USER MOD reduce.3.24.130724 H: found=0, std=0, add=479, rem=0, adj=8 USER MOD reduce.3.24.130724 removed 478 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 259 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 261 THR OG1 : rot 180:sc= -1.55! USER MOD Set 2.1: A 236 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 239 SER OG : rot 67:sc= 1.23 USER MOD Single : A 220 HIS : no HD1:sc= -1.69 K(o=-1.7,f=-0.33) USER MOD Single : A 230 MET CE :methyl -170:sc= -1.69! (180deg=-1.92!) USER MOD Single : A 237 HIS : no HD1:sc= -0.0334 X(o=-0.033,f=0) USER MOD Single : A 240 ASN : amide:sc= -2.39 K(o=-2.4,f=-5.8!) USER MOD Single : A 242 GLN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 243 GLN : amide:sc= -0.827 X(o=-0.83,f=-0.37) USER MOD Single : A 246 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 251 THR OG1 : rot 111:sc= -2.37! USER MOD Single : A 265 TYR OH : rot 180:sc= 0 USER MOD Single : A 268 SER OG : rot 180:sc= 0 USER MOD Single : A 273 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 274 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 148 N ALA A 217 12.577 -9.041 -6.099 1.00 0.00 N ATOM 149 CA ALA A 217 11.576 -9.525 -5.157 1.00 0.00 C ATOM 150 C ALA A 217 11.063 -10.904 -5.560 1.00 0.00 C ATOM 151 O ALA A 217 10.426 -11.059 -6.601 1.00 0.00 O ATOM 152 CB ALA A 217 10.421 -8.538 -5.060 1.00 0.00 C ATOM 0 HA ALA A 217 12.048 -9.613 -4.178 1.00 0.00 H new ATOM 0 HB1 ALA A 217 9.681 -8.912 -4.353 1.00 0.00 H new ATOM 0 HB2 ALA A 217 10.795 -7.573 -4.717 1.00 0.00 H new ATOM 0 HB3 ALA A 217 9.959 -8.421 -6.040 1.00 0.00 H new ATOM 158 N ALA A 218 11.347 -11.901 -4.729 1.00 0.00 N ATOM 159 CA ALA A 218 10.914 -13.267 -4.999 1.00 0.00 C ATOM 160 C ALA A 218 9.399 -13.341 -5.156 1.00 0.00 C ATOM 161 O ALA A 218 8.891 -13.961 -6.091 1.00 0.00 O ATOM 162 CB ALA A 218 11.378 -14.197 -3.888 1.00 0.00 C ATOM 0 H ALA A 218 11.875 -11.789 -3.863 1.00 0.00 H new ATOM 0 HA ALA A 218 11.366 -13.587 -5.938 1.00 0.00 H new ATOM 0 HB1 ALA A 218 11.048 -15.213 -4.103 1.00 0.00 H new ATOM 0 HB2 ALA A 218 12.466 -14.175 -3.825 1.00 0.00 H new ATOM 0 HB3 ALA A 218 10.953 -13.870 -2.939 1.00 0.00 H new ATOM 168 N PHE A 219 8.681 -12.706 -4.235 1.00 0.00 N ATOM 169 CA PHE A 219 7.224 -12.701 -4.270 1.00 0.00 C ATOM 170 C PHE A 219 6.695 -11.353 -4.751 1.00 0.00 C ATOM 171 O PHE A 219 7.230 -10.302 -4.396 1.00 0.00 O ATOM 172 CB PHE A 219 6.658 -13.019 -2.885 1.00 0.00 C ATOM 173 CG PHE A 219 6.796 -14.464 -2.498 1.00 0.00 C ATOM 174 CD1 PHE A 219 7.989 -14.946 -1.985 1.00 0.00 C ATOM 175 CD2 PHE A 219 5.733 -15.340 -2.647 1.00 0.00 C ATOM 176 CE1 PHE A 219 8.119 -16.276 -1.629 1.00 0.00 C ATOM 177 CE2 PHE A 219 5.856 -16.670 -2.293 1.00 0.00 C ATOM 178 CZ PHE A 219 7.051 -17.138 -1.782 1.00 0.00 C ATOM 0 H PHE A 219 9.085 -12.188 -3.455 1.00 0.00 H new ATOM 0 HA PHE A 219 6.900 -13.469 -4.972 1.00 0.00 H new ATOM 0 HB2 PHE A 219 7.166 -12.402 -2.143 1.00 0.00 H new ATOM 0 HB3 PHE A 219 5.604 -12.744 -2.860 1.00 0.00 H new ATOM 0 HD1 PHE A 219 8.827 -14.276 -1.862 1.00 0.00 H new ATOM 0 HD2 PHE A 219 4.796 -14.979 -3.045 1.00 0.00 H new ATOM 0 HE1 PHE A 219 9.055 -16.640 -1.232 1.00 0.00 H new ATOM 0 HE2 PHE A 219 5.020 -17.342 -2.416 1.00 0.00 H new ATOM 0 HZ PHE A 219 7.150 -18.177 -1.503 1.00 0.00 H new ATOM 188 N HIS A 220 5.642 -11.391 -5.560 1.00 0.00 N ATOM 189 CA HIS A 220 5.040 -10.173 -6.090 1.00 0.00 C ATOM 190 C HIS A 220 3.528 -10.180 -5.885 1.00 0.00 C ATOM 191 O HIS A 220 2.909 -11.240 -5.805 1.00 0.00 O ATOM 192 CB HIS A 220 5.364 -10.023 -7.577 1.00 0.00 C ATOM 193 CG HIS A 220 4.865 -11.159 -8.416 1.00 0.00 C ATOM 194 ND1 HIS A 220 5.680 -11.894 -9.250 1.00 0.00 N ATOM 195 CD2 HIS A 220 3.625 -11.687 -8.544 1.00 0.00 C ATOM 196 CE1 HIS A 220 4.964 -12.822 -9.857 1.00 0.00 C ATOM 197 NE2 HIS A 220 3.713 -12.719 -9.446 1.00 0.00 N ATOM 0 H HIS A 220 5.187 -12.252 -5.863 1.00 0.00 H new ATOM 0 HA HIS A 220 5.459 -9.325 -5.548 1.00 0.00 H new ATOM 0 HB2 HIS A 220 4.929 -9.093 -7.943 1.00 0.00 H new ATOM 0 HB3 HIS A 220 6.444 -9.939 -7.699 1.00 0.00 H new ATOM 0 HD2 HIS A 220 2.733 -11.358 -8.032 1.00 0.00 H new ATOM 0 HE1 HIS A 220 5.338 -13.543 -10.569 1.00 0.00 H new ATOM 0 HE2 HIS A 220 2.939 -13.310 -9.749 1.00 0.00 H new ATOM 205 N GLU A 221 2.941 -8.990 -5.801 1.00 0.00 N ATOM 206 CA GLU A 221 1.502 -8.861 -5.603 1.00 0.00 C ATOM 207 C GLU A 221 0.909 -7.847 -6.577 1.00 0.00 C ATOM 208 O GLU A 221 1.475 -6.778 -6.798 1.00 0.00 O ATOM 209 CB GLU A 221 1.198 -8.439 -4.164 1.00 0.00 C ATOM 210 CG GLU A 221 1.703 -9.424 -3.122 1.00 0.00 C ATOM 211 CD GLU A 221 0.991 -9.281 -1.791 1.00 0.00 C ATOM 212 OE1 GLU A 221 0.897 -8.143 -1.287 1.00 0.00 O ATOM 213 OE2 GLU A 221 0.527 -10.309 -1.254 1.00 0.00 O ATOM 0 H GLU A 221 3.439 -8.102 -5.867 1.00 0.00 H new ATOM 0 HA GLU A 221 1.046 -9.833 -5.793 1.00 0.00 H new ATOM 0 HB2 GLU A 221 1.647 -7.463 -3.978 1.00 0.00 H new ATOM 0 HB3 GLU A 221 0.121 -8.321 -4.049 1.00 0.00 H new ATOM 0 HG2 GLU A 221 1.570 -10.440 -3.494 1.00 0.00 H new ATOM 0 HG3 GLU A 221 2.773 -9.275 -2.975 1.00 0.00 H new ATOM 220 N GLU A 222 -0.236 -8.194 -7.157 1.00 0.00 N ATOM 221 CA GLU A 222 -0.906 -7.315 -8.109 1.00 0.00 C ATOM 222 C GLU A 222 -2.422 -7.443 -7.994 1.00 0.00 C ATOM 223 O GLU A 222 -2.988 -8.506 -8.250 1.00 0.00 O ATOM 224 CB GLU A 222 -0.463 -7.640 -9.537 1.00 0.00 C ATOM 225 CG GLU A 222 0.763 -6.862 -9.986 1.00 0.00 C ATOM 226 CD GLU A 222 1.602 -7.625 -10.992 1.00 0.00 C ATOM 227 OE1 GLU A 222 2.170 -8.673 -10.619 1.00 0.00 O ATOM 228 OE2 GLU A 222 1.691 -7.174 -12.153 1.00 0.00 O ATOM 0 H GLU A 222 -0.718 -9.076 -6.985 1.00 0.00 H new ATOM 0 HA GLU A 222 -0.626 -6.288 -7.874 1.00 0.00 H new ATOM 0 HB2 GLU A 222 -0.252 -8.707 -9.609 1.00 0.00 H new ATOM 0 HB3 GLU A 222 -1.286 -7.431 -10.220 1.00 0.00 H new ATOM 0 HG2 GLU A 222 0.447 -5.916 -10.425 1.00 0.00 H new ATOM 0 HG3 GLU A 222 1.375 -6.622 -9.116 1.00 0.00 H new ATOM 235 N PHE A 223 -3.075 -6.352 -7.607 1.00 0.00 N ATOM 236 CA PHE A 223 -4.525 -6.342 -7.456 1.00 0.00 C ATOM 237 C PHE A 223 -5.118 -5.041 -7.989 1.00 0.00 C ATOM 238 O PHE A 223 -4.494 -3.983 -7.912 1.00 0.00 O ATOM 239 CB PHE A 223 -4.907 -6.525 -5.986 1.00 0.00 C ATOM 240 CG PHE A 223 -4.090 -5.687 -5.045 1.00 0.00 C ATOM 241 CD1 PHE A 223 -2.837 -6.110 -4.630 1.00 0.00 C ATOM 242 CD2 PHE A 223 -4.573 -4.476 -4.576 1.00 0.00 C ATOM 243 CE1 PHE A 223 -2.082 -5.341 -3.764 1.00 0.00 C ATOM 244 CE2 PHE A 223 -3.822 -3.703 -3.711 1.00 0.00 C ATOM 245 CZ PHE A 223 -2.575 -4.136 -3.304 1.00 0.00 C ATOM 0 H PHE A 223 -2.623 -5.463 -7.392 1.00 0.00 H new ATOM 0 HA PHE A 223 -4.932 -7.171 -8.036 1.00 0.00 H new ATOM 0 HB2 PHE A 223 -5.961 -6.277 -5.859 1.00 0.00 H new ATOM 0 HB3 PHE A 223 -4.792 -7.575 -5.717 1.00 0.00 H new ATOM 0 HD1 PHE A 223 -2.446 -7.051 -4.987 1.00 0.00 H new ATOM 0 HD2 PHE A 223 -5.547 -4.132 -4.890 1.00 0.00 H new ATOM 0 HE1 PHE A 223 -1.107 -5.682 -3.448 1.00 0.00 H new ATOM 0 HE2 PHE A 223 -4.210 -2.761 -3.353 1.00 0.00 H new ATOM 0 HZ PHE A 223 -1.987 -3.533 -2.628 1.00 0.00 H new ATOM 255 N VAL A 224 -6.329 -5.129 -8.532 1.00 0.00 N ATOM 256 CA VAL A 224 -7.008 -3.960 -9.078 1.00 0.00 C ATOM 257 C VAL A 224 -7.943 -3.336 -8.049 1.00 0.00 C ATOM 258 O VAL A 224 -8.908 -3.963 -7.610 1.00 0.00 O ATOM 259 CB VAL A 224 -7.816 -4.319 -10.339 1.00 0.00 C ATOM 260 CG1 VAL A 224 -8.303 -3.059 -11.039 1.00 0.00 C ATOM 261 CG2 VAL A 224 -6.981 -5.173 -11.282 1.00 0.00 C ATOM 0 H VAL A 224 -6.859 -5.997 -8.605 1.00 0.00 H new ATOM 0 HA VAL A 224 -6.234 -3.240 -9.344 1.00 0.00 H new ATOM 0 HB VAL A 224 -8.688 -4.898 -10.037 1.00 0.00 H new ATOM 0 HG11 VAL A 224 -8.872 -3.333 -11.928 1.00 0.00 H new ATOM 0 HG12 VAL A 224 -8.940 -2.490 -10.362 1.00 0.00 H new ATOM 0 HG13 VAL A 224 -7.447 -2.450 -11.330 1.00 0.00 H new ATOM 0 HG21 VAL A 224 -7.568 -5.417 -12.168 1.00 0.00 H new ATOM 0 HG22 VAL A 224 -6.089 -4.621 -11.579 1.00 0.00 H new ATOM 0 HG23 VAL A 224 -6.687 -6.093 -10.776 1.00 0.00 H new ATOM 271 N VAL A 225 -7.653 -2.097 -7.667 1.00 0.00 N ATOM 272 CA VAL A 225 -8.469 -1.387 -6.690 1.00 0.00 C ATOM 273 C VAL A 225 -9.456 -0.449 -7.375 1.00 0.00 C ATOM 274 O VAL A 225 -9.168 0.104 -8.437 1.00 0.00 O ATOM 275 CB VAL A 225 -7.596 -0.572 -5.716 1.00 0.00 C ATOM 276 CG1 VAL A 225 -8.466 0.277 -4.802 1.00 0.00 C ATOM 277 CG2 VAL A 225 -6.699 -1.495 -4.905 1.00 0.00 C ATOM 0 H VAL A 225 -6.858 -1.564 -8.020 1.00 0.00 H new ATOM 0 HA VAL A 225 -9.019 -2.142 -6.129 1.00 0.00 H new ATOM 0 HB VAL A 225 -6.961 0.096 -6.297 1.00 0.00 H new ATOM 0 HG11 VAL A 225 -7.832 0.845 -4.121 1.00 0.00 H new ATOM 0 HG12 VAL A 225 -9.062 0.964 -5.402 1.00 0.00 H new ATOM 0 HG13 VAL A 225 -9.128 -0.370 -4.226 1.00 0.00 H new ATOM 0 HG21 VAL A 225 -6.090 -0.903 -4.223 1.00 0.00 H new ATOM 0 HG22 VAL A 225 -7.314 -2.189 -4.333 1.00 0.00 H new ATOM 0 HG23 VAL A 225 -6.050 -2.055 -5.578 1.00 0.00 H new ATOM 287 N ARG A 226 -10.622 -0.275 -6.761 1.00 0.00 N ATOM 288 CA ARG A 226 -11.653 0.596 -7.313 1.00 0.00 C ATOM 289 C ARG A 226 -11.132 2.021 -7.475 1.00 0.00 C ATOM 290 O ARG A 226 -10.649 2.627 -6.520 1.00 0.00 O ATOM 291 CB ARG A 226 -12.889 0.592 -6.412 1.00 0.00 C ATOM 292 CG ARG A 226 -13.798 -0.606 -6.629 1.00 0.00 C ATOM 293 CD ARG A 226 -14.841 -0.328 -7.700 1.00 0.00 C ATOM 294 NE ARG A 226 -14.328 -0.582 -9.044 1.00 0.00 N ATOM 295 CZ ARG A 226 -14.926 -0.159 -10.152 1.00 0.00 C ATOM 296 NH1 ARG A 226 -16.052 0.537 -10.076 1.00 0.00 N ATOM 297 NH2 ARG A 226 -14.397 -0.430 -11.338 1.00 0.00 N ATOM 0 H ARG A 226 -10.876 -0.725 -5.882 1.00 0.00 H new ATOM 0 HA ARG A 226 -11.927 0.215 -8.297 1.00 0.00 H new ATOM 0 HB2 ARG A 226 -12.569 0.610 -5.370 1.00 0.00 H new ATOM 0 HB3 ARG A 226 -13.458 1.505 -6.586 1.00 0.00 H new ATOM 0 HG2 ARG A 226 -13.200 -1.470 -6.918 1.00 0.00 H new ATOM 0 HG3 ARG A 226 -14.295 -0.861 -5.693 1.00 0.00 H new ATOM 0 HD2 ARG A 226 -15.717 -0.952 -7.523 1.00 0.00 H new ATOM 0 HD3 ARG A 226 -15.168 0.709 -7.627 1.00 0.00 H new ATOM 0 HE ARG A 226 -13.463 -1.114 -9.137 1.00 0.00 H new ATOM 0 HH11 ARG A 226 -16.460 0.748 -9.166 1.00 0.00 H new ATOM 0 HH12 ARG A 226 -16.510 0.861 -10.928 1.00 0.00 H new ATOM 0 HH21 ARG A 226 -13.530 -0.964 -11.400 1.00 0.00 H new ATOM 0 HH22 ARG A 226 -14.857 -0.105 -12.188 1.00 0.00 H new ATOM 311 N GLU A 227 -11.235 2.548 -8.691 1.00 0.00 N ATOM 312 CA GLU A 227 -10.773 3.901 -8.977 1.00 0.00 C ATOM 313 C GLU A 227 -11.402 4.906 -8.017 1.00 0.00 C ATOM 314 O GLU A 227 -10.934 6.037 -7.890 1.00 0.00 O ATOM 315 CB GLU A 227 -11.105 4.283 -10.421 1.00 0.00 C ATOM 316 CG GLU A 227 -10.178 3.651 -11.446 1.00 0.00 C ATOM 317 CD GLU A 227 -10.272 4.316 -12.806 1.00 0.00 C ATOM 318 OE1 GLU A 227 -9.771 5.451 -12.946 1.00 0.00 O ATOM 319 OE2 GLU A 227 -10.845 3.701 -13.729 1.00 0.00 O ATOM 0 H GLU A 227 -11.634 2.059 -9.493 1.00 0.00 H new ATOM 0 HA GLU A 227 -9.692 3.923 -8.842 1.00 0.00 H new ATOM 0 HB2 GLU A 227 -12.131 3.987 -10.640 1.00 0.00 H new ATOM 0 HB3 GLU A 227 -11.058 5.367 -10.521 1.00 0.00 H new ATOM 0 HG2 GLU A 227 -9.151 3.711 -11.087 1.00 0.00 H new ATOM 0 HG3 GLU A 227 -10.420 2.593 -11.546 1.00 0.00 H new ATOM 326 N ASP A 228 -12.467 4.484 -7.344 1.00 0.00 N ATOM 327 CA ASP A 228 -13.162 5.346 -6.394 1.00 0.00 C ATOM 328 C ASP A 228 -12.539 5.238 -5.006 1.00 0.00 C ATOM 329 O ASP A 228 -12.417 6.232 -4.289 1.00 0.00 O ATOM 330 CB ASP A 228 -14.645 4.979 -6.331 1.00 0.00 C ATOM 331 CG ASP A 228 -15.476 6.042 -5.639 1.00 0.00 C ATOM 332 OD1 ASP A 228 -15.538 7.177 -6.157 1.00 0.00 O ATOM 333 OD2 ASP A 228 -16.063 5.740 -4.580 1.00 0.00 O ATOM 0 H ASP A 228 -12.868 3.551 -7.438 1.00 0.00 H new ATOM 0 HA ASP A 228 -13.065 6.376 -6.737 1.00 0.00 H new ATOM 0 HB2 ASP A 228 -15.022 4.828 -7.342 1.00 0.00 H new ATOM 0 HB3 ASP A 228 -14.760 4.032 -5.804 1.00 0.00 H new ATOM 338 N LEU A 229 -12.147 4.025 -4.632 1.00 0.00 N ATOM 339 CA LEU A 229 -11.537 3.786 -3.328 1.00 0.00 C ATOM 340 C LEU A 229 -10.065 4.186 -3.334 1.00 0.00 C ATOM 341 O LEU A 229 -9.513 4.573 -2.305 1.00 0.00 O ATOM 342 CB LEU A 229 -11.675 2.313 -2.941 1.00 0.00 C ATOM 343 CG LEU A 229 -13.073 1.858 -2.520 1.00 0.00 C ATOM 344 CD1 LEU A 229 -13.124 0.344 -2.389 1.00 0.00 C ATOM 345 CD2 LEU A 229 -13.479 2.523 -1.213 1.00 0.00 C ATOM 0 H LEU A 229 -12.240 3.192 -5.213 1.00 0.00 H new ATOM 0 HA LEU A 229 -12.058 4.399 -2.593 1.00 0.00 H new ATOM 0 HB2 LEU A 229 -11.356 1.704 -3.787 1.00 0.00 H new ATOM 0 HB3 LEU A 229 -10.986 2.107 -2.122 1.00 0.00 H new ATOM 0 HG LEU A 229 -13.781 2.159 -3.292 1.00 0.00 H new ATOM 0 HD11 LEU A 229 -14.126 0.038 -2.089 1.00 0.00 H new ATOM 0 HD12 LEU A 229 -12.877 -0.113 -3.347 1.00 0.00 H new ATOM 0 HD13 LEU A 229 -12.405 0.019 -1.637 1.00 0.00 H new ATOM 0 HD21 LEU A 229 -14.476 2.188 -0.929 1.00 0.00 H new ATOM 0 HD22 LEU A 229 -12.769 2.253 -0.431 1.00 0.00 H new ATOM 0 HD23 LEU A 229 -13.483 3.605 -1.341 1.00 0.00 H new ATOM 357 N MET A 230 -9.436 4.092 -4.501 1.00 0.00 N ATOM 358 CA MET A 230 -8.029 4.448 -4.641 1.00 0.00 C ATOM 359 C MET A 230 -7.686 5.659 -3.781 1.00 0.00 C ATOM 360 O MET A 230 -6.924 5.555 -2.820 1.00 0.00 O ATOM 361 CB MET A 230 -7.697 4.738 -6.107 1.00 0.00 C ATOM 362 CG MET A 230 -7.514 3.485 -6.948 1.00 0.00 C ATOM 363 SD MET A 230 -7.040 3.853 -8.648 1.00 0.00 S ATOM 364 CE MET A 230 -5.339 3.291 -8.655 1.00 0.00 C ATOM 0 H MET A 230 -9.878 3.772 -5.363 1.00 0.00 H new ATOM 0 HA MET A 230 -7.431 3.602 -4.301 1.00 0.00 H new ATOM 0 HB2 MET A 230 -8.495 5.342 -6.539 1.00 0.00 H new ATOM 0 HB3 MET A 230 -6.785 5.333 -6.154 1.00 0.00 H new ATOM 0 HG2 MET A 230 -6.752 2.853 -6.491 1.00 0.00 H new ATOM 0 HG3 MET A 230 -8.443 2.914 -6.949 1.00 0.00 H new ATOM 0 HE1 MET A 230 -4.854 3.611 -9.577 1.00 0.00 H new ATOM 0 HE2 MET A 230 -4.812 3.716 -7.801 1.00 0.00 H new ATOM 0 HE3 MET A 230 -5.315 2.203 -8.591 1.00 0.00 H new ATOM 374 N GLY A 231 -8.253 6.809 -4.133 1.00 0.00 N ATOM 375 CA GLY A 231 -7.995 8.024 -3.382 1.00 0.00 C ATOM 376 C GLY A 231 -7.907 7.776 -1.890 1.00 0.00 C ATOM 377 O GLY A 231 -6.991 8.261 -1.225 1.00 0.00 O ATOM 0 H GLY A 231 -8.886 6.921 -4.925 1.00 0.00 H new ATOM 0 HA2 GLY A 231 -7.063 8.470 -3.728 1.00 0.00 H new ATOM 0 HA3 GLY A 231 -8.787 8.746 -3.581 1.00 0.00 H new ATOM 381 N LEU A 232 -8.863 7.021 -1.360 1.00 0.00 N ATOM 382 CA LEU A 232 -8.891 6.710 0.065 1.00 0.00 C ATOM 383 C LEU A 232 -7.754 5.765 0.439 1.00 0.00 C ATOM 384 O LEU A 232 -6.934 6.075 1.302 1.00 0.00 O ATOM 385 CB LEU A 232 -10.235 6.085 0.444 1.00 0.00 C ATOM 386 CG LEU A 232 -11.479 6.896 0.080 1.00 0.00 C ATOM 387 CD1 LEU A 232 -12.739 6.087 0.342 1.00 0.00 C ATOM 388 CD2 LEU A 232 -11.510 8.203 0.858 1.00 0.00 C ATOM 0 H LEU A 232 -9.629 6.613 -1.896 1.00 0.00 H new ATOM 0 HA LEU A 232 -8.761 7.641 0.617 1.00 0.00 H new ATOM 0 HB2 LEU A 232 -10.308 5.110 -0.037 1.00 0.00 H new ATOM 0 HB3 LEU A 232 -10.241 5.911 1.520 1.00 0.00 H new ATOM 0 HG LEU A 232 -11.438 7.131 -0.984 1.00 0.00 H new ATOM 0 HD11 LEU A 232 -13.614 6.680 0.077 1.00 0.00 H new ATOM 0 HD12 LEU A 232 -12.720 5.179 -0.261 1.00 0.00 H new ATOM 0 HD13 LEU A 232 -12.787 5.821 1.398 1.00 0.00 H new ATOM 0 HD21 LEU A 232 -12.402 8.767 0.586 1.00 0.00 H new ATOM 0 HD22 LEU A 232 -11.527 7.990 1.927 1.00 0.00 H new ATOM 0 HD23 LEU A 232 -10.623 8.790 0.619 1.00 0.00 H new ATOM 400 N ALA A 233 -7.711 4.610 -0.218 1.00 0.00 N ATOM 401 CA ALA A 233 -6.672 3.621 0.042 1.00 0.00 C ATOM 402 C ALA A 233 -5.298 4.278 0.127 1.00 0.00 C ATOM 403 O ALA A 233 -4.466 3.893 0.950 1.00 0.00 O ATOM 404 CB ALA A 233 -6.681 2.550 -1.038 1.00 0.00 C ATOM 0 H ALA A 233 -8.384 4.336 -0.934 1.00 0.00 H new ATOM 0 HA ALA A 233 -6.882 3.153 1.004 1.00 0.00 H new ATOM 0 HB1 ALA A 233 -5.900 1.818 -0.831 1.00 0.00 H new ATOM 0 HB2 ALA A 233 -7.651 2.053 -1.049 1.00 0.00 H new ATOM 0 HB3 ALA A 233 -6.499 3.011 -2.009 1.00 0.00 H new ATOM 410 N ILE A 234 -5.067 5.268 -0.728 1.00 0.00 N ATOM 411 CA ILE A 234 -3.794 5.977 -0.748 1.00 0.00 C ATOM 412 C ILE A 234 -3.702 6.976 0.401 1.00 0.00 C ATOM 413 O ILE A 234 -2.633 7.187 0.971 1.00 0.00 O ATOM 414 CB ILE A 234 -3.586 6.723 -2.079 1.00 0.00 C ATOM 415 CG1 ILE A 234 -3.622 5.740 -3.251 1.00 0.00 C ATOM 416 CG2 ILE A 234 -2.269 7.484 -2.060 1.00 0.00 C ATOM 417 CD1 ILE A 234 -3.499 6.406 -4.603 1.00 0.00 C ATOM 0 H ILE A 234 -5.744 5.597 -1.416 1.00 0.00 H new ATOM 0 HA ILE A 234 -3.013 5.225 -0.636 1.00 0.00 H new ATOM 0 HB ILE A 234 -4.396 7.441 -2.206 1.00 0.00 H new ATOM 0 HG12 ILE A 234 -2.812 5.019 -3.135 1.00 0.00 H new ATOM 0 HG13 ILE A 234 -4.556 5.179 -3.215 1.00 0.00 H new ATOM 0 HG21 ILE A 234 -2.137 8.006 -3.008 1.00 0.00 H new ATOM 0 HG22 ILE A 234 -2.279 8.208 -1.245 1.00 0.00 H new ATOM 0 HG23 ILE A 234 -1.446 6.784 -1.913 1.00 0.00 H new ATOM 0 HD11 ILE A 234 -3.532 5.649 -5.386 1.00 0.00 H new ATOM 0 HD12 ILE A 234 -4.323 7.106 -4.740 1.00 0.00 H new ATOM 0 HD13 ILE A 234 -2.553 6.944 -4.659 1.00 0.00 H new ATOM 429 N GLY A 235 -4.834 7.588 0.737 1.00 0.00 N ATOM 430 CA GLY A 235 -4.860 8.556 1.818 1.00 0.00 C ATOM 431 C GLY A 235 -4.650 9.976 1.330 1.00 0.00 C ATOM 432 O GLY A 235 -5.082 10.335 0.234 1.00 0.00 O ATOM 0 H GLY A 235 -5.732 7.431 0.280 1.00 0.00 H new ATOM 0 HA2 GLY A 235 -5.816 8.491 2.337 1.00 0.00 H new ATOM 0 HA3 GLY A 235 -4.086 8.306 2.544 1.00 0.00 H new ATOM 436 N THR A 236 -3.986 10.789 2.146 1.00 0.00 N ATOM 437 CA THR A 236 -3.722 12.178 1.793 1.00 0.00 C ATOM 438 C THR A 236 -2.295 12.355 1.287 1.00 0.00 C ATOM 439 O THR A 236 -1.368 11.709 1.776 1.00 0.00 O ATOM 440 CB THR A 236 -3.950 13.116 2.993 1.00 0.00 C ATOM 441 OG1 THR A 236 -3.251 12.620 4.141 1.00 0.00 O ATOM 442 CG2 THR A 236 -5.432 13.239 3.311 1.00 0.00 C ATOM 0 H THR A 236 -3.621 10.509 3.056 1.00 0.00 H new ATOM 0 HA THR A 236 -4.421 12.441 0.999 1.00 0.00 H new ATOM 0 HB THR A 236 -3.568 14.103 2.732 1.00 0.00 H new ATOM 0 HG1 THR A 236 -3.399 13.222 4.900 1.00 0.00 H new ATOM 0 HG21 THR A 236 -5.567 13.907 4.162 1.00 0.00 H new ATOM 0 HG22 THR A 236 -5.957 13.643 2.446 1.00 0.00 H new ATOM 0 HG23 THR A 236 -5.835 12.256 3.554 1.00 0.00 H new ATOM 450 N HIS A 237 -2.125 13.235 0.306 1.00 0.00 N ATOM 451 CA HIS A 237 -0.808 13.498 -0.265 1.00 0.00 C ATOM 452 C HIS A 237 0.036 12.228 -0.293 1.00 0.00 C ATOM 453 O HIS A 237 1.228 12.256 0.009 1.00 0.00 O ATOM 454 CB HIS A 237 -0.090 14.585 0.536 1.00 0.00 C ATOM 455 CG HIS A 237 -0.398 15.975 0.071 1.00 0.00 C ATOM 456 ND1 HIS A 237 -0.898 16.953 0.904 1.00 0.00 N ATOM 457 CD2 HIS A 237 -0.273 16.548 -1.149 1.00 0.00 C ATOM 458 CE1 HIS A 237 -1.069 18.068 0.216 1.00 0.00 C ATOM 459 NE2 HIS A 237 -0.697 17.849 -1.032 1.00 0.00 N ATOM 0 H HIS A 237 -2.882 13.778 -0.110 1.00 0.00 H new ATOM 0 HA HIS A 237 -0.946 13.843 -1.290 1.00 0.00 H new ATOM 0 HB2 HIS A 237 -0.366 14.493 1.586 1.00 0.00 H new ATOM 0 HB3 HIS A 237 0.986 14.420 0.474 1.00 0.00 H new ATOM 0 HD2 HIS A 237 0.092 16.071 -2.047 1.00 0.00 H new ATOM 0 HE1 HIS A 237 -1.449 19.000 0.608 1.00 0.00 H new ATOM 0 HE2 HIS A 237 -0.721 18.535 -1.787 1.00 0.00 H new ATOM 467 N GLY A 238 -0.592 11.114 -0.656 1.00 0.00 N ATOM 468 CA GLY A 238 0.116 9.848 -0.716 1.00 0.00 C ATOM 469 C GLY A 238 0.660 9.425 0.634 1.00 0.00 C ATOM 470 O GLY A 238 1.871 9.281 0.806 1.00 0.00 O ATOM 0 H GLY A 238 -1.579 11.065 -0.910 1.00 0.00 H new ATOM 0 HA2 GLY A 238 -0.556 9.077 -1.092 1.00 0.00 H new ATOM 0 HA3 GLY A 238 0.938 9.928 -1.427 1.00 0.00 H new ATOM 474 N SER A 239 -0.236 9.225 1.596 1.00 0.00 N ATOM 475 CA SER A 239 0.161 8.821 2.939 1.00 0.00 C ATOM 476 C SER A 239 0.281 7.303 3.036 1.00 0.00 C ATOM 477 O SER A 239 1.348 6.773 3.342 1.00 0.00 O ATOM 478 CB SER A 239 -0.850 9.331 3.968 1.00 0.00 C ATOM 479 OG SER A 239 -0.674 10.716 4.213 1.00 0.00 O ATOM 0 H SER A 239 -1.242 9.336 1.469 1.00 0.00 H new ATOM 0 HA SER A 239 1.136 9.260 3.150 1.00 0.00 H new ATOM 0 HB2 SER A 239 -1.863 9.148 3.609 1.00 0.00 H new ATOM 0 HB3 SER A 239 -0.737 8.776 4.900 1.00 0.00 H new ATOM 0 HG SER A 239 -0.906 11.223 3.407 1.00 0.00 H new ATOM 485 N ASN A 240 -0.822 6.611 2.773 1.00 0.00 N ATOM 486 CA ASN A 240 -0.842 5.153 2.831 1.00 0.00 C ATOM 487 C ASN A 240 0.326 4.562 2.048 1.00 0.00 C ATOM 488 O ASN A 240 1.110 3.776 2.582 1.00 0.00 O ATOM 489 CB ASN A 240 -2.164 4.618 2.278 1.00 0.00 C ATOM 490 CG ASN A 240 -3.350 5.003 3.141 1.00 0.00 C ATOM 491 OD1 ASN A 240 -3.578 6.183 3.411 1.00 0.00 O ATOM 492 ND2 ASN A 240 -4.112 4.008 3.578 1.00 0.00 N ATOM 0 H ASN A 240 -1.714 7.035 2.518 1.00 0.00 H new ATOM 0 HA ASN A 240 -0.745 4.854 3.875 1.00 0.00 H new ATOM 0 HB2 ASN A 240 -2.314 5.000 1.268 1.00 0.00 H new ATOM 0 HB3 ASN A 240 -2.110 3.532 2.203 1.00 0.00 H new ATOM 0 HD21 ASN A 240 -4.924 4.206 4.162 1.00 0.00 H new ATOM 0 HD22 ASN A 240 -3.885 3.045 3.329 1.00 0.00 H new ATOM 499 N ILE A 241 0.437 4.945 0.781 1.00 0.00 N ATOM 500 CA ILE A 241 1.510 4.455 -0.074 1.00 0.00 C ATOM 501 C ILE A 241 2.862 4.562 0.623 1.00 0.00 C ATOM 502 O ILE A 241 3.603 3.583 0.715 1.00 0.00 O ATOM 503 CB ILE A 241 1.569 5.229 -1.404 1.00 0.00 C ATOM 504 CG1 ILE A 241 0.408 4.816 -2.312 1.00 0.00 C ATOM 505 CG2 ILE A 241 2.901 4.990 -2.098 1.00 0.00 C ATOM 506 CD1 ILE A 241 0.469 5.434 -3.691 1.00 0.00 C ATOM 0 H ILE A 241 -0.204 5.594 0.324 1.00 0.00 H new ATOM 0 HA ILE A 241 1.293 3.407 -0.282 1.00 0.00 H new ATOM 0 HB ILE A 241 1.478 6.294 -1.191 1.00 0.00 H new ATOM 0 HG12 ILE A 241 0.402 3.730 -2.409 1.00 0.00 H new ATOM 0 HG13 ILE A 241 -0.532 5.099 -1.838 1.00 0.00 H new ATOM 0 HG21 ILE A 241 2.927 5.544 -3.036 1.00 0.00 H new ATOM 0 HG22 ILE A 241 3.713 5.329 -1.454 1.00 0.00 H new ATOM 0 HG23 ILE A 241 3.019 3.926 -2.301 1.00 0.00 H new ATOM 0 HD11 ILE A 241 -0.385 5.097 -4.279 1.00 0.00 H new ATOM 0 HD12 ILE A 241 0.444 6.520 -3.604 1.00 0.00 H new ATOM 0 HD13 ILE A 241 1.392 5.131 -4.185 1.00 0.00 H new ATOM 518 N GLN A 242 3.175 5.756 1.115 1.00 0.00 N ATOM 519 CA GLN A 242 4.437 5.991 1.806 1.00 0.00 C ATOM 520 C GLN A 242 4.647 4.969 2.919 1.00 0.00 C ATOM 521 O GLN A 242 5.737 4.420 3.072 1.00 0.00 O ATOM 522 CB GLN A 242 4.471 7.406 2.384 1.00 0.00 C ATOM 523 CG GLN A 242 4.964 8.454 1.399 1.00 0.00 C ATOM 524 CD GLN A 242 5.148 9.816 2.038 1.00 0.00 C ATOM 525 OE1 GLN A 242 4.404 10.195 2.944 1.00 0.00 O ATOM 526 NE2 GLN A 242 6.143 10.561 1.571 1.00 0.00 N ATOM 0 H GLN A 242 2.572 6.576 1.048 1.00 0.00 H new ATOM 0 HA GLN A 242 5.244 5.883 1.081 1.00 0.00 H new ATOM 0 HB2 GLN A 242 3.470 7.677 2.719 1.00 0.00 H new ATOM 0 HB3 GLN A 242 5.115 7.415 3.264 1.00 0.00 H new ATOM 0 HG2 GLN A 242 5.912 8.127 0.971 1.00 0.00 H new ATOM 0 HG3 GLN A 242 4.254 8.536 0.576 1.00 0.00 H new ATOM 0 HE21 GLN A 242 6.735 10.208 0.819 1.00 0.00 H new ATOM 0 HE22 GLN A 242 6.315 11.486 1.964 1.00 0.00 H new ATOM 535 N GLN A 243 3.595 4.720 3.692 1.00 0.00 N ATOM 536 CA GLN A 243 3.665 3.765 4.792 1.00 0.00 C ATOM 537 C GLN A 243 4.016 2.372 4.281 1.00 0.00 C ATOM 538 O GLN A 243 4.934 1.728 4.788 1.00 0.00 O ATOM 539 CB GLN A 243 2.334 3.725 5.546 1.00 0.00 C ATOM 540 CG GLN A 243 1.995 5.028 6.251 1.00 0.00 C ATOM 541 CD GLN A 243 3.142 5.552 7.092 1.00 0.00 C ATOM 542 OE1 GLN A 243 3.216 5.292 8.293 1.00 0.00 O ATOM 543 NE2 GLN A 243 4.045 6.296 6.464 1.00 0.00 N ATOM 0 H GLN A 243 2.685 5.166 3.577 1.00 0.00 H new ATOM 0 HA GLN A 243 4.451 4.091 5.474 1.00 0.00 H new ATOM 0 HB2 GLN A 243 1.536 3.483 4.844 1.00 0.00 H new ATOM 0 HB3 GLN A 243 2.367 2.921 6.282 1.00 0.00 H new ATOM 0 HG2 GLN A 243 1.722 5.778 5.509 1.00 0.00 H new ATOM 0 HG3 GLN A 243 1.123 4.876 6.887 1.00 0.00 H new ATOM 0 HE21 GLN A 243 3.945 6.487 5.467 1.00 0.00 H new ATOM 0 HE22 GLN A 243 4.839 6.677 6.979 1.00 0.00 H new ATOM 552 N ALA A 244 3.279 1.913 3.275 1.00 0.00 N ATOM 553 CA ALA A 244 3.514 0.596 2.694 1.00 0.00 C ATOM 554 C ALA A 244 4.969 0.438 2.265 1.00 0.00 C ATOM 555 O ALA A 244 5.545 -0.644 2.380 1.00 0.00 O ATOM 556 CB ALA A 244 2.585 0.367 1.512 1.00 0.00 C ATOM 0 H ALA A 244 2.514 2.433 2.845 1.00 0.00 H new ATOM 0 HA ALA A 244 3.304 -0.154 3.457 1.00 0.00 H new ATOM 0 HB1 ALA A 244 2.772 -0.620 1.088 1.00 0.00 H new ATOM 0 HB2 ALA A 244 1.549 0.429 1.846 1.00 0.00 H new ATOM 0 HB3 ALA A 244 2.767 1.128 0.753 1.00 0.00 H new ATOM 562 N ARG A 245 5.556 1.522 1.769 1.00 0.00 N ATOM 563 CA ARG A 245 6.943 1.501 1.320 1.00 0.00 C ATOM 564 C ARG A 245 7.899 1.481 2.509 1.00 0.00 C ATOM 565 O ARG A 245 9.097 1.244 2.353 1.00 0.00 O ATOM 566 CB ARG A 245 7.234 2.717 0.439 1.00 0.00 C ATOM 567 CG ARG A 245 8.700 2.861 0.064 1.00 0.00 C ATOM 568 CD ARG A 245 8.933 4.078 -0.818 1.00 0.00 C ATOM 569 NE ARG A 245 10.301 4.577 -0.712 1.00 0.00 N ATOM 570 CZ ARG A 245 10.800 5.128 0.389 1.00 0.00 C ATOM 571 NH1 ARG A 245 10.046 5.251 1.472 1.00 0.00 N ATOM 572 NH2 ARG A 245 12.055 5.558 0.407 1.00 0.00 N ATOM 0 H ARG A 245 5.093 2.425 1.668 1.00 0.00 H new ATOM 0 HA ARG A 245 7.096 0.593 0.737 1.00 0.00 H new ATOM 0 HB2 ARG A 245 6.640 2.645 -0.472 1.00 0.00 H new ATOM 0 HB3 ARG A 245 6.911 3.618 0.960 1.00 0.00 H new ATOM 0 HG2 ARG A 245 9.301 2.946 0.969 1.00 0.00 H new ATOM 0 HG3 ARG A 245 9.033 1.964 -0.457 1.00 0.00 H new ATOM 0 HD2 ARG A 245 8.721 3.820 -1.855 1.00 0.00 H new ATOM 0 HD3 ARG A 245 8.236 4.868 -0.537 1.00 0.00 H new ATOM 0 HE ARG A 245 10.907 4.498 -1.529 1.00 0.00 H new ATOM 0 HH11 ARG A 245 9.080 4.922 1.461 1.00 0.00 H new ATOM 0 HH12 ARG A 245 10.431 5.674 2.316 1.00 0.00 H new ATOM 0 HH21 ARG A 245 12.638 5.466 -0.425 1.00 0.00 H new ATOM 0 HH22 ARG A 245 12.437 5.981 1.253 1.00 0.00 H new ATOM 586 N LYS A 246 7.362 1.732 3.698 1.00 0.00 N ATOM 587 CA LYS A 246 8.165 1.743 4.915 1.00 0.00 C ATOM 588 C LYS A 246 8.132 0.381 5.601 1.00 0.00 C ATOM 589 O LYS A 246 8.508 0.252 6.766 1.00 0.00 O ATOM 590 CB LYS A 246 7.659 2.822 5.875 1.00 0.00 C ATOM 591 CG LYS A 246 8.087 4.227 5.490 1.00 0.00 C ATOM 592 CD LYS A 246 7.661 5.245 6.535 1.00 0.00 C ATOM 593 CE LYS A 246 7.895 6.669 6.053 1.00 0.00 C ATOM 594 NZ LYS A 246 9.320 7.076 6.199 1.00 0.00 N ATOM 0 H LYS A 246 6.372 1.931 3.845 1.00 0.00 H new ATOM 0 HA LYS A 246 9.195 1.966 4.638 1.00 0.00 H new ATOM 0 HB2 LYS A 246 6.570 2.781 5.914 1.00 0.00 H new ATOM 0 HB3 LYS A 246 8.022 2.603 6.879 1.00 0.00 H new ATOM 0 HG2 LYS A 246 9.170 4.259 5.370 1.00 0.00 H new ATOM 0 HG3 LYS A 246 7.652 4.490 4.526 1.00 0.00 H new ATOM 0 HD2 LYS A 246 6.605 5.108 6.769 1.00 0.00 H new ATOM 0 HD3 LYS A 246 8.217 5.076 7.457 1.00 0.00 H new ATOM 0 HE2 LYS A 246 7.599 6.752 5.007 1.00 0.00 H new ATOM 0 HE3 LYS A 246 7.262 7.353 6.619 1.00 0.00 H new ATOM 0 HZ1 LYS A 246 9.439 8.052 5.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 246 9.596 7.021 7.200 1.00 0.00 H new ATOM 0 HZ3 LYS A 246 9.922 6.439 5.639 1.00 0.00 H new ATOM 608 N VAL A 247 7.680 -0.634 4.870 1.00 0.00 N ATOM 609 CA VAL A 247 7.600 -1.987 5.407 1.00 0.00 C ATOM 610 C VAL A 247 8.819 -2.811 5.005 1.00 0.00 C ATOM 611 O VAL A 247 9.297 -2.746 3.872 1.00 0.00 O ATOM 612 CB VAL A 247 6.326 -2.707 4.927 1.00 0.00 C ATOM 613 CG1 VAL A 247 6.304 -4.144 5.427 1.00 0.00 C ATOM 614 CG2 VAL A 247 5.085 -1.956 5.385 1.00 0.00 C ATOM 0 H VAL A 247 7.364 -0.544 3.904 1.00 0.00 H new ATOM 0 HA VAL A 247 7.569 -1.895 6.493 1.00 0.00 H new ATOM 0 HB VAL A 247 6.330 -2.727 3.837 1.00 0.00 H new ATOM 0 HG11 VAL A 247 5.397 -4.637 5.078 1.00 0.00 H new ATOM 0 HG12 VAL A 247 7.176 -4.676 5.045 1.00 0.00 H new ATOM 0 HG13 VAL A 247 6.324 -4.150 6.517 1.00 0.00 H new ATOM 0 HG21 VAL A 247 4.194 -2.479 5.037 1.00 0.00 H new ATOM 0 HG22 VAL A 247 5.073 -1.903 6.474 1.00 0.00 H new ATOM 0 HG23 VAL A 247 5.098 -0.947 4.973 1.00 0.00 H new ATOM 624 N PRO A 248 9.334 -3.606 5.954 1.00 0.00 N ATOM 625 CA PRO A 248 10.504 -4.459 5.722 1.00 0.00 C ATOM 626 C PRO A 248 10.198 -5.618 4.780 1.00 0.00 C ATOM 627 O PRO A 248 9.097 -6.168 4.793 1.00 0.00 O ATOM 628 CB PRO A 248 10.844 -4.982 7.120 1.00 0.00 C ATOM 629 CG PRO A 248 9.558 -4.923 7.870 1.00 0.00 C ATOM 630 CD PRO A 248 8.816 -3.733 7.327 1.00 0.00 C ATOM 0 HA PRO A 248 11.319 -3.913 5.246 1.00 0.00 H new ATOM 0 HB2 PRO A 248 11.232 -6.000 7.078 1.00 0.00 H new ATOM 0 HB3 PRO A 248 11.609 -4.369 7.597 1.00 0.00 H new ATOM 0 HG2 PRO A 248 8.983 -5.838 7.731 1.00 0.00 H new ATOM 0 HG3 PRO A 248 9.735 -4.817 8.940 1.00 0.00 H new ATOM 0 HD2 PRO A 248 7.738 -3.893 7.337 1.00 0.00 H new ATOM 0 HD3 PRO A 248 9.010 -2.836 7.915 1.00 0.00 H new ATOM 638 N GLY A 249 11.180 -5.985 3.962 1.00 0.00 N ATOM 639 CA GLY A 249 10.995 -7.077 3.024 1.00 0.00 C ATOM 640 C GLY A 249 10.489 -6.604 1.676 1.00 0.00 C ATOM 641 O GLY A 249 10.614 -7.310 0.675 1.00 0.00 O ATOM 0 H GLY A 249 12.100 -5.546 3.932 1.00 0.00 H new ATOM 0 HA2 GLY A 249 11.941 -7.601 2.890 1.00 0.00 H new ATOM 0 HA3 GLY A 249 10.289 -7.795 3.442 1.00 0.00 H new ATOM 645 N VAL A 250 9.914 -5.406 1.648 1.00 0.00 N ATOM 646 CA VAL A 250 9.387 -4.839 0.412 1.00 0.00 C ATOM 647 C VAL A 250 10.483 -4.141 -0.384 1.00 0.00 C ATOM 648 O VAL A 250 11.015 -3.114 0.037 1.00 0.00 O ATOM 649 CB VAL A 250 8.254 -3.835 0.694 1.00 0.00 C ATOM 650 CG1 VAL A 250 7.752 -3.218 -0.602 1.00 0.00 C ATOM 651 CG2 VAL A 250 7.118 -4.511 1.447 1.00 0.00 C ATOM 0 H VAL A 250 9.801 -4.809 2.467 1.00 0.00 H new ATOM 0 HA VAL A 250 8.990 -5.669 -0.173 1.00 0.00 H new ATOM 0 HB VAL A 250 8.649 -3.035 1.320 1.00 0.00 H new ATOM 0 HG11 VAL A 250 6.952 -2.511 -0.382 1.00 0.00 H new ATOM 0 HG12 VAL A 250 8.571 -2.696 -1.098 1.00 0.00 H new ATOM 0 HG13 VAL A 250 7.373 -4.003 -1.256 1.00 0.00 H new ATOM 0 HG21 VAL A 250 6.326 -3.787 1.638 1.00 0.00 H new ATOM 0 HG22 VAL A 250 6.723 -5.332 0.849 1.00 0.00 H new ATOM 0 HG23 VAL A 250 7.490 -4.900 2.395 1.00 0.00 H new ATOM 661 N THR A 251 10.818 -4.706 -1.540 1.00 0.00 N ATOM 662 CA THR A 251 11.852 -4.139 -2.397 1.00 0.00 C ATOM 663 C THR A 251 11.398 -2.817 -3.004 1.00 0.00 C ATOM 664 O THR A 251 12.138 -1.833 -2.995 1.00 0.00 O ATOM 665 CB THR A 251 12.235 -5.108 -3.532 1.00 0.00 C ATOM 666 OG1 THR A 251 11.066 -5.492 -4.263 1.00 0.00 O ATOM 667 CG2 THR A 251 12.922 -6.346 -2.977 1.00 0.00 C ATOM 0 H THR A 251 10.388 -5.556 -1.904 1.00 0.00 H new ATOM 0 HA THR A 251 12.725 -3.966 -1.768 1.00 0.00 H new ATOM 0 HB THR A 251 12.928 -4.596 -4.199 1.00 0.00 H new ATOM 0 HG1 THR A 251 11.097 -5.099 -5.160 1.00 0.00 H new ATOM 0 HG21 THR A 251 13.183 -7.015 -3.797 1.00 0.00 H new ATOM 0 HG22 THR A 251 13.827 -6.052 -2.446 1.00 0.00 H new ATOM 0 HG23 THR A 251 12.249 -6.859 -2.290 1.00 0.00 H new ATOM 675 N ALA A 252 10.178 -2.800 -3.530 1.00 0.00 N ATOM 676 CA ALA A 252 9.625 -1.597 -4.140 1.00 0.00 C ATOM 677 C ALA A 252 8.108 -1.692 -4.264 1.00 0.00 C ATOM 678 O ALA A 252 7.531 -2.769 -4.117 1.00 0.00 O ATOM 679 CB ALA A 252 10.255 -1.359 -5.504 1.00 0.00 C ATOM 0 H ALA A 252 9.553 -3.606 -3.546 1.00 0.00 H new ATOM 0 HA ALA A 252 9.858 -0.751 -3.493 1.00 0.00 H new ATOM 0 HB1 ALA A 252 9.832 -0.457 -5.948 1.00 0.00 H new ATOM 0 HB2 ALA A 252 11.332 -1.237 -5.391 1.00 0.00 H new ATOM 0 HB3 ALA A 252 10.052 -2.212 -6.152 1.00 0.00 H new ATOM 685 N ILE A 253 7.470 -0.558 -4.535 1.00 0.00 N ATOM 686 CA ILE A 253 6.020 -0.515 -4.679 1.00 0.00 C ATOM 687 C ILE A 253 5.608 0.415 -5.815 1.00 0.00 C ATOM 688 O ILE A 253 5.837 1.623 -5.755 1.00 0.00 O ATOM 689 CB ILE A 253 5.338 -0.051 -3.378 1.00 0.00 C ATOM 690 CG1 ILE A 253 5.579 -1.068 -2.260 1.00 0.00 C ATOM 691 CG2 ILE A 253 3.848 0.152 -3.604 1.00 0.00 C ATOM 692 CD1 ILE A 253 5.065 -0.616 -0.911 1.00 0.00 C ATOM 0 H ILE A 253 7.934 0.342 -4.659 1.00 0.00 H new ATOM 0 HA ILE A 253 5.696 -1.530 -4.907 1.00 0.00 H new ATOM 0 HB ILE A 253 5.773 0.902 -3.077 1.00 0.00 H new ATOM 0 HG12 ILE A 253 5.098 -2.009 -2.526 1.00 0.00 H new ATOM 0 HG13 ILE A 253 6.648 -1.266 -2.185 1.00 0.00 H new ATOM 0 HG21 ILE A 253 3.380 0.480 -2.675 1.00 0.00 H new ATOM 0 HG22 ILE A 253 3.697 0.909 -4.373 1.00 0.00 H new ATOM 0 HG23 ILE A 253 3.397 -0.787 -3.925 1.00 0.00 H new ATOM 0 HD11 ILE A 253 5.270 -1.386 -0.167 1.00 0.00 H new ATOM 0 HD12 ILE A 253 5.564 0.309 -0.623 1.00 0.00 H new ATOM 0 HD13 ILE A 253 3.990 -0.445 -0.970 1.00 0.00 H new ATOM 704 N GLU A 254 4.997 -0.156 -6.848 1.00 0.00 N ATOM 705 CA GLU A 254 4.552 0.623 -7.998 1.00 0.00 C ATOM 706 C GLU A 254 3.036 0.546 -8.153 1.00 0.00 C ATOM 707 O GLU A 254 2.404 -0.417 -7.717 1.00 0.00 O ATOM 708 CB GLU A 254 5.233 0.125 -9.274 1.00 0.00 C ATOM 709 CG GLU A 254 6.674 0.586 -9.415 1.00 0.00 C ATOM 710 CD GLU A 254 6.783 2.016 -9.908 1.00 0.00 C ATOM 711 OE1 GLU A 254 6.642 2.237 -11.128 1.00 0.00 O ATOM 712 OE2 GLU A 254 7.009 2.915 -9.071 1.00 0.00 O ATOM 0 H GLU A 254 4.799 -1.154 -6.912 1.00 0.00 H new ATOM 0 HA GLU A 254 4.830 1.663 -7.830 1.00 0.00 H new ATOM 0 HB2 GLU A 254 5.206 -0.965 -9.289 1.00 0.00 H new ATOM 0 HB3 GLU A 254 4.664 0.470 -10.138 1.00 0.00 H new ATOM 0 HG2 GLU A 254 7.176 0.499 -8.451 1.00 0.00 H new ATOM 0 HG3 GLU A 254 7.197 -0.074 -10.107 1.00 0.00 H new ATOM 719 N LEU A 255 2.459 1.567 -8.777 1.00 0.00 N ATOM 720 CA LEU A 255 1.017 1.617 -8.990 1.00 0.00 C ATOM 721 C LEU A 255 0.692 1.948 -10.444 1.00 0.00 C ATOM 722 O LEU A 255 1.426 2.686 -11.101 1.00 0.00 O ATOM 723 CB LEU A 255 0.379 2.654 -8.065 1.00 0.00 C ATOM 724 CG LEU A 255 -0.991 3.182 -8.491 1.00 0.00 C ATOM 725 CD1 LEU A 255 -2.050 2.101 -8.340 1.00 0.00 C ATOM 726 CD2 LEU A 255 -1.364 4.414 -7.679 1.00 0.00 C ATOM 0 H LEU A 255 2.968 2.371 -9.144 1.00 0.00 H new ATOM 0 HA LEU A 255 0.607 0.634 -8.760 1.00 0.00 H new ATOM 0 HB2 LEU A 255 0.284 2.216 -7.072 1.00 0.00 H new ATOM 0 HB3 LEU A 255 1.060 3.500 -7.976 1.00 0.00 H new ATOM 0 HG LEU A 255 -0.939 3.466 -9.542 1.00 0.00 H new ATOM 0 HD11 LEU A 255 -3.019 2.495 -8.648 1.00 0.00 H new ATOM 0 HD12 LEU A 255 -1.790 1.247 -8.966 1.00 0.00 H new ATOM 0 HD13 LEU A 255 -2.101 1.785 -7.298 1.00 0.00 H new ATOM 0 HD21 LEU A 255 -2.342 4.776 -7.996 1.00 0.00 H new ATOM 0 HD22 LEU A 255 -1.398 4.156 -6.621 1.00 0.00 H new ATOM 0 HD23 LEU A 255 -0.619 5.194 -7.838 1.00 0.00 H new ATOM 738 N ASP A 256 -0.412 1.398 -10.938 1.00 0.00 N ATOM 739 CA ASP A 256 -0.836 1.638 -12.312 1.00 0.00 C ATOM 740 C ASP A 256 -2.061 2.546 -12.353 1.00 0.00 C ATOM 741 O ASP A 256 -2.999 2.372 -11.577 1.00 0.00 O ATOM 742 CB ASP A 256 -1.144 0.313 -13.011 1.00 0.00 C ATOM 743 CG ASP A 256 0.077 -0.287 -13.680 1.00 0.00 C ATOM 744 OD1 ASP A 256 0.829 0.469 -14.330 1.00 0.00 O ATOM 745 OD2 ASP A 256 0.280 -1.513 -13.555 1.00 0.00 O ATOM 0 H ASP A 256 -1.029 0.783 -10.407 1.00 0.00 H new ATOM 0 HA ASP A 256 -0.020 2.136 -12.836 1.00 0.00 H new ATOM 0 HB2 ASP A 256 -1.540 -0.395 -12.283 1.00 0.00 H new ATOM 0 HB3 ASP A 256 -1.922 0.472 -13.757 1.00 0.00 H new ATOM 750 N GLU A 257 -2.043 3.515 -13.263 1.00 0.00 N ATOM 751 CA GLU A 257 -3.152 4.452 -13.403 1.00 0.00 C ATOM 752 C GLU A 257 -4.036 4.074 -14.587 1.00 0.00 C ATOM 753 O GLU A 257 -5.182 4.515 -14.686 1.00 0.00 O ATOM 754 CB GLU A 257 -2.625 5.877 -13.579 1.00 0.00 C ATOM 755 CG GLU A 257 -2.017 6.462 -12.315 1.00 0.00 C ATOM 756 CD GLU A 257 -1.578 7.903 -12.491 1.00 0.00 C ATOM 757 OE1 GLU A 257 -0.611 8.139 -13.246 1.00 0.00 O ATOM 758 OE2 GLU A 257 -2.200 8.793 -11.875 1.00 0.00 O ATOM 0 H GLU A 257 -1.273 3.672 -13.914 1.00 0.00 H new ATOM 0 HA GLU A 257 -3.752 4.405 -12.494 1.00 0.00 H new ATOM 0 HB2 GLU A 257 -1.874 5.883 -14.369 1.00 0.00 H new ATOM 0 HB3 GLU A 257 -3.441 6.519 -13.910 1.00 0.00 H new ATOM 0 HG2 GLU A 257 -2.745 6.404 -11.506 1.00 0.00 H new ATOM 0 HG3 GLU A 257 -1.160 5.859 -12.016 1.00 0.00 H new ATOM 765 N ASP A 258 -3.496 3.257 -15.485 1.00 0.00 N ATOM 766 CA ASP A 258 -4.236 2.820 -16.663 1.00 0.00 C ATOM 767 C ASP A 258 -5.525 2.110 -16.263 1.00 0.00 C ATOM 768 O ASP A 258 -6.601 2.414 -16.779 1.00 0.00 O ATOM 769 CB ASP A 258 -3.372 1.891 -17.518 1.00 0.00 C ATOM 770 CG ASP A 258 -1.985 2.452 -17.762 1.00 0.00 C ATOM 771 OD1 ASP A 258 -1.840 3.306 -18.663 1.00 0.00 O ATOM 772 OD2 ASP A 258 -1.044 2.039 -17.052 1.00 0.00 O ATOM 0 H ASP A 258 -2.549 2.884 -15.420 1.00 0.00 H new ATOM 0 HA ASP A 258 -4.495 3.703 -17.247 1.00 0.00 H new ATOM 0 HB2 ASP A 258 -3.287 0.922 -17.025 1.00 0.00 H new ATOM 0 HB3 ASP A 258 -3.865 1.720 -18.475 1.00 0.00 H new ATOM 777 N THR A 259 -5.410 1.160 -15.340 1.00 0.00 N ATOM 778 CA THR A 259 -6.566 0.405 -14.872 1.00 0.00 C ATOM 779 C THR A 259 -6.717 0.514 -13.359 1.00 0.00 C ATOM 780 O THR A 259 -7.816 0.374 -12.824 1.00 0.00 O ATOM 781 CB THR A 259 -6.460 -1.082 -15.260 1.00 0.00 C ATOM 782 OG1 THR A 259 -5.248 -1.639 -14.740 1.00 0.00 O ATOM 783 CG2 THR A 259 -6.494 -1.250 -16.772 1.00 0.00 C ATOM 0 H THR A 259 -4.528 0.895 -14.902 1.00 0.00 H new ATOM 0 HA THR A 259 -7.443 0.837 -15.354 1.00 0.00 H new ATOM 0 HB THR A 259 -7.313 -1.608 -14.832 1.00 0.00 H new ATOM 0 HG1 THR A 259 -5.189 -2.585 -14.990 1.00 0.00 H new ATOM 0 HG21 THR A 259 -6.418 -2.308 -17.022 1.00 0.00 H new ATOM 0 HG22 THR A 259 -7.431 -0.852 -17.161 1.00 0.00 H new ATOM 0 HG23 THR A 259 -5.658 -0.711 -17.217 1.00 0.00 H new ATOM 791 N GLY A 260 -5.606 0.765 -12.673 1.00 0.00 N ATOM 792 CA GLY A 260 -5.638 0.889 -11.228 1.00 0.00 C ATOM 793 C GLY A 260 -5.181 -0.376 -10.527 1.00 0.00 C ATOM 794 O GLY A 260 -5.897 -0.923 -9.688 1.00 0.00 O ATOM 0 H GLY A 260 -4.684 0.885 -13.093 1.00 0.00 H new ATOM 0 HA2 GLY A 260 -5.001 1.720 -10.924 1.00 0.00 H new ATOM 0 HA3 GLY A 260 -6.652 1.131 -10.910 1.00 0.00 H new ATOM 798 N THR A 261 -3.985 -0.843 -10.873 1.00 0.00 N ATOM 799 CA THR A 261 -3.435 -2.052 -10.274 1.00 0.00 C ATOM 800 C THR A 261 -2.200 -1.738 -9.438 1.00 0.00 C ATOM 801 O THR A 261 -1.219 -1.190 -9.941 1.00 0.00 O ATOM 802 CB THR A 261 -3.063 -3.092 -11.348 1.00 0.00 C ATOM 803 OG1 THR A 261 -4.248 -3.595 -11.974 1.00 0.00 O ATOM 804 CG2 THR A 261 -2.278 -4.243 -10.738 1.00 0.00 C ATOM 0 H THR A 261 -3.379 -0.402 -11.565 1.00 0.00 H new ATOM 0 HA THR A 261 -4.211 -2.467 -9.630 1.00 0.00 H new ATOM 0 HB THR A 261 -2.438 -2.603 -12.095 1.00 0.00 H new ATOM 0 HG1 THR A 261 -4.003 -4.254 -12.657 1.00 0.00 H new ATOM 0 HG21 THR A 261 -2.027 -4.964 -11.515 1.00 0.00 H new ATOM 0 HG22 THR A 261 -1.362 -3.860 -10.288 1.00 0.00 H new ATOM 0 HG23 THR A 261 -2.882 -4.730 -9.973 1.00 0.00 H new ATOM 812 N PHE A 262 -2.253 -2.090 -8.157 1.00 0.00 N ATOM 813 CA PHE A 262 -1.138 -1.845 -7.250 1.00 0.00 C ATOM 814 C PHE A 262 -0.129 -2.988 -7.308 1.00 0.00 C ATOM 815 O PHE A 262 -0.430 -4.116 -6.916 1.00 0.00 O ATOM 816 CB PHE A 262 -1.647 -1.671 -5.818 1.00 0.00 C ATOM 817 CG PHE A 262 -1.974 -0.247 -5.467 1.00 0.00 C ATOM 818 CD1 PHE A 262 -0.967 0.655 -5.164 1.00 0.00 C ATOM 819 CD2 PHE A 262 -3.289 0.189 -5.441 1.00 0.00 C ATOM 820 CE1 PHE A 262 -1.265 1.965 -4.841 1.00 0.00 C ATOM 821 CE2 PHE A 262 -3.593 1.498 -5.118 1.00 0.00 C ATOM 822 CZ PHE A 262 -2.580 2.387 -4.819 1.00 0.00 C ATOM 0 H PHE A 262 -3.056 -2.546 -7.724 1.00 0.00 H new ATOM 0 HA PHE A 262 -0.640 -0.928 -7.565 1.00 0.00 H new ATOM 0 HB2 PHE A 262 -2.537 -2.284 -5.680 1.00 0.00 H new ATOM 0 HB3 PHE A 262 -0.893 -2.044 -5.125 1.00 0.00 H new ATOM 0 HD1 PHE A 262 0.063 0.330 -5.180 1.00 0.00 H new ATOM 0 HD2 PHE A 262 -4.085 -0.502 -5.676 1.00 0.00 H new ATOM 0 HE1 PHE A 262 -0.471 2.658 -4.606 1.00 0.00 H new ATOM 0 HE2 PHE A 262 -4.622 1.825 -5.100 1.00 0.00 H new ATOM 0 HZ PHE A 262 -2.815 3.411 -4.568 1.00 0.00 H new ATOM 832 N ARG A 263 1.069 -2.688 -7.798 1.00 0.00 N ATOM 833 CA ARG A 263 2.122 -3.691 -7.909 1.00 0.00 C ATOM 834 C ARG A 263 3.096 -3.587 -6.740 1.00 0.00 C ATOM 835 O ARG A 263 3.803 -2.589 -6.595 1.00 0.00 O ATOM 836 CB ARG A 263 2.875 -3.526 -9.231 1.00 0.00 C ATOM 837 CG ARG A 263 2.157 -4.140 -10.421 1.00 0.00 C ATOM 838 CD ARG A 263 2.554 -3.461 -11.723 1.00 0.00 C ATOM 839 NE ARG A 263 2.367 -2.013 -11.663 1.00 0.00 N ATOM 840 CZ ARG A 263 2.719 -1.186 -12.642 1.00 0.00 C ATOM 841 NH1 ARG A 263 3.273 -1.661 -13.749 1.00 0.00 N ATOM 842 NH2 ARG A 263 2.516 0.119 -12.514 1.00 0.00 N ATOM 0 H ARG A 263 1.335 -1.759 -8.124 1.00 0.00 H new ATOM 0 HA ARG A 263 1.656 -4.676 -7.885 1.00 0.00 H new ATOM 0 HB2 ARG A 263 3.032 -2.464 -9.420 1.00 0.00 H new ATOM 0 HB3 ARG A 263 3.861 -3.982 -9.137 1.00 0.00 H new ATOM 0 HG2 ARG A 263 2.389 -5.203 -10.478 1.00 0.00 H new ATOM 0 HG3 ARG A 263 1.079 -4.056 -10.280 1.00 0.00 H new ATOM 0 HD2 ARG A 263 3.598 -3.683 -11.944 1.00 0.00 H new ATOM 0 HD3 ARG A 263 1.961 -3.870 -12.541 1.00 0.00 H new ATOM 0 HE ARG A 263 1.943 -1.616 -10.825 1.00 0.00 H new ATOM 0 HH11 ARG A 263 3.430 -2.664 -13.851 1.00 0.00 H new ATOM 0 HH12 ARG A 263 3.542 -1.024 -14.499 1.00 0.00 H new ATOM 0 HH21 ARG A 263 2.090 0.488 -11.664 1.00 0.00 H new ATOM 0 HH22 ARG A 263 2.786 0.753 -13.266 1.00 0.00 H new ATOM 856 N ILE A 264 3.128 -4.623 -5.909 1.00 0.00 N ATOM 857 CA ILE A 264 4.015 -4.648 -4.753 1.00 0.00 C ATOM 858 C ILE A 264 5.120 -5.685 -4.931 1.00 0.00 C ATOM 859 O ILE A 264 4.859 -6.825 -5.316 1.00 0.00 O ATOM 860 CB ILE A 264 3.243 -4.954 -3.456 1.00 0.00 C ATOM 861 CG1 ILE A 264 1.961 -4.121 -3.392 1.00 0.00 C ATOM 862 CG2 ILE A 264 4.119 -4.684 -2.242 1.00 0.00 C ATOM 863 CD1 ILE A 264 1.019 -4.547 -2.287 1.00 0.00 C ATOM 0 H ILE A 264 2.550 -5.456 -6.015 1.00 0.00 H new ATOM 0 HA ILE A 264 4.459 -3.656 -4.675 1.00 0.00 H new ATOM 0 HB ILE A 264 2.969 -6.009 -3.453 1.00 0.00 H new ATOM 0 HG12 ILE A 264 2.225 -3.073 -3.250 1.00 0.00 H new ATOM 0 HG13 ILE A 264 1.443 -4.192 -4.348 1.00 0.00 H new ATOM 0 HG21 ILE A 264 3.559 -4.905 -1.333 1.00 0.00 H new ATOM 0 HG22 ILE A 264 5.006 -5.317 -2.285 1.00 0.00 H new ATOM 0 HG23 ILE A 264 4.421 -3.637 -2.237 1.00 0.00 H new ATOM 0 HD11 ILE A 264 0.132 -3.914 -2.301 1.00 0.00 H new ATOM 0 HD12 ILE A 264 0.726 -5.586 -2.439 1.00 0.00 H new ATOM 0 HD13 ILE A 264 1.520 -4.449 -1.324 1.00 0.00 H new ATOM 875 N TYR A 265 6.353 -5.282 -4.645 1.00 0.00 N ATOM 876 CA TYR A 265 7.498 -6.175 -4.774 1.00 0.00 C ATOM 877 C TYR A 265 8.115 -6.469 -3.410 1.00 0.00 C ATOM 878 O TYR A 265 8.514 -5.557 -2.686 1.00 0.00 O ATOM 879 CB TYR A 265 8.549 -5.562 -5.700 1.00 0.00 C ATOM 880 CG TYR A 265 8.050 -5.324 -7.108 1.00 0.00 C ATOM 881 CD1 TYR A 265 8.106 -6.329 -8.065 1.00 0.00 C ATOM 882 CD2 TYR A 265 7.522 -4.094 -7.480 1.00 0.00 C ATOM 883 CE1 TYR A 265 7.653 -6.116 -9.352 1.00 0.00 C ATOM 884 CE2 TYR A 265 7.065 -3.872 -8.765 1.00 0.00 C ATOM 885 CZ TYR A 265 7.133 -4.886 -9.697 1.00 0.00 C ATOM 886 OH TYR A 265 6.678 -4.670 -10.978 1.00 0.00 O ATOM 0 H TYR A 265 6.585 -4.343 -4.322 1.00 0.00 H new ATOM 0 HA TYR A 265 7.148 -7.113 -5.205 1.00 0.00 H new ATOM 0 HB2 TYR A 265 8.885 -4.615 -5.278 1.00 0.00 H new ATOM 0 HB3 TYR A 265 9.417 -6.221 -5.737 1.00 0.00 H new ATOM 0 HD1 TYR A 265 8.511 -7.294 -7.798 1.00 0.00 H new ATOM 0 HD2 TYR A 265 7.468 -3.298 -6.752 1.00 0.00 H new ATOM 0 HE1 TYR A 265 7.706 -6.908 -10.084 1.00 0.00 H new ATOM 0 HE2 TYR A 265 6.657 -2.910 -9.038 1.00 0.00 H new ATOM 0 HH TYR A 265 6.342 -3.753 -11.056 1.00 0.00 H new ATOM 896 N GLY A 266 8.192 -7.751 -3.066 1.00 0.00 N ATOM 897 CA GLY A 266 8.762 -8.144 -1.791 1.00 0.00 C ATOM 898 C GLY A 266 9.503 -9.465 -1.869 1.00 0.00 C ATOM 899 O GLY A 266 9.092 -10.372 -2.592 1.00 0.00 O ATOM 0 H GLY A 266 7.870 -8.524 -3.648 1.00 0.00 H new ATOM 0 HA2 GLY A 266 9.445 -7.367 -1.447 1.00 0.00 H new ATOM 0 HA3 GLY A 266 7.967 -8.220 -1.049 1.00 0.00 H new ATOM 903 N GLU A 267 10.599 -9.572 -1.124 1.00 0.00 N ATOM 904 CA GLU A 267 11.399 -10.791 -1.115 1.00 0.00 C ATOM 905 C GLU A 267 10.612 -11.955 -0.520 1.00 0.00 C ATOM 906 O GLU A 267 10.900 -13.119 -0.797 1.00 0.00 O ATOM 907 CB GLU A 267 12.689 -10.575 -0.322 1.00 0.00 C ATOM 908 CG GLU A 267 13.684 -9.659 -1.015 1.00 0.00 C ATOM 909 CD GLU A 267 14.620 -8.970 -0.040 1.00 0.00 C ATOM 910 OE1 GLU A 267 14.241 -8.821 1.140 1.00 0.00 O ATOM 911 OE2 GLU A 267 15.730 -8.580 -0.458 1.00 0.00 O ATOM 0 H GLU A 267 10.953 -8.830 -0.520 1.00 0.00 H new ATOM 0 HA GLU A 267 11.652 -11.036 -2.147 1.00 0.00 H new ATOM 0 HB2 GLU A 267 12.440 -10.156 0.653 1.00 0.00 H new ATOM 0 HB3 GLU A 267 13.161 -11.541 -0.143 1.00 0.00 H new ATOM 0 HG2 GLU A 267 14.270 -10.239 -1.728 1.00 0.00 H new ATOM 0 HG3 GLU A 267 13.142 -8.906 -1.586 1.00 0.00 H new ATOM 918 N SER A 268 9.616 -11.630 0.299 1.00 0.00 N ATOM 919 CA SER A 268 8.790 -12.648 0.938 1.00 0.00 C ATOM 920 C SER A 268 7.331 -12.203 0.998 1.00 0.00 C ATOM 921 O SER A 268 7.029 -11.085 1.414 1.00 0.00 O ATOM 922 CB SER A 268 9.304 -12.942 2.348 1.00 0.00 C ATOM 923 OG SER A 268 10.493 -13.712 2.307 1.00 0.00 O ATOM 0 H SER A 268 9.362 -10.671 0.535 1.00 0.00 H new ATOM 0 HA SER A 268 8.851 -13.558 0.341 1.00 0.00 H new ATOM 0 HB2 SER A 268 9.492 -12.005 2.873 1.00 0.00 H new ATOM 0 HB3 SER A 268 8.540 -13.476 2.913 1.00 0.00 H new ATOM 0 HG SER A 268 10.802 -13.885 3.221 1.00 0.00 H new ATOM 929 N ALA A 269 6.432 -13.088 0.581 1.00 0.00 N ATOM 930 CA ALA A 269 5.005 -12.789 0.590 1.00 0.00 C ATOM 931 C ALA A 269 4.601 -12.077 1.876 1.00 0.00 C ATOM 932 O ALA A 269 3.715 -11.222 1.872 1.00 0.00 O ATOM 933 CB ALA A 269 4.197 -14.066 0.415 1.00 0.00 C ATOM 0 H ALA A 269 6.666 -14.018 0.233 1.00 0.00 H new ATOM 0 HA ALA A 269 4.794 -12.121 -0.245 1.00 0.00 H new ATOM 0 HB1 ALA A 269 3.133 -13.828 0.424 1.00 0.00 H new ATOM 0 HB2 ALA A 269 4.456 -14.533 -0.535 1.00 0.00 H new ATOM 0 HB3 ALA A 269 4.421 -14.753 1.231 1.00 0.00 H new ATOM 939 N ASP A 270 5.256 -12.435 2.975 1.00 0.00 N ATOM 940 CA ASP A 270 4.964 -11.830 4.270 1.00 0.00 C ATOM 941 C ASP A 270 5.097 -10.311 4.202 1.00 0.00 C ATOM 942 O ASP A 270 4.261 -9.581 4.734 1.00 0.00 O ATOM 943 CB ASP A 270 5.903 -12.389 5.341 1.00 0.00 C ATOM 944 CG ASP A 270 5.511 -11.952 6.739 1.00 0.00 C ATOM 945 OD1 ASP A 270 4.326 -11.617 6.945 1.00 0.00 O ATOM 946 OD2 ASP A 270 6.390 -11.944 7.626 1.00 0.00 O ATOM 0 H ASP A 270 5.992 -13.141 2.995 1.00 0.00 H new ATOM 0 HA ASP A 270 3.936 -12.076 4.535 1.00 0.00 H new ATOM 0 HB2 ASP A 270 5.901 -13.478 5.290 1.00 0.00 H new ATOM 0 HB3 ASP A 270 6.922 -12.062 5.133 1.00 0.00 H new ATOM 951 N ALA A 271 6.154 -9.844 3.546 1.00 0.00 N ATOM 952 CA ALA A 271 6.395 -8.413 3.408 1.00 0.00 C ATOM 953 C ALA A 271 5.307 -7.751 2.570 1.00 0.00 C ATOM 954 O ALA A 271 4.511 -6.961 3.079 1.00 0.00 O ATOM 955 CB ALA A 271 7.764 -8.166 2.790 1.00 0.00 C ATOM 0 H ALA A 271 6.857 -10.435 3.102 1.00 0.00 H new ATOM 0 HA ALA A 271 6.371 -7.968 4.403 1.00 0.00 H new ATOM 0 HB1 ALA A 271 7.931 -7.093 2.693 1.00 0.00 H new ATOM 0 HB2 ALA A 271 8.535 -8.597 3.429 1.00 0.00 H new ATOM 0 HB3 ALA A 271 7.808 -8.631 1.805 1.00 0.00 H new ATOM 961 N VAL A 272 5.278 -8.077 1.281 1.00 0.00 N ATOM 962 CA VAL A 272 4.286 -7.514 0.372 1.00 0.00 C ATOM 963 C VAL A 272 2.884 -7.605 0.963 1.00 0.00 C ATOM 964 O VAL A 272 2.035 -6.751 0.711 1.00 0.00 O ATOM 965 CB VAL A 272 4.305 -8.230 -0.991 1.00 0.00 C ATOM 966 CG1 VAL A 272 5.391 -7.650 -1.884 1.00 0.00 C ATOM 967 CG2 VAL A 272 4.499 -9.727 -0.804 1.00 0.00 C ATOM 0 H VAL A 272 5.930 -8.728 0.843 1.00 0.00 H new ATOM 0 HA VAL A 272 4.548 -6.466 0.227 1.00 0.00 H new ATOM 0 HB VAL A 272 3.344 -8.070 -1.479 1.00 0.00 H new ATOM 0 HG11 VAL A 272 5.389 -8.169 -2.843 1.00 0.00 H new ATOM 0 HG12 VAL A 272 5.201 -6.589 -2.045 1.00 0.00 H new ATOM 0 HG13 VAL A 272 6.362 -7.776 -1.405 1.00 0.00 H new ATOM 0 HG21 VAL A 272 4.510 -10.217 -1.778 1.00 0.00 H new ATOM 0 HG22 VAL A 272 5.445 -9.910 -0.295 1.00 0.00 H new ATOM 0 HG23 VAL A 272 3.681 -10.128 -0.205 1.00 0.00 H new ATOM 977 N LYS A 273 2.648 -8.648 1.753 1.00 0.00 N ATOM 978 CA LYS A 273 1.349 -8.852 2.383 1.00 0.00 C ATOM 979 C LYS A 273 1.071 -7.768 3.420 1.00 0.00 C ATOM 980 O LYS A 273 0.014 -7.137 3.405 1.00 0.00 O ATOM 981 CB LYS A 273 1.290 -10.231 3.043 1.00 0.00 C ATOM 982 CG LYS A 273 0.878 -11.343 2.094 1.00 0.00 C ATOM 983 CD LYS A 273 1.129 -12.714 2.698 1.00 0.00 C ATOM 984 CE LYS A 273 -0.058 -13.185 3.524 1.00 0.00 C ATOM 985 NZ LYS A 273 -1.073 -13.883 2.687 1.00 0.00 N ATOM 0 H LYS A 273 3.340 -9.365 1.972 1.00 0.00 H new ATOM 0 HA LYS A 273 0.584 -8.794 1.608 1.00 0.00 H new ATOM 0 HB2 LYS A 273 2.269 -10.466 3.462 1.00 0.00 H new ATOM 0 HB3 LYS A 273 0.587 -10.196 3.875 1.00 0.00 H new ATOM 0 HG2 LYS A 273 -0.179 -11.240 1.849 1.00 0.00 H new ATOM 0 HG3 LYS A 273 1.432 -11.249 1.160 1.00 0.00 H new ATOM 0 HD2 LYS A 273 1.328 -13.432 1.903 1.00 0.00 H new ATOM 0 HD3 LYS A 273 2.019 -12.679 3.326 1.00 0.00 H new ATOM 0 HE2 LYS A 273 0.289 -13.856 4.309 1.00 0.00 H new ATOM 0 HE3 LYS A 273 -0.520 -12.330 4.017 1.00 0.00 H new ATOM 0 HZ1 LYS A 273 -1.866 -14.189 3.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 273 -1.423 -13.235 1.953 1.00 0.00 H new ATOM 0 HZ3 LYS A 273 -0.639 -14.714 2.236 1.00 0.00 H new ATOM 999 N LYS A 274 2.026 -7.556 4.318 1.00 0.00 N ATOM 1000 CA LYS A 274 1.886 -6.547 5.361 1.00 0.00 C ATOM 1001 C LYS A 274 1.688 -5.161 4.755 1.00 0.00 C ATOM 1002 O LYS A 274 0.887 -4.367 5.247 1.00 0.00 O ATOM 1003 CB LYS A 274 3.119 -6.546 6.268 1.00 0.00 C ATOM 1004 CG LYS A 274 2.833 -6.074 7.683 1.00 0.00 C ATOM 1005 CD LYS A 274 4.111 -5.699 8.414 1.00 0.00 C ATOM 1006 CE LYS A 274 3.817 -4.913 9.683 1.00 0.00 C ATOM 1007 NZ LYS A 274 4.938 -4.000 10.042 1.00 0.00 N ATOM 0 H LYS A 274 2.907 -8.070 4.345 1.00 0.00 H new ATOM 0 HA LYS A 274 1.006 -6.795 5.954 1.00 0.00 H new ATOM 0 HB2 LYS A 274 3.532 -7.554 6.307 1.00 0.00 H new ATOM 0 HB3 LYS A 274 3.883 -5.905 5.828 1.00 0.00 H new ATOM 0 HG2 LYS A 274 2.164 -5.214 7.653 1.00 0.00 H new ATOM 0 HG3 LYS A 274 2.316 -6.861 8.232 1.00 0.00 H new ATOM 0 HD2 LYS A 274 4.666 -6.603 8.665 1.00 0.00 H new ATOM 0 HD3 LYS A 274 4.747 -5.106 7.757 1.00 0.00 H new ATOM 0 HE2 LYS A 274 2.905 -4.332 9.547 1.00 0.00 H new ATOM 0 HE3 LYS A 274 3.635 -5.605 10.505 1.00 0.00 H new ATOM 0 HZ1 LYS A 274 4.699 -3.483 10.912 1.00 0.00 H new ATOM 0 HZ2 LYS A 274 5.803 -4.556 10.196 1.00 0.00 H new ATOM 0 HZ3 LYS A 274 5.095 -3.323 9.269 1.00 0.00 H new ATOM 1021 N ALA A 275 2.421 -4.879 3.683 1.00 0.00 N ATOM 1022 CA ALA A 275 2.323 -3.591 3.007 1.00 0.00 C ATOM 1023 C ALA A 275 1.024 -3.484 2.215 1.00 0.00 C ATOM 1024 O ALA A 275 0.399 -2.425 2.170 1.00 0.00 O ATOM 1025 CB ALA A 275 3.520 -3.383 2.092 1.00 0.00 C ATOM 0 H ALA A 275 3.089 -5.525 3.264 1.00 0.00 H new ATOM 0 HA ALA A 275 2.320 -2.809 3.766 1.00 0.00 H new ATOM 0 HB1 ALA A 275 3.434 -2.417 1.594 1.00 0.00 H new ATOM 0 HB2 ALA A 275 4.437 -3.407 2.681 1.00 0.00 H new ATOM 0 HB3 ALA A 275 3.549 -4.176 1.344 1.00 0.00 H new ATOM 1031 N ARG A 276 0.624 -4.588 1.592 1.00 0.00 N ATOM 1032 CA ARG A 276 -0.599 -4.617 0.800 1.00 0.00 C ATOM 1033 C ARG A 276 -1.767 -4.024 1.582 1.00 0.00 C ATOM 1034 O ARG A 276 -2.522 -3.203 1.063 1.00 0.00 O ATOM 1035 CB ARG A 276 -0.928 -6.052 0.382 1.00 0.00 C ATOM 1036 CG ARG A 276 -2.274 -6.192 -0.309 1.00 0.00 C ATOM 1037 CD ARG A 276 -2.329 -7.441 -1.175 1.00 0.00 C ATOM 1038 NE ARG A 276 -3.699 -7.807 -1.521 1.00 0.00 N ATOM 1039 CZ ARG A 276 -4.007 -8.713 -2.442 1.00 0.00 C ATOM 1040 NH1 ARG A 276 -3.047 -9.342 -3.106 1.00 0.00 N ATOM 1041 NH2 ARG A 276 -5.279 -8.992 -2.701 1.00 0.00 N ATOM 0 H ARG A 276 1.129 -5.474 1.621 1.00 0.00 H new ATOM 0 HA ARG A 276 -0.438 -4.013 -0.093 1.00 0.00 H new ATOM 0 HB2 ARG A 276 -0.147 -6.415 -0.286 1.00 0.00 H new ATOM 0 HB3 ARG A 276 -0.914 -6.691 1.265 1.00 0.00 H new ATOM 0 HG2 ARG A 276 -3.066 -6.232 0.439 1.00 0.00 H new ATOM 0 HG3 ARG A 276 -2.461 -5.312 -0.925 1.00 0.00 H new ATOM 0 HD2 ARG A 276 -1.757 -7.275 -2.088 1.00 0.00 H new ATOM 0 HD3 ARG A 276 -1.855 -8.269 -0.648 1.00 0.00 H new ATOM 0 HE ARG A 276 -4.461 -7.342 -1.029 1.00 0.00 H new ATOM 0 HH11 ARG A 276 -2.069 -9.131 -2.910 1.00 0.00 H new ATOM 0 HH12 ARG A 276 -3.287 -10.037 -3.813 1.00 0.00 H new ATOM 0 HH21 ARG A 276 -6.021 -8.510 -2.192 1.00 0.00 H new ATOM 0 HH22 ARG A 276 -5.515 -9.688 -3.409 1.00 0.00 H new ATOM 1055 N GLY A 277 -1.910 -4.446 2.835 1.00 0.00 N ATOM 1056 CA GLY A 277 -2.988 -3.947 3.668 1.00 0.00 C ATOM 1057 C GLY A 277 -3.097 -2.436 3.632 1.00 0.00 C ATOM 1058 O GLY A 277 -4.192 -1.882 3.732 1.00 0.00 O ATOM 0 H GLY A 277 -1.298 -5.125 3.288 1.00 0.00 H new ATOM 0 HA2 GLY A 277 -3.930 -4.384 3.338 1.00 0.00 H new ATOM 0 HA3 GLY A 277 -2.829 -4.272 4.696 1.00 0.00 H new ATOM 1062 N PHE A 278 -1.958 -1.765 3.489 1.00 0.00 N ATOM 1063 CA PHE A 278 -1.929 -0.308 3.443 1.00 0.00 C ATOM 1064 C PHE A 278 -2.506 0.206 2.127 1.00 0.00 C ATOM 1065 O PHE A 278 -3.259 1.180 2.104 1.00 0.00 O ATOM 1066 CB PHE A 278 -0.497 0.201 3.618 1.00 0.00 C ATOM 1067 CG PHE A 278 -0.006 0.131 5.036 1.00 0.00 C ATOM 1068 CD1 PHE A 278 -0.738 0.699 6.066 1.00 0.00 C ATOM 1069 CD2 PHE A 278 1.188 -0.504 5.339 1.00 0.00 C ATOM 1070 CE1 PHE A 278 -0.287 0.636 7.371 1.00 0.00 C ATOM 1071 CE2 PHE A 278 1.644 -0.570 6.642 1.00 0.00 C ATOM 1072 CZ PHE A 278 0.904 0.000 7.660 1.00 0.00 C ATOM 0 H PHE A 278 -1.043 -2.208 3.403 1.00 0.00 H new ATOM 0 HA PHE A 278 -2.543 0.069 4.261 1.00 0.00 H new ATOM 0 HB2 PHE A 278 0.168 -0.383 2.982 1.00 0.00 H new ATOM 0 HB3 PHE A 278 -0.442 1.234 3.273 1.00 0.00 H new ATOM 0 HD1 PHE A 278 -1.671 1.196 5.847 1.00 0.00 H new ATOM 0 HD2 PHE A 278 1.769 -0.953 4.547 1.00 0.00 H new ATOM 0 HE1 PHE A 278 -0.866 1.084 8.165 1.00 0.00 H new ATOM 0 HE2 PHE A 278 2.577 -1.066 6.864 1.00 0.00 H new ATOM 0 HZ PHE A 278 1.256 -0.052 8.680 1.00 0.00 H new ATOM 1082 N LEU A 279 -2.146 -0.456 1.032 1.00 0.00 N ATOM 1083 CA LEU A 279 -2.626 -0.067 -0.289 1.00 0.00 C ATOM 1084 C LEU A 279 -4.051 -0.561 -0.518 1.00 0.00 C ATOM 1085 O LEU A 279 -4.722 -0.134 -1.457 1.00 0.00 O ATOM 1086 CB LEU A 279 -1.702 -0.623 -1.374 1.00 0.00 C ATOM 1087 CG LEU A 279 -0.293 -0.030 -1.423 1.00 0.00 C ATOM 1088 CD1 LEU A 279 0.561 -0.769 -2.442 1.00 0.00 C ATOM 1089 CD2 LEU A 279 -0.351 1.455 -1.750 1.00 0.00 C ATOM 0 H LEU A 279 -1.524 -1.264 1.033 1.00 0.00 H new ATOM 0 HA LEU A 279 -2.625 1.022 -0.342 1.00 0.00 H new ATOM 0 HB2 LEU A 279 -1.617 -1.701 -1.234 1.00 0.00 H new ATOM 0 HB3 LEU A 279 -2.175 -0.464 -2.343 1.00 0.00 H new ATOM 0 HG LEU A 279 0.165 -0.148 -0.441 1.00 0.00 H new ATOM 0 HD11 LEU A 279 1.560 -0.334 -2.463 1.00 0.00 H new ATOM 0 HD12 LEU A 279 0.629 -1.821 -2.165 1.00 0.00 H new ATOM 0 HD13 LEU A 279 0.106 -0.683 -3.429 1.00 0.00 H new ATOM 0 HD21 LEU A 279 0.660 1.861 -1.781 1.00 0.00 H new ATOM 0 HD22 LEU A 279 -0.828 1.596 -2.720 1.00 0.00 H new ATOM 0 HD23 LEU A 279 -0.927 1.974 -0.984 1.00 0.00 H new ATOM 1101 N GLU A 280 -4.507 -1.460 0.349 1.00 0.00 N ATOM 1102 CA GLU A 280 -5.853 -2.010 0.241 1.00 0.00 C ATOM 1103 C GLU A 280 -6.901 -0.906 0.339 1.00 0.00 C ATOM 1104 O GLU A 280 -6.743 0.050 1.099 1.00 0.00 O ATOM 1105 CB GLU A 280 -6.091 -3.053 1.336 1.00 0.00 C ATOM 1106 CG GLU A 280 -5.472 -4.407 1.031 1.00 0.00 C ATOM 1107 CD GLU A 280 -6.063 -5.521 1.873 1.00 0.00 C ATOM 1108 OE1 GLU A 280 -7.240 -5.400 2.274 1.00 0.00 O ATOM 1109 OE2 GLU A 280 -5.350 -6.512 2.132 1.00 0.00 O ATOM 0 H GLU A 280 -3.965 -1.822 1.133 1.00 0.00 H new ATOM 0 HA GLU A 280 -5.945 -2.489 -0.734 1.00 0.00 H new ATOM 0 HB2 GLU A 280 -5.684 -2.680 2.276 1.00 0.00 H new ATOM 0 HB3 GLU A 280 -7.164 -3.178 1.480 1.00 0.00 H new ATOM 0 HG2 GLU A 280 -5.616 -4.639 -0.024 1.00 0.00 H new ATOM 0 HG3 GLU A 280 -4.397 -4.358 1.203 1.00 0.00 H new