USER MOD reduce.3.24.130724 H: found=0, std=0, add=626, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 624 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 237 SER OG : rot 123:sc= 0.372 USER MOD Set 1.2: A 239 HIS : no HE2:sc= -0.932 K(o=-1.9,f=-8.1!) USER MOD Set 1.3: A 275 ASN : amide:sc= -1.31 K(o=-1.9,f=-6) USER MOD Set 2.1: A 235 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 279 LYS NZ :NH3+ -124:sc= 1.28 (180deg=-1.68) USER MOD Single : A 241 MET CE :methyl -122:sc= -6.96! (180deg=-7.61!) USER MOD Single : A 244 SER OG : rot 180:sc= 0 USER MOD Single : A 246 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 248 ASN : amide:sc= -8.9! C(o=-8.9!,f=-10!) USER MOD Single : A 255 HIS : no HD1:sc= 0 X(o=0,f=-0.032) USER MOD Single : A 263 HIS : no HE2:sc= -0.0152 X(o=-0.015,f=-0.44) USER MOD Single : A 266 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 282 SER OG : rot 180:sc= -0.969 USER MOD Single : A 284 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 286 THR OG1 : rot 80:sc= 1.9 USER MOD Single : A 291 LYS NZ :NH3+ 160:sc= -0.0341 (180deg=-0.302) USER MOD Single : A 293 ASN :FLIP amide:sc= 0.216 F(o=-1.7,f=0.22) USER MOD Single : A 295 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 297 MET CE :methyl -150:sc= -1.3 (180deg=-2.78!) USER MOD Single : A 299 GLN : amide:sc=-0.00429 X(o=-0.0043,f=-0.15) USER MOD Single : A 301 TYR OH : rot 180:sc= 0 USER MOD Single : A 305 SER OG : rot 180:sc= -0.0736 USER MOD Single : A 308 THR OG1 : rot 180:sc= 0 USER MOD Single : A 311 GLN : amide:sc= 0 K(o=0,f=-0.82) USER MOD ----------------------------------------------------------------- ATOM 168 N PRO A 231 -1.114 13.232 1.342 1.00 0.00 N ATOM 169 CA PRO A 231 -0.150 12.252 1.850 1.00 0.00 C ATOM 170 C PRO A 231 -0.831 11.014 2.424 1.00 0.00 C ATOM 171 O PRO A 231 -0.486 9.885 2.074 1.00 0.00 O ATOM 172 CB PRO A 231 0.586 13.016 2.953 1.00 0.00 C ATOM 173 CG PRO A 231 -0.397 14.027 3.434 1.00 0.00 C ATOM 174 CD PRO A 231 -1.299 14.362 2.268 1.00 0.00 C ATOM 0 HA PRO A 231 0.504 11.878 1.062 1.00 0.00 H new ATOM 0 HB2 PRO A 231 0.894 12.349 3.758 1.00 0.00 H new ATOM 0 HB3 PRO A 231 1.489 13.492 2.570 1.00 0.00 H new ATOM 0 HG2 PRO A 231 -0.977 13.633 4.269 1.00 0.00 H new ATOM 0 HG3 PRO A 231 0.114 14.920 3.794 1.00 0.00 H new ATOM 0 HD2 PRO A 231 -2.339 14.456 2.581 1.00 0.00 H new ATOM 0 HD3 PRO A 231 -1.019 15.308 1.805 1.00 0.00 H new ATOM 182 N ASP A 232 -1.800 11.232 3.306 1.00 0.00 N ATOM 183 CA ASP A 232 -2.531 10.134 3.927 1.00 0.00 C ATOM 184 C ASP A 232 -2.807 9.025 2.917 1.00 0.00 C ATOM 185 O ASP A 232 -2.704 7.840 3.237 1.00 0.00 O ATOM 186 CB ASP A 232 -3.847 10.640 4.520 1.00 0.00 C ATOM 187 CG ASP A 232 -4.521 9.605 5.400 1.00 0.00 C ATOM 188 OD1 ASP A 232 -5.234 8.736 4.855 1.00 0.00 O ATOM 189 OD2 ASP A 232 -4.335 9.664 6.633 1.00 0.00 O ATOM 0 H ASP A 232 -2.098 12.160 3.607 1.00 0.00 H new ATOM 0 HA ASP A 232 -1.914 9.726 4.728 1.00 0.00 H new ATOM 0 HB2 ASP A 232 -3.657 11.541 5.104 1.00 0.00 H new ATOM 0 HB3 ASP A 232 -4.522 10.921 3.712 1.00 0.00 H new ATOM 194 N ASP A 233 -3.159 9.417 1.697 1.00 0.00 N ATOM 195 CA ASP A 233 -3.450 8.456 0.640 1.00 0.00 C ATOM 196 C ASP A 233 -2.201 7.663 0.267 1.00 0.00 C ATOM 197 O ASP A 233 -2.182 6.435 0.358 1.00 0.00 O ATOM 198 CB ASP A 233 -4.001 9.174 -0.593 1.00 0.00 C ATOM 199 CG ASP A 233 -4.910 8.287 -1.422 1.00 0.00 C ATOM 200 OD1 ASP A 233 -5.583 7.414 -0.835 1.00 0.00 O ATOM 201 OD2 ASP A 233 -4.949 8.467 -2.656 1.00 0.00 O ATOM 0 H ASP A 233 -3.250 10.393 1.416 1.00 0.00 H new ATOM 0 HA ASP A 233 -4.202 7.760 1.012 1.00 0.00 H new ATOM 0 HB2 ASP A 233 -4.552 10.060 -0.278 1.00 0.00 H new ATOM 0 HB3 ASP A 233 -3.171 9.517 -1.211 1.00 0.00 H new ATOM 206 N LEU A 234 -1.160 8.373 -0.155 1.00 0.00 N ATOM 207 CA LEU A 234 0.093 7.736 -0.543 1.00 0.00 C ATOM 208 C LEU A 234 0.659 6.904 0.603 1.00 0.00 C ATOM 209 O LEU A 234 1.356 5.914 0.380 1.00 0.00 O ATOM 210 CB LEU A 234 1.112 8.792 -0.974 1.00 0.00 C ATOM 211 CG LEU A 234 0.608 9.851 -1.955 1.00 0.00 C ATOM 212 CD1 LEU A 234 1.642 10.952 -2.130 1.00 0.00 C ATOM 213 CD2 LEU A 234 0.269 9.217 -3.296 1.00 0.00 C ATOM 0 H LEU A 234 -1.159 9.390 -0.237 1.00 0.00 H new ATOM 0 HA LEU A 234 -0.110 7.072 -1.383 1.00 0.00 H new ATOM 0 HB2 LEU A 234 1.480 9.298 -0.082 1.00 0.00 H new ATOM 0 HB3 LEU A 234 1.963 8.283 -1.426 1.00 0.00 H new ATOM 0 HG LEU A 234 -0.299 10.295 -1.546 1.00 0.00 H new ATOM 0 HD11 LEU A 234 1.266 11.696 -2.832 1.00 0.00 H new ATOM 0 HD12 LEU A 234 1.836 11.426 -1.168 1.00 0.00 H new ATOM 0 HD13 LEU A 234 2.567 10.524 -2.516 1.00 0.00 H new ATOM 0 HD21 LEU A 234 -0.088 9.985 -3.982 1.00 0.00 H new ATOM 0 HD22 LEU A 234 1.160 8.746 -3.711 1.00 0.00 H new ATOM 0 HD23 LEU A 234 -0.508 8.465 -3.157 1.00 0.00 H new ATOM 225 N TYR A 235 0.353 7.311 1.830 1.00 0.00 N ATOM 226 CA TYR A 235 0.831 6.604 3.012 1.00 0.00 C ATOM 227 C TYR A 235 -0.272 5.738 3.612 1.00 0.00 C ATOM 228 O TYR A 235 -1.150 6.233 4.320 1.00 0.00 O ATOM 229 CB TYR A 235 1.340 7.599 4.057 1.00 0.00 C ATOM 230 CG TYR A 235 2.598 8.325 3.639 1.00 0.00 C ATOM 231 CD1 TYR A 235 3.846 7.730 3.781 1.00 0.00 C ATOM 232 CD2 TYR A 235 2.540 9.606 3.104 1.00 0.00 C ATOM 233 CE1 TYR A 235 4.999 8.390 3.401 1.00 0.00 C ATOM 234 CE2 TYR A 235 3.688 10.272 2.720 1.00 0.00 C ATOM 235 CZ TYR A 235 4.915 9.661 2.871 1.00 0.00 C ATOM 236 OH TYR A 235 6.060 10.322 2.491 1.00 0.00 O ATOM 0 H TYR A 235 -0.224 8.127 2.032 1.00 0.00 H new ATOM 0 HA TYR A 235 1.652 5.955 2.708 1.00 0.00 H new ATOM 0 HB2 TYR A 235 0.559 8.331 4.260 1.00 0.00 H new ATOM 0 HB3 TYR A 235 1.530 7.068 4.990 1.00 0.00 H new ATOM 0 HD1 TYR A 235 3.916 6.735 4.195 1.00 0.00 H new ATOM 0 HD2 TYR A 235 1.581 10.089 2.986 1.00 0.00 H new ATOM 0 HE1 TYR A 235 5.961 7.913 3.518 1.00 0.00 H new ATOM 0 HE2 TYR A 235 3.625 11.266 2.304 1.00 0.00 H new ATOM 0 HH TYR A 235 5.826 11.205 2.137 1.00 0.00 H new ATOM 246 N VAL A 236 -0.220 4.441 3.325 1.00 0.00 N ATOM 247 CA VAL A 236 -1.213 3.504 3.837 1.00 0.00 C ATOM 248 C VAL A 236 -0.566 2.453 4.731 1.00 0.00 C ATOM 249 O VAL A 236 0.657 2.324 4.771 1.00 0.00 O ATOM 250 CB VAL A 236 -1.961 2.798 2.691 1.00 0.00 C ATOM 251 CG1 VAL A 236 -2.407 3.806 1.643 1.00 0.00 C ATOM 252 CG2 VAL A 236 -1.087 1.720 2.069 1.00 0.00 C ATOM 0 H VAL A 236 0.499 4.015 2.741 1.00 0.00 H new ATOM 0 HA VAL A 236 -1.926 4.085 4.422 1.00 0.00 H new ATOM 0 HB VAL A 236 -2.851 2.320 3.101 1.00 0.00 H new ATOM 0 HG11 VAL A 236 -2.934 3.288 0.841 1.00 0.00 H new ATOM 0 HG12 VAL A 236 -3.073 4.537 2.102 1.00 0.00 H new ATOM 0 HG13 VAL A 236 -1.535 4.316 1.234 1.00 0.00 H new ATOM 0 HG21 VAL A 236 -1.632 1.231 1.261 1.00 0.00 H new ATOM 0 HG22 VAL A 236 -0.178 2.172 1.672 1.00 0.00 H new ATOM 0 HG23 VAL A 236 -0.824 0.982 2.827 1.00 0.00 H new ATOM 262 N SER A 237 -1.397 1.702 5.448 1.00 0.00 N ATOM 263 CA SER A 237 -0.906 0.662 6.346 1.00 0.00 C ATOM 264 C SER A 237 -1.547 -0.683 6.021 1.00 0.00 C ATOM 265 O SER A 237 -2.715 -0.751 5.639 1.00 0.00 O ATOM 266 CB SER A 237 -1.192 1.038 7.801 1.00 0.00 C ATOM 267 OG SER A 237 -2.565 1.337 7.989 1.00 0.00 O ATOM 0 H SER A 237 -2.413 1.794 5.425 1.00 0.00 H new ATOM 0 HA SER A 237 0.171 0.575 6.206 1.00 0.00 H new ATOM 0 HB2 SER A 237 -0.902 0.216 8.456 1.00 0.00 H new ATOM 0 HB3 SER A 237 -0.587 1.899 8.083 1.00 0.00 H new ATOM 0 HG SER A 237 -2.935 0.751 8.682 1.00 0.00 H new ATOM 273 N VAL A 238 -0.773 -1.753 6.175 1.00 0.00 N ATOM 274 CA VAL A 238 -1.264 -3.098 5.899 1.00 0.00 C ATOM 275 C VAL A 238 -1.153 -3.987 7.132 1.00 0.00 C ATOM 276 O VAL A 238 -0.053 -4.355 7.549 1.00 0.00 O ATOM 277 CB VAL A 238 -0.492 -3.750 4.737 1.00 0.00 C ATOM 278 CG1 VAL A 238 -1.137 -5.070 4.341 1.00 0.00 C ATOM 279 CG2 VAL A 238 -0.419 -2.804 3.548 1.00 0.00 C ATOM 0 H VAL A 238 0.197 -1.714 6.489 1.00 0.00 H new ATOM 0 HA VAL A 238 -2.313 -3.001 5.618 1.00 0.00 H new ATOM 0 HB VAL A 238 0.525 -3.956 5.070 1.00 0.00 H new ATOM 0 HG11 VAL A 238 -0.578 -5.516 3.519 1.00 0.00 H new ATOM 0 HG12 VAL A 238 -1.131 -5.748 5.194 1.00 0.00 H new ATOM 0 HG13 VAL A 238 -2.165 -4.892 4.026 1.00 0.00 H new ATOM 0 HG21 VAL A 238 0.130 -3.281 2.736 1.00 0.00 H new ATOM 0 HG22 VAL A 238 -1.428 -2.564 3.212 1.00 0.00 H new ATOM 0 HG23 VAL A 238 0.093 -1.888 3.843 1.00 0.00 H new ATOM 289 N HIS A 239 -2.298 -4.331 7.713 1.00 0.00 N ATOM 290 CA HIS A 239 -2.329 -5.179 8.899 1.00 0.00 C ATOM 291 C HIS A 239 -2.980 -6.524 8.589 1.00 0.00 C ATOM 292 O HIS A 239 -4.147 -6.586 8.206 1.00 0.00 O ATOM 293 CB HIS A 239 -3.086 -4.482 10.031 1.00 0.00 C ATOM 294 CG HIS A 239 -2.698 -3.048 10.216 1.00 0.00 C ATOM 295 ND1 HIS A 239 -2.016 -2.589 11.323 1.00 0.00 N ATOM 296 CD2 HIS A 239 -2.899 -1.967 9.426 1.00 0.00 C ATOM 297 CE1 HIS A 239 -1.816 -1.289 11.207 1.00 0.00 C ATOM 298 NE2 HIS A 239 -2.342 -0.887 10.064 1.00 0.00 N ATOM 0 H HIS A 239 -3.216 -4.036 7.382 1.00 0.00 H new ATOM 0 HA HIS A 239 -1.301 -5.357 9.215 1.00 0.00 H new ATOM 0 HB2 HIS A 239 -4.156 -4.537 9.830 1.00 0.00 H new ATOM 0 HB3 HIS A 239 -2.908 -5.021 10.962 1.00 0.00 H new ATOM 0 HD1 HIS A 239 -1.713 -3.164 12.109 1.00 0.00 H new ATOM 0 HD2 HIS A 239 -3.404 -1.956 8.471 1.00 0.00 H new ATOM 0 HE1 HIS A 239 -1.309 -0.661 11.925 1.00 0.00 H new ATOM 306 N GLY A 240 -2.215 -7.599 8.756 1.00 0.00 N ATOM 307 CA GLY A 240 -2.734 -8.927 8.489 1.00 0.00 C ATOM 308 C GLY A 240 -1.868 -9.702 7.515 1.00 0.00 C ATOM 309 O GLY A 240 -2.357 -10.204 6.504 1.00 0.00 O ATOM 0 H GLY A 240 -1.245 -7.573 9.071 1.00 0.00 H new ATOM 0 HA2 GLY A 240 -2.807 -9.480 9.425 1.00 0.00 H new ATOM 0 HA3 GLY A 240 -3.744 -8.845 8.087 1.00 0.00 H new ATOM 313 N MET A 241 -0.578 -9.799 7.820 1.00 0.00 N ATOM 314 CA MET A 241 0.357 -10.519 6.964 1.00 0.00 C ATOM 315 C MET A 241 0.931 -11.734 7.686 1.00 0.00 C ATOM 316 O MET A 241 1.011 -11.775 8.913 1.00 0.00 O ATOM 317 CB MET A 241 1.491 -9.592 6.519 1.00 0.00 C ATOM 318 CG MET A 241 1.007 -8.339 5.807 1.00 0.00 C ATOM 319 SD MET A 241 0.409 -7.079 6.950 1.00 0.00 S ATOM 320 CE MET A 241 1.878 -6.071 7.142 1.00 0.00 C ATOM 0 H MET A 241 -0.157 -9.388 8.653 1.00 0.00 H new ATOM 0 HA MET A 241 -0.186 -10.865 6.085 1.00 0.00 H new ATOM 0 HB2 MET A 241 2.075 -9.301 7.392 1.00 0.00 H new ATOM 0 HB3 MET A 241 2.160 -10.141 5.856 1.00 0.00 H new ATOM 0 HG2 MET A 241 1.821 -7.927 5.211 1.00 0.00 H new ATOM 0 HG3 MET A 241 0.208 -8.605 5.115 1.00 0.00 H new ATOM 0 HE1 MET A 241 2.156 -6.031 8.195 1.00 0.00 H new ATOM 0 HE2 MET A 241 2.695 -6.506 6.567 1.00 0.00 H new ATOM 0 HE3 MET A 241 1.677 -5.062 6.781 1.00 0.00 H new ATOM 330 N PRO A 242 1.341 -12.747 6.908 1.00 0.00 N ATOM 331 CA PRO A 242 1.915 -13.981 7.452 1.00 0.00 C ATOM 332 C PRO A 242 2.933 -13.710 8.554 1.00 0.00 C ATOM 333 O PRO A 242 3.633 -12.697 8.530 1.00 0.00 O ATOM 334 CB PRO A 242 2.596 -14.620 6.240 1.00 0.00 C ATOM 335 CG PRO A 242 1.822 -14.126 5.066 1.00 0.00 C ATOM 336 CD PRO A 242 1.275 -12.765 5.437 1.00 0.00 C ATOM 0 HA PRO A 242 1.157 -14.613 7.915 1.00 0.00 H new ATOM 0 HB2 PRO A 242 3.644 -14.327 6.175 1.00 0.00 H new ATOM 0 HB3 PRO A 242 2.572 -15.708 6.300 1.00 0.00 H new ATOM 0 HG2 PRO A 242 2.460 -14.058 4.185 1.00 0.00 H new ATOM 0 HG3 PRO A 242 1.012 -14.813 4.821 1.00 0.00 H new ATOM 0 HD2 PRO A 242 1.870 -11.963 5.000 1.00 0.00 H new ATOM 0 HD3 PRO A 242 0.253 -12.634 5.081 1.00 0.00 H new ATOM 344 N PHE A 243 3.011 -14.620 9.518 1.00 0.00 N ATOM 345 CA PHE A 243 3.944 -14.479 10.630 1.00 0.00 C ATOM 346 C PHE A 243 5.364 -14.246 10.122 1.00 0.00 C ATOM 347 O PHE A 243 6.177 -13.608 10.790 1.00 0.00 O ATOM 348 CB PHE A 243 3.906 -15.725 11.518 1.00 0.00 C ATOM 349 CG PHE A 243 4.529 -15.518 12.868 1.00 0.00 C ATOM 350 CD1 PHE A 243 4.233 -14.390 13.618 1.00 0.00 C ATOM 351 CD2 PHE A 243 5.412 -16.450 13.389 1.00 0.00 C ATOM 352 CE1 PHE A 243 4.806 -14.197 14.860 1.00 0.00 C ATOM 353 CE2 PHE A 243 5.987 -16.263 14.632 1.00 0.00 C ATOM 354 CZ PHE A 243 5.683 -15.135 15.369 1.00 0.00 C ATOM 0 H PHE A 243 2.439 -15.464 9.552 1.00 0.00 H new ATOM 0 HA PHE A 243 3.640 -13.613 11.218 1.00 0.00 H new ATOM 0 HB2 PHE A 243 2.870 -16.037 11.649 1.00 0.00 H new ATOM 0 HB3 PHE A 243 4.422 -16.540 11.010 1.00 0.00 H new ATOM 0 HD1 PHE A 243 3.547 -13.654 13.227 1.00 0.00 H new ATOM 0 HD2 PHE A 243 5.654 -17.333 12.817 1.00 0.00 H new ATOM 0 HE1 PHE A 243 4.568 -13.313 15.433 1.00 0.00 H new ATOM 0 HE2 PHE A 243 6.673 -16.998 15.026 1.00 0.00 H new ATOM 0 HZ PHE A 243 6.130 -14.987 16.341 1.00 0.00 H new ATOM 364 N SER A 244 5.654 -14.769 8.935 1.00 0.00 N ATOM 365 CA SER A 244 6.977 -14.623 8.338 1.00 0.00 C ATOM 366 C SER A 244 6.903 -13.818 7.044 1.00 0.00 C ATOM 367 O SER A 244 7.775 -13.925 6.183 1.00 0.00 O ATOM 368 CB SER A 244 7.590 -15.997 8.062 1.00 0.00 C ATOM 369 OG SER A 244 8.112 -16.570 9.249 1.00 0.00 O ATOM 0 H SER A 244 4.991 -15.297 8.368 1.00 0.00 H new ATOM 0 HA SER A 244 7.610 -14.086 9.045 1.00 0.00 H new ATOM 0 HB2 SER A 244 6.834 -16.657 7.638 1.00 0.00 H new ATOM 0 HB3 SER A 244 8.383 -15.903 7.321 1.00 0.00 H new ATOM 0 HG SER A 244 8.497 -17.448 9.047 1.00 0.00 H new ATOM 375 N ALA A 245 5.855 -13.011 6.916 1.00 0.00 N ATOM 376 CA ALA A 245 5.667 -12.185 5.729 1.00 0.00 C ATOM 377 C ALA A 245 6.876 -11.289 5.487 1.00 0.00 C ATOM 378 O ALA A 245 7.408 -10.684 6.417 1.00 0.00 O ATOM 379 CB ALA A 245 4.404 -11.347 5.865 1.00 0.00 C ATOM 0 H ALA A 245 5.123 -12.911 7.619 1.00 0.00 H new ATOM 0 HA ALA A 245 5.560 -12.846 4.869 1.00 0.00 H new ATOM 0 HB1 ALA A 245 4.275 -10.735 4.972 1.00 0.00 H new ATOM 0 HB2 ALA A 245 3.542 -12.004 5.982 1.00 0.00 H new ATOM 0 HB3 ALA A 245 4.488 -10.701 6.739 1.00 0.00 H new ATOM 385 N MET A 246 7.306 -11.209 4.232 1.00 0.00 N ATOM 386 CA MET A 246 8.453 -10.386 3.868 1.00 0.00 C ATOM 387 C MET A 246 8.125 -9.493 2.675 1.00 0.00 C ATOM 388 O MET A 246 6.987 -9.463 2.206 1.00 0.00 O ATOM 389 CB MET A 246 9.659 -11.269 3.542 1.00 0.00 C ATOM 390 CG MET A 246 9.349 -12.380 2.552 1.00 0.00 C ATOM 391 SD MET A 246 10.724 -13.527 2.342 1.00 0.00 S ATOM 392 CE MET A 246 10.305 -14.782 3.549 1.00 0.00 C ATOM 0 H MET A 246 6.877 -11.704 3.450 1.00 0.00 H new ATOM 0 HA MET A 246 8.697 -9.750 4.719 1.00 0.00 H new ATOM 0 HB2 MET A 246 10.457 -10.646 3.138 1.00 0.00 H new ATOM 0 HB3 MET A 246 10.036 -11.710 4.465 1.00 0.00 H new ATOM 0 HG2 MET A 246 8.471 -12.930 2.892 1.00 0.00 H new ATOM 0 HG3 MET A 246 9.096 -11.941 1.587 1.00 0.00 H new ATOM 0 HE1 MET A 246 11.064 -15.564 3.539 1.00 0.00 H new ATOM 0 HE2 MET A 246 10.260 -14.332 4.541 1.00 0.00 H new ATOM 0 HE3 MET A 246 9.335 -15.214 3.303 1.00 0.00 H new ATOM 402 N GLU A 247 9.128 -8.767 2.191 1.00 0.00 N ATOM 403 CA GLU A 247 8.943 -7.873 1.054 1.00 0.00 C ATOM 404 C GLU A 247 8.213 -8.583 -0.083 1.00 0.00 C ATOM 405 O GLU A 247 7.126 -8.173 -0.488 1.00 0.00 O ATOM 406 CB GLU A 247 10.295 -7.354 0.561 1.00 0.00 C ATOM 407 CG GLU A 247 10.221 -5.982 -0.087 1.00 0.00 C ATOM 408 CD GLU A 247 11.416 -5.689 -0.973 1.00 0.00 C ATOM 409 OE1 GLU A 247 11.890 -6.619 -1.659 1.00 0.00 O ATOM 410 OE2 GLU A 247 11.878 -4.528 -0.980 1.00 0.00 O ATOM 0 H GLU A 247 10.076 -8.780 2.568 1.00 0.00 H new ATOM 0 HA GLU A 247 8.335 -7.030 1.382 1.00 0.00 H new ATOM 0 HB2 GLU A 247 10.987 -7.312 1.402 1.00 0.00 H new ATOM 0 HB3 GLU A 247 10.707 -8.064 -0.156 1.00 0.00 H new ATOM 0 HG2 GLU A 247 9.309 -5.913 -0.680 1.00 0.00 H new ATOM 0 HG3 GLU A 247 10.154 -5.221 0.690 1.00 0.00 H new ATOM 417 N ASN A 248 8.821 -9.649 -0.595 1.00 0.00 N ATOM 418 CA ASN A 248 8.230 -10.415 -1.686 1.00 0.00 C ATOM 419 C ASN A 248 6.746 -10.664 -1.435 1.00 0.00 C ATOM 420 O ASN A 248 5.921 -10.523 -2.337 1.00 0.00 O ATOM 421 CB ASN A 248 8.961 -11.749 -1.854 1.00 0.00 C ATOM 422 CG ASN A 248 8.347 -12.854 -1.017 1.00 0.00 C ATOM 423 OD1 ASN A 248 7.178 -13.201 -1.188 1.00 0.00 O ATOM 424 ND2 ASN A 248 9.135 -13.413 -0.106 1.00 0.00 N ATOM 0 H ASN A 248 9.722 -10.001 -0.272 1.00 0.00 H new ATOM 0 HA ASN A 248 8.332 -9.834 -2.602 1.00 0.00 H new ATOM 0 HB2 ASN A 248 8.943 -12.040 -2.904 1.00 0.00 H new ATOM 0 HB3 ASN A 248 10.007 -11.624 -1.575 1.00 0.00 H new ATOM 0 HD21 ASN A 248 8.778 -14.162 0.487 1.00 0.00 H new ATOM 0 HD22 ASN A 248 10.098 -13.093 0.001 1.00 0.00 H new ATOM 431 N ASP A 249 6.414 -11.034 -0.203 1.00 0.00 N ATOM 432 CA ASP A 249 5.029 -11.301 0.169 1.00 0.00 C ATOM 433 C ASP A 249 4.150 -10.084 -0.103 1.00 0.00 C ATOM 434 O ASP A 249 3.012 -10.216 -0.555 1.00 0.00 O ATOM 435 CB ASP A 249 4.941 -11.690 1.645 1.00 0.00 C ATOM 436 CG ASP A 249 5.762 -12.923 1.969 1.00 0.00 C ATOM 437 OD1 ASP A 249 6.832 -13.103 1.349 1.00 0.00 O ATOM 438 OD2 ASP A 249 5.337 -13.706 2.842 1.00 0.00 O ATOM 0 H ASP A 249 7.085 -11.156 0.555 1.00 0.00 H new ATOM 0 HA ASP A 249 4.668 -12.131 -0.439 1.00 0.00 H new ATOM 0 HB2 ASP A 249 5.284 -10.857 2.258 1.00 0.00 H new ATOM 0 HB3 ASP A 249 3.899 -11.871 1.908 1.00 0.00 H new ATOM 443 N VAL A 250 4.684 -8.900 0.178 1.00 0.00 N ATOM 444 CA VAL A 250 3.948 -7.659 -0.036 1.00 0.00 C ATOM 445 C VAL A 250 3.819 -7.346 -1.522 1.00 0.00 C ATOM 446 O VAL A 250 2.713 -7.208 -2.044 1.00 0.00 O ATOM 447 CB VAL A 250 4.631 -6.473 0.670 1.00 0.00 C ATOM 448 CG1 VAL A 250 3.917 -5.171 0.338 1.00 0.00 C ATOM 449 CG2 VAL A 250 4.671 -6.700 2.174 1.00 0.00 C ATOM 0 H VAL A 250 5.624 -8.774 0.554 1.00 0.00 H new ATOM 0 HA VAL A 250 2.955 -7.802 0.389 1.00 0.00 H new ATOM 0 HB VAL A 250 5.657 -6.399 0.309 1.00 0.00 H new ATOM 0 HG11 VAL A 250 4.414 -4.344 0.846 1.00 0.00 H new ATOM 0 HG12 VAL A 250 3.945 -5.005 -0.739 1.00 0.00 H new ATOM 0 HG13 VAL A 250 2.880 -5.230 0.669 1.00 0.00 H new ATOM 0 HG21 VAL A 250 5.157 -5.852 2.657 1.00 0.00 H new ATOM 0 HG22 VAL A 250 3.654 -6.800 2.554 1.00 0.00 H new ATOM 0 HG23 VAL A 250 5.230 -7.610 2.390 1.00 0.00 H new ATOM 459 N ARG A 251 4.958 -7.236 -2.199 1.00 0.00 N ATOM 460 CA ARG A 251 4.972 -6.938 -3.626 1.00 0.00 C ATOM 461 C ARG A 251 3.943 -7.785 -4.369 1.00 0.00 C ATOM 462 O ARG A 251 3.172 -7.273 -5.181 1.00 0.00 O ATOM 463 CB ARG A 251 6.366 -7.184 -4.206 1.00 0.00 C ATOM 464 CG ARG A 251 7.316 -6.011 -4.028 1.00 0.00 C ATOM 465 CD ARG A 251 8.760 -6.476 -3.915 1.00 0.00 C ATOM 466 NE ARG A 251 9.311 -6.871 -5.209 1.00 0.00 N ATOM 467 CZ ARG A 251 10.365 -7.667 -5.346 1.00 0.00 C ATOM 468 NH1 ARG A 251 10.979 -8.150 -4.275 1.00 0.00 N ATOM 469 NH2 ARG A 251 10.807 -7.982 -6.557 1.00 0.00 N ATOM 0 H ARG A 251 5.882 -7.349 -1.782 1.00 0.00 H new ATOM 0 HA ARG A 251 4.712 -5.887 -3.755 1.00 0.00 H new ATOM 0 HB2 ARG A 251 6.797 -8.065 -3.731 1.00 0.00 H new ATOM 0 HB3 ARG A 251 6.274 -7.408 -5.269 1.00 0.00 H new ATOM 0 HG2 ARG A 251 7.217 -5.330 -4.873 1.00 0.00 H new ATOM 0 HG3 ARG A 251 7.042 -5.452 -3.134 1.00 0.00 H new ATOM 0 HD2 ARG A 251 9.367 -5.675 -3.492 1.00 0.00 H new ATOM 0 HD3 ARG A 251 8.817 -7.318 -3.225 1.00 0.00 H new ATOM 0 HE ARG A 251 8.862 -6.516 -6.053 1.00 0.00 H new ATOM 0 HH11 ARG A 251 10.642 -7.910 -3.343 1.00 0.00 H new ATOM 0 HH12 ARG A 251 11.788 -8.761 -4.383 1.00 0.00 H new ATOM 0 HH21 ARG A 251 10.337 -7.613 -7.383 1.00 0.00 H new ATOM 0 HH22 ARG A 251 11.617 -8.593 -6.661 1.00 0.00 H new ATOM 483 N ASP A 252 3.938 -9.083 -4.086 1.00 0.00 N ATOM 484 CA ASP A 252 3.004 -10.001 -4.726 1.00 0.00 C ATOM 485 C ASP A 252 1.593 -9.421 -4.740 1.00 0.00 C ATOM 486 O ASP A 252 0.839 -9.615 -5.693 1.00 0.00 O ATOM 487 CB ASP A 252 3.007 -11.350 -4.005 1.00 0.00 C ATOM 488 CG ASP A 252 2.084 -12.359 -4.661 1.00 0.00 C ATOM 489 OD1 ASP A 252 0.911 -12.014 -4.914 1.00 0.00 O ATOM 490 OD2 ASP A 252 2.536 -13.493 -4.922 1.00 0.00 O ATOM 0 H ASP A 252 4.570 -9.523 -3.417 1.00 0.00 H new ATOM 0 HA ASP A 252 3.327 -10.147 -5.757 1.00 0.00 H new ATOM 0 HB2 ASP A 252 4.022 -11.747 -3.988 1.00 0.00 H new ATOM 0 HB3 ASP A 252 2.704 -11.205 -2.968 1.00 0.00 H new ATOM 495 N PHE A 253 1.243 -8.707 -3.675 1.00 0.00 N ATOM 496 CA PHE A 253 -0.078 -8.099 -3.563 1.00 0.00 C ATOM 497 C PHE A 253 -0.160 -6.819 -4.389 1.00 0.00 C ATOM 498 O PHE A 253 -1.110 -6.614 -5.144 1.00 0.00 O ATOM 499 CB PHE A 253 -0.401 -7.796 -2.098 1.00 0.00 C ATOM 500 CG PHE A 253 -1.860 -7.549 -1.845 1.00 0.00 C ATOM 501 CD1 PHE A 253 -2.777 -8.584 -1.931 1.00 0.00 C ATOM 502 CD2 PHE A 253 -2.316 -6.281 -1.520 1.00 0.00 C ATOM 503 CE1 PHE A 253 -4.121 -8.360 -1.699 1.00 0.00 C ATOM 504 CE2 PHE A 253 -3.659 -6.051 -1.286 1.00 0.00 C ATOM 505 CZ PHE A 253 -4.562 -7.092 -1.375 1.00 0.00 C ATOM 0 H PHE A 253 1.855 -8.535 -2.878 1.00 0.00 H new ATOM 0 HA PHE A 253 -0.810 -8.807 -3.950 1.00 0.00 H new ATOM 0 HB2 PHE A 253 -0.070 -8.631 -1.481 1.00 0.00 H new ATOM 0 HB3 PHE A 253 0.168 -6.921 -1.782 1.00 0.00 H new ATOM 0 HD1 PHE A 253 -2.437 -9.578 -2.182 1.00 0.00 H new ATOM 0 HD2 PHE A 253 -1.614 -5.463 -1.449 1.00 0.00 H new ATOM 0 HE1 PHE A 253 -4.825 -9.175 -1.771 1.00 0.00 H new ATOM 0 HE2 PHE A 253 -4.002 -5.058 -1.034 1.00 0.00 H new ATOM 0 HZ PHE A 253 -5.611 -6.915 -1.192 1.00 0.00 H new ATOM 515 N PHE A 254 0.844 -5.961 -4.240 1.00 0.00 N ATOM 516 CA PHE A 254 0.886 -4.700 -4.971 1.00 0.00 C ATOM 517 C PHE A 254 1.790 -4.810 -6.195 1.00 0.00 C ATOM 518 O PHE A 254 2.499 -3.866 -6.545 1.00 0.00 O ATOM 519 CB PHE A 254 1.379 -3.574 -4.059 1.00 0.00 C ATOM 520 CG PHE A 254 0.607 -3.460 -2.776 1.00 0.00 C ATOM 521 CD1 PHE A 254 -0.757 -3.220 -2.792 1.00 0.00 C ATOM 522 CD2 PHE A 254 1.245 -3.595 -1.553 1.00 0.00 C ATOM 523 CE1 PHE A 254 -1.470 -3.114 -1.612 1.00 0.00 C ATOM 524 CE2 PHE A 254 0.538 -3.490 -0.371 1.00 0.00 C ATOM 525 CZ PHE A 254 -0.822 -3.251 -0.400 1.00 0.00 C ATOM 0 H PHE A 254 1.639 -6.116 -3.620 1.00 0.00 H new ATOM 0 HA PHE A 254 -0.125 -4.470 -5.308 1.00 0.00 H new ATOM 0 HB2 PHE A 254 2.431 -3.740 -3.827 1.00 0.00 H new ATOM 0 HB3 PHE A 254 1.316 -2.628 -4.597 1.00 0.00 H new ATOM 0 HD1 PHE A 254 -1.269 -3.114 -3.737 1.00 0.00 H new ATOM 0 HD2 PHE A 254 2.308 -3.785 -1.524 1.00 0.00 H new ATOM 0 HE1 PHE A 254 -2.533 -2.924 -1.638 1.00 0.00 H new ATOM 0 HE2 PHE A 254 1.048 -3.595 0.575 1.00 0.00 H new ATOM 0 HZ PHE A 254 -1.377 -3.171 0.523 1.00 0.00 H new ATOM 535 N HIS A 255 1.760 -5.971 -6.842 1.00 0.00 N ATOM 536 CA HIS A 255 2.577 -6.207 -8.028 1.00 0.00 C ATOM 537 C HIS A 255 1.874 -5.694 -9.281 1.00 0.00 C ATOM 538 O HIS A 255 0.875 -6.261 -9.721 1.00 0.00 O ATOM 539 CB HIS A 255 2.882 -7.697 -8.175 1.00 0.00 C ATOM 540 CG HIS A 255 4.144 -7.978 -8.930 1.00 0.00 C ATOM 541 ND1 HIS A 255 4.255 -7.822 -10.296 1.00 0.00 N ATOM 542 CD2 HIS A 255 5.355 -8.407 -8.503 1.00 0.00 C ATOM 543 CE1 HIS A 255 5.478 -8.143 -10.676 1.00 0.00 C ATOM 544 NE2 HIS A 255 6.166 -8.502 -9.607 1.00 0.00 N ATOM 0 H HIS A 255 1.179 -6.763 -6.565 1.00 0.00 H new ATOM 0 HA HIS A 255 3.514 -5.663 -7.908 1.00 0.00 H new ATOM 0 HB2 HIS A 255 2.954 -8.144 -7.184 1.00 0.00 H new ATOM 0 HB3 HIS A 255 2.049 -8.182 -8.683 1.00 0.00 H new ATOM 0 HD2 HIS A 255 5.632 -8.633 -7.484 1.00 0.00 H new ATOM 0 HE1 HIS A 255 5.852 -8.117 -11.689 1.00 0.00 H new ATOM 0 HE2 HIS A 255 7.141 -8.801 -9.602 1.00 0.00 H new ATOM 552 N GLY A 256 2.404 -4.616 -9.852 1.00 0.00 N ATOM 553 CA GLY A 256 1.815 -4.044 -11.048 1.00 0.00 C ATOM 554 C GLY A 256 1.366 -2.611 -10.845 1.00 0.00 C ATOM 555 O GLY A 256 0.605 -2.070 -11.650 1.00 0.00 O ATOM 0 H GLY A 256 3.231 -4.129 -9.507 1.00 0.00 H new ATOM 0 HA2 GLY A 256 2.541 -4.082 -11.861 1.00 0.00 H new ATOM 0 HA3 GLY A 256 0.961 -4.649 -11.354 1.00 0.00 H new ATOM 559 N LEU A 257 1.834 -1.993 -9.766 1.00 0.00 N ATOM 560 CA LEU A 257 1.474 -0.613 -9.458 1.00 0.00 C ATOM 561 C LEU A 257 2.721 0.246 -9.271 1.00 0.00 C ATOM 562 O LEU A 257 3.845 -0.242 -9.383 1.00 0.00 O ATOM 563 CB LEU A 257 0.610 -0.560 -8.197 1.00 0.00 C ATOM 564 CG LEU A 257 -0.737 -1.279 -8.276 1.00 0.00 C ATOM 565 CD1 LEU A 257 -1.348 -1.422 -6.891 1.00 0.00 C ATOM 566 CD2 LEU A 257 -1.686 -0.534 -9.204 1.00 0.00 C ATOM 0 H LEU A 257 2.463 -2.425 -9.090 1.00 0.00 H new ATOM 0 HA LEU A 257 0.904 -0.216 -10.298 1.00 0.00 H new ATOM 0 HB2 LEU A 257 1.180 -0.988 -7.372 1.00 0.00 H new ATOM 0 HB3 LEU A 257 0.427 0.486 -7.950 1.00 0.00 H new ATOM 0 HG LEU A 257 -0.571 -2.277 -8.683 1.00 0.00 H new ATOM 0 HD11 LEU A 257 -2.306 -1.936 -6.967 1.00 0.00 H new ATOM 0 HD12 LEU A 257 -0.677 -1.999 -6.255 1.00 0.00 H new ATOM 0 HD13 LEU A 257 -1.500 -0.434 -6.457 1.00 0.00 H new ATOM 0 HD21 LEU A 257 -2.640 -1.060 -9.248 1.00 0.00 H new ATOM 0 HD22 LEU A 257 -1.846 0.476 -8.826 1.00 0.00 H new ATOM 0 HD23 LEU A 257 -1.253 -0.484 -10.203 1.00 0.00 H new ATOM 578 N ARG A 258 2.513 1.526 -8.982 1.00 0.00 N ATOM 579 CA ARG A 258 3.620 2.453 -8.778 1.00 0.00 C ATOM 580 C ARG A 258 4.134 2.377 -7.343 1.00 0.00 C ATOM 581 O ARG A 258 3.799 3.216 -6.507 1.00 0.00 O ATOM 582 CB ARG A 258 3.182 3.883 -9.099 1.00 0.00 C ATOM 583 CG ARG A 258 3.217 4.212 -10.582 1.00 0.00 C ATOM 584 CD ARG A 258 3.284 5.713 -10.818 1.00 0.00 C ATOM 585 NE ARG A 258 3.694 6.035 -12.183 1.00 0.00 N ATOM 586 CZ ARG A 258 3.406 7.184 -12.785 1.00 0.00 C ATOM 587 NH1 ARG A 258 2.712 8.115 -12.146 1.00 0.00 N ATOM 588 NH2 ARG A 258 3.815 7.403 -14.028 1.00 0.00 N ATOM 0 H ARG A 258 1.588 1.945 -8.884 1.00 0.00 H new ATOM 0 HA ARG A 258 4.428 2.169 -9.452 1.00 0.00 H new ATOM 0 HB2 ARG A 258 2.170 4.036 -8.725 1.00 0.00 H new ATOM 0 HB3 ARG A 258 3.828 4.580 -8.565 1.00 0.00 H new ATOM 0 HG2 ARG A 258 4.080 3.731 -11.042 1.00 0.00 H new ATOM 0 HG3 ARG A 258 2.330 3.806 -11.067 1.00 0.00 H new ATOM 0 HD2 ARG A 258 2.308 6.155 -10.619 1.00 0.00 H new ATOM 0 HD3 ARG A 258 3.986 6.160 -10.114 1.00 0.00 H new ATOM 0 HE ARG A 258 4.231 5.340 -12.702 1.00 0.00 H new ATOM 0 HH11 ARG A 258 2.398 7.950 -11.190 1.00 0.00 H new ATOM 0 HH12 ARG A 258 2.492 8.996 -12.611 1.00 0.00 H new ATOM 0 HH21 ARG A 258 4.351 6.689 -14.522 1.00 0.00 H new ATOM 0 HH22 ARG A 258 3.594 8.285 -14.490 1.00 0.00 H new ATOM 602 N VAL A 259 4.950 1.365 -7.066 1.00 0.00 N ATOM 603 CA VAL A 259 5.512 1.179 -5.733 1.00 0.00 C ATOM 604 C VAL A 259 6.742 2.057 -5.528 1.00 0.00 C ATOM 605 O VAL A 259 7.674 2.035 -6.331 1.00 0.00 O ATOM 606 CB VAL A 259 5.897 -0.291 -5.486 1.00 0.00 C ATOM 607 CG1 VAL A 259 6.572 -0.447 -4.132 1.00 0.00 C ATOM 608 CG2 VAL A 259 4.672 -1.187 -5.586 1.00 0.00 C ATOM 0 H VAL A 259 5.237 0.661 -7.747 1.00 0.00 H new ATOM 0 HA VAL A 259 4.740 1.469 -5.021 1.00 0.00 H new ATOM 0 HB VAL A 259 6.606 -0.596 -6.256 1.00 0.00 H new ATOM 0 HG11 VAL A 259 6.837 -1.493 -3.976 1.00 0.00 H new ATOM 0 HG12 VAL A 259 7.474 0.164 -4.103 1.00 0.00 H new ATOM 0 HG13 VAL A 259 5.890 -0.124 -3.346 1.00 0.00 H new ATOM 0 HG21 VAL A 259 4.963 -2.222 -5.409 1.00 0.00 H new ATOM 0 HG22 VAL A 259 3.937 -0.884 -4.840 1.00 0.00 H new ATOM 0 HG23 VAL A 259 4.236 -1.098 -6.581 1.00 0.00 H new ATOM 618 N ASP A 260 6.737 2.829 -4.446 1.00 0.00 N ATOM 619 CA ASP A 260 7.853 3.713 -4.133 1.00 0.00 C ATOM 620 C ASP A 260 8.682 3.155 -2.981 1.00 0.00 C ATOM 621 O ASP A 260 9.912 3.175 -3.022 1.00 0.00 O ATOM 622 CB ASP A 260 7.340 5.110 -3.780 1.00 0.00 C ATOM 623 CG ASP A 260 8.421 5.990 -3.182 1.00 0.00 C ATOM 624 OD1 ASP A 260 8.697 5.852 -1.972 1.00 0.00 O ATOM 625 OD2 ASP A 260 8.992 6.815 -3.925 1.00 0.00 O ATOM 0 H ASP A 260 5.972 2.860 -3.772 1.00 0.00 H new ATOM 0 HA ASP A 260 8.490 3.780 -5.015 1.00 0.00 H new ATOM 0 HB2 ASP A 260 6.943 5.586 -4.677 1.00 0.00 H new ATOM 0 HB3 ASP A 260 6.514 5.023 -3.074 1.00 0.00 H new ATOM 630 N ALA A 261 8.000 2.659 -1.954 1.00 0.00 N ATOM 631 CA ALA A 261 8.674 2.095 -0.791 1.00 0.00 C ATOM 632 C ALA A 261 7.749 1.159 -0.021 1.00 0.00 C ATOM 633 O ALA A 261 6.526 1.284 -0.090 1.00 0.00 O ATOM 634 CB ALA A 261 9.179 3.207 0.117 1.00 0.00 C ATOM 0 H ALA A 261 6.981 2.636 -1.904 1.00 0.00 H new ATOM 0 HA ALA A 261 9.526 1.513 -1.142 1.00 0.00 H new ATOM 0 HB1 ALA A 261 9.680 2.771 0.981 1.00 0.00 H new ATOM 0 HB2 ALA A 261 9.882 3.834 -0.432 1.00 0.00 H new ATOM 0 HB3 ALA A 261 8.337 3.813 0.453 1.00 0.00 H new ATOM 640 N VAL A 262 8.340 0.221 0.713 1.00 0.00 N ATOM 641 CA VAL A 262 7.568 -0.736 1.496 1.00 0.00 C ATOM 642 C VAL A 262 8.176 -0.929 2.881 1.00 0.00 C ATOM 643 O VAL A 262 9.280 -1.457 3.018 1.00 0.00 O ATOM 644 CB VAL A 262 7.484 -2.101 0.789 1.00 0.00 C ATOM 645 CG1 VAL A 262 6.738 -3.106 1.655 1.00 0.00 C ATOM 646 CG2 VAL A 262 6.816 -1.957 -0.570 1.00 0.00 C ATOM 0 H VAL A 262 9.351 0.104 0.781 1.00 0.00 H new ATOM 0 HA VAL A 262 6.563 -0.326 1.597 1.00 0.00 H new ATOM 0 HB VAL A 262 8.497 -2.473 0.633 1.00 0.00 H new ATOM 0 HG11 VAL A 262 6.688 -4.065 1.139 1.00 0.00 H new ATOM 0 HG12 VAL A 262 7.263 -3.230 2.602 1.00 0.00 H new ATOM 0 HG13 VAL A 262 5.728 -2.744 1.845 1.00 0.00 H new ATOM 0 HG21 VAL A 262 6.765 -2.932 -1.056 1.00 0.00 H new ATOM 0 HG22 VAL A 262 5.808 -1.563 -0.440 1.00 0.00 H new ATOM 0 HG23 VAL A 262 7.396 -1.273 -1.190 1.00 0.00 H new ATOM 656 N HIS A 263 7.448 -0.499 3.906 1.00 0.00 N ATOM 657 CA HIS A 263 7.915 -0.627 5.282 1.00 0.00 C ATOM 658 C HIS A 263 7.290 -1.844 5.958 1.00 0.00 C ATOM 659 O HIS A 263 6.100 -2.114 5.795 1.00 0.00 O ATOM 660 CB HIS A 263 7.583 0.638 6.075 1.00 0.00 C ATOM 661 CG HIS A 263 8.099 0.617 7.481 1.00 0.00 C ATOM 662 ND1 HIS A 263 9.361 0.170 7.812 1.00 0.00 N ATOM 663 CD2 HIS A 263 7.517 0.993 8.644 1.00 0.00 C ATOM 664 CE1 HIS A 263 9.532 0.270 9.118 1.00 0.00 C ATOM 665 NE2 HIS A 263 8.428 0.767 9.646 1.00 0.00 N ATOM 0 H HIS A 263 6.533 -0.059 3.810 1.00 0.00 H new ATOM 0 HA HIS A 263 8.997 -0.761 5.261 1.00 0.00 H new ATOM 0 HB2 HIS A 263 8.000 1.502 5.557 1.00 0.00 H new ATOM 0 HB3 HIS A 263 6.501 0.770 6.096 1.00 0.00 H new ATOM 0 HD1 HIS A 263 10.054 -0.183 7.152 1.00 0.00 H new ATOM 0 HD2 HIS A 263 6.522 1.396 8.762 1.00 0.00 H new ATOM 0 HE1 HIS A 263 10.423 -0.007 9.662 1.00 0.00 H new ATOM 673 N LEU A 264 8.101 -2.575 6.715 1.00 0.00 N ATOM 674 CA LEU A 264 7.628 -3.764 7.415 1.00 0.00 C ATOM 675 C LEU A 264 8.131 -3.784 8.855 1.00 0.00 C ATOM 676 O LEU A 264 9.326 -3.950 9.104 1.00 0.00 O ATOM 677 CB LEU A 264 8.088 -5.027 6.684 1.00 0.00 C ATOM 678 CG LEU A 264 7.701 -5.126 5.208 1.00 0.00 C ATOM 679 CD1 LEU A 264 8.351 -6.342 4.567 1.00 0.00 C ATOM 680 CD2 LEU A 264 6.188 -5.187 5.057 1.00 0.00 C ATOM 0 H LEU A 264 9.089 -2.365 6.860 1.00 0.00 H new ATOM 0 HA LEU A 264 6.538 -3.737 7.431 1.00 0.00 H new ATOM 0 HB2 LEU A 264 9.173 -5.092 6.760 1.00 0.00 H new ATOM 0 HB3 LEU A 264 7.680 -5.893 7.205 1.00 0.00 H new ATOM 0 HG LEU A 264 8.062 -4.234 4.696 1.00 0.00 H new ATOM 0 HD11 LEU A 264 8.064 -6.396 3.517 1.00 0.00 H new ATOM 0 HD12 LEU A 264 9.435 -6.258 4.643 1.00 0.00 H new ATOM 0 HD13 LEU A 264 8.020 -7.245 5.081 1.00 0.00 H new ATOM 0 HD21 LEU A 264 5.930 -5.257 4.000 1.00 0.00 H new ATOM 0 HD22 LEU A 264 5.805 -6.062 5.583 1.00 0.00 H new ATOM 0 HD23 LEU A 264 5.744 -4.286 5.480 1.00 0.00 H new ATOM 692 N LEU A 265 7.212 -3.617 9.800 1.00 0.00 N ATOM 693 CA LEU A 265 7.562 -3.618 11.216 1.00 0.00 C ATOM 694 C LEU A 265 8.007 -5.006 11.665 1.00 0.00 C ATOM 695 O LEU A 265 7.459 -6.018 11.227 1.00 0.00 O ATOM 696 CB LEU A 265 6.370 -3.155 12.056 1.00 0.00 C ATOM 697 CG LEU A 265 5.753 -1.813 11.663 1.00 0.00 C ATOM 698 CD1 LEU A 265 4.342 -1.692 12.216 1.00 0.00 C ATOM 699 CD2 LEU A 265 6.620 -0.663 12.153 1.00 0.00 C ATOM 0 H LEU A 265 6.219 -3.479 9.611 1.00 0.00 H new ATOM 0 HA LEU A 265 8.392 -2.926 11.361 1.00 0.00 H new ATOM 0 HB2 LEU A 265 5.594 -3.919 12.001 1.00 0.00 H new ATOM 0 HB3 LEU A 265 6.686 -3.096 13.097 1.00 0.00 H new ATOM 0 HG LEU A 265 5.701 -1.764 10.575 1.00 0.00 H new ATOM 0 HD11 LEU A 265 3.919 -0.730 11.926 1.00 0.00 H new ATOM 0 HD12 LEU A 265 3.724 -2.496 11.816 1.00 0.00 H new ATOM 0 HD13 LEU A 265 4.370 -1.763 13.303 1.00 0.00 H new ATOM 0 HD21 LEU A 265 6.165 0.284 11.864 1.00 0.00 H new ATOM 0 HD22 LEU A 265 6.705 -0.708 13.239 1.00 0.00 H new ATOM 0 HD23 LEU A 265 7.612 -0.740 11.708 1.00 0.00 H new ATOM 711 N LYS A 266 9.002 -5.047 12.544 1.00 0.00 N ATOM 712 CA LYS A 266 9.520 -6.310 13.057 1.00 0.00 C ATOM 713 C LYS A 266 9.319 -6.407 14.566 1.00 0.00 C ATOM 714 O LYS A 266 9.238 -5.392 15.258 1.00 0.00 O ATOM 715 CB LYS A 266 11.006 -6.451 12.720 1.00 0.00 C ATOM 716 CG LYS A 266 11.307 -6.329 11.236 1.00 0.00 C ATOM 717 CD LYS A 266 12.599 -7.039 10.869 1.00 0.00 C ATOM 718 CE LYS A 266 12.722 -7.232 9.366 1.00 0.00 C ATOM 719 NZ LYS A 266 14.135 -7.444 8.947 1.00 0.00 N ATOM 0 H LYS A 266 9.467 -4.219 12.917 1.00 0.00 H new ATOM 0 HA LYS A 266 8.968 -7.120 12.581 1.00 0.00 H new ATOM 0 HB2 LYS A 266 11.566 -5.688 13.260 1.00 0.00 H new ATOM 0 HB3 LYS A 266 11.361 -7.418 13.076 1.00 0.00 H new ATOM 0 HG2 LYS A 266 10.483 -6.751 10.661 1.00 0.00 H new ATOM 0 HG3 LYS A 266 11.379 -5.276 10.964 1.00 0.00 H new ATOM 0 HD2 LYS A 266 13.449 -6.462 11.233 1.00 0.00 H new ATOM 0 HD3 LYS A 266 12.636 -8.009 11.366 1.00 0.00 H new ATOM 0 HE2 LYS A 266 12.120 -8.088 9.059 1.00 0.00 H new ATOM 0 HE3 LYS A 266 12.319 -6.359 8.854 1.00 0.00 H new ATOM 0 HZ1 LYS A 266 14.176 -7.571 7.916 1.00 0.00 H new ATOM 0 HZ2 LYS A 266 14.705 -6.617 9.217 1.00 0.00 H new ATOM 0 HZ3 LYS A 266 14.513 -8.292 9.416 1.00 0.00 H new ATOM 837 N GLY A 274 3.185 -9.169 11.726 1.00 0.00 N ATOM 838 CA GLY A 274 2.077 -8.968 10.811 1.00 0.00 C ATOM 839 C GLY A 274 1.580 -7.536 10.809 1.00 0.00 C ATOM 840 O GLY A 274 0.399 -7.282 11.044 1.00 0.00 O ATOM 0 HA2 GLY A 274 2.388 -9.243 9.803 1.00 0.00 H new ATOM 0 HA3 GLY A 274 1.258 -9.633 11.085 1.00 0.00 H new ATOM 844 N ASN A 275 2.483 -6.598 10.544 1.00 0.00 N ATOM 845 CA ASN A 275 2.130 -5.183 10.515 1.00 0.00 C ATOM 846 C ASN A 275 3.187 -4.373 9.770 1.00 0.00 C ATOM 847 O ASN A 275 4.366 -4.400 10.121 1.00 0.00 O ATOM 848 CB ASN A 275 1.969 -4.646 11.938 1.00 0.00 C ATOM 849 CG ASN A 275 0.611 -4.972 12.530 1.00 0.00 C ATOM 850 OD1 ASN A 275 -0.418 -4.808 11.875 1.00 0.00 O ATOM 851 ND2 ASN A 275 0.604 -5.436 13.774 1.00 0.00 N ATOM 0 H ASN A 275 3.465 -6.792 10.346 1.00 0.00 H new ATOM 0 HA ASN A 275 1.182 -5.082 9.987 1.00 0.00 H new ATOM 0 HB2 ASN A 275 2.749 -5.067 12.572 1.00 0.00 H new ATOM 0 HB3 ASN A 275 2.110 -3.565 11.934 1.00 0.00 H new ATOM 0 HD21 ASN A 275 -0.280 -5.673 14.225 1.00 0.00 H new ATOM 0 HD22 ASN A 275 1.482 -5.556 14.279 1.00 0.00 H new ATOM 858 N GLY A 276 2.756 -3.653 8.739 1.00 0.00 N ATOM 859 CA GLY A 276 3.677 -2.845 7.961 1.00 0.00 C ATOM 860 C GLY A 276 2.983 -1.708 7.238 1.00 0.00 C ATOM 861 O GLY A 276 1.766 -1.550 7.338 1.00 0.00 O ATOM 0 H GLY A 276 1.785 -3.615 8.428 1.00 0.00 H new ATOM 0 HA2 GLY A 276 4.444 -2.438 8.620 1.00 0.00 H new ATOM 0 HA3 GLY A 276 4.185 -3.478 7.233 1.00 0.00 H new ATOM 865 N LEU A 277 3.758 -0.912 6.509 1.00 0.00 N ATOM 866 CA LEU A 277 3.211 0.218 5.767 1.00 0.00 C ATOM 867 C LEU A 277 3.701 0.210 4.323 1.00 0.00 C ATOM 868 O LEU A 277 4.574 -0.577 3.957 1.00 0.00 O ATOM 869 CB LEU A 277 3.601 1.534 6.443 1.00 0.00 C ATOM 870 CG LEU A 277 3.348 1.616 7.949 1.00 0.00 C ATOM 871 CD1 LEU A 277 3.885 2.924 8.509 1.00 0.00 C ATOM 872 CD2 LEU A 277 1.862 1.476 8.248 1.00 0.00 C ATOM 0 H LEU A 277 4.767 -1.029 6.416 1.00 0.00 H new ATOM 0 HA LEU A 277 2.125 0.127 5.763 1.00 0.00 H new ATOM 0 HB2 LEU A 277 4.661 1.712 6.263 1.00 0.00 H new ATOM 0 HB3 LEU A 277 3.055 2.344 5.959 1.00 0.00 H new ATOM 0 HG LEU A 277 3.875 0.793 8.433 1.00 0.00 H new ATOM 0 HD11 LEU A 277 3.696 2.965 9.582 1.00 0.00 H new ATOM 0 HD12 LEU A 277 4.958 2.985 8.327 1.00 0.00 H new ATOM 0 HD13 LEU A 277 3.386 3.761 8.020 1.00 0.00 H new ATOM 0 HD21 LEU A 277 1.700 1.537 9.324 1.00 0.00 H new ATOM 0 HD22 LEU A 277 1.314 2.278 7.753 1.00 0.00 H new ATOM 0 HD23 LEU A 277 1.506 0.513 7.881 1.00 0.00 H new ATOM 884 N VAL A 278 3.134 1.093 3.506 1.00 0.00 N ATOM 885 CA VAL A 278 3.516 1.190 2.102 1.00 0.00 C ATOM 886 C VAL A 278 3.335 2.611 1.581 1.00 0.00 C ATOM 887 O VAL A 278 2.345 3.276 1.888 1.00 0.00 O ATOM 888 CB VAL A 278 2.691 0.225 1.229 1.00 0.00 C ATOM 889 CG1 VAL A 278 3.081 0.365 -0.235 1.00 0.00 C ATOM 890 CG2 VAL A 278 2.872 -1.209 1.703 1.00 0.00 C ATOM 0 H VAL A 278 2.409 1.751 3.792 1.00 0.00 H new ATOM 0 HA VAL A 278 4.569 0.915 2.039 1.00 0.00 H new ATOM 0 HB VAL A 278 1.637 0.485 1.326 1.00 0.00 H new ATOM 0 HG11 VAL A 278 2.488 -0.324 -0.837 1.00 0.00 H new ATOM 0 HG12 VAL A 278 2.895 1.387 -0.565 1.00 0.00 H new ATOM 0 HG13 VAL A 278 4.139 0.132 -0.353 1.00 0.00 H new ATOM 0 HG21 VAL A 278 2.282 -1.877 1.075 1.00 0.00 H new ATOM 0 HG22 VAL A 278 3.925 -1.484 1.637 1.00 0.00 H new ATOM 0 HG23 VAL A 278 2.539 -1.295 2.737 1.00 0.00 H new ATOM 900 N LYS A 279 4.298 3.072 0.789 1.00 0.00 N ATOM 901 CA LYS A 279 4.246 4.414 0.222 1.00 0.00 C ATOM 902 C LYS A 279 4.230 4.360 -1.302 1.00 0.00 C ATOM 903 O LYS A 279 4.871 3.502 -1.910 1.00 0.00 O ATOM 904 CB LYS A 279 5.442 5.239 0.701 1.00 0.00 C ATOM 905 CG LYS A 279 5.181 6.735 0.719 1.00 0.00 C ATOM 906 CD LYS A 279 5.531 7.378 -0.612 1.00 0.00 C ATOM 907 CE LYS A 279 5.494 8.896 -0.525 1.00 0.00 C ATOM 908 NZ LYS A 279 4.175 9.393 -0.044 1.00 0.00 N ATOM 0 H LYS A 279 5.124 2.535 0.525 1.00 0.00 H new ATOM 0 HA LYS A 279 3.326 4.889 0.561 1.00 0.00 H new ATOM 0 HB2 LYS A 279 5.718 4.915 1.704 1.00 0.00 H new ATOM 0 HB3 LYS A 279 6.295 5.035 0.054 1.00 0.00 H new ATOM 0 HG2 LYS A 279 4.131 6.919 0.948 1.00 0.00 H new ATOM 0 HG3 LYS A 279 5.767 7.198 1.513 1.00 0.00 H new ATOM 0 HD2 LYS A 279 6.524 7.055 -0.923 1.00 0.00 H new ATOM 0 HD3 LYS A 279 4.831 7.039 -1.376 1.00 0.00 H new ATOM 0 HE2 LYS A 279 6.279 9.240 0.148 1.00 0.00 H new ATOM 0 HE3 LYS A 279 5.706 9.321 -1.506 1.00 0.00 H new ATOM 0 HZ1 LYS A 279 3.783 10.062 -0.737 1.00 0.00 H new ATOM 0 HZ2 LYS A 279 3.523 8.591 0.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 279 4.297 9.873 0.870 1.00 0.00 H new ATOM 922 N PHE A 280 3.494 5.282 -1.915 1.00 0.00 N ATOM 923 CA PHE A 280 3.395 5.339 -3.369 1.00 0.00 C ATOM 924 C PHE A 280 3.660 6.754 -3.876 1.00 0.00 C ATOM 925 O PHE A 280 3.592 7.721 -3.117 1.00 0.00 O ATOM 926 CB PHE A 280 2.012 4.872 -3.826 1.00 0.00 C ATOM 927 CG PHE A 280 1.632 3.517 -3.298 1.00 0.00 C ATOM 928 CD1 PHE A 280 1.003 3.389 -2.071 1.00 0.00 C ATOM 929 CD2 PHE A 280 1.906 2.373 -4.030 1.00 0.00 C ATOM 930 CE1 PHE A 280 0.652 2.144 -1.583 1.00 0.00 C ATOM 931 CE2 PHE A 280 1.557 1.126 -3.547 1.00 0.00 C ATOM 932 CZ PHE A 280 0.930 1.011 -2.321 1.00 0.00 C ATOM 0 H PHE A 280 2.958 6.000 -1.427 1.00 0.00 H new ATOM 0 HA PHE A 280 4.151 4.674 -3.787 1.00 0.00 H new ATOM 0 HB2 PHE A 280 1.267 5.600 -3.505 1.00 0.00 H new ATOM 0 HB3 PHE A 280 1.987 4.849 -4.915 1.00 0.00 H new ATOM 0 HD1 PHE A 280 0.784 4.272 -1.489 1.00 0.00 H new ATOM 0 HD2 PHE A 280 2.397 2.457 -4.988 1.00 0.00 H new ATOM 0 HE1 PHE A 280 0.161 2.058 -0.625 1.00 0.00 H new ATOM 0 HE2 PHE A 280 1.774 0.242 -4.128 1.00 0.00 H new ATOM 0 HZ PHE A 280 0.658 0.037 -1.941 1.00 0.00 H new ATOM 942 N LEU A 281 3.962 6.866 -5.165 1.00 0.00 N ATOM 943 CA LEU A 281 4.238 8.162 -5.776 1.00 0.00 C ATOM 944 C LEU A 281 2.944 8.929 -6.033 1.00 0.00 C ATOM 945 O LEU A 281 2.721 9.998 -5.465 1.00 0.00 O ATOM 946 CB LEU A 281 5.005 7.978 -7.086 1.00 0.00 C ATOM 947 CG LEU A 281 6.252 7.096 -7.015 1.00 0.00 C ATOM 948 CD1 LEU A 281 6.630 6.593 -8.400 1.00 0.00 C ATOM 949 CD2 LEU A 281 7.410 7.860 -6.389 1.00 0.00 C ATOM 0 H LEU A 281 4.022 6.076 -5.807 1.00 0.00 H new ATOM 0 HA LEU A 281 4.850 8.740 -5.083 1.00 0.00 H new ATOM 0 HB2 LEU A 281 4.326 7.553 -7.825 1.00 0.00 H new ATOM 0 HB3 LEU A 281 5.300 8.961 -7.452 1.00 0.00 H new ATOM 0 HG LEU A 281 6.029 6.234 -6.386 1.00 0.00 H new ATOM 0 HD11 LEU A 281 7.520 5.967 -8.330 1.00 0.00 H new ATOM 0 HD12 LEU A 281 5.807 6.009 -8.812 1.00 0.00 H new ATOM 0 HD13 LEU A 281 6.835 7.442 -9.052 1.00 0.00 H new ATOM 0 HD21 LEU A 281 8.289 7.217 -6.346 1.00 0.00 H new ATOM 0 HD22 LEU A 281 7.633 8.740 -6.992 1.00 0.00 H new ATOM 0 HD23 LEU A 281 7.138 8.170 -5.380 1.00 0.00 H new ATOM 961 N SER A 282 2.095 8.374 -6.893 1.00 0.00 N ATOM 962 CA SER A 282 0.824 9.006 -7.227 1.00 0.00 C ATOM 963 C SER A 282 -0.322 8.368 -6.448 1.00 0.00 C ATOM 964 O SER A 282 -0.334 7.165 -6.186 1.00 0.00 O ATOM 965 CB SER A 282 0.557 8.899 -8.730 1.00 0.00 C ATOM 966 OG SER A 282 -0.200 10.003 -9.194 1.00 0.00 O ATOM 0 H SER A 282 2.264 7.489 -7.371 1.00 0.00 H new ATOM 0 HA SER A 282 0.886 10.058 -6.950 1.00 0.00 H new ATOM 0 HB2 SER A 282 1.504 8.852 -9.268 1.00 0.00 H new ATOM 0 HB3 SER A 282 0.023 7.973 -8.942 1.00 0.00 H new ATOM 0 HG SER A 282 -0.355 9.911 -10.157 1.00 0.00 H new ATOM 972 N PRO A 283 -1.309 9.193 -6.068 1.00 0.00 N ATOM 973 CA PRO A 283 -2.479 8.732 -5.314 1.00 0.00 C ATOM 974 C PRO A 283 -3.455 7.946 -6.182 1.00 0.00 C ATOM 975 O PRO A 283 -4.451 7.417 -5.688 1.00 0.00 O ATOM 976 CB PRO A 283 -3.122 10.033 -4.829 1.00 0.00 C ATOM 977 CG PRO A 283 -2.723 11.053 -5.838 1.00 0.00 C ATOM 978 CD PRO A 283 -1.360 10.638 -6.346 1.00 0.00 C ATOM 0 HA PRO A 283 -2.203 8.051 -4.509 1.00 0.00 H new ATOM 0 HB2 PRO A 283 -4.206 9.940 -4.768 1.00 0.00 H new ATOM 0 HB3 PRO A 283 -2.769 10.302 -3.833 1.00 0.00 H new ATOM 0 HG2 PRO A 283 -3.445 11.096 -6.653 1.00 0.00 H new ATOM 0 HG3 PRO A 283 -2.686 12.047 -5.392 1.00 0.00 H new ATOM 0 HD2 PRO A 283 -1.249 10.845 -7.410 1.00 0.00 H new ATOM 0 HD3 PRO A 283 -0.561 11.173 -5.832 1.00 0.00 H new ATOM 986 N GLN A 284 -3.164 7.874 -7.477 1.00 0.00 N ATOM 987 CA GLN A 284 -4.017 7.152 -8.413 1.00 0.00 C ATOM 988 C GLN A 284 -3.743 5.653 -8.356 1.00 0.00 C ATOM 989 O GLN A 284 -4.668 4.841 -8.384 1.00 0.00 O ATOM 990 CB GLN A 284 -3.800 7.669 -9.836 1.00 0.00 C ATOM 991 CG GLN A 284 -4.906 7.274 -10.802 1.00 0.00 C ATOM 992 CD GLN A 284 -4.690 7.831 -12.196 1.00 0.00 C ATOM 993 OE1 GLN A 284 -5.099 8.952 -12.499 1.00 0.00 O ATOM 994 NE2 GLN A 284 -4.044 7.048 -13.052 1.00 0.00 N ATOM 0 H GLN A 284 -2.344 8.307 -7.902 1.00 0.00 H new ATOM 0 HA GLN A 284 -5.054 7.323 -8.126 1.00 0.00 H new ATOM 0 HB2 GLN A 284 -3.722 8.756 -9.811 1.00 0.00 H new ATOM 0 HB3 GLN A 284 -2.849 7.290 -10.210 1.00 0.00 H new ATOM 0 HG2 GLN A 284 -4.966 6.187 -10.855 1.00 0.00 H new ATOM 0 HG3 GLN A 284 -5.863 7.628 -10.418 1.00 0.00 H new ATOM 0 HE21 GLN A 284 -3.723 6.126 -12.757 1.00 0.00 H new ATOM 0 HE22 GLN A 284 -3.869 7.369 -14.004 1.00 0.00 H new ATOM 1003 N ASP A 285 -2.466 5.294 -8.276 1.00 0.00 N ATOM 1004 CA ASP A 285 -2.069 3.892 -8.214 1.00 0.00 C ATOM 1005 C ASP A 285 -2.517 3.258 -6.901 1.00 0.00 C ATOM 1006 O ASP A 285 -3.102 2.174 -6.890 1.00 0.00 O ATOM 1007 CB ASP A 285 -0.553 3.762 -8.367 1.00 0.00 C ATOM 1008 CG ASP A 285 -0.106 3.863 -9.812 1.00 0.00 C ATOM 1009 OD1 ASP A 285 -0.092 4.990 -10.351 1.00 0.00 O ATOM 1010 OD2 ASP A 285 0.229 2.816 -10.405 1.00 0.00 O ATOM 0 H ASP A 285 -1.689 5.954 -8.253 1.00 0.00 H new ATOM 0 HA ASP A 285 -2.555 3.365 -9.035 1.00 0.00 H new ATOM 0 HB2 ASP A 285 -0.064 4.542 -7.783 1.00 0.00 H new ATOM 0 HB3 ASP A 285 -0.230 2.806 -7.956 1.00 0.00 H new ATOM 1015 N THR A 286 -2.238 3.940 -5.795 1.00 0.00 N ATOM 1016 CA THR A 286 -2.610 3.443 -4.476 1.00 0.00 C ATOM 1017 C THR A 286 -4.100 3.128 -4.407 1.00 0.00 C ATOM 1018 O THR A 286 -4.504 2.110 -3.845 1.00 0.00 O ATOM 1019 CB THR A 286 -2.259 4.459 -3.373 1.00 0.00 C ATOM 1020 OG1 THR A 286 -2.010 3.777 -2.139 1.00 0.00 O ATOM 1021 CG2 THR A 286 -3.387 5.463 -3.185 1.00 0.00 C ATOM 0 H THR A 286 -1.755 4.839 -5.786 1.00 0.00 H new ATOM 0 HA THR A 286 -2.041 2.528 -4.311 1.00 0.00 H new ATOM 0 HB THR A 286 -1.361 4.997 -3.677 1.00 0.00 H new ATOM 0 HG1 THR A 286 -1.099 3.416 -2.143 1.00 0.00 H new ATOM 0 HG21 THR A 286 -3.117 6.171 -2.401 1.00 0.00 H new ATOM 0 HG22 THR A 286 -3.554 6.001 -4.118 1.00 0.00 H new ATOM 0 HG23 THR A 286 -4.299 4.937 -2.901 1.00 0.00 H new ATOM 1029 N PHE A 287 -4.913 4.008 -4.982 1.00 0.00 N ATOM 1030 CA PHE A 287 -6.359 3.824 -4.985 1.00 0.00 C ATOM 1031 C PHE A 287 -6.722 2.371 -5.278 1.00 0.00 C ATOM 1032 O PHE A 287 -7.746 1.871 -4.814 1.00 0.00 O ATOM 1033 CB PHE A 287 -7.010 4.743 -6.021 1.00 0.00 C ATOM 1034 CG PHE A 287 -8.500 4.854 -5.872 1.00 0.00 C ATOM 1035 CD1 PHE A 287 -9.053 5.636 -4.871 1.00 0.00 C ATOM 1036 CD2 PHE A 287 -9.348 4.177 -6.734 1.00 0.00 C ATOM 1037 CE1 PHE A 287 -10.424 5.739 -4.732 1.00 0.00 C ATOM 1038 CE2 PHE A 287 -10.720 4.277 -6.600 1.00 0.00 C ATOM 1039 CZ PHE A 287 -11.259 5.060 -5.598 1.00 0.00 C ATOM 0 H PHE A 287 -4.595 4.856 -5.452 1.00 0.00 H new ATOM 0 HA PHE A 287 -6.735 4.081 -3.995 1.00 0.00 H new ATOM 0 HB2 PHE A 287 -6.570 5.737 -5.941 1.00 0.00 H new ATOM 0 HB3 PHE A 287 -6.779 4.372 -7.020 1.00 0.00 H new ATOM 0 HD1 PHE A 287 -8.406 6.171 -4.192 1.00 0.00 H new ATOM 0 HD2 PHE A 287 -8.932 3.564 -7.520 1.00 0.00 H new ATOM 0 HE1 PHE A 287 -10.843 6.350 -3.946 1.00 0.00 H new ATOM 0 HE2 PHE A 287 -11.370 3.744 -7.278 1.00 0.00 H new ATOM 0 HZ PHE A 287 -12.331 5.141 -5.492 1.00 0.00 H new ATOM 1049 N GLU A 288 -5.875 1.701 -6.052 1.00 0.00 N ATOM 1050 CA GLU A 288 -6.107 0.306 -6.409 1.00 0.00 C ATOM 1051 C GLU A 288 -5.859 -0.610 -5.214 1.00 0.00 C ATOM 1052 O GLU A 288 -6.610 -1.555 -4.976 1.00 0.00 O ATOM 1053 CB GLU A 288 -5.203 -0.103 -7.574 1.00 0.00 C ATOM 1054 CG GLU A 288 -5.482 0.662 -8.858 1.00 0.00 C ATOM 1055 CD GLU A 288 -6.853 0.359 -9.431 1.00 0.00 C ATOM 1056 OE1 GLU A 288 -7.097 -0.807 -9.804 1.00 0.00 O ATOM 1057 OE2 GLU A 288 -7.682 1.290 -9.506 1.00 0.00 O ATOM 0 H GLU A 288 -5.022 2.101 -6.444 1.00 0.00 H new ATOM 0 HA GLU A 288 -7.149 0.204 -6.713 1.00 0.00 H new ATOM 0 HB2 GLU A 288 -4.163 0.052 -7.287 1.00 0.00 H new ATOM 0 HB3 GLU A 288 -5.327 -1.170 -7.762 1.00 0.00 H new ATOM 0 HG2 GLU A 288 -5.402 1.732 -8.664 1.00 0.00 H new ATOM 0 HG3 GLU A 288 -4.720 0.414 -9.597 1.00 0.00 H new ATOM 1064 N ALA A 289 -4.799 -0.322 -4.465 1.00 0.00 N ATOM 1065 CA ALA A 289 -4.452 -1.117 -3.294 1.00 0.00 C ATOM 1066 C ALA A 289 -5.530 -1.012 -2.220 1.00 0.00 C ATOM 1067 O ALA A 289 -5.951 -2.018 -1.647 1.00 0.00 O ATOM 1068 CB ALA A 289 -3.105 -0.679 -2.738 1.00 0.00 C ATOM 0 H ALA A 289 -4.166 0.456 -4.649 1.00 0.00 H new ATOM 0 HA ALA A 289 -4.383 -2.160 -3.602 1.00 0.00 H new ATOM 0 HB1 ALA A 289 -2.859 -1.282 -1.864 1.00 0.00 H new ATOM 0 HB2 ALA A 289 -2.336 -0.813 -3.499 1.00 0.00 H new ATOM 0 HB3 ALA A 289 -3.154 0.372 -2.452 1.00 0.00 H new ATOM 1074 N LEU A 290 -5.971 0.212 -1.950 1.00 0.00 N ATOM 1075 CA LEU A 290 -7.000 0.449 -0.943 1.00 0.00 C ATOM 1076 C LEU A 290 -8.260 -0.352 -1.252 1.00 0.00 C ATOM 1077 O LEU A 290 -8.945 -0.827 -0.346 1.00 0.00 O ATOM 1078 CB LEU A 290 -7.335 1.940 -0.869 1.00 0.00 C ATOM 1079 CG LEU A 290 -6.187 2.867 -0.469 1.00 0.00 C ATOM 1080 CD1 LEU A 290 -6.584 4.322 -0.663 1.00 0.00 C ATOM 1081 CD2 LEU A 290 -5.773 2.612 0.973 1.00 0.00 C ATOM 0 H LEU A 290 -5.633 1.055 -2.414 1.00 0.00 H new ATOM 0 HA LEU A 290 -6.612 0.122 0.021 1.00 0.00 H new ATOM 0 HB2 LEU A 290 -7.709 2.257 -1.843 1.00 0.00 H new ATOM 0 HB3 LEU A 290 -8.149 2.074 -0.156 1.00 0.00 H new ATOM 0 HG LEU A 290 -5.333 2.656 -1.113 1.00 0.00 H new ATOM 0 HD11 LEU A 290 -5.755 4.967 -0.373 1.00 0.00 H new ATOM 0 HD12 LEU A 290 -6.830 4.495 -1.711 1.00 0.00 H new ATOM 0 HD13 LEU A 290 -7.453 4.548 -0.044 1.00 0.00 H new ATOM 0 HD21 LEU A 290 -4.955 3.281 1.240 1.00 0.00 H new ATOM 0 HD22 LEU A 290 -6.621 2.795 1.633 1.00 0.00 H new ATOM 0 HD23 LEU A 290 -5.446 1.578 1.080 1.00 0.00 H new ATOM 1093 N LYS A 291 -8.559 -0.502 -2.538 1.00 0.00 N ATOM 1094 CA LYS A 291 -9.735 -1.249 -2.969 1.00 0.00 C ATOM 1095 C LYS A 291 -9.543 -2.744 -2.738 1.00 0.00 C ATOM 1096 O LYS A 291 -10.510 -3.506 -2.708 1.00 0.00 O ATOM 1097 CB LYS A 291 -10.019 -0.983 -4.449 1.00 0.00 C ATOM 1098 CG LYS A 291 -10.353 0.468 -4.753 1.00 0.00 C ATOM 1099 CD LYS A 291 -10.065 0.814 -6.205 1.00 0.00 C ATOM 1100 CE LYS A 291 -11.152 0.287 -7.129 1.00 0.00 C ATOM 1101 NZ LYS A 291 -12.443 1.002 -6.931 1.00 0.00 N ATOM 0 H LYS A 291 -8.003 -0.116 -3.301 1.00 0.00 H new ATOM 0 HA LYS A 291 -10.586 -0.914 -2.376 1.00 0.00 H new ATOM 0 HB2 LYS A 291 -9.149 -1.278 -5.036 1.00 0.00 H new ATOM 0 HB3 LYS A 291 -10.848 -1.613 -4.770 1.00 0.00 H new ATOM 0 HG2 LYS A 291 -11.405 0.654 -4.536 1.00 0.00 H new ATOM 0 HG3 LYS A 291 -9.773 1.120 -4.100 1.00 0.00 H new ATOM 0 HD2 LYS A 291 -9.986 1.896 -6.314 1.00 0.00 H new ATOM 0 HD3 LYS A 291 -9.103 0.393 -6.496 1.00 0.00 H new ATOM 0 HE2 LYS A 291 -10.832 0.396 -8.165 1.00 0.00 H new ATOM 0 HE3 LYS A 291 -11.296 -0.779 -6.950 1.00 0.00 H new ATOM 0 HZ1 LYS A 291 -13.044 0.872 -7.770 1.00 0.00 H new ATOM 0 HZ2 LYS A 291 -12.928 0.618 -6.095 1.00 0.00 H new ATOM 0 HZ3 LYS A 291 -12.260 2.016 -6.790 1.00 0.00 H new ATOM 1115 N ARG A 292 -8.291 -3.158 -2.575 1.00 0.00 N ATOM 1116 CA ARG A 292 -7.974 -4.563 -2.347 1.00 0.00 C ATOM 1117 C ARG A 292 -7.934 -4.875 -0.854 1.00 0.00 C ATOM 1118 O ARG A 292 -7.417 -5.912 -0.440 1.00 0.00 O ATOM 1119 CB ARG A 292 -6.631 -4.915 -2.988 1.00 0.00 C ATOM 1120 CG ARG A 292 -6.616 -4.753 -4.499 1.00 0.00 C ATOM 1121 CD ARG A 292 -5.202 -4.820 -5.053 1.00 0.00 C ATOM 1122 NE ARG A 292 -5.188 -5.071 -6.492 1.00 0.00 N ATOM 1123 CZ ARG A 292 -4.103 -5.439 -7.164 1.00 0.00 C ATOM 1124 NH1 ARG A 292 -2.950 -5.598 -6.530 1.00 0.00 N ATOM 1125 NH2 ARG A 292 -4.171 -5.649 -8.472 1.00 0.00 N ATOM 0 H ARG A 292 -7.479 -2.541 -2.597 1.00 0.00 H new ATOM 0 HA ARG A 292 -8.757 -5.166 -2.806 1.00 0.00 H new ATOM 0 HB2 ARG A 292 -5.855 -4.283 -2.556 1.00 0.00 H new ATOM 0 HB3 ARG A 292 -6.378 -5.946 -2.739 1.00 0.00 H new ATOM 0 HG2 ARG A 292 -7.224 -5.534 -4.956 1.00 0.00 H new ATOM 0 HG3 ARG A 292 -7.068 -3.799 -4.768 1.00 0.00 H new ATOM 0 HD2 ARG A 292 -4.686 -3.883 -4.844 1.00 0.00 H new ATOM 0 HD3 ARG A 292 -4.650 -5.609 -4.542 1.00 0.00 H new ATOM 0 HE ARG A 292 -6.060 -4.957 -7.009 1.00 0.00 H new ATOM 0 HH11 ARG A 292 -2.895 -5.438 -5.524 1.00 0.00 H new ATOM 0 HH12 ARG A 292 -2.118 -5.881 -7.048 1.00 0.00 H new ATOM 0 HH21 ARG A 292 -5.057 -5.528 -8.963 1.00 0.00 H new ATOM 0 HH22 ARG A 292 -3.337 -5.932 -8.987 1.00 0.00 H new ATOM 1139 N ASN A 293 -8.484 -3.970 -0.050 1.00 0.00 N ATOM 1140 CA ASN A 293 -8.511 -4.149 1.397 1.00 0.00 C ATOM 1141 C ASN A 293 -9.343 -5.370 1.780 1.00 0.00 C ATOM 1142 O ASN A 293 -10.329 -5.693 1.118 1.00 0.00 O ATOM 1143 CB ASN A 293 -9.077 -2.900 2.076 1.00 0.00 C ATOM 1144 CG ASN A 293 -10.528 -2.652 1.714 1.00 0.00 C ATOM 1145 OD1 ASN A 293 -11.432 -3.006 2.620 1.00 0.00 O flip ATOM 1146 ND2 ASN A 293 -10.833 -2.149 0.633 1.00 0.00 N flip ATOM 0 H ASN A 293 -8.917 -3.106 -0.376 1.00 0.00 H new ATOM 0 HA ASN A 293 -7.488 -4.308 1.737 1.00 0.00 H new ATOM 0 HB2 ASN A 293 -8.988 -3.006 3.157 1.00 0.00 H new ATOM 0 HB3 ASN A 293 -8.481 -2.033 1.791 1.00 0.00 H new ATOM 0 HD21 ASN A 293 -10.105 -1.892 -0.034 1.00 0.00 H new ATOM 0 HD22 ASN A 293 -11.814 -1.989 0.404 1.00 0.00 H new ATOM 1153 N ARG A 294 -8.938 -6.043 2.852 1.00 0.00 N ATOM 1154 CA ARG A 294 -9.645 -7.228 3.322 1.00 0.00 C ATOM 1155 C ARG A 294 -9.572 -8.349 2.290 1.00 0.00 C ATOM 1156 O ARG A 294 -10.560 -9.037 2.036 1.00 0.00 O ATOM 1157 CB ARG A 294 -11.106 -6.890 3.622 1.00 0.00 C ATOM 1158 CG ARG A 294 -11.277 -5.819 4.687 1.00 0.00 C ATOM 1159 CD ARG A 294 -10.873 -6.330 6.061 1.00 0.00 C ATOM 1160 NE ARG A 294 -11.912 -7.161 6.663 1.00 0.00 N ATOM 1161 CZ ARG A 294 -11.991 -8.476 6.495 1.00 0.00 C ATOM 1162 NH1 ARG A 294 -11.096 -9.107 5.747 1.00 0.00 N ATOM 1163 NH2 ARG A 294 -12.966 -9.164 7.076 1.00 0.00 N ATOM 0 H ARG A 294 -8.124 -5.788 3.411 1.00 0.00 H new ATOM 0 HA ARG A 294 -9.163 -7.569 4.238 1.00 0.00 H new ATOM 0 HB2 ARG A 294 -11.589 -6.557 2.703 1.00 0.00 H new ATOM 0 HB3 ARG A 294 -11.621 -7.795 3.943 1.00 0.00 H new ATOM 0 HG2 ARG A 294 -10.673 -4.949 4.429 1.00 0.00 H new ATOM 0 HG3 ARG A 294 -12.316 -5.491 4.711 1.00 0.00 H new ATOM 0 HD2 ARG A 294 -9.951 -6.906 5.977 1.00 0.00 H new ATOM 0 HD3 ARG A 294 -10.661 -5.484 6.715 1.00 0.00 H new ATOM 0 HE ARG A 294 -12.616 -6.706 7.245 1.00 0.00 H new ATOM 0 HH11 ARG A 294 -10.345 -8.582 5.299 1.00 0.00 H new ATOM 0 HH12 ARG A 294 -11.159 -10.117 5.620 1.00 0.00 H new ATOM 0 HH21 ARG A 294 -13.656 -8.683 7.653 1.00 0.00 H new ATOM 0 HH22 ARG A 294 -13.025 -10.174 6.946 1.00 0.00 H new ATOM 1177 N MET A 295 -8.395 -8.527 1.698 1.00 0.00 N ATOM 1178 CA MET A 295 -8.194 -9.566 0.694 1.00 0.00 C ATOM 1179 C MET A 295 -7.374 -10.719 1.263 1.00 0.00 C ATOM 1180 O MET A 295 -6.989 -10.704 2.433 1.00 0.00 O ATOM 1181 CB MET A 295 -7.495 -8.986 -0.537 1.00 0.00 C ATOM 1182 CG MET A 295 -8.456 -8.437 -1.579 1.00 0.00 C ATOM 1183 SD MET A 295 -7.715 -8.331 -3.219 1.00 0.00 S ATOM 1184 CE MET A 295 -9.029 -9.011 -4.229 1.00 0.00 C ATOM 0 H MET A 295 -7.567 -7.966 1.896 1.00 0.00 H new ATOM 0 HA MET A 295 -9.172 -9.949 0.401 1.00 0.00 H new ATOM 0 HB2 MET A 295 -6.821 -8.190 -0.221 1.00 0.00 H new ATOM 0 HB3 MET A 295 -6.880 -9.761 -0.994 1.00 0.00 H new ATOM 0 HG2 MET A 295 -9.339 -9.074 -1.624 1.00 0.00 H new ATOM 0 HG3 MET A 295 -8.792 -7.447 -1.272 1.00 0.00 H new ATOM 0 HE1 MET A 295 -8.721 -9.012 -5.274 1.00 0.00 H new ATOM 0 HE2 MET A 295 -9.241 -10.032 -3.912 1.00 0.00 H new ATOM 0 HE3 MET A 295 -9.926 -8.403 -4.116 1.00 0.00 H new ATOM 1194 N LEU A 296 -7.111 -11.719 0.429 1.00 0.00 N ATOM 1195 CA LEU A 296 -6.337 -12.882 0.849 1.00 0.00 C ATOM 1196 C LEU A 296 -4.870 -12.729 0.459 1.00 0.00 C ATOM 1197 O LEU A 296 -4.543 -12.050 -0.514 1.00 0.00 O ATOM 1198 CB LEU A 296 -6.911 -14.155 0.224 1.00 0.00 C ATOM 1199 CG LEU A 296 -7.991 -14.872 1.035 1.00 0.00 C ATOM 1200 CD1 LEU A 296 -8.514 -16.082 0.276 1.00 0.00 C ATOM 1201 CD2 LEU A 296 -7.449 -15.286 2.396 1.00 0.00 C ATOM 0 H LEU A 296 -7.422 -11.748 -0.542 1.00 0.00 H new ATOM 0 HA LEU A 296 -6.401 -12.957 1.935 1.00 0.00 H new ATOM 0 HB2 LEU A 296 -7.325 -13.902 -0.752 1.00 0.00 H new ATOM 0 HB3 LEU A 296 -6.091 -14.852 0.051 1.00 0.00 H new ATOM 0 HG LEU A 296 -8.820 -14.182 1.191 1.00 0.00 H new ATOM 0 HD11 LEU A 296 -9.282 -16.579 0.869 1.00 0.00 H new ATOM 0 HD12 LEU A 296 -8.941 -15.759 -0.673 1.00 0.00 H new ATOM 0 HD13 LEU A 296 -7.695 -16.776 0.088 1.00 0.00 H new ATOM 0 HD21 LEU A 296 -8.231 -15.795 2.960 1.00 0.00 H new ATOM 0 HD22 LEU A 296 -6.602 -15.959 2.261 1.00 0.00 H new ATOM 0 HD23 LEU A 296 -7.125 -14.401 2.943 1.00 0.00 H new ATOM 1213 N MET A 297 -3.990 -13.366 1.225 1.00 0.00 N ATOM 1214 CA MET A 297 -2.558 -13.303 0.958 1.00 0.00 C ATOM 1215 C MET A 297 -1.824 -14.444 1.656 1.00 0.00 C ATOM 1216 O MET A 297 -1.633 -14.419 2.872 1.00 0.00 O ATOM 1217 CB MET A 297 -1.990 -11.959 1.418 1.00 0.00 C ATOM 1218 CG MET A 297 -0.473 -11.889 1.362 1.00 0.00 C ATOM 1219 SD MET A 297 0.197 -10.543 2.358 1.00 0.00 S ATOM 1220 CE MET A 297 0.532 -9.320 1.092 1.00 0.00 C ATOM 0 H MET A 297 -4.244 -13.931 2.035 1.00 0.00 H new ATOM 0 HA MET A 297 -2.410 -13.403 -0.117 1.00 0.00 H new ATOM 0 HB2 MET A 297 -2.405 -11.166 0.796 1.00 0.00 H new ATOM 0 HB3 MET A 297 -2.317 -11.766 2.440 1.00 0.00 H new ATOM 0 HG2 MET A 297 -0.056 -12.835 1.709 1.00 0.00 H new ATOM 0 HG3 MET A 297 -0.157 -11.762 0.327 1.00 0.00 H new ATOM 0 HE1 MET A 297 1.378 -8.703 1.396 1.00 0.00 H new ATOM 0 HE2 MET A 297 0.768 -9.823 0.154 1.00 0.00 H new ATOM 0 HE3 MET A 297 -0.346 -8.689 0.954 1.00 0.00 H new ATOM 1230 N ILE A 298 -1.415 -15.441 0.880 1.00 0.00 N ATOM 1231 CA ILE A 298 -0.702 -16.590 1.424 1.00 0.00 C ATOM 1232 C ILE A 298 -1.457 -17.198 2.601 1.00 0.00 C ATOM 1233 O ILE A 298 -0.865 -17.516 3.633 1.00 0.00 O ATOM 1234 CB ILE A 298 0.718 -16.205 1.883 1.00 0.00 C ATOM 1235 CG1 ILE A 298 1.396 -15.326 0.831 1.00 0.00 C ATOM 1236 CG2 ILE A 298 1.544 -17.454 2.150 1.00 0.00 C ATOM 1237 CD1 ILE A 298 2.652 -14.646 1.330 1.00 0.00 C ATOM 0 H ILE A 298 -1.565 -15.477 -0.128 1.00 0.00 H new ATOM 0 HA ILE A 298 -0.630 -17.325 0.623 1.00 0.00 H new ATOM 0 HB ILE A 298 0.644 -15.637 2.810 1.00 0.00 H new ATOM 0 HG12 ILE A 298 1.644 -15.937 -0.037 1.00 0.00 H new ATOM 0 HG13 ILE A 298 0.690 -14.566 0.495 1.00 0.00 H new ATOM 0 HG21 ILE A 298 2.544 -17.166 2.473 1.00 0.00 H new ATOM 0 HG22 ILE A 298 1.066 -18.046 2.931 1.00 0.00 H new ATOM 0 HG23 ILE A 298 1.614 -18.046 1.237 1.00 0.00 H new ATOM 0 HD11 ILE A 298 3.079 -14.040 0.531 1.00 0.00 H new ATOM 0 HD12 ILE A 298 2.407 -14.008 2.179 1.00 0.00 H new ATOM 0 HD13 ILE A 298 3.376 -15.400 1.640 1.00 0.00 H new ATOM 1249 N GLN A 299 -2.766 -17.358 2.438 1.00 0.00 N ATOM 1250 CA GLN A 299 -3.601 -17.930 3.487 1.00 0.00 C ATOM 1251 C GLN A 299 -3.714 -16.978 4.673 1.00 0.00 C ATOM 1252 O GLN A 299 -3.949 -17.404 5.804 1.00 0.00 O ATOM 1253 CB GLN A 299 -3.030 -19.272 3.949 1.00 0.00 C ATOM 1254 CG GLN A 299 -2.704 -20.220 2.806 1.00 0.00 C ATOM 1255 CD GLN A 299 -3.873 -21.109 2.432 1.00 0.00 C ATOM 1256 OE1 GLN A 299 -4.460 -21.774 3.286 1.00 0.00 O ATOM 1257 NE2 GLN A 299 -4.219 -21.124 1.150 1.00 0.00 N ATOM 0 H GLN A 299 -3.271 -17.100 1.590 1.00 0.00 H new ATOM 0 HA GLN A 299 -4.598 -18.089 3.075 1.00 0.00 H new ATOM 0 HB2 GLN A 299 -2.125 -19.092 4.530 1.00 0.00 H new ATOM 0 HB3 GLN A 299 -3.747 -19.752 4.615 1.00 0.00 H new ATOM 0 HG2 GLN A 299 -2.400 -19.641 1.934 1.00 0.00 H new ATOM 0 HG3 GLN A 299 -1.855 -20.843 3.087 1.00 0.00 H new ATOM 0 HE21 GLN A 299 -3.704 -20.557 0.476 1.00 0.00 H new ATOM 0 HE22 GLN A 299 -4.999 -21.703 0.839 1.00 0.00 H new ATOM 1266 N ARG A 300 -3.546 -15.687 4.407 1.00 0.00 N ATOM 1267 CA ARG A 300 -3.627 -14.674 5.452 1.00 0.00 C ATOM 1268 C ARG A 300 -4.356 -13.431 4.949 1.00 0.00 C ATOM 1269 O ARG A 300 -4.051 -12.911 3.876 1.00 0.00 O ATOM 1270 CB ARG A 300 -2.226 -14.296 5.936 1.00 0.00 C ATOM 1271 CG ARG A 300 -2.223 -13.227 7.017 1.00 0.00 C ATOM 1272 CD ARG A 300 -2.684 -13.786 8.354 1.00 0.00 C ATOM 1273 NE ARG A 300 -3.192 -12.741 9.238 1.00 0.00 N ATOM 1274 CZ ARG A 300 -3.706 -12.980 10.440 1.00 0.00 C ATOM 1275 NH1 ARG A 300 -3.778 -14.222 10.898 1.00 0.00 N ATOM 1276 NH2 ARG A 300 -4.148 -11.976 11.186 1.00 0.00 N ATOM 0 H ARG A 300 -3.353 -15.318 3.476 1.00 0.00 H new ATOM 0 HA ARG A 300 -4.191 -15.093 6.286 1.00 0.00 H new ATOM 0 HB2 ARG A 300 -1.730 -15.188 6.318 1.00 0.00 H new ATOM 0 HB3 ARG A 300 -1.640 -13.944 5.087 1.00 0.00 H new ATOM 0 HG2 ARG A 300 -1.219 -12.815 7.120 1.00 0.00 H new ATOM 0 HG3 ARG A 300 -2.875 -12.406 6.720 1.00 0.00 H new ATOM 0 HD2 ARG A 300 -3.463 -14.530 8.187 1.00 0.00 H new ATOM 0 HD3 ARG A 300 -1.853 -14.298 8.839 1.00 0.00 H new ATOM 0 HE ARG A 300 -3.150 -11.774 8.915 1.00 0.00 H new ATOM 0 HH11 ARG A 300 -3.438 -14.996 10.328 1.00 0.00 H new ATOM 0 HH12 ARG A 300 -4.173 -14.403 11.821 1.00 0.00 H new ATOM 0 HH21 ARG A 300 -4.094 -11.019 10.837 1.00 0.00 H new ATOM 0 HH22 ARG A 300 -4.542 -12.161 12.108 1.00 0.00 H new ATOM 1290 N TYR A 301 -5.321 -12.960 5.732 1.00 0.00 N ATOM 1291 CA TYR A 301 -6.095 -11.780 5.365 1.00 0.00 C ATOM 1292 C TYR A 301 -5.314 -10.503 5.657 1.00 0.00 C ATOM 1293 O TYR A 301 -4.773 -10.328 6.749 1.00 0.00 O ATOM 1294 CB TYR A 301 -7.425 -11.762 6.121 1.00 0.00 C ATOM 1295 CG TYR A 301 -8.318 -12.940 5.804 1.00 0.00 C ATOM 1296 CD1 TYR A 301 -9.105 -12.952 4.659 1.00 0.00 C ATOM 1297 CD2 TYR A 301 -8.374 -14.042 6.649 1.00 0.00 C ATOM 1298 CE1 TYR A 301 -9.923 -14.025 4.366 1.00 0.00 C ATOM 1299 CE2 TYR A 301 -9.188 -15.121 6.362 1.00 0.00 C ATOM 1300 CZ TYR A 301 -9.961 -15.107 5.220 1.00 0.00 C ATOM 1301 OH TYR A 301 -10.774 -16.180 4.931 1.00 0.00 O ATOM 0 H TYR A 301 -5.586 -13.377 6.624 1.00 0.00 H new ATOM 0 HA TYR A 301 -6.293 -11.826 4.294 1.00 0.00 H new ATOM 0 HB2 TYR A 301 -7.224 -11.747 7.192 1.00 0.00 H new ATOM 0 HB3 TYR A 301 -7.956 -10.840 5.883 1.00 0.00 H new ATOM 0 HD1 TYR A 301 -9.076 -12.107 3.987 1.00 0.00 H new ATOM 0 HD2 TYR A 301 -7.771 -14.055 7.545 1.00 0.00 H new ATOM 0 HE1 TYR A 301 -10.530 -14.017 3.473 1.00 0.00 H new ATOM 0 HE2 TYR A 301 -9.219 -15.970 7.028 1.00 0.00 H new ATOM 0 HH TYR A 301 -10.683 -16.858 5.633 1.00 0.00 H new ATOM 1311 N VAL A 302 -5.259 -9.612 4.672 1.00 0.00 N ATOM 1312 CA VAL A 302 -4.546 -8.350 4.822 1.00 0.00 C ATOM 1313 C VAL A 302 -5.517 -7.180 4.938 1.00 0.00 C ATOM 1314 O VAL A 302 -6.564 -7.165 4.292 1.00 0.00 O ATOM 1315 CB VAL A 302 -3.595 -8.098 3.637 1.00 0.00 C ATOM 1316 CG1 VAL A 302 -2.363 -8.984 3.743 1.00 0.00 C ATOM 1317 CG2 VAL A 302 -4.316 -8.329 2.317 1.00 0.00 C ATOM 0 H VAL A 302 -5.700 -9.741 3.761 1.00 0.00 H new ATOM 0 HA VAL A 302 -3.961 -8.425 5.738 1.00 0.00 H new ATOM 0 HB VAL A 302 -3.269 -7.058 3.670 1.00 0.00 H new ATOM 0 HG11 VAL A 302 -1.703 -8.792 2.897 1.00 0.00 H new ATOM 0 HG12 VAL A 302 -1.836 -8.765 4.672 1.00 0.00 H new ATOM 0 HG13 VAL A 302 -2.666 -10.031 3.736 1.00 0.00 H new ATOM 0 HG21 VAL A 302 -3.629 -8.146 1.490 1.00 0.00 H new ATOM 0 HG22 VAL A 302 -4.672 -9.358 2.272 1.00 0.00 H new ATOM 0 HG23 VAL A 302 -5.164 -7.648 2.241 1.00 0.00 H new ATOM 1327 N GLU A 303 -5.161 -6.202 5.765 1.00 0.00 N ATOM 1328 CA GLU A 303 -6.003 -5.028 5.965 1.00 0.00 C ATOM 1329 C GLU A 303 -5.348 -3.783 5.375 1.00 0.00 C ATOM 1330 O GLU A 303 -4.497 -3.156 6.006 1.00 0.00 O ATOM 1331 CB GLU A 303 -6.275 -4.817 7.456 1.00 0.00 C ATOM 1332 CG GLU A 303 -7.619 -4.168 7.743 1.00 0.00 C ATOM 1333 CD GLU A 303 -7.881 -4.000 9.227 1.00 0.00 C ATOM 1334 OE1 GLU A 303 -6.900 -3.918 9.996 1.00 0.00 O ATOM 1335 OE2 GLU A 303 -9.065 -3.951 9.619 1.00 0.00 O ATOM 0 H GLU A 303 -4.297 -6.199 6.307 1.00 0.00 H new ATOM 0 HA GLU A 303 -6.949 -5.198 5.451 1.00 0.00 H new ATOM 0 HB2 GLU A 303 -6.230 -5.780 7.965 1.00 0.00 H new ATOM 0 HB3 GLU A 303 -5.484 -4.196 7.877 1.00 0.00 H new ATOM 0 HG2 GLU A 303 -7.658 -3.192 7.258 1.00 0.00 H new ATOM 0 HG3 GLU A 303 -8.412 -4.774 7.304 1.00 0.00 H new ATOM 1342 N VAL A 304 -5.751 -3.429 4.158 1.00 0.00 N ATOM 1343 CA VAL A 304 -5.205 -2.259 3.482 1.00 0.00 C ATOM 1344 C VAL A 304 -6.077 -1.031 3.718 1.00 0.00 C ATOM 1345 O VAL A 304 -7.247 -1.004 3.335 1.00 0.00 O ATOM 1346 CB VAL A 304 -5.074 -2.497 1.966 1.00 0.00 C ATOM 1347 CG1 VAL A 304 -4.320 -1.351 1.308 1.00 0.00 C ATOM 1348 CG2 VAL A 304 -4.383 -3.826 1.694 1.00 0.00 C ATOM 0 H VAL A 304 -6.454 -3.936 3.621 1.00 0.00 H new ATOM 0 HA VAL A 304 -4.215 -2.084 3.902 1.00 0.00 H new ATOM 0 HB VAL A 304 -6.074 -2.537 1.534 1.00 0.00 H new ATOM 0 HG11 VAL A 304 -4.237 -1.537 0.237 1.00 0.00 H new ATOM 0 HG12 VAL A 304 -4.859 -0.418 1.474 1.00 0.00 H new ATOM 0 HG13 VAL A 304 -3.323 -1.276 1.741 1.00 0.00 H new ATOM 0 HG21 VAL A 304 -4.298 -3.979 0.618 1.00 0.00 H new ATOM 0 HG22 VAL A 304 -3.388 -3.816 2.138 1.00 0.00 H new ATOM 0 HG23 VAL A 304 -4.967 -4.636 2.131 1.00 0.00 H new ATOM 1358 N SER A 305 -5.500 -0.015 4.351 1.00 0.00 N ATOM 1359 CA SER A 305 -6.225 1.216 4.642 1.00 0.00 C ATOM 1360 C SER A 305 -5.266 2.397 4.759 1.00 0.00 C ATOM 1361 O SER A 305 -4.089 2.244 5.086 1.00 0.00 O ATOM 1362 CB SER A 305 -7.028 1.067 5.935 1.00 0.00 C ATOM 1363 OG SER A 305 -7.952 -0.004 5.841 1.00 0.00 O ATOM 0 H SER A 305 -4.532 -0.020 4.672 1.00 0.00 H new ATOM 0 HA SER A 305 -6.911 1.408 3.817 1.00 0.00 H new ATOM 0 HB2 SER A 305 -6.349 0.894 6.770 1.00 0.00 H new ATOM 0 HB3 SER A 305 -7.561 1.994 6.145 1.00 0.00 H new ATOM 0 HG SER A 305 -8.452 -0.080 6.681 1.00 0.00 H new ATOM 1369 N PRO A 306 -5.781 3.605 4.485 1.00 0.00 N ATOM 1370 CA PRO A 306 -4.988 4.837 4.552 1.00 0.00 C ATOM 1371 C PRO A 306 -4.275 4.994 5.891 1.00 0.00 C ATOM 1372 O PRO A 306 -4.756 4.521 6.920 1.00 0.00 O ATOM 1373 CB PRO A 306 -6.033 5.941 4.370 1.00 0.00 C ATOM 1374 CG PRO A 306 -7.135 5.296 3.602 1.00 0.00 C ATOM 1375 CD PRO A 306 -7.175 3.862 4.088 1.00 0.00 C ATOM 0 HA PRO A 306 -4.195 4.854 3.804 1.00 0.00 H new ATOM 0 HB2 PRO A 306 -6.386 6.314 5.331 1.00 0.00 H new ATOM 0 HB3 PRO A 306 -5.619 6.793 3.830 1.00 0.00 H new ATOM 0 HG2 PRO A 306 -8.086 5.799 3.781 1.00 0.00 H new ATOM 0 HG3 PRO A 306 -6.947 5.343 2.529 1.00 0.00 H new ATOM 0 HD2 PRO A 306 -7.862 3.739 4.925 1.00 0.00 H new ATOM 0 HD3 PRO A 306 -7.503 3.180 3.304 1.00 0.00 H new ATOM 1383 N ALA A 307 -3.127 5.662 5.869 1.00 0.00 N ATOM 1384 CA ALA A 307 -2.349 5.884 7.082 1.00 0.00 C ATOM 1385 C ALA A 307 -1.991 7.358 7.243 1.00 0.00 C ATOM 1386 O ALA A 307 -2.399 8.198 6.440 1.00 0.00 O ATOM 1387 CB ALA A 307 -1.088 5.032 7.064 1.00 0.00 C ATOM 0 H ALA A 307 -2.715 6.059 5.025 1.00 0.00 H new ATOM 0 HA ALA A 307 -2.961 5.590 7.935 1.00 0.00 H new ATOM 0 HB1 ALA A 307 -0.517 5.208 7.976 1.00 0.00 H new ATOM 0 HB2 ALA A 307 -1.361 3.979 7.005 1.00 0.00 H new ATOM 0 HB3 ALA A 307 -0.481 5.298 6.199 1.00 0.00 H new ATOM 1393 N THR A 308 -1.227 7.666 8.286 1.00 0.00 N ATOM 1394 CA THR A 308 -0.817 9.039 8.554 1.00 0.00 C ATOM 1395 C THR A 308 0.670 9.114 8.882 1.00 0.00 C ATOM 1396 O THR A 308 1.208 8.243 9.564 1.00 0.00 O ATOM 1397 CB THR A 308 -1.620 9.649 9.718 1.00 0.00 C ATOM 1398 OG1 THR A 308 -1.668 8.730 10.815 1.00 0.00 O ATOM 1399 CG2 THR A 308 -3.034 9.995 9.277 1.00 0.00 C ATOM 0 H THR A 308 -0.879 6.983 8.959 1.00 0.00 H new ATOM 0 HA THR A 308 -1.016 9.611 7.648 1.00 0.00 H new ATOM 0 HB THR A 308 -1.121 10.565 10.034 1.00 0.00 H new ATOM 0 HG1 THR A 308 -2.179 9.126 11.552 1.00 0.00 H new ATOM 0 HG21 THR A 308 -3.582 10.424 10.116 1.00 0.00 H new ATOM 0 HG22 THR A 308 -2.994 10.717 8.462 1.00 0.00 H new ATOM 0 HG23 THR A 308 -3.540 9.092 8.937 1.00 0.00 H new ATOM 1407 N GLU A 309 1.327 10.161 8.394 1.00 0.00 N ATOM 1408 CA GLU A 309 2.753 10.348 8.637 1.00 0.00 C ATOM 1409 C GLU A 309 3.121 9.938 10.059 1.00 0.00 C ATOM 1410 O GLU A 309 4.116 9.248 10.280 1.00 0.00 O ATOM 1411 CB GLU A 309 3.147 11.807 8.397 1.00 0.00 C ATOM 1412 CG GLU A 309 4.613 12.095 8.673 1.00 0.00 C ATOM 1413 CD GLU A 309 5.080 13.394 8.046 1.00 0.00 C ATOM 1414 OE1 GLU A 309 5.240 13.432 6.808 1.00 0.00 O ATOM 1415 OE2 GLU A 309 5.286 14.373 8.794 1.00 0.00 O ATOM 0 H GLU A 309 0.896 10.892 7.829 1.00 0.00 H new ATOM 0 HA GLU A 309 3.300 9.712 7.941 1.00 0.00 H new ATOM 0 HB2 GLU A 309 2.922 12.070 7.363 1.00 0.00 H new ATOM 0 HB3 GLU A 309 2.534 12.449 9.030 1.00 0.00 H new ATOM 0 HG2 GLU A 309 4.775 12.137 9.750 1.00 0.00 H new ATOM 0 HG3 GLU A 309 5.219 11.273 8.292 1.00 0.00 H new ATOM 1422 N ARG A 310 2.311 10.368 11.021 1.00 0.00 N ATOM 1423 CA ARG A 310 2.552 10.047 12.423 1.00 0.00 C ATOM 1424 C ARG A 310 2.884 8.568 12.593 1.00 0.00 C ATOM 1425 O ARG A 310 3.941 8.216 13.117 1.00 0.00 O ATOM 1426 CB ARG A 310 1.328 10.406 13.268 1.00 0.00 C ATOM 1427 CG ARG A 310 1.039 11.898 13.318 1.00 0.00 C ATOM 1428 CD ARG A 310 0.373 12.292 14.627 1.00 0.00 C ATOM 1429 NE ARG A 310 1.350 12.617 15.663 1.00 0.00 N ATOM 1430 CZ ARG A 310 1.057 12.680 16.957 1.00 0.00 C ATOM 1431 NH1 ARG A 310 -0.179 12.441 17.372 1.00 0.00 N ATOM 1432 NH2 ARG A 310 2.001 12.981 17.839 1.00 0.00 N ATOM 0 H ARG A 310 1.482 10.939 10.855 1.00 0.00 H new ATOM 0 HA ARG A 310 3.405 10.635 12.763 1.00 0.00 H new ATOM 0 HB2 ARG A 310 0.456 9.889 12.868 1.00 0.00 H new ATOM 0 HB3 ARG A 310 1.478 10.039 14.283 1.00 0.00 H new ATOM 0 HG2 ARG A 310 1.969 12.454 13.200 1.00 0.00 H new ATOM 0 HG3 ARG A 310 0.395 12.173 12.483 1.00 0.00 H new ATOM 0 HD2 ARG A 310 -0.276 13.151 14.459 1.00 0.00 H new ATOM 0 HD3 ARG A 310 -0.262 11.475 14.971 1.00 0.00 H new ATOM 0 HE ARG A 310 2.311 12.806 15.377 1.00 0.00 H new ATOM 0 HH11 ARG A 310 -0.907 12.208 16.697 1.00 0.00 H new ATOM 0 HH12 ARG A 310 -0.402 12.490 18.366 1.00 0.00 H new ATOM 0 HH21 ARG A 310 2.954 13.165 17.524 1.00 0.00 H new ATOM 0 HH22 ARG A 310 1.774 13.029 18.832 1.00 0.00 H new ATOM 1446 N GLN A 311 1.975 7.707 12.147 1.00 0.00 N ATOM 1447 CA GLN A 311 2.171 6.266 12.252 1.00 0.00 C ATOM 1448 C GLN A 311 3.461 5.841 11.556 1.00 0.00 C ATOM 1449 O GLN A 311 4.240 5.058 12.098 1.00 0.00 O ATOM 1450 CB GLN A 311 0.981 5.522 11.644 1.00 0.00 C ATOM 1451 CG GLN A 311 -0.312 5.707 12.421 1.00 0.00 C ATOM 1452 CD GLN A 311 -1.322 4.611 12.142 1.00 0.00 C ATOM 1453 OE1 GLN A 311 -1.169 3.836 11.197 1.00 0.00 O ATOM 1454 NE2 GLN A 311 -2.363 4.541 12.963 1.00 0.00 N ATOM 0 H GLN A 311 1.096 7.982 11.710 1.00 0.00 H new ATOM 0 HA GLN A 311 2.248 6.011 13.309 1.00 0.00 H new ATOM 0 HB2 GLN A 311 0.833 5.866 10.620 1.00 0.00 H new ATOM 0 HB3 GLN A 311 1.215 4.459 11.592 1.00 0.00 H new ATOM 0 HG2 GLN A 311 -0.090 5.729 13.488 1.00 0.00 H new ATOM 0 HG3 GLN A 311 -0.749 6.672 12.167 1.00 0.00 H new ATOM 0 HE21 GLN A 311 -2.450 5.204 13.734 1.00 0.00 H new ATOM 0 HE22 GLN A 311 -3.075 3.825 12.823 1.00 0.00 H new ATOM 1463 N TRP A 312 3.677 6.362 10.354 1.00 0.00 N ATOM 1464 CA TRP A 312 4.872 6.036 9.584 1.00 0.00 C ATOM 1465 C TRP A 312 6.134 6.295 10.401 1.00 0.00 C ATOM 1466 O TRP A 312 6.976 5.411 10.557 1.00 0.00 O ATOM 1467 CB TRP A 312 4.910 6.852 8.291 1.00 0.00 C ATOM 1468 CG TRP A 312 6.034 6.467 7.378 1.00 0.00 C ATOM 1469 CD1 TRP A 312 7.284 7.014 7.340 1.00 0.00 C ATOM 1470 CD2 TRP A 312 6.007 5.451 6.368 1.00 0.00 C ATOM 1471 NE1 TRP A 312 8.037 6.400 6.368 1.00 0.00 N ATOM 1472 CE2 TRP A 312 7.277 5.437 5.759 1.00 0.00 C ATOM 1473 CE3 TRP A 312 5.036 4.551 5.922 1.00 0.00 C ATOM 1474 CZ2 TRP A 312 7.597 4.559 4.726 1.00 0.00 C ATOM 1475 CZ3 TRP A 312 5.355 3.681 4.898 1.00 0.00 C ATOM 1476 CH2 TRP A 312 6.627 3.689 4.309 1.00 0.00 C ATOM 0 H TRP A 312 3.041 7.012 9.891 1.00 0.00 H new ATOM 0 HA TRP A 312 4.835 4.976 9.334 1.00 0.00 H new ATOM 0 HB2 TRP A 312 3.964 6.728 7.764 1.00 0.00 H new ATOM 0 HB3 TRP A 312 5.000 7.909 8.540 1.00 0.00 H new ATOM 0 HD1 TRP A 312 7.630 7.812 7.980 1.00 0.00 H new ATOM 0 HE1 TRP A 312 9.005 6.625 6.138 1.00 0.00 H new ATOM 0 HE3 TRP A 312 4.053 4.536 6.370 1.00 0.00 H new ATOM 0 HZ2 TRP A 312 8.576 4.565 4.270 1.00 0.00 H new ATOM 0 HZ3 TRP A 312 4.611 2.982 4.545 1.00 0.00 H new ATOM 0 HH2 TRP A 312 6.845 2.995 3.511 1.00 0.00 H new ATOM 1487 N VAL A 313 6.258 7.512 10.920 1.00 0.00 N ATOM 1488 CA VAL A 313 7.416 7.886 11.722 1.00 0.00 C ATOM 1489 C VAL A 313 7.578 6.958 12.920 1.00 0.00 C ATOM 1490 O VAL A 313 8.621 6.328 13.094 1.00 0.00 O ATOM 1491 CB VAL A 313 7.306 9.339 12.223 1.00 0.00 C ATOM 1492 CG1 VAL A 313 8.499 9.694 13.098 1.00 0.00 C ATOM 1493 CG2 VAL A 313 7.192 10.300 11.049 1.00 0.00 C ATOM 0 H VAL A 313 5.571 8.256 10.799 1.00 0.00 H new ATOM 0 HA VAL A 313 8.290 7.797 11.077 1.00 0.00 H new ATOM 0 HB VAL A 313 6.403 9.429 12.827 1.00 0.00 H new ATOM 0 HG11 VAL A 313 8.404 10.724 13.442 1.00 0.00 H new ATOM 0 HG12 VAL A 313 8.531 9.025 13.958 1.00 0.00 H new ATOM 0 HG13 VAL A 313 9.418 9.588 12.521 1.00 0.00 H new ATOM 0 HG21 VAL A 313 7.115 11.322 11.421 1.00 0.00 H new ATOM 0 HG22 VAL A 313 8.076 10.209 10.417 1.00 0.00 H new ATOM 0 HG23 VAL A 313 6.303 10.058 10.466 1.00 0.00 H new ATOM 1503 N ALA A 314 6.539 6.879 13.745 1.00 0.00 N ATOM 1504 CA ALA A 314 6.565 6.025 14.926 1.00 0.00 C ATOM 1505 C ALA A 314 7.001 4.608 14.570 1.00 0.00 C ATOM 1506 O ALA A 314 7.908 4.054 15.191 1.00 0.00 O ATOM 1507 CB ALA A 314 5.197 6.006 15.594 1.00 0.00 C ATOM 0 H ALA A 314 5.669 7.396 13.617 1.00 0.00 H new ATOM 0 HA ALA A 314 7.293 6.436 15.625 1.00 0.00 H new ATOM 0 HB1 ALA A 314 5.231 5.364 16.474 1.00 0.00 H new ATOM 0 HB2 ALA A 314 4.924 7.018 15.893 1.00 0.00 H new ATOM 0 HB3 ALA A 314 4.455 5.622 14.894 1.00 0.00 H new ATOM 1513 N ALA A 315 6.350 4.027 13.568 1.00 0.00 N ATOM 1514 CA ALA A 315 6.672 2.675 13.130 1.00 0.00 C ATOM 1515 C ALA A 315 8.171 2.515 12.900 1.00 0.00 C ATOM 1516 O ALA A 315 8.762 1.504 13.275 1.00 0.00 O ATOM 1517 CB ALA A 315 5.903 2.334 11.862 1.00 0.00 C ATOM 0 H ALA A 315 5.596 4.472 13.044 1.00 0.00 H new ATOM 0 HA ALA A 315 6.376 1.984 13.919 1.00 0.00 H new ATOM 0 HB1 ALA A 315 6.153 1.321 11.546 1.00 0.00 H new ATOM 0 HB2 ALA A 315 4.833 2.399 12.057 1.00 0.00 H new ATOM 0 HB3 ALA A 315 6.172 3.037 11.073 1.00 0.00 H new ATOM 1523 N GLY A 316 8.781 3.521 12.280 1.00 0.00 N ATOM 1524 CA GLY A 316 10.206 3.472 12.010 1.00 0.00 C ATOM 1525 C GLY A 316 10.517 3.510 10.526 1.00 0.00 C ATOM 1526 O GLY A 316 11.420 2.820 10.057 1.00 0.00 O ATOM 0 H GLY A 316 8.313 4.369 11.960 1.00 0.00 H new ATOM 0 HA2 GLY A 316 10.695 4.313 12.502 1.00 0.00 H new ATOM 0 HA3 GLY A 316 10.624 2.563 12.442 1.00 0.00 H new