N ATOM 979 CA PHE A 67 -15.462 5.550 2.186 1.00 0.00 C ATOM 980 C PHE A 67 -15.788 4.334 3.047 1.00 0.00 C ATOM 981 O PHE A 67 -15.016 3.378 3.135 1.00 0.00 O ATOM 982 CB PHE A 67 -15.969 5.330 0.759 1.00 0.00 C ATOM 983 CG PHE A 67 -15.881 6.555 -0.104 1.00 0.00 C ATOM 984 CD1 PHE A 67 -16.263 7.794 0.386 1.00 0.00 C ATOM 985 CD2 PHE A 67 -15.415 6.469 -1.406 1.00 0.00 C ATOM 986 CE1 PHE A 67 -16.184 8.923 -0.407 1.00 0.00 C ATOM 987 CE2 PHE A 67 -15.333 7.595 -2.204 1.00 0.00 C ATOM 988 CZ PHE A 67 -15.717 8.824 -1.703 1.00 0.00 C ATOM 0 H PHE A 67 -13.474 5.119 1.673 1.00 0.00 H new ATOM 0 HA PHE A 67 -15.963 6.419 2.612 1.00 0.00 H new ATOM 0 HB2 PHE A 67 -15.393 4.528 0.297 1.00 0.00 H new ATOM 0 HB3 PHE A 67 -17.006 4.996 0.798 1.00 0.00 H new ATOM 0 HD1 PHE A 67 -16.627 7.878 1.399 1.00 0.00 H new ATOM 0 HD2 PHE A 67 -15.112 5.511 -1.802 1.00 0.00 H new ATOM 0 HE1 PHE A 67 -16.487 9.882 -0.014 1.00 0.00 H new ATOM 0 HE2 PHE A 67 -14.969 7.514 -3.218 1.00 0.00 H new ATOM 0 HZ PHE A 67 -15.652 9.706 -2.324 1.00 0.00 H new ATOM 998 N PRO A 68 -16.959 4.369 3.700 1.00 0.00 N ATOM 999 CA PRO A 68 -17.415 3.278 4.567 1.00 0.00 C ATOM 1000 C PRO A 68 -17.780 2.025 3.778 1.00 0.00 C ATOM 1001 O PRO A 68 -18.648 2.060 2.906 1.00 0.00 O ATOM 1002 CB PRO A 68 -18.655 3.861 5.249 1.00 0.00 C ATOM 1003 CG PRO A 68 -19.150 4.903 4.307 1.00 0.00 C ATOM 1004 CD PRO A 68 -17.928 5.475 3.643 1.00 0.00 C ATOM 0 HA PRO A 68 -16.639 2.959 5.263 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -19.409 3.093 5.422 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -18.408 4.290 6.220 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -19.829 4.473 3.571 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -19.704 5.677 4.838 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -18.133 5.777 2.616 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -17.562 6.357 4.168 1.00 0.00 H new ATOM 1012 N SER A 69 -17.113 0.919 4.091 1.00 0.00 N ATOM 1013 CA SER A 69 -17.365 -0.345 3.408 1.00 0.00 C ATOM 1014 C SER A 69 -16.987 -0.251 1.933 1.00 0.00 C ATOM 1015 O SER A 69 -17.651 -0.827 1.071 1.00 0.00 O ATOM 1016 CB SER A 69 -18.838 -0.737 3.545 1.00 0.00 C ATOM 1017 OG SER A 69 -19.075 -2.024 3.000 1.00 0.00 O ATOM 0 H SER A 69 -16.394 0.872 4.813 1.00 0.00 H new ATOM 0 HA SER A 69 -16.747 -1.112 3.875 1.00 0.00 H new ATOM 0 HB2 SER A 69 -19.125 -0.725 4.597 1.00 0.00 H new ATOM 0 HB3 SER A 69 -19.462 -0.002 3.036 1.00 0.00 H new ATOM 0 HG SER A 69 -18.761 -2.049 2.072 1.00 0.00 H new ATOM 1023 N THR A 70 -15.913 0.480 1.650 1.00 0.00 N ATOM 1024 CA THR A 70 -15.446 0.652 0.280 1.00 0.00 C ATOM 1025 C THR A 70 -14.082 0.001 0.079 1.00 0.00 C ATOM 1026 O THR A 70 -13.156 0.224 0.859 1.00 0.00 O ATOM 1027 CB THR A 70 -15.352 2.142 -0.099 1.00 0.00 C ATOM 1028 OG1 THR A 70 -16.657 2.732 -0.092 1.00 0.00 O ATOM 1029 CG2 THR A 70 -14.721 2.312 -1.472 1.00 0.00 C ATOM 0 H THR A 70 -15.351 0.962 2.351 1.00 0.00 H new ATOM 0 HA THR A 70 -16.177 0.166 -0.367 1.00 0.00 H new ATOM 0 HB THR A 70 -14.723 2.643 0.637 1.00 0.00 H new ATOM 0 HG1 THR A 70 -16.799 3.222 -0.929 1.00 0.00 H new ATOM 0 HG21 THR A 70 -14.665 3.372 -1.718 1.00 0.00 H new ATOM 0 HG22 THR A 70 -13.717 1.888 -1.466 1.00 0.00 H new ATOM 0 HG23 THR A 70 -15.328 1.798 -2.217 1.00 0.00 H new ATOM 1037 N SER A 71 -13.964 -0.803 -0.972 1.00 0.00 N ATOM 1038 CA SER A 71 -12.713 -1.489 -1.274 1.00 0.00 C ATOM 1039 C SER A 71 -11.717 -0.538 -1.930 1.00 0.00 C ATOM 1040 O SER A 71 -12.086 0.281 -2.772 1.00 0.00 O ATOM 1041 CB SER A 71 -12.971 -2.687 -2.190 1.00 0.00 C ATOM 1042 OG SER A 71 -11.781 -3.423 -2.415 1.00 0.00 O ATOM 0 H SER A 71 -14.720 -0.996 -1.629 1.00 0.00 H new ATOM 0 HA SER A 71 -12.287 -1.844 -0.336 1.00 0.00 H new ATOM 0 HB2 SER A 71 -13.724 -3.335 -1.742 1.00 0.00 H new ATOM 0 HB3 SER A 71 -13.374 -2.341 -3.142 1.00 0.00 H new ATOM 0 HG SER A 71 -11.973 -4.184 -3.002 1.00 0.00 H new ATOM 1048 N TYR A 72 -10.453 -0.652 -1.539 1.00 0.00 N ATOM 1049 CA TYR A 72 -9.403 0.198 -2.086 1.00 0.00 C ATOM 1050 C TYR A 72 -8.184 -0.629 -2.483 1.00 0.00 C ATOM 1051 O TYR A 72 -7.933 -1.694 -1.922 1.00 0.00 O ATOM 1052 CB TYR A 72 -8.999 1.266 -1.068 1.00 0.00 C ATOM 1053 CG TYR A 72 -9.968 2.424 -0.989 1.00 0.00 C ATOM 1054 CD1 TYR A 72 -11.058 2.386 -0.128 1.00 0.00 C ATOM 1055 CD2 TYR A 72 -9.793 3.556 -1.775 1.00 0.00 C ATOM 1056 CE1 TYR A 72 -11.946 3.442 -0.053 1.00 0.00 C ATOM 1057 CE2 TYR A 72 -10.675 4.617 -1.705 1.00 0.00 C ATOM 1058 CZ TYR A 72 -11.750 4.555 -0.843 1.00 0.00 C ATOM 1059 OH TYR A 72 -12.631 5.609 -0.772 1.00 0.00 O ATOM 0 H TYR A 72 -10.130 -1.326 -0.844 1.00 0.00 H new ATOM 0 HA TYR A 72 -9.795 0.686 -2.978 1.00 0.00 H new ATOM 0 HB2 TYR A 72 -8.916 0.805 -0.084 1.00 0.00 H new ATOM 0 HB3 TYR A 72 -8.011 1.647 -1.326 1.00 0.00 H new ATOM 0 HD1 TYR A 72 -11.214 1.516 0.493 1.00 0.00 H new ATOM 0 HD2 TYR A 72 -8.953 3.607 -2.452 1.00 0.00 H new ATOM 0 HE1 TYR A 72 -12.789 3.396 0.621 1.00 0.00 H new ATOM 0 HE2 TYR A 72 -10.524 5.490 -2.322 1.00 0.00 H new ATOM 0 HH TYR A 72 -13.515 5.318 -1.080 1.00 0.00 H new ATOM 1069 N ASN A 73 -7.428 -0.128 -3.455 1.00 0.00 N ATOM 1070 CA ASN A 73 -6.235 -0.819 -3.929 1.00 0.00 C ATOM 1071 C ASN A 73 -5.000 0.065 -3.782 1.00 0.00 C ATOM 1072 O ASN A 73 -4.825 1.032 -4.523 1.00 0.00 O ATOM 1073 CB ASN A 73 -6.407 -1.235 -5.391 1.00 0.00 C ATOM 1074 CG ASN A 73 -5.424 -2.312 -5.806 1.00 0.00 C ATOM 1075 OD1 ASN A 73 -5.081 -3.192 -5.016 1.00 0.00 O ATOM 1076 ND2 ASN A 73 -4.965 -2.247 -7.050 1.00 0.00 N ATOM 0 H ASN A 73 -7.621 0.754 -3.929 1.00 0.00 H new ATOM 0 HA ASN A 73 -6.096 -1.711 -3.319 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -7.424 -1.596 -5.546 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -6.278 -0.363 -6.032 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -4.300 -2.944 -7.385 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -5.277 -1.500 -7.670 1.00 0.00 H new ATOM 1083 N ALA A 74 -4.146 -0.274 -2.822 1.00 0.00 N ATOM 1084 CA ALA A 74 -2.927 0.487 -2.580 1.00 0.00 C ATOM 1085 C ALA A 74 -1.740 -0.130 -3.312 1.00 0.00 C ATOM 1086 O ALA A 74 -1.702 -1.339 -3.544 1.00 0.00 O ATOM 1087 CB ALA A 74 -2.644 0.569 -1.087 1.00 0.00 C ATOM 0 H ALA A 74 -4.276 -1.071 -2.199 1.00 0.00 H new ATOM 0 HA ALA A 74 -3.075 1.495 -2.967 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -1.731 1.140 -0.921 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -3.477 1.062 -0.585 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -2.522 -0.436 -0.684 1.00 0.00 H new ATOM 1093 N ARG A 75 -0.774 0.707 -3.675 1.00 0.00 N ATOM 1094 CA ARG A 75 0.413 0.243 -4.383 1.00 0.00 C ATOM 1095 C ARG A 75 1.655 0.993 -3.910 1.00 0.00 C ATOM 1096 O ARG A 75 1.838 2.171 -4.219 1.00 0.00 O ATOM 1097 CB ARG A 75 0.237 0.426 -5.891 1.00 0.00 C ATOM 1098 CG ARG A 75 1.385 -0.139 -6.711 1.00 0.00 C ATOM 1099 CD ARG A 75 1.173 0.090 -8.200 1.00 0.00 C ATOM 1100 NE ARG A 75 -0.017 -0.598 -8.695 1.00 0.00 N ATOM 1101 CZ ARG A 75 -0.368 -0.629 -9.976 1.00 0.00 C ATOM 1102 NH1 ARG A 75 0.376 -0.015 -10.885 1.00 0.00 N ATOM 1103 NH2 ARG A 75 -1.465 -1.276 -10.349 1.00 0.00 N ATOM 0 H ARG A 75 -0.790 1.710 -3.491 1.00 0.00 H new ATOM 0 HA ARG A 75 0.545 -0.817 -4.166 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -0.691 -0.055 -6.201 1.00 0.00 H new ATOM 0 HB3 ARG A 75 0.134 1.489 -6.110 1.00 0.00 H new ATOM 0 HG2 ARG A 75 2.320 0.327 -6.400 1.00 0.00 H new ATOM 0 HG3 ARG A 75 1.481 -1.207 -6.516 1.00 0.00 H new ATOM 0 HD2 ARG A 75 1.081 1.159 -8.393 1.00 0.00 H new ATOM 0 HD3 ARG A 75 2.048 -0.258 -8.749 1.00 0.00 H new ATOM 0 HE ARG A 75 -0.611 -1.081 -8.020 1.00 0.00 H new ATOM 0 HH11 ARG A 75 1.220 0.483 -10.602 1.00 0.00 H new ATOM 0 HH12 ARG A 75 0.105 -0.040 -11.868 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -2.039 -1.750 -9.652 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -1.734 -1.299 -11.333 1.00 0.00 H new ATOM 1117 N LEU A 76 2.507 0.302 -3.160 1.00 0.00 N ATOM 1118 CA LEU A 76 3.732 0.902 -2.644 1.00 0.00 C ATOM 1119 C LEU A 76 4.889 0.700 -3.617 1.00 0.00 C ATOM 1120 O LEU A 76 5.327 -0.426 -3.850 1.00 0.00 O ATOM 1121 CB LEU A 76 4.085 0.299 -1.283 1.00 0.00 C ATOM 1122 CG LEU A 76 5.360 0.828 -0.625 1.00 0.00 C ATOM 1123 CD1 LEU A 76 5.073 2.110 0.141 1.00 0.00 C ATOM 1124 CD2 LEU A 76 5.959 -0.224 0.298 1.00 0.00 C ATOM 0 H LEU A 76 2.372 -0.674 -2.896 1.00 0.00 H new ATOM 0 HA LEU A 76 3.562 1.972 -2.527 1.00 0.00 H new ATOM 0 HB2 LEU A 76 3.250 0.473 -0.604 1.00 0.00 H new ATOM 0 HB3 LEU A 76 4.181 -0.780 -1.400 1.00 0.00 H new ATOM 0 HG LEU A 76 6.085 1.051 -1.408 1.00 0.00 H new ATOM 0 HD11 LEU A 76 5.992 2.472 0.602 1.00 0.00 H new ATOM 0 HD12 LEU A 76 4.690 2.866 -0.545 1.00 0.00 H new ATOM 0 HD13 LEU A 76 4.331 1.913 0.915 1.00 0.00 H new ATOM 0 HD21 LEU A 76 6.866 0.169 0.758 1.00 0.00 H new ATOM 0 HD22 LEU A 76 5.239 -0.478 1.076 1.00 0.00 H new ATOM 0 HD23 LEU A 76 6.202 -1.117 -0.278 1.00 0.00 H new ATOM 1136 N GLN A 77 5.380 1.799 -4.181 1.00 0.00 N ATOM 1137 CA GLN A 77 6.487 1.742 -5.128 1.00 0.00 C ATOM 1138 C GLN A 77 7.662 2.585 -4.643 1.00 0.00 C ATOM 1139 O GLN A 77 7.474 3.624 -4.011 1.00 0.00 O ATOM 1140 CB GLN A 77 6.033 2.225 -6.506 1.00 0.00 C ATOM 1141 CG GLN A 77 6.905 1.723 -7.645 1.00 0.00 C ATOM 1142 CD GLN A 77 6.939 2.679 -8.821 1.00 0.00 C ATOM 1143 OE1 GLN A 77 6.383 3.777 -8.759 1.00 0.00 O ATOM 1144 NE2 GLN A 77 7.593 2.268 -9.901 1.00 0.00 N ATOM 0 H GLN A 77 5.029 2.739 -3.999 1.00 0.00 H new ATOM 0 HA GLN A 77 6.814 0.705 -5.204 1.00 0.00 H new ATOM 0 HB2 GLN A 77 5.006 1.900 -6.675 1.00 0.00 H new ATOM 0 HB3 GLN A 77 6.028 3.315 -6.516 1.00 0.00 H new ATOM 0 HG2 GLN A 77 7.920 1.568 -7.279 1.00 0.00 H new ATOM 0 HG3 GLN A 77 6.535 0.754 -7.980 1.00 0.00 H new ATOM 0 HE21 GLN A 77 8.039 1.351 -9.909 1.00 0.00 H new ATOM 0 HE22 GLN A 77 7.649 2.870 -10.723 1.00 0.00 H new ATOM 1153 N ALA A 78 8.874 2.130 -4.943 1.00 0.00 N ATOM 1154 CA ALA A 78 10.080 2.843 -4.539 1.00 0.00 C ATOM 1155 C ALA A 78 10.885 3.292 -5.754 1.00 0.00 C ATOM 1156 O ALA A 78 11.080 2.528 -6.698 1.00 0.00 O ATOM 1157 CB ALA A 78 10.932 1.967 -3.633 1.00 0.00 C ATOM 0 H ALA A 78 9.047 1.271 -5.465 1.00 0.00 H new ATOM 0 HA ALA A 78 9.779 3.733 -3.987 1.00 0.00 H new ATOM 0 HB1 ALA A 78 11.829 2.512 -3.339 1.00 0.00 H new ATOM 0 HB2 ALA A 78 10.361 1.700 -2.743 1.00 0.00 H new ATOM 0 HB3 ALA A 78 11.217 1.060 -4.167 1.00 0.00 H new ATOM 1163 N MET A 79 11.349 4.537 -5.722 1.00 0.00 N ATOM 1164 CA MET A 79 12.133 5.088 -6.822 1.00 0.00 C ATOM 1165 C MET A 79 13.607 4.722 -6.674 1.00 0.00 C ATOM 1166 O MET A 79 14.266 5.137 -5.721 1.00 0.00 O ATOM 1167 CB MET A 79 11.976 6.609 -6.877 1.00 0.00 C ATOM 1168 CG MET A 79 10.535 7.076 -6.749 1.00 0.00 C ATOM 1169 SD MET A 79 10.376 8.869 -6.844 1.00 0.00 S ATOM 1170 CE MET A 79 10.368 9.301 -5.106 1.00 0.00 C ATOM 0 H MET A 79 11.196 5.183 -4.947 1.00 0.00 H new ATOM 0 HA MET A 79 11.761 4.658 -7.752 1.00 0.00 H new ATOM 0 HB2 MET A 79 12.567 7.056 -6.077 1.00 0.00 H new ATOM 0 HB3 MET A 79 12.386 6.975 -7.819 1.00 0.00 H new ATOM 0 HG2 MET A 79 9.938 6.620 -7.538 1.00 0.00 H new ATOM 0 HG3 MET A 79 10.127 6.729 -5.800 1.00 0.00 H new ATOM 0 HE1 MET A 79 9.947 10.298 -4.981 1.00 0.00 H new ATOM 0 HE2 MET A 79 9.764 8.580 -4.555 1.00 0.00 H new ATOM 0 HE3 MET A 79 11.388 9.288 -4.723 1.00 0.00 H new ATOM 1180 N TRP A 80 14.116 3.944 -7.622 1.00 0.00 N ATOM 1181 CA TRP A 80 15.512 3.523 -7.597 1.00 0.00 C ATOM 1182 C TRP A 80 16.292 4.153 -8.745 1.00 0.00 C ATOM 1183 O TRP A 80 15.713 4.565 -9.749 1.00 0.00 O ATOM 1184 CB TRP A 80 15.608 1.998 -7.676 1.00 0.00 C ATOM 1185 CG TRP A 80 15.546 1.329 -6.336 1.00 0.00 C ATOM 1186 CD1 TRP A 80 16.581 1.141 -5.465 1.00 0.00 C ATOM 1187 CD2 TRP A 80 14.388 0.758 -5.717 1.00 0.00 C ATOM 1188 NE1 TRP A 80 16.137 0.487 -4.342 1.00 0.00 N ATOM 1189 CE2 TRP A 80 14.795 0.241 -4.471 1.00 0.00 C ATOM 1190 CE3 TRP A 80 13.048 0.633 -6.092 1.00 0.00 C ATOM 1191 CZ2 TRP A 80 13.909 -0.389 -3.601 1.00 0.00 C ATOM 1192 CZ3 TRP A 80 12.170 0.008 -5.228 1.00 0.00 C ATOM 1193 CH2 TRP A 80 12.602 -0.496 -3.994 1.00 0.00 C ATOM 0 H TRP A 80 13.583 3.592 -8.417 1.00 0.00 H new ATOM 0 HA TRP A 80 15.950 3.860 -6.657 1.00 0.00 H new ATOM 0 HB2 TRP A 80 14.797 1.622 -8.300 1.00 0.00 H new ATOM 0 HB3 TRP A 80 16.542 1.725 -8.168 1.00 0.00 H new ATOM 0 HD1 TRP A 80 17.599 1.460 -5.634 1.00 0.00 H new ATOM 0 HE1 TRP A 80 16.713 0.226 -3.541 1.00 0.00 H new ATOM 0 HE3 TRP A 80 12.705 1.018 -7.041 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 14.241 -0.779 -2.650 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 11.132 -0.094 -5.509 1.00 0.00 H new ATOM 0 HH2 TRP A 80 11.890 -0.978 -3.340 1.00 0.00 H new ATOM 1204 N GLY A 81 17.611 4.227 -8.590 1.00 0.00 N ATOM 1205 CA GLY A 81 18.448 4.809 -9.622 1.00 0.00 C ATOM 1206 C GLY A 81 18.205 4.189 -10.984 1.00 0.00 C ATOM 1207 O GLY A 81 18.347 2.978 -11.155 1.00 0.00 O ATOM 0 H GLY A 81 18.114 3.894 -7.768 1.00 0.00 H new ATOM 0 HA2 GLY A 81 18.260 5.881 -9.676 1.00 0.00 H new ATOM 0 HA3 GLY A 81 19.496 4.682 -9.350 1.00 0.00 H new ATOM 1211 N GLN A 82 17.837 5.020 -11.954 1.00 0.00 N ATOM 1212 CA GLN A 82 17.572 4.544 -13.307 1.00 0.00 C ATOM 1213 C GLN A 82 16.874 3.188 -13.280 1.00 0.00 C ATOM 1214 O GLN A 82 17.113 2.339 -14.139 1.00 0.00 O ATOM 1215 CB GLN A 82 18.876 4.444 -14.100 1.00 0.00 C ATOM 1216 CG GLN A 82 19.317 5.763 -14.714 1.00 0.00 C ATOM 1217 CD GLN A 82 20.644 5.654 -15.438 1.00 0.00 C ATOM 1218 OE1 GLN A 82 21.458 4.779 -15.140 1.00 0.00 O ATOM 1219 NE2 GLN A 82 20.871 6.545 -16.397 1.00 0.00 N ATOM 0 H GLN A 82 17.716 6.025 -11.829 1.00 0.00 H new ATOM 0 HA GLN A 82 16.913 5.262 -13.795 1.00 0.00 H new ATOM 0 HB2 GLN A 82 19.664 4.077 -13.442 1.00 0.00 H new ATOM 0 HB3 GLN A 82 18.754 3.706 -14.893 1.00 0.00 H new ATOM 0 HG2 GLN A 82 18.554 6.108 -15.412 1.00 0.00 H new ATOM 0 HG3 GLN A 82 19.396 6.516 -13.930 1.00 0.00 H new ATOM 0 HE21 GLN A 82 20.169 7.253 -16.612 1.00 0.00 H new ATOM 0 HE22 GLN A 82 21.747 6.521 -16.919 1.00 0.00 H new ATOM 1228 N SER A 83 16.011 2.992 -12.288 1.00 0.00 N ATOM 1229 CA SER A 83 15.281 1.738 -12.148 1.00 0.00 C ATOM 1230 C SER A 83 14.180 1.864 -11.098 1.00 0.00 C ATOM 1231 O SER A 83 14.266 2.689 -10.188 1.00 0.00 O ATOM 1232 CB SER A 83 16.237 0.607 -11.765 1.00 0.00 C ATOM 1233 OG SER A 83 16.909 0.099 -12.906 1.00 0.00 O ATOM 0 H SER A 83 15.801 3.685 -11.570 1.00 0.00 H new ATOM 0 HA SER A 83 14.820 1.506 -13.108 1.00 0.00 H new ATOM 0 HB2 SER A 83 16.966 0.972 -11.042 1.00 0.00 H new ATOM 0 HB3 SER A 83 15.681 -0.195 -11.279 1.00 0.00 H new ATOM 0 HG SER A 83 17.334 -0.755 -12.682 1.00 0.00 H new ATOM 1239 N LEU A 84 13.146 1.041 -11.233 1.00 0.00 N ATOM 1240 CA LEU A 84 12.027 1.060 -10.297 1.00 0.00 C ATOM 1241 C LEU A 84 11.494 -0.349 -10.059 1.00 0.00 C ATOM 1242 O LEU A 84 10.811 -0.919 -10.911 1.00 0.00 O ATOM 1243 CB LEU A 84 10.908 1.958 -10.828 1.00 0.00 C ATOM 1244 CG LEU A 84 11.332 3.347 -11.307 1.00 0.00 C ATOM 1245 CD1 LEU A 84 11.685 3.317 -12.786 1.00 0.00 C ATOM 1246 CD2 LEU A 84 10.230 4.362 -11.039 1.00 0.00 C ATOM 0 H LEU A 84 13.059 0.353 -11.981 1.00 0.00 H new ATOM 0 HA LEU A 84 12.385 1.459 -9.348 1.00 0.00 H new ATOM 0 HB2 LEU A 84 10.419 1.444 -11.655 1.00 0.00 H new ATOM 0 HB3 LEU A 84 10.162 2.079 -10.042 1.00 0.00 H new ATOM 0 HG LEU A 84 12.219 3.648 -10.750 1.00 0.00 H new ATOM 0 HD11 LEU A 84 11.984 4.314 -13.109 1.00 0.00 H new ATOM 0 HD12 LEU A 84 12.507 2.620 -12.950 1.00 0.00 H new ATOM 0 HD13 LEU A 84 10.817 2.995 -13.361 1.00 0.00 H new ATOM 0 HD21 LEU A 84 10.548 5.345 -11.386 1.00 0.00 H new ATOM 0 HD22 LEU A 84 9.325 4.065 -11.570 1.00 0.00 H new ATOM 0 HD23 LEU A 84 10.026 4.404 -9.969 1.00 0.00 H new ATOM 1258 N LEU A 85 11.808 -0.905 -8.894 1.00 0.00 N ATOM 1259 CA LEU A 85 11.359 -2.248 -8.541 1.00 0.00 C ATOM 1260 C LEU A 85 9.837 -2.341 -8.583 1.00 0.00 C ATOM 1261 O LEU A 85 9.124 -1.358 -8.381 1.00 0.00 O ATOM 1262 CB LEU A 85 11.866 -2.627 -7.148 1.00 0.00 C ATOM 1263 CG LEU A 85 13.372 -2.492 -6.923 1.00 0.00 C ATOM 1264 CD1 LEU A 85 13.746 -2.960 -5.525 1.00 0.00 C ATOM 1265 CD2 LEU A 85 14.141 -3.280 -7.974 1.00 0.00 C ATOM 0 H LEU A 85 12.372 -0.447 -8.178 1.00 0.00 H new ATOM 0 HA LEU A 85 11.768 -2.945 -9.272 1.00 0.00 H new ATOM 0 HB2 LEU A 85 11.352 -2.006 -6.415 1.00 0.00 H new ATOM 0 HB3 LEU A 85 11.580 -3.659 -6.947 1.00 0.00 H new ATOM 0 HG LEU A 85 13.641 -1.440 -7.017 1.00 0.00 H new ATOM 0 HD11 LEU A 85 14.822 -2.857 -5.382 1.00 0.00 H new ATOM 0 HD12 LEU A 85 13.222 -2.354 -4.786 1.00 0.00 H new ATOM 0 HD13 LEU A 85 13.463 -4.005 -5.403 1.00 0.00 H new ATOM 0 HD21 LEU A 85 15.211 -3.172 -7.798 1.00 0.00 H new ATOM 0 HD22 LEU A 85 13.867 -4.333 -7.912 1.00 0.00 H new ATOM 0 HD23 LEU A 85 13.896 -2.899 -8.966 1.00 0.00 H new ATOM 1277 N PRO A 86 9.325 -3.552 -8.851 1.00 0.00 N ATOM 1278 CA PRO A 86 7.883 -3.803 -8.924 1.00 0.00 C ATOM 1279 C PRO A 86 7.210 -3.713 -7.559 1.00 0.00 C ATOM 1280 O PRO A 86 7.530 -4.456 -6.631 1.00 0.00 O ATOM 1281 CB PRO A 86 7.799 -5.232 -9.467 1.00 0.00 C ATOM 1282 CG PRO A 86 9.087 -5.865 -9.069 1.00 0.00 C ATOM 1283 CD PRO A 86 10.116 -4.768 -9.103 1.00 0.00 C ATOM 0 HA PRO A 86 7.372 -3.066 -9.543 1.00 0.00 H new ATOM 0 HB2 PRO A 86 6.948 -5.767 -9.045 1.00 0.00 H new ATOM 0 HB3 PRO A 86 7.673 -5.237 -10.550 1.00 0.00 H new ATOM 0 HG2 PRO A 86 9.016 -6.302 -8.073 1.00 0.00 H new ATOM 0 HG3 PRO A 86 9.353 -6.671 -9.753 1.00 0.00 H new ATOM 0 HD2 PRO A 86 10.884 -4.913 -8.343 1.00 0.00 H new ATOM 0 HD3 PRO A 86 10.625 -4.724 -10.066 1.00 0.00 H new ATOM 1291 N PRO A 87 6.253 -2.781 -7.430 1.00 0.00 N ATOM 1292 CA PRO A 87 5.514 -2.572 -6.182 1.00 0.00 C ATOM 1293 C PRO A 87 4.568 -3.726 -5.868 1.00 0.00 C ATOM 1294 O PRO A 87 4.422 -4.656 -6.662 1.00 0.00 O ATOM 1295 CB PRO A 87 4.722 -1.290 -6.449 1.00 0.00 C ATOM 1296 CG PRO A 87 4.572 -1.239 -7.931 1.00 0.00 C ATOM 1297 CD PRO A 87 5.820 -1.860 -8.495 1.00 0.00 C ATOM 0 HA PRO A 87 6.179 -2.507 -5.321 1.00 0.00 H new ATOM 0 HB2 PRO A 87 3.751 -1.314 -5.953 1.00 0.00 H new ATOM 0 HB3 PRO A 87 5.250 -0.413 -6.074 1.00 0.00 H new ATOM 0 HG2 PRO A 87 3.685 -1.785 -8.252 1.00 0.00 H new ATOM 0 HG3 PRO A 87 4.457 -0.212 -8.276 1.00 0.00 H new ATOM 0 HD2 PRO A 87 5.620 -2.389 -9.427 1.00 0.00 H new ATOM 0 HD3 PRO A 87 6.580 -1.109 -8.711 1.00 0.00 H new ATOM 1305 N VAL A 88 3.927 -3.661 -4.706 1.00 0.00 N ATOM 1306 CA VAL A 88 2.994 -4.700 -4.288 1.00 0.00 C ATOM 1307 C VAL A 88 1.576 -4.151 -4.171 1.00 0.00 C ATOM 1308 O VAL A 88 1.335 -3.172 -3.465 1.00 0.00 O ATOM 1309 CB VAL A 88 3.407 -5.315 -2.938 1.00 0.00 C ATOM 1310 CG1 VAL A 88 4.504 -6.350 -3.136 1.00 0.00 C ATOM 1311 CG2 VAL A 88 3.856 -4.229 -1.972 1.00 0.00 C ATOM 0 H VAL A 88 4.037 -2.899 -4.037 1.00 0.00 H new ATOM 0 HA VAL A 88 3.019 -5.474 -5.055 1.00 0.00 H new ATOM 0 HB VAL A 88 2.540 -5.816 -2.507 1.00 0.00 H new ATOM 0 HG11 VAL A 88 4.783 -6.774 -2.171 1.00 0.00 H new ATOM 0 HG12 VAL A 88 4.142 -7.143 -3.790 1.00 0.00 H new ATOM 0 HG13 VAL A 88 5.374 -5.875 -3.589 1.00 0.00 H new ATOM 0 HG21 VAL A 88 4.144 -4.682 -1.023 1.00 0.00 H new ATOM 0 HG22 VAL A 88 4.709 -3.697 -2.394 1.00 0.00 H new ATOM 0 HG23 VAL A 88 3.037 -3.529 -1.806 1.00 0.00 H new ATOM 1321 N SER A 89 0.641 -4.789 -4.868 1.00 0.00 N ATOM 1322 CA SER A 89 -0.753 -4.362 -4.845 1.00 0.00 C ATOM 1323 C SER A 89 -1.579 -5.254 -3.922 1.00 0.00 C ATOM 1324 O SER A 89 -1.571 -6.478 -4.052 1.00 0.00 O ATOM 1325 CB SER A 89 -1.340 -4.389 -6.258 1.00 0.00 C ATOM 1326 OG SER A 89 -1.474 -5.718 -6.729 1.00 0.00 O ATOM 0 H SER A 89 0.823 -5.603 -5.455 1.00 0.00 H new ATOM 0 HA SER A 89 -0.789 -3.342 -4.464 1.00 0.00 H new ATOM 0 HB2 SER A 89 -2.314 -3.899 -6.260 1.00 0.00 H new ATOM 0 HB3 SER A 89 -0.697 -3.824 -6.933 1.00 0.00 H new ATOM 0 HG SER A 89 -1.477 -6.336 -5.968 1.00 0.00 H new ATOM 1332 N THR A 90 -2.292 -4.630 -2.989 1.00 0.00 N ATOM 1333 CA THR A 90 -3.122 -5.365 -2.044 1.00 0.00 C ATOM 1334 C THR A 90 -4.534 -4.792 -1.990 1.00 0.00 C ATOM 1335 O THR A 90 -4.762 -3.643 -2.370 1.00 0.00 O ATOM 1336 CB THR A 90 -2.517 -5.341 -0.628 1.00 0.00 C ATOM 1337 OG1 THR A 90 -3.192 -6.286 0.210 1.00 0.00 O ATOM 1338 CG2 THR A 90 -2.620 -3.951 -0.018 1.00 0.00 C ATOM 0 H THR A 90 -2.311 -3.617 -2.868 1.00 0.00 H new ATOM 0 HA THR A 90 -3.164 -6.396 -2.396 1.00 0.00 H new ATOM 0 HB THR A 90 -1.463 -5.610 -0.703 1.00 0.00 H new ATOM 0 HG1 THR A 90 -2.800 -6.265 1.108 1.00 0.00 H new ATOM 0 HG21 THR A 90 -2.186 -3.959 0.982 1.00 0.00 H new ATOM 0 HG22 THR A 90 -2.080 -3.239 -0.642 1.00 0.00 H new ATOM 0 HG23 THR A 90 -3.668 -3.657 0.044 1.00 0.00 H new ATOM 1346 N SER A 91 -5.478 -5.598 -1.516 1.00 0.00 N ATOM 1347 CA SER A 91 -6.868 -5.171 -1.415 1.00 0.00 C ATOM 1348 C SER A 91 -7.332 -5.169 0.038 1.00 0.00 C ATOM 1349 O SER A 91 -7.118 -6.135 0.772 1.00 0.00 O ATOM 1350 CB SER A 91 -7.767 -6.088 -2.248 1.00 0.00 C ATOM 1351 OG SER A 91 -7.647 -7.437 -1.830 1.00 0.00 O ATOM 0 H SER A 91 -5.305 -6.551 -1.196 1.00 0.00 H new ATOM 0 HA SER A 91 -6.939 -4.154 -1.802 1.00 0.00 H new ATOM 0 HB2 SER A 91 -8.804 -5.767 -2.156 1.00 0.00 H new ATOM 0 HB3 SER A 91 -7.500 -6.005 -3.301 1.00 0.00 H new ATOM 0 HG SER A 91 -7.455 -7.466 -0.869 1.00 0.00 H new ATOM 1357 N PHE A 92 -7.970 -4.077 0.447 1.00 0.00 N ATOM 1358 CA PHE A 92 -8.464 -3.948 1.813 1.00 0.00 C ATOM 1359 C PHE A 92 -9.803 -3.216 1.840 1.00 0.00 C ATOM 1360 O PHE A 92 -9.997 -2.224 1.136 1.00 0.00 O ATOM 1361 CB PHE A 92 -7.446 -3.201 2.678 1.00 0.00 C ATOM 1362 CG PHE A 92 -7.293 -1.754 2.309 1.00 0.00 C ATOM 1363 CD1 PHE A 92 -8.122 -0.792 2.864 1.00 0.00 C ATOM 1364 CD2 PHE A 92 -6.319 -1.354 1.408 1.00 0.00 C ATOM 1365 CE1 PHE A 92 -7.984 0.541 2.526 1.00 0.00 C ATOM 1366 CE2 PHE A 92 -6.176 -0.022 1.066 1.00 0.00 C ATOM 1367 CZ PHE A 92 -7.009 0.926 1.627 1.00 0.00 C ATOM 0 H PHE A 92 -8.157 -3.269 -0.147 1.00 0.00 H new ATOM 0 HA PHE A 92 -8.608 -4.950 2.216 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -7.748 -3.271 3.723 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -6.478 -3.694 2.593 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -8.885 -1.087 3.569 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -5.664 -2.091 0.968 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -8.638 1.281 2.964 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -5.414 0.277 0.361 1.00 0.00 H new ATOM 0 HZ PHE A 92 -6.898 1.967 1.363 1.00 0.00 H new ATOM 1377 N THR A 93 -10.726 -3.714 2.657 1.00 0.00 N ATOM 1378 CA THR A 93 -12.048 -3.111 2.775 1.00 0.00 C ATOM 1379 C THR A 93 -12.213 -2.407 4.116 1.00 0.00 C ATOM 1380 O THR A 93 -11.733 -2.886 5.145 1.00 0.00 O ATOM 1381 CB THR A 93 -13.162 -4.164 2.620 1.00 0.00 C ATOM 1382 OG1 THR A 93 -12.968 -4.909 1.412 1.00 0.00 O ATOM 1383 CG2 THR A 93 -14.532 -3.503 2.599 1.00 0.00 C ATOM 0 H THR A 93 -10.582 -4.534 3.247 1.00 0.00 H new ATOM 0 HA THR A 93 -12.135 -2.380 1.971 1.00 0.00 H new ATOM 0 HB THR A 93 -13.114 -4.839 3.474 1.00 0.00 H new ATOM 0 HG1 THR A 93 -13.679 -5.577 1.322 1.00 0.00 H new ATOM 0 HG21 THR A 93 -15.302 -4.266 2.489 1.00 0.00 H new ATOM 0 HG22 THR A 93 -14.689 -2.961 3.532 1.00 0.00 H new ATOM 0 HG23 THR A 93 -14.588 -2.808 1.762 1.00 0.00 H new ATOM 1391 N THR A 94 -12.895 -1.266 4.101 1.00 0.00 N ATOM 1392 CA THR A 94 -13.123 -0.495 5.316 1.00 0.00 C ATOM 1393 C THR A 94 -14.354 -0.997 6.063 1.00 0.00 C ATOM 1394 O THR A 94 -15.211 -1.666 5.488 1.00 0.00 O ATOM 1395 CB THR A 94 -13.301 1.003 5.006 1.00 0.00 C ATOM 1396 OG1 THR A 94 -14.563 1.225 4.367 1.00 0.00 O ATOM 1397 CG2 THR A 94 -12.179 1.508 4.112 1.00 0.00 C ATOM 0 H THR A 94 -13.299 -0.855 3.259 1.00 0.00 H new ATOM 0 HA THR A 94 -12.241 -0.626 5.943 1.00 0.00 H new ATOM 0 HB THR A 94 -13.269 1.552 5.947 1.00 0.00 H new ATOM 0 HG1 THR A 94 -14.476 1.951 3.715 1.00 0.00 H new ATOM 0 HG21 THR A 94 -12.326 2.568 3.907 1.00 0.00 H new ATOM 0 HG22 THR A 94 -11.222 1.365 4.614 1.00 0.00 H new ATOM 0 HG23 THR A 94 -12.183 0.953 3.174 1.00 0.00 H new ATOM 1405 N GLY A 95 -14.434 -0.670 7.349 1.00 0.00 N ATOM 1406 CA GLY A 95 -15.564 -1.096 8.154 1.00 0.00 C ATOM 1407 C GLY A 95 -16.843 -0.366 7.791 1.00 0.00 C ATOM 1408 O GLY A 95 -17.113 -0.121 6.616 1.00 0.00 O ATOM 0 H GLY A 95 -13.737 -0.118 7.848 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -15.713 -2.168 8.027 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -15.340 -0.928 9.207 1.00 0.00 H new ATOM 1412 N GLY A 96 -17.632 -0.020 8.803 1.00 0.00 N ATOM 1413 CA GLY A 96 -18.881 0.681 8.563 1.00 0.00 C ATOM 1414 C GLY A 96 -19.205 1.679 9.657 1.00 0.00 C ATOM 1415 O GLY A 96 -18.821 1.492 10.812 1.00 0.00 O ATOM 0 H GLY A 96 -17.430 -0.212 9.784 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -18.824 1.201 7.607 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -19.692 -0.044 8.485 1.00 0.00 H new ATOM 1419 N LEU A 97 -19.911 2.744 9.293 1.00 0.00 N ATOM 1420 CA LEU A 97 -20.286 3.777 10.252 1.00 0.00 C ATOM 1421 C LEU A 97 -21.280 3.237 11.275 1.00 0.00 C ATOM 1422 O LEU A 97 -22.490 3.255 11.049 1.00 0.00 O ATOM 1423 CB LEU A 97 -20.888 4.981 9.526 1.00 0.00 C ATOM 1424 CG LEU A 97 -19.905 5.854 8.745 1.00 0.00 C ATOM 1425 CD1 LEU A 97 -20.649 6.761 7.777 1.00 0.00 C ATOM 1426 CD2 LEU A 97 -19.049 6.676 9.698 1.00 0.00 C ATOM 0 H LEU A 97 -20.235 2.915 8.341 1.00 0.00 H new ATOM 0 HA LEU A 97 -19.385 4.091 10.779 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -21.650 4.620 8.835 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -21.394 5.607 10.261 1.00 0.00 H new ATOM 0 HG LEU A 97 -19.249 5.202 8.168 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -19.933 7.375 7.230 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -21.218 6.153 7.073 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -21.330 7.406 8.333 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -18.355 7.291 9.125 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -19.691 7.318 10.301 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -18.487 6.008 10.351 1.00 0.00 H new ATOM 1438 N ARG A 98 -20.761 2.758 12.401 1.00 0.00 N ATOM 1439 CA ARG A 98 -21.603 2.214 13.460 1.00 0.00 C ATOM 1440 C ARG A 98 -20.909 2.318 14.814 1.00 0.00 C ATOM 1441 O ARG A 98 -19.808 2.861 14.919 1.00 0.00 O ATOM 1442 CB ARG A 98 -21.950 0.753 13.163 1.00 0.00 C ATOM 1443 CG ARG A 98 -20.732 -0.137 12.979 1.00 0.00 C ATOM 1444 CD ARG A 98 -21.020 -1.284 12.022 1.00 0.00 C ATOM 1445 NE ARG A 98 -21.543 -2.457 12.716 1.00 0.00 N ATOM 1446 CZ ARG A 98 -22.074 -3.503 12.093 1.00 0.00 C ATOM 1447 NH1 ARG A 98 -22.151 -3.522 10.770 1.00 0.00 N ATOM 1448 NH2 ARG A 98 -22.529 -4.534 12.794 1.00 0.00 N ATOM 0 H ARG A 98 -19.762 2.736 12.603 1.00 0.00 H new ATOM 0 HA ARG A 98 -22.522 2.799 13.497 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -22.557 0.360 13.978 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -22.561 0.710 12.261 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -19.901 0.456 12.598 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -20.422 -0.536 13.945 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -21.738 -0.957 11.270 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -20.106 -1.553 11.493 1.00 0.00 H new ATOM 0 HE ARG A 98 -21.498 -2.474 13.735 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -21.802 -2.732 10.227 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -22.559 -4.327 10.294 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -22.471 -4.524 13.812 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -22.937 -5.337 12.314 1.00 0.00 H new ATOM 1462 N ILE A 99 -21.559 1.795 15.848 1.00 0.00 N ATOM 1463 CA ILE A 99 -21.004 1.829 17.196 1.00 0.00 C ATOM 1464 C ILE A 99 -20.246 0.544 17.510 1.00 0.00 C ATOM 1465 O ILE A 99 -19.117 0.582 18.001 1.00 0.00 O ATOM 1466 CB ILE A 99 -22.105 2.034 18.253 1.00 0.00 C ATOM 1467 CG1 ILE A 99 -22.969 3.244 17.893 1.00 0.00 C ATOM 1468 CG2 ILE A 99 -21.489 2.208 19.633 1.00 0.00 C ATOM 1469 CD1 ILE A 99 -23.953 2.974 16.777 1.00 0.00 C ATOM 0 H ILE A 99 -22.471 1.343 15.778 1.00 0.00 H new ATOM 0 HA ILE A 99 -20.315 2.673 17.233 1.00 0.00 H new ATOM 0 HB ILE A 99 -22.741 1.149 18.270 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -23.516 3.566 18.779 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -22.320 4.070 17.602 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -22.280 2.352 20.369 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -20.913 1.319 19.889 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -20.832 3.078 19.631 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -24.531 3.876 16.576 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -23.412 2.682 15.877 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -24.627 2.170 17.073 1.00 0.00 H new ATOM 1481 N SER A 100 -20.872 -0.592 17.223 1.00 0.00 N ATOM 1482 CA SER A 100 -20.257 -1.890 17.477 1.00 0.00 C ATOM 1483 C SER A 100 -19.703 -2.490 16.188 1.00 0.00 C ATOM 1484 O SER A 100 -20.428 -3.128 15.426 1.00 0.00 O ATOM 1485 CB SER A 100 -21.274 -2.846 18.102 1.00 0.00 C ATOM 1486 OG SER A 100 -20.631 -3.820 18.906 1.00 0.00 O ATOM 0 H SER A 100 -21.805 -0.641 16.814 1.00 0.00 H new ATOM 0 HA SER A 100 -19.431 -1.743 18.173 1.00 0.00 H new ATOM 0 HB2 SER A 100 -21.984 -2.282 18.707 1.00 0.00 H new ATOM 0 HB3 SER A 100 -21.846 -3.339 17.316 1.00 0.00 H new ATOM 0 HG SER A 100 -21.303 -4.418 19.296 1.00 0.00 H new ATOM 1492 N GLY A 101 -18.412 -2.280 15.952 1.00 0.00 N ATOM 1493 CA GLY A 101 -17.781 -2.806 14.755 1.00 0.00 C ATOM 1494 C GLY A 101 -16.365 -3.283 15.008 1.00 0.00 C ATOM 1495 O GLY A 101 -16.004 -3.660 16.123 1.00 0.00 O ATOM 0 H GLY A 101 -17.791 -1.755 16.568 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -18.376 -3.633 14.368 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -17.769 -2.034 13.985 1.00 0.00 H new ATOM 1499 N PRO A 102 -15.536 -3.272 13.954 1.00 0.00 N ATOM 1500 CA PRO A 102 -14.138 -3.705 14.041 1.00 0.00 C ATOM 1501 C PRO A 102 -13.281 -2.737 14.850 1.00 0.00 C ATOM 1502 O PRO A 102 -12.077 -2.940 15.005 1.00 0.00 O ATOM 1503 CB PRO A 102 -13.683 -3.731 12.580 1.00 0.00 C ATOM 1504 CG PRO A 102 -14.574 -2.759 11.888 1.00 0.00 C ATOM 1505 CD PRO A 102 -15.899 -2.836 12.595 1.00 0.00 C ATOM 0 HA PRO A 102 -14.039 -4.664 14.549 1.00 0.00 H new ATOM 0 HB2 PRO A 102 -12.636 -3.444 12.486 1.00 0.00 H new ATOM 0 HB3 PRO A 102 -13.779 -4.729 12.153 1.00 0.00 H new ATOM 0 HG2 PRO A 102 -14.164 -1.750 11.937 1.00 0.00 H new ATOM 0 HG3 PRO A 102 -14.680 -3.009 10.832 1.00 0.00 H new ATOM 0 HD2 PRO A 102 -16.406 -1.871 12.605 1.00 0.00 H new ATOM 0 HD3 PRO A 102 -16.572 -3.545 12.112 1.00 0.00 H new ATOM 1513 N SER A 103 -13.909 -1.684 15.363 1.00 0.00 N ATOM 1514 CA SER A 103 -13.203 -0.683 16.153 1.00 0.00 C ATOM 1515 C SER A 103 -12.503 -1.327 17.346 1.00 0.00 C ATOM 1516 O SER A 103 -13.135 -1.642 18.354 1.00 0.00 O ATOM 1517 CB SER A 103 -14.175 0.394 16.637 1.00 0.00 C ATOM 1518 OG SER A 103 -13.479 1.502 17.183 1.00 0.00 O ATOM 0 H SER A 103 -14.906 -1.502 15.245 1.00 0.00 H new ATOM 0 HA SER A 103 -12.448 -0.221 15.517 1.00 0.00 H new ATOM 0 HB2 SER A 103 -14.798 0.726 15.806 1.00 0.00 H new ATOM 0 HB3 SER A 103 -14.843 -0.026 17.389 1.00 0.00 H new ATOM 0 HG SER A 103 -14.123 2.177 17.484 1.00 0.00 H new ATOM 1524 N SER A 104 -11.193 -1.519 17.223 1.00 0.00 N ATOM 1525 CA SER A 104 -10.407 -2.128 18.289 1.00 0.00 C ATOM 1526 C SER A 104 -9.671 -1.064 19.097 1.00 0.00 C ATOM 1527 O SER A 104 -9.583 0.092 18.688 1.00 0.00 O ATOM 1528 CB SER A 104 -9.404 -3.126 17.705 1.00 0.00 C ATOM 1529 OG SER A 104 -8.315 -2.456 17.094 1.00 0.00 O ATOM 0 H SER A 104 -10.654 -1.262 16.396 1.00 0.00 H new ATOM 0 HA SER A 104 -11.090 -2.657 18.954 1.00 0.00 H new ATOM 0 HB2 SER A 104 -9.035 -3.780 18.495 1.00 0.00 H new ATOM 0 HB3 SER A 104 -9.902 -3.760 16.972 1.00 0.00 H new ATOM 0 HG SER A 104 -7.688 -3.115 16.730 1.00 0.00 H new ATOM 1535 N GLY A 105 -9.143 -1.466 20.250 1.00 0.00 N ATOM 1536 CA GLY A 105 -8.422 -0.536 21.099 1.00 0.00 C ATOM 1537 C GLY A 105 -7.218 0.069 20.404 1.00 0.00 C ATOM 1538 O GLY A 105 -7.024 1.285 20.431 1.00 0.00 O ATOM 0 H GLY A 105 -9.202 -2.418 20.610 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -9.095 0.262 21.413 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -8.095 -1.051 22.002 1.00 0.00 H new TER 1542 GLY A 105