USER MOD reduce.3.24.130724 H: found=0, std=0, add=541, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 539 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 224 ASN : amide:sc= -1.21! C(o=-2.2!,f=-2.3!) USER MOD Set 1.2: A 232 THR OG1 : rot -82:sc= -0.998 USER MOD Set 2.1: A 194 HIS : no HD1:sc= -1.66 X(o=-2.1,f=-1.7) USER MOD Set 2.2: A 197 TYR OH : rot 64:sc= -0.44 USER MOD Set 3.1: A 182 HIS : no HD1:sc=-0.00303 X(o=-0.003,f=-0.057) USER MOD Set 3.2: A 186 MET CE :methyl -147:sc= 0 (180deg=0) USER MOD Single : A 180 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 181 GLN : amide:sc= -0.403 X(o=-0.4,f=-0.21) USER MOD Single : A 189 SER OG : rot -34:sc= -0.626 USER MOD Single : A 193 LYS NZ :NH3+ -160:sc= -0.238 (180deg=-1.05) USER MOD Single : A 195 GLN : amide:sc= -0.109 X(o=-0.11,f=-0.093) USER MOD Single : A 196 TYR OH : rot 180:sc= 0 USER MOD Single : A 198 ASN : amide:sc= -2.18! C(o=-2.2!,f=-13!) USER MOD Single : A 200 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 206 THR OG1 : rot 30:sc= 0.719 USER MOD Single : A 207 LYS NZ :NH3+ 155:sc= -0.148 (180deg=-0.86) USER MOD Single : A 208 GLN : amide:sc= -2.39! C(o=-2.4!,f=-3.5!) USER MOD Single : A 212 TYR OH : rot 70:sc= 0 USER MOD Single : A 214 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 218 LYS NZ :NH3+ -150:sc= -0.224 (180deg=-1.47!) USER MOD Single : A 223 GLN : amide:sc= -13.1! C(o=-13!,f=-1.2!) USER MOD Single : A 226 LYS NZ :NH3+ -123:sc= -0.989 (180deg=-3.25!) USER MOD Single : A 229 HIS : no HD1:sc= -0.833 K(o=-0.83,f=-0.23) USER MOD Single : A 230 LYS NZ :NH3+ 137:sc= -3.13 (180deg=-5.66!) USER MOD Single : A 231 ASN : amide:sc= -0.434 X(o=-0.43,f=-0.24) USER MOD Single : A 236 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 239 TYR OH : rot -16:sc= -0.215 USER MOD ----------------------------------------------------------------- ATOM 69 N ASP A 179 5.520 -6.574 -7.670 1.00 0.00 N ATOM 70 CA ASP A 179 5.150 -5.156 -7.445 1.00 0.00 C ATOM 71 C ASP A 179 4.295 -5.077 -6.192 1.00 0.00 C ATOM 72 O ASP A 179 4.411 -4.177 -5.398 1.00 0.00 O ATOM 73 CB ASP A 179 4.363 -4.637 -8.646 1.00 0.00 C ATOM 74 CG ASP A 179 5.304 -4.505 -9.841 1.00 0.00 C ATOM 75 OD1 ASP A 179 6.496 -4.379 -9.618 1.00 0.00 O ATOM 76 OD2 ASP A 179 4.817 -4.533 -10.959 1.00 0.00 O ATOM 0 HA ASP A 179 6.045 -4.546 -7.322 1.00 0.00 H new ATOM 0 HB2 ASP A 179 3.547 -5.319 -8.884 1.00 0.00 H new ATOM 0 HB3 ASP A 179 3.914 -3.672 -8.413 1.00 0.00 H new ATOM 81 N LYS A 180 3.420 -6.018 -6.013 1.00 0.00 N ATOM 82 CA LYS A 180 2.550 -5.984 -4.811 1.00 0.00 C ATOM 83 C LYS A 180 3.393 -5.870 -3.538 1.00 0.00 C ATOM 84 O LYS A 180 3.229 -4.958 -2.758 1.00 0.00 O ATOM 85 CB LYS A 180 1.729 -7.272 -4.749 1.00 0.00 C ATOM 86 CG LYS A 180 0.805 -7.231 -3.536 1.00 0.00 C ATOM 87 CD LYS A 180 -0.039 -8.505 -3.496 1.00 0.00 C ATOM 88 CE LYS A 180 -0.776 -8.582 -2.163 1.00 0.00 C ATOM 89 NZ LYS A 180 -1.720 -9.738 -2.182 1.00 0.00 N ATOM 0 H LYS A 180 3.269 -6.806 -6.642 1.00 0.00 H new ATOM 0 HA LYS A 180 1.893 -5.117 -4.879 1.00 0.00 H new ATOM 0 HB2 LYS A 180 1.144 -7.386 -5.661 1.00 0.00 H new ATOM 0 HB3 LYS A 180 2.392 -8.135 -4.685 1.00 0.00 H new ATOM 0 HG2 LYS A 180 1.391 -7.141 -2.622 1.00 0.00 H new ATOM 0 HG3 LYS A 180 0.158 -6.355 -3.587 1.00 0.00 H new ATOM 0 HD2 LYS A 180 -0.753 -8.508 -4.320 1.00 0.00 H new ATOM 0 HD3 LYS A 180 0.598 -9.381 -3.623 1.00 0.00 H new ATOM 0 HE2 LYS A 180 -0.062 -8.695 -1.347 1.00 0.00 H new ATOM 0 HE3 LYS A 180 -1.322 -7.656 -1.983 1.00 0.00 H new ATOM 0 HZ1 LYS A 180 -2.223 -9.791 -1.273 1.00 0.00 H new ATOM 0 HZ2 LYS A 180 -2.408 -9.612 -2.951 1.00 0.00 H new ATOM 0 HZ3 LYS A 180 -1.188 -10.618 -2.335 1.00 0.00 H new ATOM 103 N GLN A 181 4.287 -6.789 -3.310 1.00 0.00 N ATOM 104 CA GLN A 181 5.113 -6.714 -2.072 1.00 0.00 C ATOM 105 C GLN A 181 5.947 -5.438 -2.089 1.00 0.00 C ATOM 106 O GLN A 181 6.055 -4.735 -1.107 1.00 0.00 O ATOM 107 CB GLN A 181 6.032 -7.937 -2.002 1.00 0.00 C ATOM 108 CG GLN A 181 6.799 -7.940 -0.679 1.00 0.00 C ATOM 109 CD GLN A 181 5.816 -8.202 0.462 1.00 0.00 C ATOM 110 OE1 GLN A 181 5.472 -9.334 0.734 1.00 0.00 O ATOM 111 NE2 GLN A 181 5.336 -7.195 1.137 1.00 0.00 N ATOM 0 H GLN A 181 4.482 -7.583 -3.920 1.00 0.00 H new ATOM 0 HA GLN A 181 4.462 -6.701 -1.198 1.00 0.00 H new ATOM 0 HB2 GLN A 181 5.444 -8.850 -2.093 1.00 0.00 H new ATOM 0 HB3 GLN A 181 6.732 -7.925 -2.838 1.00 0.00 H new ATOM 0 HG2 GLN A 181 7.573 -8.707 -0.694 1.00 0.00 H new ATOM 0 HG3 GLN A 181 7.301 -6.984 -0.532 1.00 0.00 H new ATOM 0 HE21 GLN A 181 5.625 -6.244 0.909 1.00 0.00 H new ATOM 0 HE22 GLN A 181 4.672 -7.358 1.893 1.00 0.00 H new ATOM 120 N HIS A 182 6.536 -5.135 -3.202 1.00 0.00 N ATOM 121 CA HIS A 182 7.363 -3.910 -3.305 1.00 0.00 C ATOM 122 C HIS A 182 6.470 -2.675 -3.209 1.00 0.00 C ATOM 123 O HIS A 182 6.857 -1.653 -2.678 1.00 0.00 O ATOM 124 CB HIS A 182 8.080 -3.951 -4.642 1.00 0.00 C ATOM 125 CG HIS A 182 8.915 -2.725 -4.841 1.00 0.00 C ATOM 126 ND1 HIS A 182 9.693 -2.172 -3.838 1.00 0.00 N ATOM 127 CD2 HIS A 182 9.118 -1.949 -5.947 1.00 0.00 C ATOM 128 CE1 HIS A 182 10.329 -1.108 -4.363 1.00 0.00 C ATOM 129 NE2 HIS A 182 10.012 -0.927 -5.648 1.00 0.00 N ATOM 0 H HIS A 182 6.480 -5.690 -4.056 1.00 0.00 H new ATOM 0 HA HIS A 182 8.090 -3.861 -2.494 1.00 0.00 H new ATOM 0 HB2 HIS A 182 8.712 -4.838 -4.693 1.00 0.00 H new ATOM 0 HB3 HIS A 182 7.350 -4.033 -5.448 1.00 0.00 H new ATOM 0 HD2 HIS A 182 8.654 -2.106 -6.909 1.00 0.00 H new ATOM 0 HE1 HIS A 182 11.012 -0.478 -3.813 1.00 0.00 H new ATOM 0 HE2 HIS A 182 10.352 -0.197 -6.274 1.00 0.00 H new ATOM 137 N VAL A 183 5.283 -2.757 -3.731 1.00 0.00 N ATOM 138 CA VAL A 183 4.373 -1.588 -3.675 1.00 0.00 C ATOM 139 C VAL A 183 3.957 -1.335 -2.229 1.00 0.00 C ATOM 140 O VAL A 183 3.893 -0.205 -1.790 1.00 0.00 O ATOM 141 CB VAL A 183 3.134 -1.847 -4.552 1.00 0.00 C ATOM 142 CG1 VAL A 183 2.074 -0.766 -4.279 1.00 0.00 C ATOM 143 CG2 VAL A 183 3.526 -1.820 -6.053 1.00 0.00 C ATOM 0 H VAL A 183 4.904 -3.583 -4.194 1.00 0.00 H new ATOM 0 HA VAL A 183 4.890 -0.706 -4.054 1.00 0.00 H new ATOM 0 HB VAL A 183 2.727 -2.828 -4.308 1.00 0.00 H new ATOM 0 HG11 VAL A 183 1.198 -0.951 -4.900 1.00 0.00 H new ATOM 0 HG12 VAL A 183 1.786 -0.796 -3.228 1.00 0.00 H new ATOM 0 HG13 VAL A 183 2.486 0.215 -4.515 1.00 0.00 H new ATOM 0 HG21 VAL A 183 2.642 -2.004 -6.663 1.00 0.00 H new ATOM 0 HG22 VAL A 183 3.942 -0.844 -6.303 1.00 0.00 H new ATOM 0 HG23 VAL A 183 4.270 -2.593 -6.249 1.00 0.00 H new ATOM 153 N LEU A 184 3.673 -2.359 -1.470 1.00 0.00 N ATOM 154 CA LEU A 184 3.270 -2.106 -0.064 1.00 0.00 C ATOM 155 C LEU A 184 4.394 -1.342 0.637 1.00 0.00 C ATOM 156 O LEU A 184 4.154 -0.422 1.391 1.00 0.00 O ATOM 157 CB LEU A 184 3.006 -3.427 0.656 1.00 0.00 C ATOM 158 CG LEU A 184 1.774 -4.123 0.064 1.00 0.00 C ATOM 159 CD1 LEU A 184 1.641 -5.503 0.706 1.00 0.00 C ATOM 160 CD2 LEU A 184 0.499 -3.306 0.334 1.00 0.00 C ATOM 0 H LEU A 184 3.702 -3.337 -1.757 1.00 0.00 H new ATOM 0 HA LEU A 184 2.353 -1.517 -0.045 1.00 0.00 H new ATOM 0 HB2 LEU A 184 3.876 -4.077 0.567 1.00 0.00 H new ATOM 0 HB3 LEU A 184 2.852 -3.244 1.719 1.00 0.00 H new ATOM 0 HG LEU A 184 1.898 -4.213 -1.015 1.00 0.00 H new ATOM 0 HD11 LEU A 184 0.769 -6.012 0.296 1.00 0.00 H new ATOM 0 HD12 LEU A 184 2.536 -6.089 0.497 1.00 0.00 H new ATOM 0 HD13 LEU A 184 1.523 -5.393 1.784 1.00 0.00 H new ATOM 0 HD21 LEU A 184 -0.361 -3.820 -0.096 1.00 0.00 H new ATOM 0 HD22 LEU A 184 0.357 -3.198 1.409 1.00 0.00 H new ATOM 0 HD23 LEU A 184 0.596 -2.320 -0.120 1.00 0.00 H new ATOM 172 N ASP A 185 5.625 -1.692 0.375 1.00 0.00 N ATOM 173 CA ASP A 185 6.751 -0.953 1.013 1.00 0.00 C ATOM 174 C ASP A 185 6.599 0.530 0.713 1.00 0.00 C ATOM 175 O ASP A 185 6.837 1.373 1.553 1.00 0.00 O ATOM 176 CB ASP A 185 8.083 -1.457 0.456 1.00 0.00 C ATOM 177 CG ASP A 185 8.357 -2.856 1.006 1.00 0.00 C ATOM 178 OD1 ASP A 185 7.829 -3.169 2.061 1.00 0.00 O ATOM 179 OD2 ASP A 185 9.090 -3.591 0.368 1.00 0.00 O ATOM 0 H ASP A 185 5.898 -2.452 -0.248 1.00 0.00 H new ATOM 0 HA ASP A 185 6.734 -1.116 2.091 1.00 0.00 H new ATOM 0 HB2 ASP A 185 8.050 -1.481 -0.633 1.00 0.00 H new ATOM 0 HB3 ASP A 185 8.889 -0.778 0.736 1.00 0.00 H new ATOM 184 N MET A 186 6.190 0.862 -0.474 1.00 0.00 N ATOM 185 CA MET A 186 6.008 2.296 -0.802 1.00 0.00 C ATOM 186 C MET A 186 4.862 2.854 0.038 1.00 0.00 C ATOM 187 O MET A 186 4.898 3.984 0.481 1.00 0.00 O ATOM 188 CB MET A 186 5.670 2.455 -2.283 1.00 0.00 C ATOM 189 CG MET A 186 6.844 1.986 -3.142 1.00 0.00 C ATOM 190 SD MET A 186 8.272 3.069 -2.859 1.00 0.00 S ATOM 191 CE MET A 186 9.303 2.487 -4.232 1.00 0.00 C ATOM 0 H MET A 186 5.975 0.208 -1.226 1.00 0.00 H new ATOM 0 HA MET A 186 6.930 2.836 -0.587 1.00 0.00 H new ATOM 0 HB2 MET A 186 4.778 1.877 -2.525 1.00 0.00 H new ATOM 0 HB3 MET A 186 5.442 3.498 -2.502 1.00 0.00 H new ATOM 0 HG2 MET A 186 7.101 0.956 -2.895 1.00 0.00 H new ATOM 0 HG3 MET A 186 6.566 2.001 -4.196 1.00 0.00 H new ATOM 0 HE1 MET A 186 10.354 2.541 -3.946 1.00 0.00 H new ATOM 0 HE2 MET A 186 9.044 1.455 -4.469 1.00 0.00 H new ATOM 0 HE3 MET A 186 9.132 3.114 -5.107 1.00 0.00 H new ATOM 201 N LEU A 187 3.839 2.073 0.253 1.00 0.00 N ATOM 202 CA LEU A 187 2.687 2.565 1.059 1.00 0.00 C ATOM 203 C LEU A 187 3.142 2.812 2.495 1.00 0.00 C ATOM 204 O LEU A 187 2.889 3.855 3.063 1.00 0.00 O ATOM 205 CB LEU A 187 1.577 1.511 1.073 1.00 0.00 C ATOM 206 CG LEU A 187 1.100 1.175 -0.347 1.00 0.00 C ATOM 207 CD1 LEU A 187 -0.136 0.273 -0.246 1.00 0.00 C ATOM 208 CD2 LEU A 187 0.728 2.453 -1.106 1.00 0.00 C ATOM 0 H LEU A 187 3.751 1.118 -0.094 1.00 0.00 H new ATOM 0 HA LEU A 187 2.314 3.489 0.618 1.00 0.00 H new ATOM 0 HB2 LEU A 187 1.940 0.606 1.559 1.00 0.00 H new ATOM 0 HB3 LEU A 187 0.736 1.875 1.664 1.00 0.00 H new ATOM 0 HG LEU A 187 1.902 0.670 -0.885 1.00 0.00 H new ATOM 0 HD11 LEU A 187 -0.488 0.025 -1.247 1.00 0.00 H new ATOM 0 HD12 LEU A 187 0.124 -0.643 0.285 1.00 0.00 H new ATOM 0 HD13 LEU A 187 -0.924 0.795 0.297 1.00 0.00 H new ATOM 0 HD21 LEU A 187 0.392 2.195 -2.110 1.00 0.00 H new ATOM 0 HD22 LEU A 187 -0.073 2.970 -0.577 1.00 0.00 H new ATOM 0 HD23 LEU A 187 1.600 3.104 -1.171 1.00 0.00 H new ATOM 220 N PHE A 188 3.817 1.863 3.090 1.00 0.00 N ATOM 221 CA PHE A 188 4.284 2.067 4.485 1.00 0.00 C ATOM 222 C PHE A 188 5.177 3.297 4.516 1.00 0.00 C ATOM 223 O PHE A 188 5.071 4.127 5.394 1.00 0.00 O ATOM 224 CB PHE A 188 5.051 0.831 4.975 1.00 0.00 C ATOM 225 CG PHE A 188 4.071 -0.268 5.331 1.00 0.00 C ATOM 226 CD1 PHE A 188 3.370 -0.219 6.547 1.00 0.00 C ATOM 227 CD2 PHE A 188 3.859 -1.331 4.446 1.00 0.00 C ATOM 228 CE1 PHE A 188 2.459 -1.235 6.872 1.00 0.00 C ATOM 229 CE2 PHE A 188 2.948 -2.344 4.770 1.00 0.00 C ATOM 230 CZ PHE A 188 2.249 -2.297 5.982 1.00 0.00 C ATOM 0 H PHE A 188 4.061 0.965 2.672 1.00 0.00 H new ATOM 0 HA PHE A 188 3.431 2.214 5.147 1.00 0.00 H new ATOM 0 HB2 PHE A 188 5.735 0.485 4.201 1.00 0.00 H new ATOM 0 HB3 PHE A 188 5.657 1.087 5.844 1.00 0.00 H new ATOM 0 HD1 PHE A 188 3.532 0.600 7.232 1.00 0.00 H new ATOM 0 HD2 PHE A 188 4.399 -1.370 3.511 1.00 0.00 H new ATOM 0 HE1 PHE A 188 1.920 -1.199 7.807 1.00 0.00 H new ATOM 0 HE2 PHE A 188 2.785 -3.162 4.084 1.00 0.00 H new ATOM 0 HZ PHE A 188 1.548 -3.079 6.231 1.00 0.00 H new ATOM 240 N SER A 189 6.039 3.444 3.554 1.00 0.00 N ATOM 241 CA SER A 189 6.906 4.652 3.544 1.00 0.00 C ATOM 242 C SER A 189 6.008 5.886 3.444 1.00 0.00 C ATOM 243 O SER A 189 6.177 6.860 4.156 1.00 0.00 O ATOM 244 CB SER A 189 7.842 4.611 2.341 1.00 0.00 C ATOM 245 OG SER A 189 7.071 4.613 1.149 1.00 0.00 O ATOM 0 H SER A 189 6.181 2.791 2.784 1.00 0.00 H new ATOM 0 HA SER A 189 7.504 4.687 4.455 1.00 0.00 H new ATOM 0 HB2 SER A 189 8.511 5.471 2.357 1.00 0.00 H new ATOM 0 HB3 SER A 189 8.468 3.719 2.382 1.00 0.00 H new ATOM 0 HG SER A 189 6.238 4.118 1.297 1.00 0.00 H new ATOM 251 N ALA A 190 5.039 5.841 2.573 1.00 0.00 N ATOM 252 CA ALA A 190 4.107 6.987 2.433 1.00 0.00 C ATOM 253 C ALA A 190 3.290 7.117 3.711 1.00 0.00 C ATOM 254 O ALA A 190 3.158 8.186 4.265 1.00 0.00 O ATOM 255 CB ALA A 190 3.178 6.735 1.243 1.00 0.00 C ATOM 0 H ALA A 190 4.854 5.054 1.950 1.00 0.00 H new ATOM 0 HA ALA A 190 4.665 7.908 2.264 1.00 0.00 H new ATOM 0 HB1 ALA A 190 2.490 7.574 1.134 1.00 0.00 H new ATOM 0 HB2 ALA A 190 3.771 6.632 0.334 1.00 0.00 H new ATOM 0 HB3 ALA A 190 2.610 5.820 1.412 1.00 0.00 H new ATOM 261 N PHE A 191 2.743 6.031 4.195 1.00 0.00 N ATOM 262 CA PHE A 191 1.936 6.113 5.444 1.00 0.00 C ATOM 263 C PHE A 191 2.847 6.427 6.626 1.00 0.00 C ATOM 264 O PHE A 191 2.396 6.890 7.654 1.00 0.00 O ATOM 265 CB PHE A 191 1.160 4.809 5.685 1.00 0.00 C ATOM 266 CG PHE A 191 -0.083 4.798 4.816 1.00 0.00 C ATOM 267 CD1 PHE A 191 -1.143 5.671 5.107 1.00 0.00 C ATOM 268 CD2 PHE A 191 -0.167 3.936 3.719 1.00 0.00 C ATOM 269 CE1 PHE A 191 -2.288 5.677 4.301 1.00 0.00 C ATOM 270 CE2 PHE A 191 -1.310 3.943 2.909 1.00 0.00 C ATOM 271 CZ PHE A 191 -2.372 4.812 3.199 1.00 0.00 C ATOM 0 H PHE A 191 2.820 5.101 3.783 1.00 0.00 H new ATOM 0 HA PHE A 191 1.207 6.916 5.337 1.00 0.00 H new ATOM 0 HB2 PHE A 191 1.789 3.950 5.451 1.00 0.00 H new ATOM 0 HB3 PHE A 191 0.884 4.726 6.736 1.00 0.00 H new ATOM 0 HD1 PHE A 191 -1.075 6.339 5.953 1.00 0.00 H new ATOM 0 HD2 PHE A 191 0.649 3.265 3.496 1.00 0.00 H new ATOM 0 HE1 PHE A 191 -3.105 6.346 4.527 1.00 0.00 H new ATOM 0 HE2 PHE A 191 -1.373 3.278 2.060 1.00 0.00 H new ATOM 0 HZ PHE A 191 -3.253 4.816 2.575 1.00 0.00 H new ATOM 281 N GLU A 192 4.122 6.202 6.493 1.00 0.00 N ATOM 282 CA GLU A 192 5.035 6.519 7.621 1.00 0.00 C ATOM 283 C GLU A 192 5.082 8.040 7.787 1.00 0.00 C ATOM 284 O GLU A 192 5.275 8.548 8.873 1.00 0.00 O ATOM 285 CB GLU A 192 6.441 5.969 7.335 1.00 0.00 C ATOM 286 CG GLU A 192 7.357 6.211 8.541 1.00 0.00 C ATOM 287 CD GLU A 192 6.898 5.342 9.716 1.00 0.00 C ATOM 288 OE1 GLU A 192 6.048 4.490 9.502 1.00 0.00 O ATOM 289 OE2 GLU A 192 7.410 5.535 10.805 1.00 0.00 O ATOM 0 H GLU A 192 4.568 5.816 5.661 1.00 0.00 H new ATOM 0 HA GLU A 192 4.672 6.056 8.539 1.00 0.00 H new ATOM 0 HB2 GLU A 192 6.386 4.902 7.119 1.00 0.00 H new ATOM 0 HB3 GLU A 192 6.856 6.452 6.450 1.00 0.00 H new ATOM 0 HG2 GLU A 192 8.388 5.973 8.281 1.00 0.00 H new ATOM 0 HG3 GLU A 192 7.334 7.264 8.823 1.00 0.00 H new ATOM 296 N LYS A 193 4.903 8.770 6.715 1.00 0.00 N ATOM 297 CA LYS A 193 4.935 10.263 6.811 1.00 0.00 C ATOM 298 C LYS A 193 3.566 10.803 7.254 1.00 0.00 C ATOM 299 O LYS A 193 3.480 11.826 7.905 1.00 0.00 O ATOM 300 CB LYS A 193 5.289 10.847 5.444 1.00 0.00 C ATOM 301 CG LYS A 193 6.749 10.537 5.129 1.00 0.00 C ATOM 302 CD LYS A 193 7.103 11.113 3.759 1.00 0.00 C ATOM 303 CE LYS A 193 8.592 10.904 3.484 1.00 0.00 C ATOM 304 NZ LYS A 193 9.398 11.493 4.596 1.00 0.00 N ATOM 0 H LYS A 193 4.736 8.399 5.780 1.00 0.00 H new ATOM 0 HA LYS A 193 5.683 10.554 7.548 1.00 0.00 H new ATOM 0 HB2 LYS A 193 4.641 10.425 4.676 1.00 0.00 H new ATOM 0 HB3 LYS A 193 5.125 11.925 5.442 1.00 0.00 H new ATOM 0 HG2 LYS A 193 7.397 10.964 5.894 1.00 0.00 H new ATOM 0 HG3 LYS A 193 6.914 9.460 5.137 1.00 0.00 H new ATOM 0 HD2 LYS A 193 6.508 10.628 2.985 1.00 0.00 H new ATOM 0 HD3 LYS A 193 6.863 12.176 3.727 1.00 0.00 H new ATOM 0 HE2 LYS A 193 8.808 9.840 3.390 1.00 0.00 H new ATOM 0 HE3 LYS A 193 8.866 11.370 2.537 1.00 0.00 H new ATOM 0 HZ1 LYS A 193 10.371 11.659 4.269 1.00 0.00 H new ATOM 0 HZ2 LYS A 193 8.974 12.395 4.892 1.00 0.00 H new ATOM 0 HZ3 LYS A 193 9.410 10.836 5.402 1.00 0.00 H new ATOM 318 N HIS A 194 2.493 10.133 6.916 1.00 0.00 N ATOM 319 CA HIS A 194 1.142 10.629 7.334 1.00 0.00 C ATOM 320 C HIS A 194 0.150 9.461 7.429 1.00 0.00 C ATOM 321 O HIS A 194 0.250 8.488 6.717 1.00 0.00 O ATOM 322 CB HIS A 194 0.628 11.654 6.312 1.00 0.00 C ATOM 323 CG HIS A 194 1.353 12.958 6.483 1.00 0.00 C ATOM 324 ND1 HIS A 194 2.060 13.544 5.450 1.00 0.00 N ATOM 325 CD2 HIS A 194 1.477 13.806 7.552 1.00 0.00 C ATOM 326 CE1 HIS A 194 2.569 14.701 5.912 1.00 0.00 C ATOM 327 NE2 HIS A 194 2.247 14.908 7.190 1.00 0.00 N ATOM 0 H HIS A 194 2.491 9.270 6.373 1.00 0.00 H new ATOM 0 HA HIS A 194 1.230 11.100 8.313 1.00 0.00 H new ATOM 0 HB2 HIS A 194 0.776 11.276 5.300 1.00 0.00 H new ATOM 0 HB3 HIS A 194 -0.444 11.804 6.443 1.00 0.00 H new ATOM 0 HD2 HIS A 194 1.043 13.644 8.528 1.00 0.00 H new ATOM 0 HE1 HIS A 194 3.166 15.379 5.320 1.00 0.00 H new ATOM 0 HE2 HIS A 194 2.508 15.702 7.775 1.00 0.00 H new ATOM 335 N GLN A 195 -0.799 9.551 8.321 1.00 0.00 N ATOM 336 CA GLN A 195 -1.799 8.451 8.482 1.00 0.00 C ATOM 337 C GLN A 195 -2.728 8.350 7.263 1.00 0.00 C ATOM 338 O GLN A 195 -3.239 7.288 6.972 1.00 0.00 O ATOM 339 CB GLN A 195 -2.639 8.703 9.749 1.00 0.00 C ATOM 340 CG GLN A 195 -3.565 7.505 10.027 1.00 0.00 C ATOM 341 CD GLN A 195 -2.725 6.315 10.497 1.00 0.00 C ATOM 342 OE1 GLN A 195 -2.319 6.257 11.640 1.00 0.00 O ATOM 343 NE2 GLN A 195 -2.433 5.362 9.654 1.00 0.00 N ATOM 0 H GLN A 195 -0.927 10.344 8.950 1.00 0.00 H new ATOM 0 HA GLN A 195 -1.256 7.510 8.571 1.00 0.00 H new ATOM 0 HB2 GLN A 195 -1.981 8.868 10.602 1.00 0.00 H new ATOM 0 HB3 GLN A 195 -3.233 9.609 9.625 1.00 0.00 H new ATOM 0 HG2 GLN A 195 -4.301 7.768 10.787 1.00 0.00 H new ATOM 0 HG3 GLN A 195 -4.118 7.241 9.125 1.00 0.00 H new ATOM 0 HE21 GLN A 195 -2.773 5.409 8.694 1.00 0.00 H new ATOM 0 HE22 GLN A 195 -1.865 4.571 9.956 1.00 0.00 H new ATOM 352 N TYR A 196 -2.997 9.440 6.575 1.00 0.00 N ATOM 353 CA TYR A 196 -3.960 9.382 5.415 1.00 0.00 C ATOM 354 C TYR A 196 -3.301 9.735 4.070 1.00 0.00 C ATOM 355 O TYR A 196 -2.416 10.563 3.987 1.00 0.00 O ATOM 356 CB TYR A 196 -5.084 10.382 5.685 1.00 0.00 C ATOM 357 CG TYR A 196 -5.823 9.986 6.939 1.00 0.00 C ATOM 358 CD1 TYR A 196 -6.909 9.106 6.864 1.00 0.00 C ATOM 359 CD2 TYR A 196 -5.433 10.515 8.176 1.00 0.00 C ATOM 360 CE1 TYR A 196 -7.605 8.752 8.025 1.00 0.00 C ATOM 361 CE2 TYR A 196 -6.132 10.165 9.336 1.00 0.00 C ATOM 362 CZ TYR A 196 -7.217 9.284 9.265 1.00 0.00 C ATOM 363 OH TYR A 196 -7.910 8.951 10.412 1.00 0.00 O ATOM 0 H TYR A 196 -2.597 10.360 6.762 1.00 0.00 H new ATOM 0 HA TYR A 196 -4.327 8.359 5.336 1.00 0.00 H new ATOM 0 HB2 TYR A 196 -4.673 11.386 5.795 1.00 0.00 H new ATOM 0 HB3 TYR A 196 -5.771 10.409 4.839 1.00 0.00 H new ATOM 0 HD1 TYR A 196 -7.210 8.700 5.909 1.00 0.00 H new ATOM 0 HD2 TYR A 196 -4.594 11.192 8.234 1.00 0.00 H new ATOM 0 HE1 TYR A 196 -8.440 8.070 7.967 1.00 0.00 H new ATOM 0 HE2 TYR A 196 -5.833 10.576 10.289 1.00 0.00 H new ATOM 0 HH TYR A 196 -7.508 9.406 11.181 1.00 0.00 H new ATOM 373 N TYR A 197 -3.783 9.113 3.012 1.00 0.00 N ATOM 374 CA TYR A 197 -3.274 9.387 1.625 1.00 0.00 C ATOM 375 C TYR A 197 -4.405 9.155 0.608 1.00 0.00 C ATOM 376 O TYR A 197 -5.059 8.131 0.621 1.00 0.00 O ATOM 377 CB TYR A 197 -2.090 8.459 1.294 1.00 0.00 C ATOM 378 CG TYR A 197 -0.803 9.029 1.840 1.00 0.00 C ATOM 379 CD1 TYR A 197 -0.399 8.758 3.149 1.00 0.00 C ATOM 380 CD2 TYR A 197 -0.010 9.832 1.014 1.00 0.00 C ATOM 381 CE1 TYR A 197 0.803 9.294 3.634 1.00 0.00 C ATOM 382 CE2 TYR A 197 1.190 10.366 1.494 1.00 0.00 C ATOM 383 CZ TYR A 197 1.600 10.098 2.806 1.00 0.00 C ATOM 384 OH TYR A 197 2.787 10.629 3.282 1.00 0.00 O ATOM 0 H TYR A 197 -4.523 8.413 3.055 1.00 0.00 H new ATOM 0 HA TYR A 197 -2.936 10.422 1.573 1.00 0.00 H new ATOM 0 HB2 TYR A 197 -2.266 7.470 1.718 1.00 0.00 H new ATOM 0 HB3 TYR A 197 -2.010 8.333 0.214 1.00 0.00 H new ATOM 0 HD1 TYR A 197 -1.011 8.137 3.787 1.00 0.00 H new ATOM 0 HD2 TYR A 197 -0.325 10.040 0.002 1.00 0.00 H new ATOM 0 HE1 TYR A 197 1.115 9.087 4.647 1.00 0.00 H new ATOM 0 HE2 TYR A 197 1.800 10.985 0.853 1.00 0.00 H new ATOM 0 HH TYR A 197 3.407 9.902 3.498 1.00 0.00 H new ATOM 394 N ASN A 198 -4.641 10.090 -0.282 1.00 0.00 N ATOM 395 CA ASN A 198 -5.728 9.894 -1.296 1.00 0.00 C ATOM 396 C ASN A 198 -5.163 9.192 -2.539 1.00 0.00 C ATOM 397 O ASN A 198 -3.966 9.100 -2.727 1.00 0.00 O ATOM 398 CB ASN A 198 -6.332 11.249 -1.683 1.00 0.00 C ATOM 399 CG ASN A 198 -5.354 12.051 -2.535 1.00 0.00 C ATOM 400 OD1 ASN A 198 -4.182 11.742 -2.596 1.00 0.00 O ATOM 401 ND2 ASN A 198 -5.800 13.078 -3.211 1.00 0.00 N ATOM 0 H ASN A 198 -4.134 10.972 -0.351 1.00 0.00 H new ATOM 0 HA ASN A 198 -6.511 9.270 -0.864 1.00 0.00 H new ATOM 0 HB2 ASN A 198 -7.260 11.095 -2.233 1.00 0.00 H new ATOM 0 HB3 ASN A 198 -6.584 11.811 -0.784 1.00 0.00 H new ATOM 0 HD21 ASN A 198 -5.162 13.622 -3.792 1.00 0.00 H new ATOM 0 HD22 ASN A 198 -6.786 13.335 -3.157 1.00 0.00 H new ATOM 408 N LEU A 199 -6.018 8.693 -3.387 1.00 0.00 N ATOM 409 CA LEU A 199 -5.537 7.995 -4.614 1.00 0.00 C ATOM 410 C LEU A 199 -4.595 8.923 -5.407 1.00 0.00 C ATOM 411 O LEU A 199 -3.580 8.496 -5.919 1.00 0.00 O ATOM 412 CB LEU A 199 -6.749 7.636 -5.487 1.00 0.00 C ATOM 413 CG LEU A 199 -7.649 6.630 -4.745 1.00 0.00 C ATOM 414 CD1 LEU A 199 -8.953 6.435 -5.521 1.00 0.00 C ATOM 415 CD2 LEU A 199 -6.934 5.270 -4.603 1.00 0.00 C ATOM 0 H LEU A 199 -7.032 8.738 -3.284 1.00 0.00 H new ATOM 0 HA LEU A 199 -4.996 7.091 -4.333 1.00 0.00 H new ATOM 0 HB2 LEU A 199 -7.315 8.536 -5.727 1.00 0.00 H new ATOM 0 HB3 LEU A 199 -6.414 7.209 -6.432 1.00 0.00 H new ATOM 0 HG LEU A 199 -7.865 7.024 -3.752 1.00 0.00 H new ATOM 0 HD11 LEU A 199 -9.587 5.723 -4.993 1.00 0.00 H new ATOM 0 HD12 LEU A 199 -9.472 7.390 -5.606 1.00 0.00 H new ATOM 0 HD13 LEU A 199 -8.730 6.053 -6.517 1.00 0.00 H new ATOM 0 HD21 LEU A 199 -7.584 4.571 -4.077 1.00 0.00 H new ATOM 0 HD22 LEU A 199 -6.702 4.876 -5.592 1.00 0.00 H new ATOM 0 HD23 LEU A 199 -6.010 5.402 -4.040 1.00 0.00 H new ATOM 427 N LYS A 200 -4.927 10.182 -5.531 1.00 0.00 N ATOM 428 CA LYS A 200 -4.055 11.117 -6.321 1.00 0.00 C ATOM 429 C LYS A 200 -2.636 11.181 -5.742 1.00 0.00 C ATOM 430 O LYS A 200 -1.661 11.188 -6.468 1.00 0.00 O ATOM 431 CB LYS A 200 -4.668 12.526 -6.312 1.00 0.00 C ATOM 432 CG LYS A 200 -3.920 13.457 -7.296 1.00 0.00 C ATOM 433 CD LYS A 200 -4.532 13.363 -8.697 1.00 0.00 C ATOM 434 CE LYS A 200 -3.676 14.179 -9.675 1.00 0.00 C ATOM 435 NZ LYS A 200 -4.276 14.119 -11.038 1.00 0.00 N ATOM 0 H LYS A 200 -5.760 10.607 -5.123 1.00 0.00 H new ATOM 0 HA LYS A 200 -3.994 10.739 -7.342 1.00 0.00 H new ATOM 0 HB2 LYS A 200 -5.722 12.471 -6.586 1.00 0.00 H new ATOM 0 HB3 LYS A 200 -4.622 12.941 -5.305 1.00 0.00 H new ATOM 0 HG2 LYS A 200 -3.969 14.486 -6.940 1.00 0.00 H new ATOM 0 HG3 LYS A 200 -2.866 13.183 -7.335 1.00 0.00 H new ATOM 0 HD2 LYS A 200 -4.580 12.322 -9.017 1.00 0.00 H new ATOM 0 HD3 LYS A 200 -5.554 13.741 -8.687 1.00 0.00 H new ATOM 0 HE2 LYS A 200 -3.612 15.214 -9.341 1.00 0.00 H new ATOM 0 HE3 LYS A 200 -2.659 13.788 -9.697 1.00 0.00 H new ATOM 0 HZ1 LYS A 200 -3.694 14.673 -11.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 200 -4.315 13.130 -11.357 1.00 0.00 H new ATOM 0 HZ3 LYS A 200 -5.238 14.512 -11.011 1.00 0.00 H new ATOM 449 N ASP A 201 -2.499 11.250 -4.456 1.00 0.00 N ATOM 450 CA ASP A 201 -1.127 11.330 -3.882 1.00 0.00 C ATOM 451 C ASP A 201 -0.400 10.004 -4.104 1.00 0.00 C ATOM 452 O ASP A 201 0.774 9.971 -4.413 1.00 0.00 O ATOM 453 CB ASP A 201 -1.211 11.635 -2.380 1.00 0.00 C ATOM 454 CG ASP A 201 -1.628 13.092 -2.173 1.00 0.00 C ATOM 455 OD1 ASP A 201 -1.461 13.874 -3.095 1.00 0.00 O ATOM 456 OD2 ASP A 201 -2.098 13.405 -1.092 1.00 0.00 O ATOM 0 H ASP A 201 -3.263 11.255 -3.780 1.00 0.00 H new ATOM 0 HA ASP A 201 -0.574 12.128 -4.377 1.00 0.00 H new ATOM 0 HB2 ASP A 201 -1.931 10.969 -1.904 1.00 0.00 H new ATOM 0 HB3 ASP A 201 -0.246 11.452 -1.907 1.00 0.00 H new ATOM 461 N LEU A 202 -1.092 8.915 -3.936 1.00 0.00 N ATOM 462 CA LEU A 202 -0.455 7.576 -4.111 1.00 0.00 C ATOM 463 C LEU A 202 0.088 7.381 -5.535 1.00 0.00 C ATOM 464 O LEU A 202 1.149 6.817 -5.722 1.00 0.00 O ATOM 465 CB LEU A 202 -1.494 6.490 -3.818 1.00 0.00 C ATOM 466 CG LEU A 202 -1.889 6.518 -2.329 1.00 0.00 C ATOM 467 CD1 LEU A 202 -2.996 5.489 -2.088 1.00 0.00 C ATOM 468 CD2 LEU A 202 -0.670 6.184 -1.439 1.00 0.00 C ATOM 0 H LEU A 202 -2.080 8.891 -3.683 1.00 0.00 H new ATOM 0 HA LEU A 202 0.385 7.508 -3.420 1.00 0.00 H new ATOM 0 HB2 LEU A 202 -2.377 6.644 -4.439 1.00 0.00 H new ATOM 0 HB3 LEU A 202 -1.090 5.511 -4.076 1.00 0.00 H new ATOM 0 HG LEU A 202 -2.243 7.516 -2.072 1.00 0.00 H new ATOM 0 HD11 LEU A 202 -3.282 5.502 -1.036 1.00 0.00 H new ATOM 0 HD12 LEU A 202 -3.862 5.735 -2.703 1.00 0.00 H new ATOM 0 HD13 LEU A 202 -2.634 4.496 -2.353 1.00 0.00 H new ATOM 0 HD21 LEU A 202 -0.967 6.208 -0.391 1.00 0.00 H new ATOM 0 HD22 LEU A 202 -0.299 5.190 -1.688 1.00 0.00 H new ATOM 0 HD23 LEU A 202 0.117 6.918 -1.610 1.00 0.00 H new ATOM 480 N VAL A 203 -0.612 7.825 -6.541 1.00 0.00 N ATOM 481 CA VAL A 203 -0.089 7.628 -7.923 1.00 0.00 C ATOM 482 C VAL A 203 1.198 8.428 -8.093 1.00 0.00 C ATOM 483 O VAL A 203 2.122 8.000 -8.752 1.00 0.00 O ATOM 484 CB VAL A 203 -1.119 8.067 -8.966 1.00 0.00 C ATOM 485 CG1 VAL A 203 -2.268 7.058 -9.031 1.00 0.00 C ATOM 486 CG2 VAL A 203 -1.678 9.430 -8.575 1.00 0.00 C ATOM 0 H VAL A 203 -1.508 8.308 -6.471 1.00 0.00 H new ATOM 0 HA VAL A 203 0.113 6.568 -8.074 1.00 0.00 H new ATOM 0 HB VAL A 203 -0.635 8.123 -9.941 1.00 0.00 H new ATOM 0 HG11 VAL A 203 -2.994 7.381 -9.777 1.00 0.00 H new ATOM 0 HG12 VAL A 203 -1.877 6.079 -9.306 1.00 0.00 H new ATOM 0 HG13 VAL A 203 -2.752 6.995 -8.056 1.00 0.00 H new ATOM 0 HG21 VAL A 203 -2.413 9.748 -9.315 1.00 0.00 H new ATOM 0 HG22 VAL A 203 -2.154 9.361 -7.597 1.00 0.00 H new ATOM 0 HG23 VAL A 203 -0.867 10.157 -8.533 1.00 0.00 H new ATOM 496 N ASP A 204 1.276 9.589 -7.499 1.00 0.00 N ATOM 497 CA ASP A 204 2.524 10.389 -7.637 1.00 0.00 C ATOM 498 C ASP A 204 3.679 9.567 -7.067 1.00 0.00 C ATOM 499 O ASP A 204 4.750 9.485 -7.636 1.00 0.00 O ATOM 500 CB ASP A 204 2.388 11.705 -6.867 1.00 0.00 C ATOM 501 CG ASP A 204 3.605 12.583 -7.156 1.00 0.00 C ATOM 502 OD1 ASP A 204 4.513 12.105 -7.819 1.00 0.00 O ATOM 503 OD2 ASP A 204 3.610 13.719 -6.714 1.00 0.00 O ATOM 0 H ASP A 204 0.541 10.012 -6.933 1.00 0.00 H new ATOM 0 HA ASP A 204 2.709 10.622 -8.685 1.00 0.00 H new ATOM 0 HB2 ASP A 204 1.474 12.220 -7.162 1.00 0.00 H new ATOM 0 HB3 ASP A 204 2.312 11.509 -5.798 1.00 0.00 H new ATOM 508 N ILE A 205 3.453 8.939 -5.956 1.00 0.00 N ATOM 509 CA ILE A 205 4.503 8.096 -5.337 1.00 0.00 C ATOM 510 C ILE A 205 4.743 6.874 -6.239 1.00 0.00 C ATOM 511 O ILE A 205 5.840 6.358 -6.332 1.00 0.00 O ATOM 512 CB ILE A 205 4.005 7.653 -3.957 1.00 0.00 C ATOM 513 CG1 ILE A 205 3.682 8.901 -3.120 1.00 0.00 C ATOM 514 CG2 ILE A 205 5.081 6.831 -3.248 1.00 0.00 C ATOM 515 CD1 ILE A 205 3.100 8.484 -1.771 1.00 0.00 C ATOM 0 H ILE A 205 2.573 8.974 -5.442 1.00 0.00 H new ATOM 0 HA ILE A 205 5.438 8.645 -5.226 1.00 0.00 H new ATOM 0 HB ILE A 205 3.112 7.039 -4.075 1.00 0.00 H new ATOM 0 HG12 ILE A 205 4.585 9.493 -2.969 1.00 0.00 H new ATOM 0 HG13 ILE A 205 2.972 9.533 -3.653 1.00 0.00 H new ATOM 0 HG21 ILE A 205 4.716 6.522 -2.269 1.00 0.00 H new ATOM 0 HG22 ILE A 205 5.316 5.948 -3.843 1.00 0.00 H new ATOM 0 HG23 ILE A 205 5.980 7.436 -3.126 1.00 0.00 H new ATOM 0 HD11 ILE A 205 2.873 9.373 -1.182 1.00 0.00 H new ATOM 0 HD12 ILE A 205 2.186 7.911 -1.930 1.00 0.00 H new ATOM 0 HD13 ILE A 205 3.825 7.870 -1.236 1.00 0.00 H new ATOM 527 N THR A 206 3.709 6.407 -6.904 1.00 0.00 N ATOM 528 CA THR A 206 3.833 5.220 -7.804 1.00 0.00 C ATOM 529 C THR A 206 3.062 5.483 -9.105 1.00 0.00 C ATOM 530 O THR A 206 1.876 5.685 -9.098 1.00 0.00 O ATOM 531 CB THR A 206 3.219 4.009 -7.096 1.00 0.00 C ATOM 532 OG1 THR A 206 1.875 4.305 -6.743 1.00 0.00 O ATOM 533 CG2 THR A 206 4.021 3.689 -5.837 1.00 0.00 C ATOM 0 H THR A 206 2.772 6.807 -6.858 1.00 0.00 H new ATOM 0 HA THR A 206 4.882 5.034 -8.035 1.00 0.00 H new ATOM 0 HB THR A 206 3.240 3.147 -7.763 1.00 0.00 H new ATOM 0 HG1 THR A 206 1.500 4.942 -7.387 1.00 0.00 H new ATOM 0 HG21 THR A 206 3.582 2.827 -5.335 1.00 0.00 H new ATOM 0 HG22 THR A 206 5.052 3.464 -6.110 1.00 0.00 H new ATOM 0 HG23 THR A 206 4.003 4.548 -5.166 1.00 0.00 H new ATOM 541 N LYS A 207 3.726 5.475 -10.222 1.00 0.00 N ATOM 542 CA LYS A 207 3.019 5.726 -11.517 1.00 0.00 C ATOM 543 C LYS A 207 2.316 4.450 -11.983 1.00 0.00 C ATOM 544 O LYS A 207 2.001 4.295 -13.148 1.00 0.00 O ATOM 545 CB LYS A 207 4.027 6.165 -12.575 1.00 0.00 C ATOM 546 CG LYS A 207 4.641 7.502 -12.165 1.00 0.00 C ATOM 547 CD LYS A 207 5.698 7.904 -13.199 1.00 0.00 C ATOM 548 CE LYS A 207 6.490 9.105 -12.686 1.00 0.00 C ATOM 549 NZ LYS A 207 7.230 8.722 -11.451 1.00 0.00 N ATOM 0 H LYS A 207 4.729 5.306 -10.301 1.00 0.00 H new ATOM 0 HA LYS A 207 2.278 6.512 -11.371 1.00 0.00 H new ATOM 0 HB2 LYS A 207 4.807 5.412 -12.685 1.00 0.00 H new ATOM 0 HB3 LYS A 207 3.537 6.259 -13.544 1.00 0.00 H new ATOM 0 HG2 LYS A 207 3.868 8.267 -12.100 1.00 0.00 H new ATOM 0 HG3 LYS A 207 5.093 7.421 -11.176 1.00 0.00 H new ATOM 0 HD2 LYS A 207 6.370 7.068 -13.390 1.00 0.00 H new ATOM 0 HD3 LYS A 207 5.219 8.150 -14.146 1.00 0.00 H new ATOM 0 HE2 LYS A 207 7.188 9.447 -13.450 1.00 0.00 H new ATOM 0 HE3 LYS A 207 5.816 9.936 -12.476 1.00 0.00 H new ATOM 0 HZ1 LYS A 207 8.059 9.339 -11.338 1.00 0.00 H new ATOM 0 HZ2 LYS A 207 6.606 8.826 -10.626 1.00 0.00 H new ATOM 0 HZ3 LYS A 207 7.542 7.733 -11.526 1.00 0.00 H new ATOM 563 N GLN A 208 2.077 3.530 -11.086 1.00 0.00 N ATOM 564 CA GLN A 208 1.411 2.255 -11.479 1.00 0.00 C ATOM 565 C GLN A 208 -0.116 2.466 -11.544 1.00 0.00 C ATOM 566 O GLN A 208 -0.679 3.176 -10.735 1.00 0.00 O ATOM 567 CB GLN A 208 1.743 1.195 -10.426 1.00 0.00 C ATOM 568 CG GLN A 208 3.257 0.947 -10.437 1.00 0.00 C ATOM 569 CD GLN A 208 3.681 0.272 -9.137 1.00 0.00 C ATOM 570 OE1 GLN A 208 3.501 -0.918 -8.965 1.00 0.00 O ATOM 571 NE2 GLN A 208 4.244 0.991 -8.209 1.00 0.00 N ATOM 0 H GLN A 208 2.315 3.607 -10.097 1.00 0.00 H new ATOM 0 HA GLN A 208 1.763 1.933 -12.459 1.00 0.00 H new ATOM 0 HB2 GLN A 208 1.422 1.529 -9.439 1.00 0.00 H new ATOM 0 HB3 GLN A 208 1.207 0.270 -10.639 1.00 0.00 H new ATOM 0 HG2 GLN A 208 3.526 0.320 -11.287 1.00 0.00 H new ATOM 0 HG3 GLN A 208 3.788 1.891 -10.557 1.00 0.00 H new ATOM 0 HE21 GLN A 208 4.393 1.989 -8.357 1.00 0.00 H new ATOM 0 HE22 GLN A 208 4.536 0.556 -7.334 1.00 0.00 H new ATOM 580 N PRO A 209 -0.789 1.853 -12.497 1.00 0.00 N ATOM 581 CA PRO A 209 -2.268 1.994 -12.655 1.00 0.00 C ATOM 582 C PRO A 209 -3.027 1.991 -11.318 1.00 0.00 C ATOM 583 O PRO A 209 -2.832 1.132 -10.482 1.00 0.00 O ATOM 584 CB PRO A 209 -2.650 0.757 -13.474 1.00 0.00 C ATOM 585 CG PRO A 209 -1.444 0.441 -14.306 1.00 0.00 C ATOM 586 CD PRO A 209 -0.221 0.975 -13.542 1.00 0.00 C ATOM 0 HA PRO A 209 -2.528 2.945 -13.119 1.00 0.00 H new ATOM 0 HB2 PRO A 209 -2.909 -0.079 -12.825 1.00 0.00 H new ATOM 0 HB3 PRO A 209 -3.519 0.955 -14.101 1.00 0.00 H new ATOM 0 HG2 PRO A 209 -1.358 -0.633 -14.469 1.00 0.00 H new ATOM 0 HG3 PRO A 209 -1.520 0.908 -15.288 1.00 0.00 H new ATOM 0 HD2 PRO A 209 0.359 0.162 -13.105 1.00 0.00 H new ATOM 0 HD3 PRO A 209 0.449 1.526 -14.202 1.00 0.00 H new ATOM 594 N VAL A 210 -3.907 2.936 -11.126 1.00 0.00 N ATOM 595 CA VAL A 210 -4.688 2.980 -9.861 1.00 0.00 C ATOM 596 C VAL A 210 -5.436 1.666 -9.682 1.00 0.00 C ATOM 597 O VAL A 210 -5.481 1.104 -8.605 1.00 0.00 O ATOM 598 CB VAL A 210 -5.687 4.129 -9.903 1.00 0.00 C ATOM 599 CG1 VAL A 210 -4.933 5.445 -9.976 1.00 0.00 C ATOM 600 CG2 VAL A 210 -6.604 3.994 -11.124 1.00 0.00 C ATOM 0 H VAL A 210 -4.118 3.679 -11.792 1.00 0.00 H new ATOM 0 HA VAL A 210 -4.005 3.132 -9.026 1.00 0.00 H new ATOM 0 HB VAL A 210 -6.299 4.102 -9.001 1.00 0.00 H new ATOM 0 HG11 VAL A 210 -5.644 6.271 -10.006 1.00 0.00 H new ATOM 0 HG12 VAL A 210 -4.295 5.548 -9.098 1.00 0.00 H new ATOM 0 HG13 VAL A 210 -4.318 5.463 -10.876 1.00 0.00 H new ATOM 0 HG21 VAL A 210 -7.312 4.822 -11.140 1.00 0.00 H new ATOM 0 HG22 VAL A 210 -6.004 4.012 -12.034 1.00 0.00 H new ATOM 0 HG23 VAL A 210 -7.149 3.052 -11.067 1.00 0.00 H new ATOM 610 N VAL A 211 -6.038 1.175 -10.726 1.00 0.00 N ATOM 611 CA VAL A 211 -6.787 -0.097 -10.612 1.00 0.00 C ATOM 612 C VAL A 211 -5.906 -1.136 -9.928 1.00 0.00 C ATOM 613 O VAL A 211 -6.368 -1.924 -9.133 1.00 0.00 O ATOM 614 CB VAL A 211 -7.177 -0.592 -12.011 1.00 0.00 C ATOM 615 CG1 VAL A 211 -8.097 0.427 -12.693 1.00 0.00 C ATOM 616 CG2 VAL A 211 -5.914 -0.784 -12.858 1.00 0.00 C ATOM 0 H VAL A 211 -6.042 1.602 -11.652 1.00 0.00 H new ATOM 0 HA VAL A 211 -7.691 0.061 -10.024 1.00 0.00 H new ATOM 0 HB VAL A 211 -7.704 -1.542 -11.917 1.00 0.00 H new ATOM 0 HG11 VAL A 211 -8.368 0.066 -13.685 1.00 0.00 H new ATOM 0 HG12 VAL A 211 -8.999 0.559 -12.096 1.00 0.00 H new ATOM 0 HG13 VAL A 211 -7.579 1.382 -12.783 1.00 0.00 H new ATOM 0 HG21 VAL A 211 -6.192 -1.136 -13.852 1.00 0.00 H new ATOM 0 HG22 VAL A 211 -5.386 0.166 -12.944 1.00 0.00 H new ATOM 0 HG23 VAL A 211 -5.265 -1.519 -12.382 1.00 0.00 H new ATOM 626 N TYR A 212 -4.634 -1.139 -10.215 1.00 0.00 N ATOM 627 CA TYR A 212 -3.739 -2.134 -9.556 1.00 0.00 C ATOM 628 C TYR A 212 -3.533 -1.713 -8.106 1.00 0.00 C ATOM 629 O TYR A 212 -3.596 -2.517 -7.197 1.00 0.00 O ATOM 630 CB TYR A 212 -2.394 -2.182 -10.284 1.00 0.00 C ATOM 631 CG TYR A 212 -1.520 -3.264 -9.694 1.00 0.00 C ATOM 632 CD1 TYR A 212 -1.635 -4.588 -10.144 1.00 0.00 C ATOM 633 CD2 TYR A 212 -0.584 -2.941 -8.710 1.00 0.00 C ATOM 634 CE1 TYR A 212 -0.808 -5.585 -9.608 1.00 0.00 C ATOM 635 CE2 TYR A 212 0.240 -3.937 -8.172 1.00 0.00 C ATOM 636 CZ TYR A 212 0.130 -5.259 -8.622 1.00 0.00 C ATOM 637 OH TYR A 212 0.950 -6.238 -8.099 1.00 0.00 O ATOM 0 H TYR A 212 -4.178 -0.504 -10.870 1.00 0.00 H new ATOM 0 HA TYR A 212 -4.190 -3.126 -9.593 1.00 0.00 H new ATOM 0 HB2 TYR A 212 -2.553 -2.372 -11.346 1.00 0.00 H new ATOM 0 HB3 TYR A 212 -1.894 -1.217 -10.204 1.00 0.00 H new ATOM 0 HD1 TYR A 212 -2.361 -4.839 -10.903 1.00 0.00 H new ATOM 0 HD2 TYR A 212 -0.495 -1.922 -8.363 1.00 0.00 H new ATOM 0 HE1 TYR A 212 -0.895 -6.604 -9.956 1.00 0.00 H new ATOM 0 HE2 TYR A 212 0.962 -3.686 -7.409 1.00 0.00 H new ATOM 0 HH TYR A 212 1.597 -6.520 -8.779 1.00 0.00 H new ATOM 647 N LEU A 213 -3.303 -0.449 -7.882 1.00 0.00 N ATOM 648 CA LEU A 213 -3.111 0.034 -6.487 1.00 0.00 C ATOM 649 C LEU A 213 -4.403 -0.174 -5.700 1.00 0.00 C ATOM 650 O LEU A 213 -4.388 -0.594 -4.561 1.00 0.00 O ATOM 651 CB LEU A 213 -2.773 1.525 -6.496 1.00 0.00 C ATOM 652 CG LEU A 213 -1.434 1.760 -7.197 1.00 0.00 C ATOM 653 CD1 LEU A 213 -1.192 3.267 -7.305 1.00 0.00 C ATOM 654 CD2 LEU A 213 -0.291 1.103 -6.393 1.00 0.00 C ATOM 0 H LEU A 213 -3.240 0.269 -8.604 1.00 0.00 H new ATOM 0 HA LEU A 213 -2.296 -0.522 -6.025 1.00 0.00 H new ATOM 0 HB2 LEU A 213 -3.561 2.081 -7.005 1.00 0.00 H new ATOM 0 HB3 LEU A 213 -2.727 1.901 -5.474 1.00 0.00 H new ATOM 0 HG LEU A 213 -1.459 1.316 -8.192 1.00 0.00 H new ATOM 0 HD11 LEU A 213 -0.240 3.448 -7.803 1.00 0.00 H new ATOM 0 HD12 LEU A 213 -1.996 3.724 -7.882 1.00 0.00 H new ATOM 0 HD13 LEU A 213 -1.168 3.704 -6.307 1.00 0.00 H new ATOM 0 HD21 LEU A 213 0.658 1.276 -6.901 1.00 0.00 H new ATOM 0 HD22 LEU A 213 -0.252 1.537 -5.394 1.00 0.00 H new ATOM 0 HD23 LEU A 213 -0.470 0.031 -6.316 1.00 0.00 H new ATOM 666 N LYS A 214 -5.523 0.139 -6.300 1.00 0.00 N ATOM 667 CA LYS A 214 -6.831 -0.025 -5.595 1.00 0.00 C ATOM 668 C LYS A 214 -7.046 -1.481 -5.187 1.00 0.00 C ATOM 669 O LYS A 214 -7.562 -1.763 -4.125 1.00 0.00 O ATOM 670 CB LYS A 214 -7.980 0.412 -6.505 1.00 0.00 C ATOM 671 CG LYS A 214 -7.956 1.937 -6.699 1.00 0.00 C ATOM 672 CD LYS A 214 -9.336 2.419 -7.194 1.00 0.00 C ATOM 673 CE LYS A 214 -10.247 2.720 -5.995 1.00 0.00 C ATOM 674 NZ LYS A 214 -11.575 3.207 -6.479 1.00 0.00 N ATOM 0 H LYS A 214 -5.588 0.502 -7.251 1.00 0.00 H new ATOM 0 HA LYS A 214 -6.812 0.599 -4.701 1.00 0.00 H new ATOM 0 HB2 LYS A 214 -7.897 -0.086 -7.471 1.00 0.00 H new ATOM 0 HB3 LYS A 214 -8.933 0.109 -6.071 1.00 0.00 H new ATOM 0 HG2 LYS A 214 -7.703 2.429 -5.760 1.00 0.00 H new ATOM 0 HG3 LYS A 214 -7.185 2.210 -7.419 1.00 0.00 H new ATOM 0 HD2 LYS A 214 -9.220 3.313 -7.807 1.00 0.00 H new ATOM 0 HD3 LYS A 214 -9.792 1.657 -7.826 1.00 0.00 H new ATOM 0 HE2 LYS A 214 -10.377 1.822 -5.390 1.00 0.00 H new ATOM 0 HE3 LYS A 214 -9.785 3.471 -5.355 1.00 0.00 H new ATOM 0 HZ1 LYS A 214 -12.189 3.410 -5.664 1.00 0.00 H new ATOM 0 HZ2 LYS A 214 -11.444 4.074 -7.038 1.00 0.00 H new ATOM 0 HZ3 LYS A 214 -12.018 2.476 -7.072 1.00 0.00 H new ATOM 688 N GLU A 215 -6.674 -2.410 -6.021 1.00 0.00 N ATOM 689 CA GLU A 215 -6.879 -3.846 -5.666 1.00 0.00 C ATOM 690 C GLU A 215 -6.105 -4.168 -4.391 1.00 0.00 C ATOM 691 O GLU A 215 -6.586 -4.860 -3.517 1.00 0.00 O ATOM 692 CB GLU A 215 -6.394 -4.729 -6.817 1.00 0.00 C ATOM 693 CG GLU A 215 -7.415 -4.681 -7.958 1.00 0.00 C ATOM 694 CD GLU A 215 -6.864 -5.435 -9.173 1.00 0.00 C ATOM 695 OE1 GLU A 215 -5.660 -5.399 -9.370 1.00 0.00 O ATOM 696 OE2 GLU A 215 -7.653 -6.036 -9.884 1.00 0.00 O ATOM 0 H GLU A 215 -6.239 -2.242 -6.928 1.00 0.00 H new ATOM 0 HA GLU A 215 -7.939 -4.037 -5.496 1.00 0.00 H new ATOM 0 HB2 GLU A 215 -5.422 -4.385 -7.169 1.00 0.00 H new ATOM 0 HB3 GLU A 215 -6.264 -5.755 -6.473 1.00 0.00 H new ATOM 0 HG2 GLU A 215 -8.356 -5.127 -7.636 1.00 0.00 H new ATOM 0 HG3 GLU A 215 -7.628 -3.646 -8.226 1.00 0.00 H new ATOM 703 N ILE A 216 -4.915 -3.655 -4.272 1.00 0.00 N ATOM 704 CA ILE A 216 -4.109 -3.902 -3.045 1.00 0.00 C ATOM 705 C ILE A 216 -4.734 -3.142 -1.883 1.00 0.00 C ATOM 706 O ILE A 216 -4.862 -3.651 -0.787 1.00 0.00 O ATOM 707 CB ILE A 216 -2.689 -3.401 -3.292 1.00 0.00 C ATOM 708 CG1 ILE A 216 -2.039 -4.300 -4.346 1.00 0.00 C ATOM 709 CG2 ILE A 216 -1.878 -3.436 -1.990 1.00 0.00 C ATOM 710 CD1 ILE A 216 -0.741 -3.674 -4.855 1.00 0.00 C ATOM 0 H ILE A 216 -4.462 -3.072 -4.976 1.00 0.00 H new ATOM 0 HA ILE A 216 -4.086 -4.965 -2.806 1.00 0.00 H new ATOM 0 HB ILE A 216 -2.714 -2.370 -3.645 1.00 0.00 H new ATOM 0 HG12 ILE A 216 -1.833 -5.282 -3.919 1.00 0.00 H new ATOM 0 HG13 ILE A 216 -2.727 -4.452 -5.178 1.00 0.00 H new ATOM 0 HG21 ILE A 216 -0.867 -3.076 -2.181 1.00 0.00 H new ATOM 0 HG22 ILE A 216 -2.356 -2.798 -1.246 1.00 0.00 H new ATOM 0 HG23 ILE A 216 -1.834 -4.459 -1.616 1.00 0.00 H new ATOM 0 HD11 ILE A 216 -0.292 -4.326 -5.604 1.00 0.00 H new ATOM 0 HD12 ILE A 216 -0.956 -2.703 -5.301 1.00 0.00 H new ATOM 0 HD13 ILE A 216 -0.048 -3.546 -4.023 1.00 0.00 H new ATOM 722 N LEU A 217 -5.134 -1.926 -2.122 1.00 0.00 N ATOM 723 CA LEU A 217 -5.767 -1.119 -1.041 1.00 0.00 C ATOM 724 C LEU A 217 -7.139 -1.712 -0.709 1.00 0.00 C ATOM 725 O LEU A 217 -7.578 -1.708 0.421 1.00 0.00 O ATOM 726 CB LEU A 217 -5.954 0.324 -1.514 1.00 0.00 C ATOM 727 CG LEU A 217 -4.596 0.990 -1.776 1.00 0.00 C ATOM 728 CD1 LEU A 217 -4.832 2.351 -2.457 1.00 0.00 C ATOM 729 CD2 LEU A 217 -3.849 1.195 -0.442 1.00 0.00 C ATOM 0 H LEU A 217 -5.050 -1.454 -3.022 1.00 0.00 H new ATOM 0 HA LEU A 217 -5.127 -1.134 -0.159 1.00 0.00 H new ATOM 0 HB2 LEU A 217 -6.553 0.339 -2.424 1.00 0.00 H new ATOM 0 HB3 LEU A 217 -6.503 0.890 -0.762 1.00 0.00 H new ATOM 0 HG LEU A 217 -3.992 0.354 -2.423 1.00 0.00 H new ATOM 0 HD11 LEU A 217 -3.873 2.833 -2.648 1.00 0.00 H new ATOM 0 HD12 LEU A 217 -5.356 2.200 -3.401 1.00 0.00 H new ATOM 0 HD13 LEU A 217 -5.434 2.985 -1.805 1.00 0.00 H new ATOM 0 HD21 LEU A 217 -2.886 1.668 -0.633 1.00 0.00 H new ATOM 0 HD22 LEU A 217 -4.443 1.833 0.213 1.00 0.00 H new ATOM 0 HD23 LEU A 217 -3.690 0.229 0.038 1.00 0.00 H new ATOM 741 N LYS A 218 -7.829 -2.203 -1.690 1.00 0.00 N ATOM 742 CA LYS A 218 -9.174 -2.782 -1.430 1.00 0.00 C ATOM 743 C LYS A 218 -9.071 -3.948 -0.443 1.00 0.00 C ATOM 744 O LYS A 218 -9.954 -4.169 0.364 1.00 0.00 O ATOM 745 CB LYS A 218 -9.772 -3.286 -2.750 1.00 0.00 C ATOM 746 CG LYS A 218 -10.336 -2.108 -3.569 1.00 0.00 C ATOM 747 CD LYS A 218 -11.798 -1.833 -3.160 1.00 0.00 C ATOM 748 CE LYS A 218 -12.743 -2.746 -3.958 1.00 0.00 C ATOM 749 NZ LYS A 218 -12.551 -2.499 -5.415 1.00 0.00 N ATOM 0 H LYS A 218 -7.523 -2.230 -2.663 1.00 0.00 H new ATOM 0 HA LYS A 218 -9.814 -2.011 -1.000 1.00 0.00 H new ATOM 0 HB2 LYS A 218 -9.008 -3.806 -3.328 1.00 0.00 H new ATOM 0 HB3 LYS A 218 -10.563 -4.007 -2.546 1.00 0.00 H new ATOM 0 HG2 LYS A 218 -9.730 -1.217 -3.405 1.00 0.00 H new ATOM 0 HG3 LYS A 218 -10.284 -2.337 -4.633 1.00 0.00 H new ATOM 0 HD2 LYS A 218 -11.925 -2.008 -2.092 1.00 0.00 H new ATOM 0 HD3 LYS A 218 -12.046 -0.788 -3.344 1.00 0.00 H new ATOM 0 HE2 LYS A 218 -12.541 -3.791 -3.725 1.00 0.00 H new ATOM 0 HE3 LYS A 218 -13.778 -2.552 -3.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 218 -13.444 -2.678 -5.918 1.00 0.00 H new ATOM 0 HZ2 LYS A 218 -12.261 -1.511 -5.564 1.00 0.00 H new ATOM 0 HZ3 LYS A 218 -11.814 -3.135 -5.781 1.00 0.00 H new ATOM 763 N GLU A 219 -8.028 -4.727 -0.533 1.00 0.00 N ATOM 764 CA GLU A 219 -7.904 -5.905 0.373 1.00 0.00 C ATOM 765 C GLU A 219 -7.443 -5.496 1.782 1.00 0.00 C ATOM 766 O GLU A 219 -8.027 -5.899 2.768 1.00 0.00 O ATOM 767 CB GLU A 219 -6.892 -6.888 -0.224 1.00 0.00 C ATOM 768 CG GLU A 219 -7.480 -7.555 -1.474 1.00 0.00 C ATOM 769 CD GLU A 219 -6.401 -8.415 -2.141 1.00 0.00 C ATOM 770 OE1 GLU A 219 -5.243 -8.250 -1.796 1.00 0.00 O ATOM 771 OE2 GLU A 219 -6.752 -9.224 -2.984 1.00 0.00 O ATOM 0 H GLU A 219 -7.259 -4.600 -1.191 1.00 0.00 H new ATOM 0 HA GLU A 219 -8.886 -6.369 0.464 1.00 0.00 H new ATOM 0 HB2 GLU A 219 -5.972 -6.363 -0.481 1.00 0.00 H new ATOM 0 HB3 GLU A 219 -6.631 -7.647 0.514 1.00 0.00 H new ATOM 0 HG2 GLU A 219 -8.337 -8.171 -1.203 1.00 0.00 H new ATOM 0 HG3 GLU A 219 -7.840 -6.797 -2.170 1.00 0.00 H new ATOM 778 N ILE A 220 -6.392 -4.721 1.887 1.00 0.00 N ATOM 779 CA ILE A 220 -5.877 -4.309 3.241 1.00 0.00 C ATOM 780 C ILE A 220 -6.145 -2.825 3.500 1.00 0.00 C ATOM 781 O ILE A 220 -6.009 -2.343 4.606 1.00 0.00 O ATOM 782 CB ILE A 220 -4.357 -4.545 3.295 1.00 0.00 C ATOM 783 CG1 ILE A 220 -3.659 -3.762 2.161 1.00 0.00 C ATOM 784 CG2 ILE A 220 -4.053 -6.045 3.149 1.00 0.00 C ATOM 785 CD1 ILE A 220 -2.158 -3.650 2.450 1.00 0.00 C ATOM 0 H ILE A 220 -5.864 -4.353 1.096 1.00 0.00 H new ATOM 0 HA ILE A 220 -6.390 -4.901 3.999 1.00 0.00 H new ATOM 0 HB ILE A 220 -3.981 -4.194 4.256 1.00 0.00 H new ATOM 0 HG12 ILE A 220 -3.818 -4.267 1.208 1.00 0.00 H new ATOM 0 HG13 ILE A 220 -4.096 -2.767 2.072 1.00 0.00 H new ATOM 0 HG21 ILE A 220 -2.975 -6.203 3.188 1.00 0.00 H new ATOM 0 HG22 ILE A 220 -4.530 -6.594 3.961 1.00 0.00 H new ATOM 0 HG23 ILE A 220 -4.438 -6.403 2.194 1.00 0.00 H new ATOM 0 HD11 ILE A 220 -1.673 -3.097 1.646 1.00 0.00 H new ATOM 0 HD12 ILE A 220 -2.007 -3.126 3.394 1.00 0.00 H new ATOM 0 HD13 ILE A 220 -1.725 -4.648 2.516 1.00 0.00 H new ATOM 797 N GLY A 221 -6.471 -2.086 2.480 1.00 0.00 N ATOM 798 CA GLY A 221 -6.688 -0.621 2.655 1.00 0.00 C ATOM 799 C GLY A 221 -8.124 -0.302 3.084 1.00 0.00 C ATOM 800 O GLY A 221 -8.929 -1.175 3.340 1.00 0.00 O ATOM 0 H GLY A 221 -6.598 -2.432 1.529 1.00 0.00 H new ATOM 0 HA2 GLY A 221 -5.993 -0.238 3.402 1.00 0.00 H new ATOM 0 HA3 GLY A 221 -6.466 -0.107 1.720 1.00 0.00 H new ATOM 804 N VAL A 222 -8.435 0.968 3.161 1.00 0.00 N ATOM 805 CA VAL A 222 -9.800 1.415 3.570 1.00 0.00 C ATOM 806 C VAL A 222 -10.119 2.708 2.829 1.00 0.00 C ATOM 807 O VAL A 222 -9.288 3.232 2.128 1.00 0.00 O ATOM 808 CB VAL A 222 -9.804 1.677 5.075 1.00 0.00 C ATOM 809 CG1 VAL A 222 -11.198 2.108 5.543 1.00 0.00 C ATOM 810 CG2 VAL A 222 -9.398 0.396 5.796 1.00 0.00 C ATOM 0 H VAL A 222 -7.787 1.728 2.953 1.00 0.00 H new ATOM 0 HA VAL A 222 -10.542 0.653 3.332 1.00 0.00 H new ATOM 0 HB VAL A 222 -9.101 2.478 5.302 1.00 0.00 H new ATOM 0 HG11 VAL A 222 -11.181 2.290 6.618 1.00 0.00 H new ATOM 0 HG12 VAL A 222 -11.489 3.022 5.025 1.00 0.00 H new ATOM 0 HG13 VAL A 222 -11.917 1.319 5.320 1.00 0.00 H new ATOM 0 HG21 VAL A 222 -9.397 0.569 6.872 1.00 0.00 H new ATOM 0 HG22 VAL A 222 -10.107 -0.397 5.557 1.00 0.00 H new ATOM 0 HG23 VAL A 222 -8.400 0.099 5.475 1.00 0.00 H new ATOM 820 N GLN A 223 -11.311 3.225 2.967 1.00 0.00 N ATOM 821 CA GLN A 223 -11.679 4.484 2.253 1.00 0.00 C ATOM 822 C GLN A 223 -12.476 5.395 3.193 1.00 0.00 C ATOM 823 O GLN A 223 -13.088 4.943 4.140 1.00 0.00 O ATOM 824 CB GLN A 223 -12.539 4.095 1.048 1.00 0.00 C ATOM 825 CG GLN A 223 -13.023 5.343 0.306 1.00 0.00 C ATOM 826 CD GLN A 223 -11.826 6.202 -0.105 1.00 0.00 C ATOM 827 OE1 GLN A 223 -11.021 5.792 -0.918 1.00 0.00 O ATOM 828 NE2 GLN A 223 -11.673 7.383 0.430 1.00 0.00 N ATOM 0 H GLN A 223 -12.050 2.827 3.547 1.00 0.00 H new ATOM 0 HA GLN A 223 -10.787 5.020 1.928 1.00 0.00 H new ATOM 0 HB2 GLN A 223 -11.963 3.464 0.372 1.00 0.00 H new ATOM 0 HB3 GLN A 223 -13.395 3.508 1.380 1.00 0.00 H new ATOM 0 HG2 GLN A 223 -13.594 5.054 -0.576 1.00 0.00 H new ATOM 0 HG3 GLN A 223 -13.693 5.919 0.944 1.00 0.00 H new ATOM 0 HE21 GLN A 223 -12.350 7.725 1.112 1.00 0.00 H new ATOM 0 HE22 GLN A 223 -10.877 7.963 0.166 1.00 0.00 H new ATOM 837 N ASN A 224 -12.459 6.679 2.950 1.00 0.00 N ATOM 838 CA ASN A 224 -13.207 7.615 3.836 1.00 0.00 C ATOM 839 C ASN A 224 -13.607 8.853 3.034 1.00 0.00 C ATOM 840 O ASN A 224 -12.768 9.582 2.538 1.00 0.00 O ATOM 841 CB ASN A 224 -12.307 8.062 4.997 1.00 0.00 C ATOM 842 CG ASN A 224 -11.442 6.892 5.472 1.00 0.00 C ATOM 843 OD1 ASN A 224 -11.784 6.212 6.420 1.00 0.00 O ATOM 844 ND2 ASN A 224 -10.320 6.634 4.852 1.00 0.00 N ATOM 0 H ASN A 224 -11.960 7.119 2.177 1.00 0.00 H new ATOM 0 HA ASN A 224 -14.091 7.109 4.224 1.00 0.00 H new ATOM 0 HB2 ASN A 224 -11.672 8.888 4.678 1.00 0.00 H new ATOM 0 HB3 ASN A 224 -12.919 8.430 5.821 1.00 0.00 H new ATOM 0 HD21 ASN A 224 -9.731 5.862 5.164 1.00 0.00 H new ATOM 0 HD22 ASN A 224 -10.034 7.205 4.057 1.00 0.00 H new ATOM 851 N VAL A 225 -14.878 9.105 2.925 1.00 0.00 N ATOM 852 CA VAL A 225 -15.348 10.308 2.181 1.00 0.00 C ATOM 853 C VAL A 225 -15.631 11.400 3.207 1.00 0.00 C ATOM 854 O VAL A 225 -16.139 11.134 4.277 1.00 0.00 O ATOM 855 CB VAL A 225 -16.620 9.972 1.415 1.00 0.00 C ATOM 856 CG1 VAL A 225 -16.281 9.006 0.283 1.00 0.00 C ATOM 857 CG2 VAL A 225 -17.619 9.321 2.370 1.00 0.00 C ATOM 0 H VAL A 225 -15.619 8.527 3.321 1.00 0.00 H new ATOM 0 HA VAL A 225 -14.595 10.641 1.467 1.00 0.00 H new ATOM 0 HB VAL A 225 -17.057 10.879 0.997 1.00 0.00 H new ATOM 0 HG11 VAL A 225 -17.188 8.761 -0.270 1.00 0.00 H new ATOM 0 HG12 VAL A 225 -15.561 9.472 -0.389 1.00 0.00 H new ATOM 0 HG13 VAL A 225 -15.852 8.094 0.699 1.00 0.00 H new ATOM 0 HG21 VAL A 225 -18.533 9.077 1.829 1.00 0.00 H new ATOM 0 HG22 VAL A 225 -17.187 8.409 2.782 1.00 0.00 H new ATOM 0 HG23 VAL A 225 -17.850 10.012 3.181 1.00 0.00 H new ATOM 867 N LYS A 226 -15.259 12.618 2.919 1.00 0.00 N ATOM 868 CA LYS A 226 -15.454 13.724 3.915 1.00 0.00 C ATOM 869 C LYS A 226 -16.219 14.900 3.295 1.00 0.00 C ATOM 870 O LYS A 226 -16.896 14.751 2.301 1.00 0.00 O ATOM 871 CB LYS A 226 -14.072 14.151 4.399 1.00 0.00 C ATOM 872 CG LYS A 226 -13.327 12.890 4.851 1.00 0.00 C ATOM 873 CD LYS A 226 -11.941 13.241 5.384 1.00 0.00 C ATOM 874 CE LYS A 226 -12.038 13.986 6.729 1.00 0.00 C ATOM 875 NZ LYS A 226 -12.190 15.448 6.482 1.00 0.00 N ATOM 0 H LYS A 226 -14.828 12.900 2.039 1.00 0.00 H new ATOM 0 HA LYS A 226 -16.055 13.377 4.755 1.00 0.00 H new ATOM 0 HB2 LYS A 226 -13.525 14.653 3.601 1.00 0.00 H new ATOM 0 HB3 LYS A 226 -14.157 14.861 5.222 1.00 0.00 H new ATOM 0 HG2 LYS A 226 -13.901 12.381 5.625 1.00 0.00 H new ATOM 0 HG3 LYS A 226 -13.235 12.197 4.015 1.00 0.00 H new ATOM 0 HD2 LYS A 226 -11.355 12.331 5.510 1.00 0.00 H new ATOM 0 HD3 LYS A 226 -11.415 13.861 4.658 1.00 0.00 H new ATOM 0 HE2 LYS A 226 -12.887 13.614 7.302 1.00 0.00 H new ATOM 0 HE3 LYS A 226 -11.145 13.799 7.325 1.00 0.00 H new ATOM 0 HZ1 LYS A 226 -11.424 15.963 6.962 1.00 0.00 H new ATOM 0 HZ2 LYS A 226 -12.145 15.634 5.460 1.00 0.00 H new ATOM 0 HZ3 LYS A 226 -13.107 15.769 6.852 1.00 0.00 H new ATOM 889 N GLY A 227 -16.143 16.057 3.913 1.00 0.00 N ATOM 890 CA GLY A 227 -16.881 17.263 3.409 1.00 0.00 C ATOM 891 C GLY A 227 -16.961 17.273 1.880 1.00 0.00 C ATOM 892 O GLY A 227 -18.006 17.035 1.303 1.00 0.00 O ATOM 0 H GLY A 227 -15.593 16.219 4.757 1.00 0.00 H new ATOM 0 HA2 GLY A 227 -17.887 17.276 3.827 1.00 0.00 H new ATOM 0 HA3 GLY A 227 -16.381 18.168 3.754 1.00 0.00 H new ATOM 896 N ILE A 228 -15.870 17.544 1.217 1.00 0.00 N ATOM 897 CA ILE A 228 -15.886 17.566 -0.276 1.00 0.00 C ATOM 898 C ILE A 228 -15.589 16.156 -0.783 1.00 0.00 C ATOM 899 O ILE A 228 -14.963 15.970 -1.805 1.00 0.00 O ATOM 900 CB ILE A 228 -14.831 18.561 -0.795 1.00 0.00 C ATOM 901 CG1 ILE A 228 -13.422 18.131 -0.354 1.00 0.00 C ATOM 902 CG2 ILE A 228 -15.128 19.952 -0.230 1.00 0.00 C ATOM 903 CD1 ILE A 228 -12.379 19.014 -1.042 1.00 0.00 C ATOM 0 H ILE A 228 -14.967 17.751 1.644 1.00 0.00 H new ATOM 0 HA ILE A 228 -16.863 17.886 -0.639 1.00 0.00 H new ATOM 0 HB ILE A 228 -14.872 18.579 -1.884 1.00 0.00 H new ATOM 0 HG12 ILE A 228 -13.327 18.214 0.729 1.00 0.00 H new ATOM 0 HG13 ILE A 228 -13.253 17.085 -0.609 1.00 0.00 H new ATOM 0 HG21 ILE A 228 -14.383 20.660 -0.595 1.00 0.00 H new ATOM 0 HG22 ILE A 228 -16.120 20.271 -0.551 1.00 0.00 H new ATOM 0 HG23 ILE A 228 -15.093 19.918 0.859 1.00 0.00 H new ATOM 0 HD11 ILE A 228 -11.380 18.709 -0.729 1.00 0.00 H new ATOM 0 HD12 ILE A 228 -12.469 18.908 -2.123 1.00 0.00 H new ATOM 0 HD13 ILE A 228 -12.544 20.055 -0.765 1.00 0.00 H new ATOM 915 N HIS A 229 -16.029 15.158 -0.054 1.00 0.00 N ATOM 916 CA HIS A 229 -15.777 13.747 -0.465 1.00 0.00 C ATOM 917 C HIS A 229 -14.278 13.517 -0.628 1.00 0.00 C ATOM 918 O HIS A 229 -13.827 12.952 -1.606 1.00 0.00 O ATOM 919 CB HIS A 229 -16.500 13.451 -1.782 1.00 0.00 C ATOM 920 CG HIS A 229 -17.973 13.639 -1.575 1.00 0.00 C ATOM 921 ND1 HIS A 229 -18.908 13.330 -2.550 1.00 0.00 N ATOM 922 CD2 HIS A 229 -18.691 14.092 -0.498 1.00 0.00 C ATOM 923 CE1 HIS A 229 -20.126 13.595 -2.041 1.00 0.00 C ATOM 924 NE2 HIS A 229 -20.049 14.063 -0.793 1.00 0.00 N ATOM 0 H HIS A 229 -16.555 15.265 0.813 1.00 0.00 H new ATOM 0 HA HIS A 229 -16.158 13.076 0.305 1.00 0.00 H new ATOM 0 HB2 HIS A 229 -16.141 14.116 -2.568 1.00 0.00 H new ATOM 0 HB3 HIS A 229 -16.291 12.432 -2.107 1.00 0.00 H new ATOM 0 HD2 HIS A 229 -18.265 14.422 0.438 1.00 0.00 H new ATOM 0 HE1 HIS A 229 -21.052 13.447 -2.577 1.00 0.00 H new ATOM 0 HE2 HIS A 229 -20.821 14.340 -0.186 1.00 0.00 H new ATOM 932 N LYS A 230 -13.503 13.950 0.329 1.00 0.00 N ATOM 933 CA LYS A 230 -12.033 13.756 0.235 1.00 0.00 C ATOM 934 C LYS A 230 -11.724 12.261 0.244 1.00 0.00 C ATOM 935 O LYS A 230 -11.996 11.560 1.200 1.00 0.00 O ATOM 936 CB LYS A 230 -11.339 14.423 1.426 1.00 0.00 C ATOM 937 CG LYS A 230 -11.644 15.925 1.432 1.00 0.00 C ATOM 938 CD LYS A 230 -11.026 16.563 2.684 1.00 0.00 C ATOM 939 CE LYS A 230 -11.587 17.974 2.878 1.00 0.00 C ATOM 940 NZ LYS A 230 -11.167 18.826 1.730 1.00 0.00 N ATOM 0 H LYS A 230 -13.826 14.429 1.170 1.00 0.00 H new ATOM 0 HA LYS A 230 -11.669 14.206 -0.688 1.00 0.00 H new ATOM 0 HB2 LYS A 230 -11.680 13.970 2.357 1.00 0.00 H new ATOM 0 HB3 LYS A 230 -10.263 14.262 1.368 1.00 0.00 H new ATOM 0 HG2 LYS A 230 -11.240 16.393 0.534 1.00 0.00 H new ATOM 0 HG3 LYS A 230 -12.722 16.089 1.420 1.00 0.00 H new ATOM 0 HD2 LYS A 230 -11.244 15.952 3.560 1.00 0.00 H new ATOM 0 HD3 LYS A 230 -9.941 16.604 2.585 1.00 0.00 H new ATOM 0 HE2 LYS A 230 -12.674 17.941 2.944 1.00 0.00 H new ATOM 0 HE3 LYS A 230 -11.224 18.398 3.814 1.00 0.00 H new ATOM 0 HZ1 LYS A 230 -11.970 19.408 1.417 1.00 0.00 H new ATOM 0 HZ2 LYS A 230 -10.385 19.445 2.025 1.00 0.00 H new ATOM 0 HZ3 LYS A 230 -10.852 18.221 0.945 1.00 0.00 H new ATOM 954 N ASN A 231 -11.159 11.771 -0.821 1.00 0.00 N ATOM 955 CA ASN A 231 -10.824 10.324 -0.896 1.00 0.00 C ATOM 956 C ASN A 231 -9.571 10.057 -0.065 1.00 0.00 C ATOM 957 O ASN A 231 -8.502 10.510 -0.411 1.00 0.00 O ATOM 958 CB ASN A 231 -10.516 9.961 -2.354 1.00 0.00 C ATOM 959 CG ASN A 231 -11.484 10.700 -3.272 1.00 0.00 C ATOM 960 OD1 ASN A 231 -12.634 10.331 -3.389 1.00 0.00 O ATOM 961 ND2 ASN A 231 -11.056 11.748 -3.928 1.00 0.00 N ATOM 0 H ASN A 231 -10.913 12.314 -1.649 1.00 0.00 H new ATOM 0 HA ASN A 231 -11.661 9.734 -0.522 1.00 0.00 H new ATOM 0 HB2 ASN A 231 -9.488 10.229 -2.598 1.00 0.00 H new ATOM 0 HB3 ASN A 231 -10.608 8.885 -2.500 1.00 0.00 H new ATOM 0 HD21 ASN A 231 -11.690 12.260 -4.542 1.00 0.00 H new ATOM 0 HD22 ASN A 231 -10.088 12.054 -3.826 1.00 0.00 H new ATOM 968 N THR A 232 -9.672 9.316 1.007 1.00 0.00 N ATOM 969 CA THR A 232 -8.449 9.013 1.827 1.00 0.00 C ATOM 970 C THR A 232 -8.368 7.513 2.081 1.00 0.00 C ATOM 971 O THR A 232 -9.347 6.866 2.411 1.00 0.00 O ATOM 972 CB THR A 232 -8.499 9.766 3.153 1.00 0.00 C ATOM 973 OG1 THR A 232 -9.685 9.435 3.845 1.00 0.00 O ATOM 974 CG2 THR A 232 -8.459 11.264 2.879 1.00 0.00 C ATOM 0 H THR A 232 -10.540 8.907 1.353 1.00 0.00 H new ATOM 0 HA THR A 232 -7.564 9.336 1.280 1.00 0.00 H new ATOM 0 HB THR A 232 -7.643 9.486 3.766 1.00 0.00 H new ATOM 0 HG1 THR A 232 -10.427 9.975 3.500 1.00 0.00 H new ATOM 0 HG21 THR A 232 -8.494 11.808 3.823 1.00 0.00 H new ATOM 0 HG22 THR A 232 -7.538 11.513 2.351 1.00 0.00 H new ATOM 0 HG23 THR A 232 -9.316 11.545 2.266 1.00 0.00 H new ATOM 982 N TRP A 233 -7.194 6.958 1.896 1.00 0.00 N ATOM 983 CA TRP A 233 -6.991 5.491 2.087 1.00 0.00 C ATOM 984 C TRP A 233 -6.076 5.237 3.283 1.00 0.00 C ATOM 985 O TRP A 233 -5.189 6.014 3.576 1.00 0.00 O ATOM 986 CB TRP A 233 -6.366 4.904 0.817 1.00 0.00 C ATOM 987 CG TRP A 233 -7.382 4.898 -0.281 1.00 0.00 C ATOM 988 CD1 TRP A 233 -7.647 5.936 -1.110 1.00 0.00 C ATOM 989 CD2 TRP A 233 -8.268 3.816 -0.684 1.00 0.00 C ATOM 990 NE1 TRP A 233 -8.648 5.559 -1.989 1.00 0.00 N ATOM 991 CE2 TRP A 233 -9.059 4.257 -1.768 1.00 0.00 C ATOM 992 CE3 TRP A 233 -8.456 2.502 -0.215 1.00 0.00 C ATOM 993 CZ2 TRP A 233 -10.010 3.426 -2.365 1.00 0.00 C ATOM 994 CZ3 TRP A 233 -9.411 1.663 -0.811 1.00 0.00 C ATOM 995 CH2 TRP A 233 -10.184 2.123 -1.885 1.00 0.00 C ATOM 0 H TRP A 233 -6.357 7.469 1.617 1.00 0.00 H new ATOM 0 HA TRP A 233 -7.952 5.013 2.278 1.00 0.00 H new ATOM 0 HB2 TRP A 233 -5.498 5.492 0.521 1.00 0.00 H new ATOM 0 HB3 TRP A 233 -6.014 3.890 1.007 1.00 0.00 H new ATOM 0 HD1 TRP A 233 -7.158 6.899 -1.089 1.00 0.00 H new ATOM 0 HE1 TRP A 233 -9.035 6.167 -2.711 1.00 0.00 H new ATOM 0 HE3 TRP A 233 -7.861 2.137 0.609 1.00 0.00 H new ATOM 0 HZ2 TRP A 233 -10.606 3.786 -3.190 1.00 0.00 H new ATOM 0 HZ3 TRP A 233 -9.550 0.658 -0.440 1.00 0.00 H new ATOM 0 HH2 TRP A 233 -10.914 1.472 -2.343 1.00 0.00 H new ATOM 1006 N GLU A 234 -6.296 4.148 3.981 1.00 0.00 N ATOM 1007 CA GLU A 234 -5.449 3.816 5.177 1.00 0.00 C ATOM 1008 C GLU A 234 -5.142 2.316 5.193 1.00 0.00 C ATOM 1009 O GLU A 234 -5.982 1.507 4.872 1.00 0.00 O ATOM 1010 CB GLU A 234 -6.216 4.147 6.463 1.00 0.00 C ATOM 1011 CG GLU A 234 -6.340 5.658 6.649 1.00 0.00 C ATOM 1012 CD GLU A 234 -6.973 5.936 8.016 1.00 0.00 C ATOM 1013 OE1 GLU A 234 -8.100 5.522 8.221 1.00 0.00 O ATOM 1014 OE2 GLU A 234 -6.317 6.559 8.837 1.00 0.00 O ATOM 0 H GLU A 234 -7.029 3.470 3.774 1.00 0.00 H new ATOM 0 HA GLU A 234 -4.528 4.395 5.120 1.00 0.00 H new ATOM 0 HB2 GLU A 234 -7.209 3.698 6.425 1.00 0.00 H new ATOM 0 HB3 GLU A 234 -5.702 3.712 7.320 1.00 0.00 H new ATOM 0 HG2 GLU A 234 -5.359 6.128 6.585 1.00 0.00 H new ATOM 0 HG3 GLU A 234 -6.952 6.087 5.855 1.00 0.00 H new ATOM 1021 N LEU A 235 -3.957 1.934 5.587 1.00 0.00 N ATOM 1022 CA LEU A 235 -3.637 0.475 5.638 1.00 0.00 C ATOM 1023 C LEU A 235 -4.397 -0.172 6.793 1.00 0.00 C ATOM 1024 O LEU A 235 -4.047 0.016 7.935 1.00 0.00 O ATOM 1025 CB LEU A 235 -2.140 0.269 5.868 1.00 0.00 C ATOM 1026 CG LEU A 235 -1.344 0.794 4.670 1.00 0.00 C ATOM 1027 CD1 LEU A 235 0.143 0.735 5.015 1.00 0.00 C ATOM 1028 CD2 LEU A 235 -1.626 -0.069 3.420 1.00 0.00 C ATOM 0 H LEU A 235 -3.204 2.559 5.873 1.00 0.00 H new ATOM 0 HA LEU A 235 -3.927 0.022 4.690 1.00 0.00 H new ATOM 0 HB2 LEU A 235 -1.829 0.787 6.775 1.00 0.00 H new ATOM 0 HB3 LEU A 235 -1.930 -0.790 6.018 1.00 0.00 H new ATOM 0 HG LEU A 235 -1.640 1.820 4.453 1.00 0.00 H new ATOM 0 HD11 LEU A 235 0.727 1.105 4.172 1.00 0.00 H new ATOM 0 HD12 LEU A 235 0.338 1.353 5.891 1.00 0.00 H new ATOM 0 HD13 LEU A 235 0.427 -0.296 5.228 1.00 0.00 H new ATOM 0 HD21 LEU A 235 -1.054 0.315 2.576 1.00 0.00 H new ATOM 0 HD22 LEU A 235 -1.334 -1.101 3.617 1.00 0.00 H new ATOM 0 HD23 LEU A 235 -2.690 -0.032 3.184 1.00 0.00 H new ATOM 1040 N LYS A 236 -5.413 -0.948 6.507 1.00 0.00 N ATOM 1041 CA LYS A 236 -6.180 -1.618 7.597 1.00 0.00 C ATOM 1042 C LYS A 236 -5.199 -2.499 8.404 1.00 0.00 C ATOM 1043 O LYS A 236 -4.711 -3.491 7.898 1.00 0.00 O ATOM 1044 CB LYS A 236 -7.260 -2.500 6.945 1.00 0.00 C ATOM 1045 CG LYS A 236 -8.336 -2.893 7.960 1.00 0.00 C ATOM 1046 CD LYS A 236 -9.494 -3.584 7.217 1.00 0.00 C ATOM 1047 CE LYS A 236 -10.579 -4.002 8.206 1.00 0.00 C ATOM 1048 NZ LYS A 236 -11.699 -4.640 7.465 1.00 0.00 N ATOM 0 H LYS A 236 -5.743 -1.146 5.562 1.00 0.00 H new ATOM 0 HA LYS A 236 -6.649 -0.891 8.260 1.00 0.00 H new ATOM 0 HB2 LYS A 236 -7.718 -1.965 6.113 1.00 0.00 H new ATOM 0 HB3 LYS A 236 -6.800 -3.398 6.532 1.00 0.00 H new ATOM 0 HG2 LYS A 236 -7.918 -3.562 8.712 1.00 0.00 H new ATOM 0 HG3 LYS A 236 -8.699 -2.010 8.485 1.00 0.00 H new ATOM 0 HD2 LYS A 236 -9.912 -2.908 6.471 1.00 0.00 H new ATOM 0 HD3 LYS A 236 -9.123 -4.458 6.682 1.00 0.00 H new ATOM 0 HE2 LYS A 236 -10.170 -4.697 8.940 1.00 0.00 H new ATOM 0 HE3 LYS A 236 -10.940 -3.133 8.756 1.00 0.00 H new ATOM 0 HZ1 LYS A 236 -12.440 -4.926 8.136 1.00 0.00 H new ATOM 0 HZ2 LYS A 236 -12.093 -3.963 6.781 1.00 0.00 H new ATOM 0 HZ3 LYS A 236 -11.348 -5.478 6.959 1.00 0.00 H new ATOM 1062 N PRO A 237 -4.892 -2.152 9.641 1.00 0.00 N ATOM 1063 CA PRO A 237 -3.946 -2.939 10.486 1.00 0.00 C ATOM 1064 C PRO A 237 -4.649 -4.057 11.249 1.00 0.00 C ATOM 1065 O PRO A 237 -4.067 -4.717 12.084 1.00 0.00 O ATOM 1066 CB PRO A 237 -3.431 -1.898 11.474 1.00 0.00 C ATOM 1067 CG PRO A 237 -4.606 -1.002 11.707 1.00 0.00 C ATOM 1068 CD PRO A 237 -5.405 -0.986 10.389 1.00 0.00 C ATOM 0 HA PRO A 237 -3.173 -3.426 9.892 1.00 0.00 H new ATOM 0 HB2 PRO A 237 -3.093 -2.361 12.401 1.00 0.00 H new ATOM 0 HB3 PRO A 237 -2.584 -1.346 11.066 1.00 0.00 H new ATOM 0 HG2 PRO A 237 -5.219 -1.371 12.529 1.00 0.00 H new ATOM 0 HG3 PRO A 237 -4.281 0.003 11.977 1.00 0.00 H new ATOM 0 HD2 PRO A 237 -6.476 -1.070 10.572 1.00 0.00 H new ATOM 0 HD3 PRO A 237 -5.247 -0.059 9.839 1.00 0.00 H new ATOM 1076 N GLU A 238 -5.909 -4.224 11.013 1.00 0.00 N ATOM 1077 CA GLU A 238 -6.676 -5.247 11.768 1.00 0.00 C ATOM 1078 C GLU A 238 -6.017 -6.625 11.671 1.00 0.00 C ATOM 1079 O GLU A 238 -5.904 -7.322 12.660 1.00 0.00 O ATOM 1080 CB GLU A 238 -8.099 -5.313 11.200 1.00 0.00 C ATOM 1081 CG GLU A 238 -8.852 -4.021 11.546 1.00 0.00 C ATOM 1082 CD GLU A 238 -9.043 -3.925 13.066 1.00 0.00 C ATOM 1083 OE1 GLU A 238 -8.894 -4.943 13.725 1.00 0.00 O ATOM 1084 OE2 GLU A 238 -9.334 -2.840 13.546 1.00 0.00 O ATOM 0 H GLU A 238 -6.448 -3.696 10.327 1.00 0.00 H new ATOM 0 HA GLU A 238 -6.697 -4.963 12.820 1.00 0.00 H new ATOM 0 HB2 GLU A 238 -8.064 -5.447 10.119 1.00 0.00 H new ATOM 0 HB3 GLU A 238 -8.626 -6.174 11.611 1.00 0.00 H new ATOM 0 HG2 GLU A 238 -8.296 -3.156 11.184 1.00 0.00 H new ATOM 0 HG3 GLU A 238 -9.821 -4.008 11.046 1.00 0.00 H new ATOM 1091 N TYR A 239 -5.594 -7.038 10.501 1.00 0.00 N ATOM 1092 CA TYR A 239 -4.969 -8.394 10.362 1.00 0.00 C ATOM 1093 C TYR A 239 -3.647 -8.326 9.585 1.00 0.00 C ATOM 1094 O TYR A 239 -3.242 -9.303 8.987 1.00 0.00 O ATOM 1095 CB TYR A 239 -5.951 -9.297 9.619 1.00 0.00 C ATOM 1096 CG TYR A 239 -6.130 -8.781 8.215 1.00 0.00 C ATOM 1097 CD1 TYR A 239 -7.023 -7.732 7.969 1.00 0.00 C ATOM 1098 CD2 TYR A 239 -5.400 -9.344 7.162 1.00 0.00 C ATOM 1099 CE1 TYR A 239 -7.190 -7.245 6.673 1.00 0.00 C ATOM 1100 CE2 TYR A 239 -5.566 -8.856 5.862 1.00 0.00 C ATOM 1101 CZ TYR A 239 -6.463 -7.806 5.615 1.00 0.00 C ATOM 1102 OH TYR A 239 -6.631 -7.322 4.333 1.00 0.00 O ATOM 0 H TYR A 239 -5.653 -6.498 9.638 1.00 0.00 H new ATOM 0 HA TYR A 239 -4.750 -8.788 11.354 1.00 0.00 H new ATOM 0 HB2 TYR A 239 -5.578 -10.321 9.599 1.00 0.00 H new ATOM 0 HB3 TYR A 239 -6.910 -9.317 10.137 1.00 0.00 H new ATOM 0 HD1 TYR A 239 -7.584 -7.299 8.784 1.00 0.00 H new ATOM 0 HD2 TYR A 239 -4.710 -10.153 7.353 1.00 0.00 H new ATOM 0 HE1 TYR A 239 -7.880 -6.435 6.485 1.00 0.00 H new ATOM 0 HE2 TYR A 239 -5.003 -9.288 5.048 1.00 0.00 H new ATOM 0 HH TYR A 239 -7.447 -6.782 4.292 1.00 0.00 H new ATOM 1112 N ARG A 240 -2.957 -7.209 9.576 1.00 0.00 N ATOM 1113 CA ARG A 240 -1.662 -7.172 8.825 1.00 0.00 C ATOM 1114 C ARG A 240 -0.567 -7.849 9.648 1.00 0.00 C ATOM 1115 O ARG A 240 -0.027 -7.290 10.583 1.00 0.00 O ATOM 1116 CB ARG A 240 -1.257 -5.719 8.494 1.00 0.00 C ATOM 1117 CG ARG A 240 -1.998 -5.227 7.221 1.00 0.00 C ATOM 1118 CD ARG A 240 -1.099 -5.362 5.970 1.00 0.00 C ATOM 1119 NE ARG A 240 -0.839 -6.799 5.655 1.00 0.00 N ATOM 1120 CZ ARG A 240 -0.409 -7.132 4.464 1.00 0.00 C ATOM 1121 NH1 ARG A 240 -0.253 -6.220 3.547 1.00 0.00 N ATOM 1122 NH2 ARG A 240 -0.150 -8.380 4.182 1.00 0.00 N ATOM 0 H ARG A 240 -3.225 -6.343 10.043 1.00 0.00 H new ATOM 0 HA ARG A 240 -1.792 -7.710 7.886 1.00 0.00 H new ATOM 0 HB2 ARG A 240 -1.495 -5.068 9.335 1.00 0.00 H new ATOM 0 HB3 ARG A 240 -0.179 -5.661 8.341 1.00 0.00 H new ATOM 0 HG2 ARG A 240 -2.911 -5.805 7.081 1.00 0.00 H new ATOM 0 HG3 ARG A 240 -2.296 -4.186 7.349 1.00 0.00 H new ATOM 0 HD2 ARG A 240 -1.579 -4.880 5.118 1.00 0.00 H new ATOM 0 HD3 ARG A 240 -0.154 -4.845 6.138 1.00 0.00 H new ATOM 0 HE ARG A 240 -0.995 -7.516 6.363 1.00 0.00 H new ATOM 0 HH11 ARG A 240 -0.466 -5.245 3.756 1.00 0.00 H new ATOM 0 HH12 ARG A 240 0.082 -6.481 2.620 1.00 0.00 H new ATOM 0 HH21 ARG A 240 -0.282 -9.101 4.891 1.00 0.00 H new ATOM 0 HH22 ARG A 240 0.185 -8.634 3.253 1.00 0.00 H new