USER MOD reduce.3.24.130724 H: found=0, std=0, add=626, rem=0, adj=13 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 180:sc= 0 USER MOD Set 1.2: A 239 HIS : no HD1:sc= -0.0251 K(o=-0.025,f=-0.93) USER MOD Set 1.3: A 305 SER OG : rot 180:sc= 0 USER MOD Single : A 235 TYR OH : rot 180:sc= 0 USER MOD Single : A 241 MET CE :methyl -157:sc= -1.17 (180deg=-2.31!) 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= -0.206 K(o=-0.21,f=-1.5) USER MOD Single : A 255 HIS : no HD1:sc= 0 X(o=0,f=-0.0044) USER MOD Single : A 263 HIS : no HD1:sc= -1.58! C(o=-1.6!,f=-5.7!) USER MOD Single : A 266 LYS NZ :NH3+ -108:sc= -0.989 (180deg=-2.42!) USER MOD Single : A 275 ASN : amide:sc= -2.84 K(o=-2.8,f=-4.6!) USER MOD Single : A 279 LYS NZ :NH3+ -130:sc= -1.06 (180deg=-2.7!) USER MOD Single : A 282 SER OG : rot 180:sc= 0 USER MOD Single : A 284 GLN : amide:sc= 0 X(o=0,f=-0.5) USER MOD Single : A 286 THR OG1 : rot 107:sc= 1.71 USER MOD Single : A 291 LYS NZ :NH3+ -159:sc= -1.38! (180deg=-2.68!) USER MOD Single : A 293 ASN : amide:sc= -0.266 K(o=-0.27,f=-2.1) USER MOD Single : A 295 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 297 MET CE :methyl -127:sc= -2.57! (180deg=-6.74!) USER MOD Single : A 299 GLN : amide:sc= -0.111 K(o=-0.11,f=-2!) USER MOD Single : A 301 TYR OH : rot 180:sc= 0 USER MOD Single : A 308 THR OG1 : rot 180:sc= -0.0415 USER MOD Single : A 311 GLN : amide:sc= -0.134 K(o=-0.13,f=-3.3!) USER MOD ----------------------------------------------------------------- ATOM 168 N PRO A 231 -0.992 13.344 -0.111 1.00 0.00 N ATOM 169 CA PRO A 231 0.084 12.613 0.565 1.00 0.00 C ATOM 170 C PRO A 231 -0.444 11.492 1.453 1.00 0.00 C ATOM 171 O PRO A 231 -0.103 10.324 1.264 1.00 0.00 O ATOM 172 CB PRO A 231 0.767 13.690 1.412 1.00 0.00 C ATOM 173 CG PRO A 231 0.518 14.963 0.679 1.00 0.00 C ATOM 174 CD PRO A 231 -0.763 14.799 -0.110 1.00 0.00 C ATOM 0 HA PRO A 231 0.751 12.122 -0.144 1.00 0.00 H new ATOM 0 HB2 PRO A 231 0.351 13.725 2.419 1.00 0.00 H new ATOM 0 HB3 PRO A 231 1.834 13.495 1.515 1.00 0.00 H new ATOM 0 HG2 PRO A 231 0.433 15.796 1.377 1.00 0.00 H new ATOM 0 HG3 PRO A 231 1.351 15.190 0.013 1.00 0.00 H new ATOM 0 HD2 PRO A 231 -1.591 15.334 0.356 1.00 0.00 H new ATOM 0 HD3 PRO A 231 -0.661 15.189 -1.123 1.00 0.00 H new ATOM 182 N ASP A 232 -1.279 11.854 2.421 1.00 0.00 N ATOM 183 CA ASP A 232 -1.856 10.878 3.337 1.00 0.00 C ATOM 184 C ASP A 232 -2.341 9.644 2.583 1.00 0.00 C ATOM 185 O ASP A 232 -2.234 8.521 3.076 1.00 0.00 O ATOM 186 CB ASP A 232 -3.015 11.502 4.117 1.00 0.00 C ATOM 187 CG ASP A 232 -3.167 10.906 5.503 1.00 0.00 C ATOM 188 OD1 ASP A 232 -2.514 11.411 6.440 1.00 0.00 O ATOM 189 OD2 ASP A 232 -3.938 9.935 5.650 1.00 0.00 O ATOM 0 H ASP A 232 -1.571 12.816 2.591 1.00 0.00 H new ATOM 0 HA ASP A 232 -1.079 10.571 4.038 1.00 0.00 H new ATOM 0 HB2 ASP A 232 -2.855 12.577 4.202 1.00 0.00 H new ATOM 0 HB3 ASP A 232 -3.941 11.361 3.560 1.00 0.00 H new ATOM 194 N ASP A 233 -2.874 9.861 1.385 1.00 0.00 N ATOM 195 CA ASP A 233 -3.375 8.766 0.562 1.00 0.00 C ATOM 196 C ASP A 233 -2.237 7.849 0.127 1.00 0.00 C ATOM 197 O ASP A 233 -2.388 6.626 0.098 1.00 0.00 O ATOM 198 CB ASP A 233 -4.102 9.316 -0.666 1.00 0.00 C ATOM 199 CG ASP A 233 -5.149 8.356 -1.197 1.00 0.00 C ATOM 200 OD1 ASP A 233 -5.570 7.458 -0.438 1.00 0.00 O ATOM 201 OD2 ASP A 233 -5.547 8.503 -2.371 1.00 0.00 O ATOM 0 H ASP A 233 -2.970 10.784 0.963 1.00 0.00 H new ATOM 0 HA ASP A 233 -4.077 8.185 1.160 1.00 0.00 H new ATOM 0 HB2 ASP A 233 -4.578 10.262 -0.409 1.00 0.00 H new ATOM 0 HB3 ASP A 233 -3.375 9.527 -1.451 1.00 0.00 H new ATOM 206 N LEU A 234 -1.100 8.445 -0.212 1.00 0.00 N ATOM 207 CA LEU A 234 0.064 7.681 -0.647 1.00 0.00 C ATOM 208 C LEU A 234 0.587 6.795 0.479 1.00 0.00 C ATOM 209 O LEU A 234 1.224 5.771 0.233 1.00 0.00 O ATOM 210 CB LEU A 234 1.170 8.626 -1.123 1.00 0.00 C ATOM 211 CG LEU A 234 0.731 9.759 -2.051 1.00 0.00 C ATOM 212 CD1 LEU A 234 1.807 10.830 -2.132 1.00 0.00 C ATOM 213 CD2 LEU A 234 0.408 9.219 -3.437 1.00 0.00 C ATOM 0 H LEU A 234 -0.959 9.455 -0.194 1.00 0.00 H new ATOM 0 HA LEU A 234 -0.241 7.041 -1.475 1.00 0.00 H new ATOM 0 HB2 LEU A 234 1.647 9.065 -0.247 1.00 0.00 H new ATOM 0 HB3 LEU A 234 1.929 8.036 -1.637 1.00 0.00 H new ATOM 0 HG LEU A 234 -0.172 10.210 -1.639 1.00 0.00 H new ATOM 0 HD11 LEU A 234 1.477 11.628 -2.797 1.00 0.00 H new ATOM 0 HD12 LEU A 234 1.990 11.238 -1.138 1.00 0.00 H new ATOM 0 HD13 LEU A 234 2.727 10.393 -2.519 1.00 0.00 H new ATOM 0 HD21 LEU A 234 0.097 10.039 -4.084 1.00 0.00 H new ATOM 0 HD22 LEU A 234 1.293 8.741 -3.857 1.00 0.00 H new ATOM 0 HD23 LEU A 234 -0.398 8.489 -3.364 1.00 0.00 H new ATOM 225 N TYR A 235 0.311 7.195 1.716 1.00 0.00 N ATOM 226 CA TYR A 235 0.753 6.438 2.880 1.00 0.00 C ATOM 227 C TYR A 235 -0.378 5.576 3.431 1.00 0.00 C ATOM 228 O TYR A 235 -1.344 6.086 3.999 1.00 0.00 O ATOM 229 CB TYR A 235 1.262 7.386 3.968 1.00 0.00 C ATOM 230 CG TYR A 235 2.600 8.013 3.647 1.00 0.00 C ATOM 231 CD1 TYR A 235 3.767 7.259 3.673 1.00 0.00 C ATOM 232 CD2 TYR A 235 2.698 9.360 3.318 1.00 0.00 C ATOM 233 CE1 TYR A 235 4.992 7.827 3.381 1.00 0.00 C ATOM 234 CE2 TYR A 235 3.918 9.936 3.024 1.00 0.00 C ATOM 235 CZ TYR A 235 5.062 9.166 3.056 1.00 0.00 C ATOM 236 OH TYR A 235 6.280 9.737 2.765 1.00 0.00 O ATOM 0 H TYR A 235 -0.217 8.039 1.937 1.00 0.00 H new ATOM 0 HA TYR A 235 1.566 5.783 2.568 1.00 0.00 H new ATOM 0 HB2 TYR A 235 0.527 8.176 4.122 1.00 0.00 H new ATOM 0 HB3 TYR A 235 1.343 6.838 4.907 1.00 0.00 H new ATOM 0 HD1 TYR A 235 3.715 6.210 3.926 1.00 0.00 H new ATOM 0 HD2 TYR A 235 1.805 9.966 3.292 1.00 0.00 H new ATOM 0 HE1 TYR A 235 5.889 7.227 3.407 1.00 0.00 H new ATOM 0 HE2 TYR A 235 3.976 10.984 2.770 1.00 0.00 H new ATOM 0 HH TYR A 235 6.155 10.686 2.556 1.00 0.00 H new ATOM 246 N VAL A 236 -0.251 4.264 3.259 1.00 0.00 N ATOM 247 CA VAL A 236 -1.260 3.328 3.740 1.00 0.00 C ATOM 248 C VAL A 236 -0.627 2.207 4.556 1.00 0.00 C ATOM 249 O VAL A 236 0.504 1.798 4.295 1.00 0.00 O ATOM 250 CB VAL A 236 -2.055 2.712 2.573 1.00 0.00 C ATOM 251 CG1 VAL A 236 -2.542 3.798 1.626 1.00 0.00 C ATOM 252 CG2 VAL A 236 -1.207 1.688 1.833 1.00 0.00 C ATOM 0 H VAL A 236 0.541 3.825 2.790 1.00 0.00 H new ATOM 0 HA VAL A 236 -1.940 3.895 4.375 1.00 0.00 H new ATOM 0 HB VAL A 236 -2.928 2.201 2.980 1.00 0.00 H new ATOM 0 HG11 VAL A 236 -3.101 3.344 0.808 1.00 0.00 H new ATOM 0 HG12 VAL A 236 -3.188 4.490 2.167 1.00 0.00 H new ATOM 0 HG13 VAL A 236 -1.686 4.340 1.223 1.00 0.00 H new ATOM 0 HG21 VAL A 236 -1.784 1.263 1.012 1.00 0.00 H new ATOM 0 HG22 VAL A 236 -0.315 2.173 1.437 1.00 0.00 H new ATOM 0 HG23 VAL A 236 -0.914 0.894 2.520 1.00 0.00 H new ATOM 262 N SER A 237 -1.364 1.715 5.547 1.00 0.00 N ATOM 263 CA SER A 237 -0.873 0.643 6.405 1.00 0.00 C ATOM 264 C SER A 237 -1.499 -0.693 6.017 1.00 0.00 C ATOM 265 O SER A 237 -2.563 -0.737 5.400 1.00 0.00 O ATOM 266 CB SER A 237 -1.176 0.955 7.871 1.00 0.00 C ATOM 267 OG SER A 237 -2.488 0.546 8.219 1.00 0.00 O ATOM 0 H SER A 237 -2.303 2.042 5.775 1.00 0.00 H new ATOM 0 HA SER A 237 0.206 0.571 6.273 1.00 0.00 H new ATOM 0 HB2 SER A 237 -0.452 0.450 8.511 1.00 0.00 H new ATOM 0 HB3 SER A 237 -1.066 2.025 8.049 1.00 0.00 H new ATOM 0 HG SER A 237 -2.657 0.755 9.162 1.00 0.00 H new ATOM 273 N VAL A 238 -0.831 -1.782 6.385 1.00 0.00 N ATOM 274 CA VAL A 238 -1.321 -3.120 6.078 1.00 0.00 C ATOM 275 C VAL A 238 -1.200 -4.041 7.287 1.00 0.00 C ATOM 276 O VAL A 238 -0.117 -4.208 7.848 1.00 0.00 O ATOM 277 CB VAL A 238 -0.555 -3.741 4.895 1.00 0.00 C ATOM 278 CG1 VAL A 238 -1.220 -5.033 4.446 1.00 0.00 C ATOM 279 CG2 VAL A 238 -0.461 -2.752 3.744 1.00 0.00 C ATOM 0 H VAL A 238 0.051 -1.763 6.896 1.00 0.00 H new ATOM 0 HA VAL A 238 -2.372 -3.017 5.807 1.00 0.00 H new ATOM 0 HB VAL A 238 0.457 -3.978 5.224 1.00 0.00 H new ATOM 0 HG11 VAL A 238 -0.664 -5.457 3.609 1.00 0.00 H new ATOM 0 HG12 VAL A 238 -1.229 -5.744 5.272 1.00 0.00 H new ATOM 0 HG13 VAL A 238 -2.244 -4.826 4.134 1.00 0.00 H new ATOM 0 HG21 VAL A 238 0.083 -3.207 2.917 1.00 0.00 H new ATOM 0 HG22 VAL A 238 -1.464 -2.482 3.414 1.00 0.00 H new ATOM 0 HG23 VAL A 238 0.065 -1.857 4.076 1.00 0.00 H new ATOM 289 N HIS A 239 -2.320 -4.637 7.684 1.00 0.00 N ATOM 290 CA HIS A 239 -2.340 -5.543 8.828 1.00 0.00 C ATOM 291 C HIS A 239 -3.036 -6.853 8.471 1.00 0.00 C ATOM 292 O HIS A 239 -4.198 -6.859 8.065 1.00 0.00 O ATOM 293 CB HIS A 239 -3.043 -4.884 10.015 1.00 0.00 C ATOM 294 CG HIS A 239 -2.412 -3.597 10.446 1.00 0.00 C ATOM 295 ND1 HIS A 239 -1.352 -3.536 11.327 1.00 0.00 N ATOM 296 CD2 HIS A 239 -2.695 -2.316 10.111 1.00 0.00 C ATOM 297 CE1 HIS A 239 -1.012 -2.273 11.516 1.00 0.00 C ATOM 298 NE2 HIS A 239 -1.811 -1.513 10.789 1.00 0.00 N ATOM 0 H HIS A 239 -3.225 -4.509 7.231 1.00 0.00 H new ATOM 0 HA HIS A 239 -1.309 -5.764 9.104 1.00 0.00 H new ATOM 0 HB2 HIS A 239 -4.084 -4.698 9.752 1.00 0.00 H new ATOM 0 HB3 HIS A 239 -3.045 -5.577 10.856 1.00 0.00 H new ATOM 0 HD2 HIS A 239 -3.471 -1.987 9.436 1.00 0.00 H new ATOM 0 HE1 HIS A 239 -0.216 -1.922 12.156 1.00 0.00 H new ATOM 0 HE2 HIS A 239 -1.777 -0.495 10.739 1.00 0.00 H new ATOM 306 N GLY A 240 -2.318 -7.961 8.625 1.00 0.00 N ATOM 307 CA GLY A 240 -2.883 -9.261 8.314 1.00 0.00 C ATOM 308 C GLY A 240 -1.971 -10.095 7.437 1.00 0.00 C ATOM 309 O GLY A 240 -2.432 -10.784 6.528 1.00 0.00 O ATOM 0 H GLY A 240 -1.355 -7.982 8.960 1.00 0.00 H new ATOM 0 HA2 GLY A 240 -3.081 -9.799 9.241 1.00 0.00 H new ATOM 0 HA3 GLY A 240 -3.841 -9.127 7.812 1.00 0.00 H new ATOM 313 N MET A 241 -0.671 -10.032 7.709 1.00 0.00 N ATOM 314 CA MET A 241 0.308 -10.787 6.937 1.00 0.00 C ATOM 315 C MET A 241 0.943 -11.883 7.788 1.00 0.00 C ATOM 316 O MET A 241 1.311 -11.670 8.944 1.00 0.00 O ATOM 317 CB MET A 241 1.392 -9.854 6.395 1.00 0.00 C ATOM 318 CG MET A 241 0.843 -8.691 5.586 1.00 0.00 C ATOM 319 SD MET A 241 0.228 -7.351 6.624 1.00 0.00 S ATOM 320 CE MET A 241 1.679 -6.304 6.720 1.00 0.00 C ATOM 0 H MET A 241 -0.272 -9.466 8.458 1.00 0.00 H new ATOM 0 HA MET A 241 -0.210 -11.255 6.100 1.00 0.00 H new ATOM 0 HB2 MET A 241 1.974 -9.463 7.230 1.00 0.00 H new ATOM 0 HB3 MET A 241 2.076 -10.429 5.771 1.00 0.00 H new ATOM 0 HG2 MET A 241 1.625 -8.308 4.931 1.00 0.00 H new ATOM 0 HG3 MET A 241 0.037 -9.048 4.945 1.00 0.00 H new ATOM 0 HE1 MET A 241 1.619 -5.680 7.612 1.00 0.00 H new ATOM 0 HE2 MET A 241 2.573 -6.925 6.771 1.00 0.00 H new ATOM 0 HE3 MET A 241 1.729 -5.669 5.836 1.00 0.00 H new ATOM 330 N PRO A 242 1.076 -13.084 7.206 1.00 0.00 N ATOM 331 CA PRO A 242 1.667 -14.236 7.894 1.00 0.00 C ATOM 332 C PRO A 242 2.950 -13.873 8.634 1.00 0.00 C ATOM 333 O PRO A 242 3.450 -12.755 8.519 1.00 0.00 O ATOM 334 CB PRO A 242 1.965 -15.214 6.755 1.00 0.00 C ATOM 335 CG PRO A 242 0.964 -14.886 5.702 1.00 0.00 C ATOM 336 CD PRO A 242 0.660 -13.409 5.832 1.00 0.00 C ATOM 0 HA PRO A 242 1.003 -14.640 8.658 1.00 0.00 H new ATOM 0 HB2 PRO A 242 2.983 -15.092 6.385 1.00 0.00 H new ATOM 0 HB3 PRO A 242 1.867 -16.248 7.086 1.00 0.00 H new ATOM 0 HG2 PRO A 242 1.357 -15.114 4.711 1.00 0.00 H new ATOM 0 HG3 PRO A 242 0.059 -15.480 5.831 1.00 0.00 H new ATOM 0 HD2 PRO A 242 1.211 -12.821 5.098 1.00 0.00 H new ATOM 0 HD3 PRO A 242 -0.399 -13.203 5.675 1.00 0.00 H new ATOM 344 N PHE A 243 3.478 -14.827 9.394 1.00 0.00 N ATOM 345 CA PHE A 243 4.703 -14.608 10.154 1.00 0.00 C ATOM 346 C PHE A 243 5.928 -14.684 9.246 1.00 0.00 C ATOM 347 O PHE A 243 6.913 -13.975 9.453 1.00 0.00 O ATOM 348 CB PHE A 243 4.823 -15.639 11.278 1.00 0.00 C ATOM 349 CG PHE A 243 3.759 -15.505 12.330 1.00 0.00 C ATOM 350 CD1 PHE A 243 3.475 -14.272 12.894 1.00 0.00 C ATOM 351 CD2 PHE A 243 3.044 -16.613 12.755 1.00 0.00 C ATOM 352 CE1 PHE A 243 2.496 -14.146 13.862 1.00 0.00 C ATOM 353 CE2 PHE A 243 2.064 -16.493 13.722 1.00 0.00 C ATOM 354 CZ PHE A 243 1.791 -15.258 14.277 1.00 0.00 C ATOM 0 H PHE A 243 3.077 -15.759 9.500 1.00 0.00 H new ATOM 0 HA PHE A 243 4.657 -13.610 10.590 1.00 0.00 H new ATOM 0 HB2 PHE A 243 4.775 -16.640 10.849 1.00 0.00 H new ATOM 0 HB3 PHE A 243 5.802 -15.541 11.748 1.00 0.00 H new ATOM 0 HD1 PHE A 243 4.025 -13.399 12.574 1.00 0.00 H new ATOM 0 HD2 PHE A 243 3.255 -17.581 12.326 1.00 0.00 H new ATOM 0 HE1 PHE A 243 2.283 -13.179 14.293 1.00 0.00 H new ATOM 0 HE2 PHE A 243 1.512 -17.364 14.043 1.00 0.00 H new ATOM 0 HZ PHE A 243 1.027 -15.162 15.034 1.00 0.00 H new ATOM 364 N SER A 244 5.858 -15.549 8.240 1.00 0.00 N ATOM 365 CA SER A 244 6.961 -15.722 7.302 1.00 0.00 C ATOM 366 C SER A 244 6.980 -14.597 6.272 1.00 0.00 C ATOM 367 O SER A 244 8.012 -14.315 5.663 1.00 0.00 O ATOM 368 CB SER A 244 6.850 -17.074 6.595 1.00 0.00 C ATOM 369 OG SER A 244 6.842 -18.140 7.530 1.00 0.00 O ATOM 0 H SER A 244 5.049 -16.141 8.053 1.00 0.00 H new ATOM 0 HA SER A 244 7.893 -15.690 7.866 1.00 0.00 H new ATOM 0 HB2 SER A 244 5.938 -17.102 5.999 1.00 0.00 H new ATOM 0 HB3 SER A 244 7.685 -17.197 5.906 1.00 0.00 H new ATOM 0 HG SER A 244 6.769 -18.993 7.053 1.00 0.00 H new ATOM 375 N ALA A 245 5.831 -13.957 6.083 1.00 0.00 N ATOM 376 CA ALA A 245 5.714 -12.861 5.129 1.00 0.00 C ATOM 377 C ALA A 245 6.951 -11.969 5.164 1.00 0.00 C ATOM 378 O ALA A 245 7.280 -11.390 6.198 1.00 0.00 O ATOM 379 CB ALA A 245 4.463 -12.044 5.414 1.00 0.00 C ATOM 0 H ALA A 245 4.967 -14.179 6.578 1.00 0.00 H new ATOM 0 HA ALA A 245 5.635 -13.289 4.130 1.00 0.00 H new ATOM 0 HB1 ALA A 245 4.389 -11.229 4.694 1.00 0.00 H new ATOM 0 HB2 ALA A 245 3.584 -12.683 5.331 1.00 0.00 H new ATOM 0 HB3 ALA A 245 4.518 -11.633 6.422 1.00 0.00 H new ATOM 385 N MET A 246 7.632 -11.865 4.027 1.00 0.00 N ATOM 386 CA MET A 246 8.832 -11.043 3.929 1.00 0.00 C ATOM 387 C MET A 246 8.641 -9.920 2.915 1.00 0.00 C ATOM 388 O MET A 246 7.692 -9.935 2.132 1.00 0.00 O ATOM 389 CB MET A 246 10.035 -11.903 3.534 1.00 0.00 C ATOM 390 CG MET A 246 9.873 -12.592 2.189 1.00 0.00 C ATOM 391 SD MET A 246 11.443 -13.151 1.502 1.00 0.00 S ATOM 392 CE MET A 246 10.938 -14.665 0.689 1.00 0.00 C ATOM 0 H MET A 246 7.373 -12.339 3.162 1.00 0.00 H new ATOM 0 HA MET A 246 9.018 -10.598 4.907 1.00 0.00 H new ATOM 0 HB2 MET A 246 10.926 -11.276 3.507 1.00 0.00 H new ATOM 0 HB3 MET A 246 10.200 -12.658 4.303 1.00 0.00 H new ATOM 0 HG2 MET A 246 9.205 -13.446 2.301 1.00 0.00 H new ATOM 0 HG3 MET A 246 9.398 -11.905 1.488 1.00 0.00 H new ATOM 0 HE1 MET A 246 11.803 -15.129 0.215 1.00 0.00 H new ATOM 0 HE2 MET A 246 10.516 -15.350 1.425 1.00 0.00 H new ATOM 0 HE3 MET A 246 10.187 -14.438 -0.068 1.00 0.00 H new ATOM 402 N GLU A 247 9.547 -8.948 2.936 1.00 0.00 N ATOM 403 CA GLU A 247 9.476 -7.817 2.018 1.00 0.00 C ATOM 404 C GLU A 247 9.042 -8.272 0.627 1.00 0.00 C ATOM 405 O GLU A 247 8.107 -7.722 0.047 1.00 0.00 O ATOM 406 CB GLU A 247 10.831 -7.111 1.937 1.00 0.00 C ATOM 407 CG GLU A 247 10.727 -5.630 1.613 1.00 0.00 C ATOM 408 CD GLU A 247 11.953 -5.103 0.893 1.00 0.00 C ATOM 409 OE1 GLU A 247 12.395 -5.751 -0.079 1.00 0.00 O ATOM 410 OE2 GLU A 247 12.470 -4.042 1.302 1.00 0.00 O ATOM 0 H GLU A 247 10.339 -8.921 3.578 1.00 0.00 H new ATOM 0 HA GLU A 247 8.733 -7.117 2.401 1.00 0.00 H new ATOM 0 HB2 GLU A 247 11.351 -7.231 2.887 1.00 0.00 H new ATOM 0 HB3 GLU A 247 11.441 -7.599 1.176 1.00 0.00 H new ATOM 0 HG2 GLU A 247 9.846 -5.458 0.995 1.00 0.00 H new ATOM 0 HG3 GLU A 247 10.583 -5.069 2.536 1.00 0.00 H new ATOM 417 N ASN A 248 9.730 -9.279 0.100 1.00 0.00 N ATOM 418 CA ASN A 248 9.417 -9.807 -1.223 1.00 0.00 C ATOM 419 C ASN A 248 7.937 -10.157 -1.334 1.00 0.00 C ATOM 420 O ASN A 248 7.250 -9.713 -2.254 1.00 0.00 O ATOM 421 CB ASN A 248 10.268 -11.045 -1.515 1.00 0.00 C ATOM 422 CG ASN A 248 10.031 -11.594 -2.909 1.00 0.00 C ATOM 423 OD1 ASN A 248 9.343 -10.978 -3.722 1.00 0.00 O ATOM 424 ND2 ASN A 248 10.602 -12.760 -3.190 1.00 0.00 N ATOM 0 H ASN A 248 10.507 -9.746 0.568 1.00 0.00 H new ATOM 0 HA ASN A 248 9.645 -9.035 -1.958 1.00 0.00 H new ATOM 0 HB2 ASN A 248 11.322 -10.793 -1.401 1.00 0.00 H new ATOM 0 HB3 ASN A 248 10.044 -11.818 -0.780 1.00 0.00 H new ATOM 0 HD21 ASN A 248 10.478 -13.180 -4.111 1.00 0.00 H new ATOM 0 HD22 ASN A 248 11.164 -13.236 -2.484 1.00 0.00 H new ATOM 431 N ASP A 249 7.451 -10.955 -0.389 1.00 0.00 N ATOM 432 CA ASP A 249 6.051 -11.364 -0.378 1.00 0.00 C ATOM 433 C ASP A 249 5.132 -10.160 -0.563 1.00 0.00 C ATOM 434 O ASP A 249 4.174 -10.210 -1.334 1.00 0.00 O ATOM 435 CB ASP A 249 5.717 -12.080 0.932 1.00 0.00 C ATOM 436 CG ASP A 249 6.278 -13.487 0.982 1.00 0.00 C ATOM 437 OD1 ASP A 249 6.006 -14.268 0.046 1.00 0.00 O ATOM 438 OD2 ASP A 249 6.989 -13.809 1.957 1.00 0.00 O ATOM 0 H ASP A 249 8.006 -11.331 0.379 1.00 0.00 H new ATOM 0 HA ASP A 249 5.892 -12.051 -1.209 1.00 0.00 H new ATOM 0 HB2 ASP A 249 6.113 -11.504 1.769 1.00 0.00 H new ATOM 0 HB3 ASP A 249 4.635 -12.119 1.056 1.00 0.00 H new ATOM 443 N VAL A 250 5.431 -9.079 0.150 1.00 0.00 N ATOM 444 CA VAL A 250 4.632 -7.862 0.065 1.00 0.00 C ATOM 445 C VAL A 250 4.411 -7.450 -1.387 1.00 0.00 C ATOM 446 O VAL A 250 3.275 -7.371 -1.854 1.00 0.00 O ATOM 447 CB VAL A 250 5.300 -6.698 0.821 1.00 0.00 C ATOM 448 CG1 VAL A 250 4.500 -5.417 0.643 1.00 0.00 C ATOM 449 CG2 VAL A 250 5.453 -7.040 2.295 1.00 0.00 C ATOM 0 H VAL A 250 6.221 -9.021 0.793 1.00 0.00 H new ATOM 0 HA VAL A 250 3.670 -8.082 0.528 1.00 0.00 H new ATOM 0 HB VAL A 250 6.294 -6.538 0.403 1.00 0.00 H new ATOM 0 HG11 VAL A 250 4.987 -4.606 1.184 1.00 0.00 H new ATOM 0 HG12 VAL A 250 4.446 -5.166 -0.416 1.00 0.00 H new ATOM 0 HG13 VAL A 250 3.492 -5.560 1.034 1.00 0.00 H new ATOM 0 HG21 VAL A 250 5.927 -6.207 2.815 1.00 0.00 H new ATOM 0 HG22 VAL A 250 4.471 -7.227 2.729 1.00 0.00 H new ATOM 0 HG23 VAL A 250 6.071 -7.931 2.399 1.00 0.00 H new ATOM 459 N ARG A 251 5.505 -7.190 -2.095 1.00 0.00 N ATOM 460 CA ARG A 251 5.431 -6.785 -3.494 1.00 0.00 C ATOM 461 C ARG A 251 4.350 -7.571 -4.230 1.00 0.00 C ATOM 462 O ARG A 251 3.475 -6.990 -4.872 1.00 0.00 O ATOM 463 CB ARG A 251 6.783 -6.992 -4.179 1.00 0.00 C ATOM 464 CG ARG A 251 7.767 -5.859 -3.939 1.00 0.00 C ATOM 465 CD ARG A 251 8.611 -6.108 -2.698 1.00 0.00 C ATOM 466 NE ARG A 251 9.937 -5.505 -2.808 1.00 0.00 N ATOM 467 CZ ARG A 251 10.146 -4.195 -2.863 1.00 0.00 C ATOM 468 NH1 ARG A 251 9.122 -3.354 -2.817 1.00 0.00 N ATOM 469 NH2 ARG A 251 11.382 -3.723 -2.963 1.00 0.00 N ATOM 0 H ARG A 251 6.453 -7.252 -1.723 1.00 0.00 H new ATOM 0 HA ARG A 251 5.173 -5.726 -3.527 1.00 0.00 H new ATOM 0 HB2 ARG A 251 7.222 -7.924 -3.824 1.00 0.00 H new ATOM 0 HB3 ARG A 251 6.624 -7.103 -5.252 1.00 0.00 H new ATOM 0 HG2 ARG A 251 8.417 -5.750 -4.807 1.00 0.00 H new ATOM 0 HG3 ARG A 251 7.223 -4.921 -3.829 1.00 0.00 H new ATOM 0 HD2 ARG A 251 8.100 -5.703 -1.825 1.00 0.00 H new ATOM 0 HD3 ARG A 251 8.713 -7.181 -2.538 1.00 0.00 H new ATOM 0 HE ARG A 251 10.747 -6.124 -2.845 1.00 0.00 H new ATOM 0 HH11 ARG A 251 8.170 -3.713 -2.739 1.00 0.00 H new ATOM 0 HH12 ARG A 251 9.286 -2.348 -2.859 1.00 0.00 H new ATOM 0 HH21 ARG A 251 12.172 -4.367 -2.998 1.00 0.00 H new ATOM 0 HH22 ARG A 251 11.542 -2.716 -3.005 1.00 0.00 H new ATOM 483 N ASP A 252 4.418 -8.894 -4.133 1.00 0.00 N ATOM 484 CA ASP A 252 3.445 -9.760 -4.790 1.00 0.00 C ATOM 485 C ASP A 252 2.062 -9.118 -4.794 1.00 0.00 C ATOM 486 O ASP A 252 1.335 -9.191 -5.785 1.00 0.00 O ATOM 487 CB ASP A 252 3.388 -11.120 -4.091 1.00 0.00 C ATOM 488 CG ASP A 252 2.498 -12.108 -4.820 1.00 0.00 C ATOM 489 OD1 ASP A 252 1.304 -11.798 -5.016 1.00 0.00 O ATOM 490 OD2 ASP A 252 2.996 -13.189 -5.194 1.00 0.00 O ATOM 0 H ASP A 252 5.136 -9.391 -3.606 1.00 0.00 H new ATOM 0 HA ASP A 252 3.762 -9.904 -5.823 1.00 0.00 H new ATOM 0 HB2 ASP A 252 4.395 -11.529 -4.016 1.00 0.00 H new ATOM 0 HB3 ASP A 252 3.021 -10.987 -3.073 1.00 0.00 H new ATOM 495 N PHE A 253 1.703 -8.489 -3.680 1.00 0.00 N ATOM 496 CA PHE A 253 0.406 -7.835 -3.554 1.00 0.00 C ATOM 497 C PHE A 253 0.335 -6.593 -4.439 1.00 0.00 C ATOM 498 O PHE A 253 -0.414 -6.555 -5.415 1.00 0.00 O ATOM 499 CB PHE A 253 0.143 -7.452 -2.097 1.00 0.00 C ATOM 500 CG PHE A 253 -1.307 -7.202 -1.795 1.00 0.00 C ATOM 501 CD1 PHE A 253 -1.919 -6.025 -2.195 1.00 0.00 C ATOM 502 CD2 PHE A 253 -2.058 -8.144 -1.110 1.00 0.00 C ATOM 503 CE1 PHE A 253 -3.253 -5.792 -1.919 1.00 0.00 C ATOM 504 CE2 PHE A 253 -3.393 -7.917 -0.832 1.00 0.00 C ATOM 505 CZ PHE A 253 -3.991 -6.739 -1.236 1.00 0.00 C ATOM 0 H PHE A 253 2.293 -8.418 -2.851 1.00 0.00 H new ATOM 0 HA PHE A 253 -0.360 -8.538 -3.881 1.00 0.00 H new ATOM 0 HB2 PHE A 253 0.509 -8.248 -1.449 1.00 0.00 H new ATOM 0 HB3 PHE A 253 0.716 -6.556 -1.856 1.00 0.00 H new ATOM 0 HD1 PHE A 253 -1.347 -5.281 -2.729 1.00 0.00 H new ATOM 0 HD2 PHE A 253 -1.595 -9.066 -0.790 1.00 0.00 H new ATOM 0 HE1 PHE A 253 -3.718 -4.871 -2.237 1.00 0.00 H new ATOM 0 HE2 PHE A 253 -3.968 -8.660 -0.299 1.00 0.00 H new ATOM 0 HZ PHE A 253 -5.033 -6.559 -1.018 1.00 0.00 H new ATOM 515 N PHE A 254 1.120 -5.580 -4.089 1.00 0.00 N ATOM 516 CA PHE A 254 1.146 -4.335 -4.849 1.00 0.00 C ATOM 517 C PHE A 254 2.224 -4.379 -5.928 1.00 0.00 C ATOM 518 O PHE A 254 2.911 -3.387 -6.176 1.00 0.00 O ATOM 519 CB PHE A 254 1.389 -3.148 -3.916 1.00 0.00 C ATOM 520 CG PHE A 254 0.528 -3.166 -2.686 1.00 0.00 C ATOM 521 CD1 PHE A 254 -0.842 -2.987 -2.781 1.00 0.00 C ATOM 522 CD2 PHE A 254 1.089 -3.362 -1.434 1.00 0.00 C ATOM 523 CE1 PHE A 254 -1.637 -3.002 -1.650 1.00 0.00 C ATOM 524 CE2 PHE A 254 0.300 -3.379 -0.300 1.00 0.00 C ATOM 525 CZ PHE A 254 -1.065 -3.200 -0.408 1.00 0.00 C ATOM 0 H PHE A 254 1.747 -5.596 -3.284 1.00 0.00 H new ATOM 0 HA PHE A 254 0.177 -4.214 -5.334 1.00 0.00 H new ATOM 0 HB2 PHE A 254 2.437 -3.141 -3.616 1.00 0.00 H new ATOM 0 HB3 PHE A 254 1.208 -2.223 -4.463 1.00 0.00 H new ATOM 0 HD1 PHE A 254 -1.294 -2.834 -3.750 1.00 0.00 H new ATOM 0 HD2 PHE A 254 2.156 -3.503 -1.344 1.00 0.00 H new ATOM 0 HE1 PHE A 254 -2.704 -2.859 -1.737 1.00 0.00 H new ATOM 0 HE2 PHE A 254 0.750 -3.532 0.670 1.00 0.00 H new ATOM 0 HZ PHE A 254 -1.684 -3.215 0.477 1.00 0.00 H new ATOM 535 N HIS A 255 2.368 -5.536 -6.566 1.00 0.00 N ATOM 536 CA HIS A 255 3.364 -5.710 -7.618 1.00 0.00 C ATOM 537 C HIS A 255 2.869 -5.123 -8.936 1.00 0.00 C ATOM 538 O HIS A 255 3.650 -4.581 -9.718 1.00 0.00 O ATOM 539 CB HIS A 255 3.692 -7.193 -7.798 1.00 0.00 C ATOM 540 CG HIS A 255 4.637 -7.464 -8.928 1.00 0.00 C ATOM 541 ND1 HIS A 255 4.325 -8.288 -9.989 1.00 0.00 N ATOM 542 CD2 HIS A 255 5.892 -7.013 -9.160 1.00 0.00 C ATOM 543 CE1 HIS A 255 5.348 -8.334 -10.823 1.00 0.00 C ATOM 544 NE2 HIS A 255 6.312 -7.568 -10.344 1.00 0.00 N ATOM 0 H HIS A 255 1.808 -6.367 -6.373 1.00 0.00 H new ATOM 0 HA HIS A 255 4.268 -5.179 -7.321 1.00 0.00 H new ATOM 0 HB2 HIS A 255 4.124 -7.576 -6.874 1.00 0.00 H new ATOM 0 HB3 HIS A 255 2.767 -7.743 -7.969 1.00 0.00 H new ATOM 0 HD2 HIS A 255 6.458 -6.342 -8.531 1.00 0.00 H new ATOM 0 HE1 HIS A 255 5.390 -8.902 -11.741 1.00 0.00 H new ATOM 0 HE2 HIS A 255 7.220 -7.414 -10.782 1.00 0.00 H new ATOM 552 N GLY A 256 1.566 -5.235 -9.177 1.00 0.00 N ATOM 553 CA GLY A 256 0.990 -4.711 -10.402 1.00 0.00 C ATOM 554 C GLY A 256 0.700 -3.225 -10.317 1.00 0.00 C ATOM 555 O GLY A 256 -0.144 -2.707 -11.049 1.00 0.00 O ATOM 0 H GLY A 256 0.899 -5.679 -8.546 1.00 0.00 H new ATOM 0 HA2 GLY A 256 1.674 -4.898 -11.230 1.00 0.00 H new ATOM 0 HA3 GLY A 256 0.067 -5.246 -10.624 1.00 0.00 H new ATOM 559 N LEU A 257 1.401 -2.538 -9.422 1.00 0.00 N ATOM 560 CA LEU A 257 1.213 -1.102 -9.243 1.00 0.00 C ATOM 561 C LEU A 257 2.556 -0.390 -9.113 1.00 0.00 C ATOM 562 O LEU A 257 3.608 -1.028 -9.080 1.00 0.00 O ATOM 563 CB LEU A 257 0.358 -0.830 -8.004 1.00 0.00 C ATOM 564 CG LEU A 257 -1.072 -1.371 -8.044 1.00 0.00 C ATOM 565 CD1 LEU A 257 -1.651 -1.454 -6.641 1.00 0.00 C ATOM 566 CD2 LEU A 257 -1.947 -0.500 -8.933 1.00 0.00 C ATOM 0 H LEU A 257 2.104 -2.951 -8.809 1.00 0.00 H new ATOM 0 HA LEU A 257 0.700 -0.715 -10.123 1.00 0.00 H new ATOM 0 HB2 LEU A 257 0.863 -1.257 -7.138 1.00 0.00 H new ATOM 0 HB3 LEU A 257 0.313 0.248 -7.847 1.00 0.00 H new ATOM 0 HG LEU A 257 -1.048 -2.376 -8.465 1.00 0.00 H new ATOM 0 HD11 LEU A 257 -2.669 -1.841 -6.690 1.00 0.00 H new ATOM 0 HD12 LEU A 257 -1.038 -2.120 -6.033 1.00 0.00 H new ATOM 0 HD13 LEU A 257 -1.662 -0.461 -6.192 1.00 0.00 H new ATOM 0 HD21 LEU A 257 -2.961 -0.900 -8.950 1.00 0.00 H new ATOM 0 HD22 LEU A 257 -1.965 0.517 -8.542 1.00 0.00 H new ATOM 0 HD23 LEU A 257 -1.543 -0.492 -9.945 1.00 0.00 H new ATOM 578 N ARG A 258 2.511 0.936 -9.039 1.00 0.00 N ATOM 579 CA ARG A 258 3.724 1.736 -8.913 1.00 0.00 C ATOM 580 C ARG A 258 4.198 1.778 -7.463 1.00 0.00 C ATOM 581 O ARG A 258 3.624 2.482 -6.631 1.00 0.00 O ATOM 582 CB ARG A 258 3.479 3.157 -9.422 1.00 0.00 C ATOM 583 CG ARG A 258 3.564 3.285 -10.935 1.00 0.00 C ATOM 584 CD ARG A 258 3.758 4.732 -11.361 1.00 0.00 C ATOM 585 NE ARG A 258 4.218 4.838 -12.743 1.00 0.00 N ATOM 586 CZ ARG A 258 4.356 5.992 -13.385 1.00 0.00 C ATOM 587 NH1 ARG A 258 4.071 7.133 -12.773 1.00 0.00 N ATOM 588 NH2 ARG A 258 4.780 6.007 -14.643 1.00 0.00 N ATOM 0 H ARG A 258 1.648 1.479 -9.064 1.00 0.00 H new ATOM 0 HA ARG A 258 4.501 1.270 -9.519 1.00 0.00 H new ATOM 0 HB2 ARG A 258 2.494 3.487 -9.093 1.00 0.00 H new ATOM 0 HB3 ARG A 258 4.208 3.828 -8.967 1.00 0.00 H new ATOM 0 HG2 ARG A 258 4.392 2.681 -11.307 1.00 0.00 H new ATOM 0 HG3 ARG A 258 2.654 2.890 -11.386 1.00 0.00 H new ATOM 0 HD2 ARG A 258 2.818 5.272 -11.249 1.00 0.00 H new ATOM 0 HD3 ARG A 258 4.481 5.211 -10.700 1.00 0.00 H new ATOM 0 HE ARG A 258 4.446 3.978 -13.242 1.00 0.00 H new ATOM 0 HH11 ARG A 258 3.745 7.126 -11.807 1.00 0.00 H new ATOM 0 HH12 ARG A 258 4.178 8.018 -13.269 1.00 0.00 H new ATOM 0 HH21 ARG A 258 5.000 5.131 -15.117 1.00 0.00 H new ATOM 0 HH22 ARG A 258 4.886 6.894 -15.135 1.00 0.00 H new ATOM 602 N VAL A 259 5.249 1.020 -7.167 1.00 0.00 N ATOM 603 CA VAL A 259 5.801 0.971 -5.818 1.00 0.00 C ATOM 604 C VAL A 259 6.961 1.949 -5.663 1.00 0.00 C ATOM 605 O VAL A 259 7.878 1.974 -6.483 1.00 0.00 O ATOM 606 CB VAL A 259 6.288 -0.446 -5.462 1.00 0.00 C ATOM 607 CG1 VAL A 259 6.937 -0.457 -4.086 1.00 0.00 C ATOM 608 CG2 VAL A 259 5.135 -1.436 -5.524 1.00 0.00 C ATOM 0 H VAL A 259 5.735 0.431 -7.843 1.00 0.00 H new ATOM 0 HA VAL A 259 4.998 1.253 -5.137 1.00 0.00 H new ATOM 0 HB VAL A 259 7.037 -0.749 -6.194 1.00 0.00 H new ATOM 0 HG11 VAL A 259 7.275 -1.466 -3.851 1.00 0.00 H new ATOM 0 HG12 VAL A 259 7.790 0.222 -4.081 1.00 0.00 H new ATOM 0 HG13 VAL A 259 6.212 -0.134 -3.339 1.00 0.00 H new ATOM 0 HG21 VAL A 259 5.497 -2.432 -5.270 1.00 0.00 H new ATOM 0 HG22 VAL A 259 4.362 -1.139 -4.815 1.00 0.00 H new ATOM 0 HG23 VAL A 259 4.719 -1.447 -6.531 1.00 0.00 H new ATOM 618 N ASP A 260 6.913 2.752 -4.606 1.00 0.00 N ATOM 619 CA ASP A 260 7.960 3.731 -4.342 1.00 0.00 C ATOM 620 C ASP A 260 8.795 3.321 -3.132 1.00 0.00 C ATOM 621 O ASP A 260 10.024 3.320 -3.186 1.00 0.00 O ATOM 622 CB ASP A 260 7.349 5.114 -4.110 1.00 0.00 C ATOM 623 CG ASP A 260 8.233 6.002 -3.257 1.00 0.00 C ATOM 624 OD1 ASP A 260 8.360 5.726 -2.046 1.00 0.00 O ATOM 625 OD2 ASP A 260 8.798 6.974 -3.801 1.00 0.00 O ATOM 0 H ASP A 260 6.160 2.744 -3.918 1.00 0.00 H new ATOM 0 HA ASP A 260 8.612 3.772 -5.214 1.00 0.00 H new ATOM 0 HB2 ASP A 260 7.174 5.597 -5.072 1.00 0.00 H new ATOM 0 HB3 ASP A 260 6.378 5.003 -3.628 1.00 0.00 H new ATOM 630 N ALA A 261 8.117 2.976 -2.042 1.00 0.00 N ATOM 631 CA ALA A 261 8.796 2.563 -0.820 1.00 0.00 C ATOM 632 C ALA A 261 7.962 1.549 -0.044 1.00 0.00 C ATOM 633 O ALA A 261 6.738 1.513 -0.168 1.00 0.00 O ATOM 634 CB ALA A 261 9.100 3.774 0.049 1.00 0.00 C ATOM 0 H ALA A 261 7.099 2.974 -1.980 1.00 0.00 H new ATOM 0 HA ALA A 261 9.735 2.084 -1.099 1.00 0.00 H new ATOM 0 HB1 ALA A 261 9.607 3.451 0.958 1.00 0.00 H new ATOM 0 HB2 ALA A 261 9.742 4.463 -0.499 1.00 0.00 H new ATOM 0 HB3 ALA A 261 8.169 4.276 0.312 1.00 0.00 H new ATOM 640 N VAL A 262 8.633 0.725 0.755 1.00 0.00 N ATOM 641 CA VAL A 262 7.953 -0.289 1.551 1.00 0.00 C ATOM 642 C VAL A 262 8.540 -0.369 2.956 1.00 0.00 C ATOM 643 O VAL A 262 9.704 -0.728 3.135 1.00 0.00 O ATOM 644 CB VAL A 262 8.045 -1.677 0.888 1.00 0.00 C ATOM 645 CG1 VAL A 262 7.421 -2.738 1.782 1.00 0.00 C ATOM 646 CG2 VAL A 262 7.377 -1.659 -0.478 1.00 0.00 C ATOM 0 H VAL A 262 9.647 0.740 0.868 1.00 0.00 H new ATOM 0 HA VAL A 262 6.906 0.007 1.614 1.00 0.00 H new ATOM 0 HB VAL A 262 9.097 -1.926 0.750 1.00 0.00 H new ATOM 0 HG11 VAL A 262 7.495 -3.712 1.297 1.00 0.00 H new ATOM 0 HG12 VAL A 262 7.948 -2.766 2.736 1.00 0.00 H new ATOM 0 HG13 VAL A 262 6.372 -2.497 1.954 1.00 0.00 H new ATOM 0 HG21 VAL A 262 7.451 -2.647 -0.932 1.00 0.00 H new ATOM 0 HG22 VAL A 262 6.327 -1.389 -0.366 1.00 0.00 H new ATOM 0 HG23 VAL A 262 7.874 -0.928 -1.116 1.00 0.00 H new ATOM 656 N HIS A 263 7.725 -0.033 3.951 1.00 0.00 N ATOM 657 CA HIS A 263 8.163 -0.067 5.342 1.00 0.00 C ATOM 658 C HIS A 263 7.471 -1.195 6.101 1.00 0.00 C ATOM 659 O HIS A 263 6.271 -1.421 5.941 1.00 0.00 O ATOM 660 CB HIS A 263 7.877 1.272 6.022 1.00 0.00 C ATOM 661 CG HIS A 263 8.415 1.362 7.417 1.00 0.00 C ATOM 662 ND1 HIS A 263 9.763 1.406 7.702 1.00 0.00 N ATOM 663 CD2 HIS A 263 7.778 1.419 8.610 1.00 0.00 C ATOM 664 CE1 HIS A 263 9.932 1.483 9.010 1.00 0.00 C ATOM 665 NE2 HIS A 263 8.743 1.493 9.584 1.00 0.00 N ATOM 0 H HIS A 263 6.759 0.266 3.820 1.00 0.00 H new ATOM 0 HA HIS A 263 9.238 -0.249 5.355 1.00 0.00 H new ATOM 0 HB2 HIS A 263 8.308 2.074 5.423 1.00 0.00 H new ATOM 0 HB3 HIS A 263 6.800 1.435 6.046 1.00 0.00 H new ATOM 0 HD2 HIS A 263 6.709 1.408 8.767 1.00 0.00 H new ATOM 0 HE1 HIS A 263 10.881 1.530 9.523 1.00 0.00 H new ATOM 0 HE2 HIS A 263 8.570 1.547 10.588 1.00 0.00 H new ATOM 673 N LEU A 264 8.235 -1.901 6.928 1.00 0.00 N ATOM 674 CA LEU A 264 7.696 -3.007 7.712 1.00 0.00 C ATOM 675 C LEU A 264 7.940 -2.788 9.202 1.00 0.00 C ATOM 676 O LEU A 264 8.875 -2.087 9.592 1.00 0.00 O ATOM 677 CB LEU A 264 8.327 -4.328 7.269 1.00 0.00 C ATOM 678 CG LEU A 264 7.814 -4.908 5.951 1.00 0.00 C ATOM 679 CD1 LEU A 264 8.685 -6.072 5.505 1.00 0.00 C ATOM 680 CD2 LEU A 264 6.364 -5.347 6.090 1.00 0.00 C ATOM 0 H LEU A 264 9.230 -1.727 7.073 1.00 0.00 H new ATOM 0 HA LEU A 264 6.620 -3.050 7.541 1.00 0.00 H new ATOM 0 HB2 LEU A 264 9.404 -4.183 7.184 1.00 0.00 H new ATOM 0 HB3 LEU A 264 8.166 -5.066 8.055 1.00 0.00 H new ATOM 0 HG LEU A 264 7.866 -4.130 5.189 1.00 0.00 H new ATOM 0 HD11 LEU A 264 8.304 -6.472 4.565 1.00 0.00 H new ATOM 0 HD12 LEU A 264 9.709 -5.727 5.364 1.00 0.00 H new ATOM 0 HD13 LEU A 264 8.666 -6.853 6.266 1.00 0.00 H new ATOM 0 HD21 LEU A 264 6.016 -5.757 5.142 1.00 0.00 H new ATOM 0 HD22 LEU A 264 6.287 -6.109 6.865 1.00 0.00 H new ATOM 0 HD23 LEU A 264 5.749 -4.489 6.362 1.00 0.00 H new ATOM 692 N LEU A 265 7.095 -3.393 10.029 1.00 0.00 N ATOM 693 CA LEU A 265 7.220 -3.266 11.477 1.00 0.00 C ATOM 694 C LEU A 265 7.460 -4.626 12.124 1.00 0.00 C ATOM 695 O LEU A 265 6.839 -5.622 11.751 1.00 0.00 O ATOM 696 CB LEU A 265 5.961 -2.625 12.064 1.00 0.00 C ATOM 697 CG LEU A 265 5.491 -1.334 11.394 1.00 0.00 C ATOM 698 CD1 LEU A 265 4.027 -1.070 11.709 1.00 0.00 C ATOM 699 CD2 LEU A 265 6.353 -0.160 11.835 1.00 0.00 C ATOM 0 H LEU A 265 6.316 -3.976 9.722 1.00 0.00 H new ATOM 0 HA LEU A 265 8.078 -2.627 11.688 1.00 0.00 H new ATOM 0 HB2 LEU A 265 5.151 -3.352 12.015 1.00 0.00 H new ATOM 0 HB3 LEU A 265 6.141 -2.419 13.119 1.00 0.00 H new ATOM 0 HG LEU A 265 5.594 -1.450 10.315 1.00 0.00 H new ATOM 0 HD11 LEU A 265 3.711 -0.147 11.223 1.00 0.00 H new ATOM 0 HD12 LEU A 265 3.421 -1.899 11.343 1.00 0.00 H new ATOM 0 HD13 LEU A 265 3.898 -0.975 12.787 1.00 0.00 H new ATOM 0 HD21 LEU A 265 6.004 0.751 11.348 1.00 0.00 H new ATOM 0 HD22 LEU A 265 6.283 -0.043 12.916 1.00 0.00 H new ATOM 0 HD23 LEU A 265 7.390 -0.346 11.557 1.00 0.00 H new ATOM 711 N LYS A 266 8.364 -4.662 13.097 1.00 0.00 N ATOM 712 CA LYS A 266 8.685 -5.898 13.800 1.00 0.00 C ATOM 713 C LYS A 266 8.163 -5.862 15.233 1.00 0.00 C ATOM 714 O LYS A 266 7.984 -4.790 15.811 1.00 0.00 O ATOM 715 CB LYS A 266 10.198 -6.129 13.804 1.00 0.00 C ATOM 716 CG LYS A 266 10.855 -5.874 12.458 1.00 0.00 C ATOM 717 CD LYS A 266 10.849 -7.119 11.589 1.00 0.00 C ATOM 718 CE LYS A 266 9.594 -7.194 10.732 1.00 0.00 C ATOM 719 NZ LYS A 266 9.568 -6.128 9.692 1.00 0.00 N ATOM 0 H LYS A 266 8.888 -3.848 13.417 1.00 0.00 H new ATOM 0 HA LYS A 266 8.199 -6.720 13.275 1.00 0.00 H new ATOM 0 HB2 LYS A 266 10.654 -5.479 14.551 1.00 0.00 H new ATOM 0 HB3 LYS A 266 10.400 -7.156 14.109 1.00 0.00 H new ATOM 0 HG2 LYS A 266 10.332 -5.068 11.944 1.00 0.00 H new ATOM 0 HG3 LYS A 266 11.882 -5.541 12.611 1.00 0.00 H new ATOM 0 HD2 LYS A 266 11.730 -7.120 10.947 1.00 0.00 H new ATOM 0 HD3 LYS A 266 10.913 -8.005 12.220 1.00 0.00 H new ATOM 0 HE2 LYS A 266 9.540 -8.171 10.252 1.00 0.00 H new ATOM 0 HE3 LYS A 266 8.714 -7.102 11.368 1.00 0.00 H new ATOM 0 HZ1 LYS A 266 8.855 -5.414 9.945 1.00 0.00 H new ATOM 0 HZ2 LYS A 266 10.504 -5.678 9.633 1.00 0.00 H new ATOM 0 HZ3 LYS A 266 9.327 -6.547 8.771 1.00 0.00 H new ATOM 837 N GLY A 274 3.004 -8.823 10.975 1.00 0.00 N ATOM 838 CA GLY A 274 1.841 -8.496 10.170 1.00 0.00 C ATOM 839 C GLY A 274 1.404 -7.055 10.343 1.00 0.00 C ATOM 840 O GLY A 274 0.267 -6.786 10.728 1.00 0.00 O ATOM 0 HA2 GLY A 274 2.066 -8.681 9.120 1.00 0.00 H new ATOM 0 HA3 GLY A 274 1.018 -9.157 10.441 1.00 0.00 H new ATOM 844 N ASN A 275 2.310 -6.125 10.058 1.00 0.00 N ATOM 845 CA ASN A 275 2.012 -4.703 10.186 1.00 0.00 C ATOM 846 C ASN A 275 3.102 -3.858 9.533 1.00 0.00 C ATOM 847 O ASN A 275 4.249 -3.854 9.978 1.00 0.00 O ATOM 848 CB ASN A 275 1.869 -4.321 11.660 1.00 0.00 C ATOM 849 CG ASN A 275 3.019 -4.835 12.505 1.00 0.00 C ATOM 850 OD1 ASN A 275 4.050 -5.255 11.980 1.00 0.00 O ATOM 851 ND2 ASN A 275 2.845 -4.806 13.821 1.00 0.00 N ATOM 0 H ASN A 275 3.256 -6.330 9.737 1.00 0.00 H new ATOM 0 HA ASN A 275 1.070 -4.507 9.674 1.00 0.00 H new ATOM 0 HB2 ASN A 275 1.814 -3.236 11.748 1.00 0.00 H new ATOM 0 HB3 ASN A 275 0.931 -4.720 12.047 1.00 0.00 H new ATOM 0 HD21 ASN A 275 3.583 -5.141 14.441 1.00 0.00 H new ATOM 0 HD22 ASN A 275 1.973 -4.449 14.212 1.00 0.00 H new ATOM 858 N GLY A 276 2.734 -3.141 8.475 1.00 0.00 N ATOM 859 CA GLY A 276 3.691 -2.302 7.779 1.00 0.00 C ATOM 860 C GLY A 276 3.026 -1.171 7.020 1.00 0.00 C ATOM 861 O GLY A 276 1.799 -1.068 6.993 1.00 0.00 O ATOM 0 H GLY A 276 1.790 -3.127 8.088 1.00 0.00 H new ATOM 0 HA2 GLY A 276 4.397 -1.887 8.499 1.00 0.00 H new ATOM 0 HA3 GLY A 276 4.267 -2.913 7.084 1.00 0.00 H new ATOM 865 N LEU A 277 3.837 -0.318 6.402 1.00 0.00 N ATOM 866 CA LEU A 277 3.319 0.813 5.640 1.00 0.00 C ATOM 867 C LEU A 277 3.882 0.817 4.222 1.00 0.00 C ATOM 868 O LEU A 277 5.022 0.411 3.994 1.00 0.00 O ATOM 869 CB LEU A 277 3.665 2.127 6.342 1.00 0.00 C ATOM 870 CG LEU A 277 2.958 2.383 7.673 1.00 0.00 C ATOM 871 CD1 LEU A 277 3.651 3.499 8.440 1.00 0.00 C ATOM 872 CD2 LEU A 277 1.493 2.722 7.442 1.00 0.00 C ATOM 0 H LEU A 277 4.855 -0.388 6.414 1.00 0.00 H new ATOM 0 HA LEU A 277 2.235 0.714 5.581 1.00 0.00 H new ATOM 0 HB2 LEU A 277 4.741 2.151 6.514 1.00 0.00 H new ATOM 0 HB3 LEU A 277 3.432 2.949 5.666 1.00 0.00 H new ATOM 0 HG LEU A 277 3.010 1.473 8.271 1.00 0.00 H new ATOM 0 HD11 LEU A 277 3.134 3.667 9.385 1.00 0.00 H new ATOM 0 HD12 LEU A 277 4.685 3.217 8.638 1.00 0.00 H new ATOM 0 HD13 LEU A 277 3.631 4.414 7.848 1.00 0.00 H new ATOM 0 HD21 LEU A 277 1.005 2.901 8.400 1.00 0.00 H new ATOM 0 HD22 LEU A 277 1.420 3.617 6.825 1.00 0.00 H new ATOM 0 HD23 LEU A 277 1.003 1.891 6.935 1.00 0.00 H new ATOM 884 N VAL A 278 3.076 1.280 3.272 1.00 0.00 N ATOM 885 CA VAL A 278 3.495 1.341 1.877 1.00 0.00 C ATOM 886 C VAL A 278 3.317 2.745 1.310 1.00 0.00 C ATOM 887 O VAL A 278 2.371 3.452 1.658 1.00 0.00 O ATOM 888 CB VAL A 278 2.702 0.345 1.009 1.00 0.00 C ATOM 889 CG1 VAL A 278 3.283 0.279 -0.395 1.00 0.00 C ATOM 890 CG2 VAL A 278 2.690 -1.032 1.656 1.00 0.00 C ATOM 0 H VAL A 278 2.129 1.618 3.443 1.00 0.00 H new ATOM 0 HA VAL A 278 4.551 1.073 1.852 1.00 0.00 H new ATOM 0 HB VAL A 278 1.672 0.695 0.933 1.00 0.00 H new ATOM 0 HG11 VAL A 278 2.710 -0.429 -0.993 1.00 0.00 H new ATOM 0 HG12 VAL A 278 3.234 1.266 -0.856 1.00 0.00 H new ATOM 0 HG13 VAL A 278 4.322 -0.047 -0.344 1.00 0.00 H new ATOM 0 HG21 VAL A 278 2.126 -1.723 1.030 1.00 0.00 H new ATOM 0 HG22 VAL A 278 3.713 -1.392 1.764 1.00 0.00 H new ATOM 0 HG23 VAL A 278 2.223 -0.968 2.639 1.00 0.00 H new ATOM 900 N LYS A 279 4.234 3.144 0.435 1.00 0.00 N ATOM 901 CA LYS A 279 4.179 4.463 -0.183 1.00 0.00 C ATOM 902 C LYS A 279 4.227 4.355 -1.704 1.00 0.00 C ATOM 903 O LYS A 279 5.023 3.595 -2.257 1.00 0.00 O ATOM 904 CB LYS A 279 5.338 5.330 0.314 1.00 0.00 C ATOM 905 CG LYS A 279 5.839 6.326 -0.718 1.00 0.00 C ATOM 906 CD LYS A 279 4.787 7.375 -1.038 1.00 0.00 C ATOM 907 CE LYS A 279 4.924 8.593 -0.138 1.00 0.00 C ATOM 908 NZ LYS A 279 4.486 9.841 -0.823 1.00 0.00 N ATOM 0 H LYS A 279 5.025 2.572 0.138 1.00 0.00 H new ATOM 0 HA LYS A 279 3.236 4.930 0.100 1.00 0.00 H new ATOM 0 HB2 LYS A 279 5.020 5.872 1.205 1.00 0.00 H new ATOM 0 HB3 LYS A 279 6.163 4.683 0.612 1.00 0.00 H new ATOM 0 HG2 LYS A 279 6.740 6.814 -0.346 1.00 0.00 H new ATOM 0 HG3 LYS A 279 6.116 5.798 -1.630 1.00 0.00 H new ATOM 0 HD2 LYS A 279 4.880 7.679 -2.081 1.00 0.00 H new ATOM 0 HD3 LYS A 279 3.793 6.943 -0.919 1.00 0.00 H new ATOM 0 HE2 LYS A 279 4.330 8.446 0.764 1.00 0.00 H new ATOM 0 HE3 LYS A 279 5.962 8.697 0.177 1.00 0.00 H new ATOM 0 HZ1 LYS A 279 5.219 10.571 -0.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 279 4.335 9.648 -1.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 279 3.598 10.177 -0.398 1.00 0.00 H new ATOM 922 N PHE A 280 3.372 5.119 -2.375 1.00 0.00 N ATOM 923 CA PHE A 280 3.318 5.109 -3.832 1.00 0.00 C ATOM 924 C PHE A 280 3.479 6.519 -4.392 1.00 0.00 C ATOM 925 O PHE A 280 3.014 7.493 -3.798 1.00 0.00 O ATOM 926 CB PHE A 280 1.996 4.506 -4.310 1.00 0.00 C ATOM 927 CG PHE A 280 1.556 3.314 -3.508 1.00 0.00 C ATOM 928 CD1 PHE A 280 0.985 3.478 -2.256 1.00 0.00 C ATOM 929 CD2 PHE A 280 1.713 2.031 -4.006 1.00 0.00 C ATOM 930 CE1 PHE A 280 0.579 2.384 -1.516 1.00 0.00 C ATOM 931 CE2 PHE A 280 1.308 0.933 -3.271 1.00 0.00 C ATOM 932 CZ PHE A 280 0.742 1.110 -2.023 1.00 0.00 C ATOM 0 H PHE A 280 2.707 5.753 -1.933 1.00 0.00 H new ATOM 0 HA PHE A 280 4.142 4.496 -4.197 1.00 0.00 H new ATOM 0 HB2 PHE A 280 1.220 5.270 -4.266 1.00 0.00 H new ATOM 0 HB3 PHE A 280 2.096 4.214 -5.355 1.00 0.00 H new ATOM 0 HD1 PHE A 280 0.856 4.472 -1.854 1.00 0.00 H new ATOM 0 HD2 PHE A 280 2.157 1.887 -4.980 1.00 0.00 H new ATOM 0 HE1 PHE A 280 0.135 2.525 -0.542 1.00 0.00 H new ATOM 0 HE2 PHE A 280 1.434 -0.062 -3.672 1.00 0.00 H new ATOM 0 HZ PHE A 280 0.428 0.253 -1.445 1.00 0.00 H new ATOM 942 N LEU A 281 4.141 6.622 -5.539 1.00 0.00 N ATOM 943 CA LEU A 281 4.364 7.912 -6.181 1.00 0.00 C ATOM 944 C LEU A 281 3.052 8.673 -6.347 1.00 0.00 C ATOM 945 O LEU A 281 2.868 9.746 -5.772 1.00 0.00 O ATOM 946 CB LEU A 281 5.029 7.718 -7.545 1.00 0.00 C ATOM 947 CG LEU A 281 6.291 6.854 -7.559 1.00 0.00 C ATOM 948 CD1 LEU A 281 6.585 6.362 -8.968 1.00 0.00 C ATOM 949 CD2 LEU A 281 7.476 7.631 -7.005 1.00 0.00 C ATOM 0 H LEU A 281 4.533 5.827 -6.044 1.00 0.00 H new ATOM 0 HA LEU A 281 5.024 8.498 -5.541 1.00 0.00 H new ATOM 0 HB2 LEU A 281 4.300 7.273 -8.222 1.00 0.00 H new ATOM 0 HB3 LEU A 281 5.280 8.699 -7.947 1.00 0.00 H new ATOM 0 HG LEU A 281 6.121 5.987 -6.921 1.00 0.00 H new ATOM 0 HD11 LEU A 281 7.486 5.749 -8.959 1.00 0.00 H new ATOM 0 HD12 LEU A 281 5.745 5.767 -9.328 1.00 0.00 H new ATOM 0 HD13 LEU A 281 6.734 7.217 -9.628 1.00 0.00 H new ATOM 0 HD21 LEU A 281 8.365 7.000 -7.023 1.00 0.00 H new ATOM 0 HD22 LEU A 281 7.648 8.517 -7.616 1.00 0.00 H new ATOM 0 HD23 LEU A 281 7.266 7.933 -5.979 1.00 0.00 H new ATOM 961 N SER A 282 2.142 8.108 -7.134 1.00 0.00 N ATOM 962 CA SER A 282 0.847 8.734 -7.376 1.00 0.00 C ATOM 963 C SER A 282 -0.235 8.093 -6.513 1.00 0.00 C ATOM 964 O SER A 282 -0.111 6.956 -6.059 1.00 0.00 O ATOM 965 CB SER A 282 0.471 8.619 -8.855 1.00 0.00 C ATOM 966 OG SER A 282 1.228 9.519 -9.645 1.00 0.00 O ATOM 0 H SER A 282 2.277 7.219 -7.615 1.00 0.00 H new ATOM 0 HA SER A 282 0.924 9.788 -7.108 1.00 0.00 H new ATOM 0 HB2 SER A 282 0.640 7.598 -9.198 1.00 0.00 H new ATOM 0 HB3 SER A 282 -0.592 8.826 -8.980 1.00 0.00 H new ATOM 0 HG SER A 282 0.970 9.425 -10.586 1.00 0.00 H new ATOM 972 N PRO A 283 -1.324 8.841 -6.280 1.00 0.00 N ATOM 973 CA PRO A 283 -2.451 8.368 -5.471 1.00 0.00 C ATOM 974 C PRO A 283 -3.368 7.428 -6.246 1.00 0.00 C ATOM 975 O PRO A 283 -4.124 6.657 -5.656 1.00 0.00 O ATOM 976 CB PRO A 283 -3.191 9.657 -5.105 1.00 0.00 C ATOM 977 CG PRO A 283 -2.884 10.598 -6.217 1.00 0.00 C ATOM 978 CD PRO A 283 -1.540 10.206 -6.790 1.00 0.00 C ATOM 0 HA PRO A 283 -2.119 7.791 -4.608 1.00 0.00 H new ATOM 0 HB2 PRO A 283 -4.264 9.486 -5.016 1.00 0.00 H new ATOM 0 HB3 PRO A 283 -2.850 10.051 -4.147 1.00 0.00 H new ATOM 0 HG2 PRO A 283 -3.656 10.549 -6.984 1.00 0.00 H new ATOM 0 HG3 PRO A 283 -2.860 11.625 -5.854 1.00 0.00 H new ATOM 0 HD2 PRO A 283 -1.548 10.229 -7.880 1.00 0.00 H new ATOM 0 HD3 PRO A 283 -0.752 10.885 -6.462 1.00 0.00 H new ATOM 986 N GLN A 284 -3.296 7.499 -7.572 1.00 0.00 N ATOM 987 CA GLN A 284 -4.121 6.655 -8.427 1.00 0.00 C ATOM 988 C GLN A 284 -3.725 5.188 -8.290 1.00 0.00 C ATOM 989 O GLN A 284 -4.552 4.293 -8.462 1.00 0.00 O ATOM 990 CB GLN A 284 -3.995 7.094 -9.887 1.00 0.00 C ATOM 991 CG GLN A 284 -5.034 6.467 -10.803 1.00 0.00 C ATOM 992 CD GLN A 284 -5.022 7.065 -12.195 1.00 0.00 C ATOM 993 OE1 GLN A 284 -4.876 8.277 -12.362 1.00 0.00 O ATOM 994 NE2 GLN A 284 -5.176 6.218 -13.206 1.00 0.00 N ATOM 0 H GLN A 284 -2.675 8.132 -8.076 1.00 0.00 H new ATOM 0 HA GLN A 284 -5.158 6.764 -8.110 1.00 0.00 H new ATOM 0 HB2 GLN A 284 -4.083 8.179 -9.940 1.00 0.00 H new ATOM 0 HB3 GLN A 284 -3.000 6.837 -10.250 1.00 0.00 H new ATOM 0 HG2 GLN A 284 -4.853 5.394 -10.871 1.00 0.00 H new ATOM 0 HG3 GLN A 284 -6.024 6.596 -10.365 1.00 0.00 H new ATOM 0 HE21 GLN A 284 -5.294 5.221 -13.023 1.00 0.00 H new ATOM 0 HE22 GLN A 284 -5.176 6.564 -14.166 1.00 0.00 H new ATOM 1003 N ASP A 285 -2.455 4.951 -7.979 1.00 0.00 N ATOM 1004 CA ASP A 285 -1.949 3.592 -7.817 1.00 0.00 C ATOM 1005 C ASP A 285 -2.422 2.990 -6.498 1.00 0.00 C ATOM 1006 O ASP A 285 -2.929 1.868 -6.461 1.00 0.00 O ATOM 1007 CB ASP A 285 -0.421 3.585 -7.877 1.00 0.00 C ATOM 1008 CG ASP A 285 0.108 4.012 -9.232 1.00 0.00 C ATOM 1009 OD1 ASP A 285 0.299 5.229 -9.437 1.00 0.00 O ATOM 1010 OD2 ASP A 285 0.330 3.130 -10.088 1.00 0.00 O ATOM 0 H ASP A 285 -1.758 5.681 -7.834 1.00 0.00 H new ATOM 0 HA ASP A 285 -2.340 2.984 -8.633 1.00 0.00 H new ATOM 0 HB2 ASP A 285 -0.027 4.252 -7.110 1.00 0.00 H new ATOM 0 HB3 ASP A 285 -0.056 2.584 -7.647 1.00 0.00 H new ATOM 1015 N THR A 286 -2.252 3.742 -5.415 1.00 0.00 N ATOM 1016 CA THR A 286 -2.659 3.281 -4.093 1.00 0.00 C ATOM 1017 C THR A 286 -4.171 3.110 -4.012 1.00 0.00 C ATOM 1018 O THR A 286 -4.666 2.115 -3.482 1.00 0.00 O ATOM 1019 CB THR A 286 -2.205 4.259 -2.993 1.00 0.00 C ATOM 1020 OG1 THR A 286 -2.026 3.558 -1.758 1.00 0.00 O ATOM 1021 CG2 THR A 286 -3.222 5.374 -2.807 1.00 0.00 C ATOM 0 H THR A 286 -1.835 4.673 -5.427 1.00 0.00 H new ATOM 0 HA THR A 286 -2.178 2.316 -3.933 1.00 0.00 H new ATOM 0 HB THR A 286 -1.257 4.701 -3.299 1.00 0.00 H new ATOM 0 HG1 THR A 286 -1.069 3.468 -1.569 1.00 0.00 H new ATOM 0 HG21 THR A 286 -2.880 6.052 -2.025 1.00 0.00 H new ATOM 0 HG22 THR A 286 -3.334 5.924 -3.741 1.00 0.00 H new ATOM 0 HG23 THR A 286 -4.183 4.946 -2.521 1.00 0.00 H new ATOM 1029 N PHE A 287 -4.902 4.086 -4.542 1.00 0.00 N ATOM 1030 CA PHE A 287 -6.359 4.043 -4.529 1.00 0.00 C ATOM 1031 C PHE A 287 -6.863 2.613 -4.699 1.00 0.00 C ATOM 1032 O PHE A 287 -7.876 2.227 -4.117 1.00 0.00 O ATOM 1033 CB PHE A 287 -6.927 4.931 -5.638 1.00 0.00 C ATOM 1034 CG PHE A 287 -8.427 4.996 -5.646 1.00 0.00 C ATOM 1035 CD1 PHE A 287 -9.109 5.698 -4.665 1.00 0.00 C ATOM 1036 CD2 PHE A 287 -9.156 4.355 -6.635 1.00 0.00 C ATOM 1037 CE1 PHE A 287 -10.489 5.758 -4.670 1.00 0.00 C ATOM 1038 CE2 PHE A 287 -10.537 4.412 -6.645 1.00 0.00 C ATOM 1039 CZ PHE A 287 -11.205 5.116 -5.661 1.00 0.00 C ATOM 0 H PHE A 287 -4.509 4.916 -4.986 1.00 0.00 H new ATOM 0 HA PHE A 287 -6.699 4.417 -3.563 1.00 0.00 H new ATOM 0 HB2 PHE A 287 -6.528 5.939 -5.525 1.00 0.00 H new ATOM 0 HB3 PHE A 287 -6.583 4.558 -6.603 1.00 0.00 H new ATOM 0 HD1 PHE A 287 -8.555 6.204 -3.888 1.00 0.00 H new ATOM 0 HD2 PHE A 287 -8.639 3.804 -7.407 1.00 0.00 H new ATOM 0 HE1 PHE A 287 -11.008 6.307 -3.899 1.00 0.00 H new ATOM 0 HE2 PHE A 287 -11.093 3.907 -7.421 1.00 0.00 H new ATOM 0 HZ PHE A 287 -12.284 5.164 -5.667 1.00 0.00 H new ATOM 1049 N GLU A 288 -6.148 1.832 -5.503 1.00 0.00 N ATOM 1050 CA GLU A 288 -6.523 0.445 -5.751 1.00 0.00 C ATOM 1051 C GLU A 288 -6.293 -0.412 -4.509 1.00 0.00 C ATOM 1052 O GLU A 288 -7.171 -1.166 -4.091 1.00 0.00 O ATOM 1053 CB GLU A 288 -5.725 -0.120 -6.929 1.00 0.00 C ATOM 1054 CG GLU A 288 -5.875 0.686 -8.208 1.00 0.00 C ATOM 1055 CD GLU A 288 -7.263 0.573 -8.809 1.00 0.00 C ATOM 1056 OE1 GLU A 288 -7.738 -0.566 -8.995 1.00 0.00 O ATOM 1057 OE2 GLU A 288 -7.873 1.625 -9.093 1.00 0.00 O ATOM 0 H GLU A 288 -5.307 2.136 -5.993 1.00 0.00 H new ATOM 0 HA GLU A 288 -7.585 0.421 -5.996 1.00 0.00 H new ATOM 0 HB2 GLU A 288 -4.670 -0.160 -6.657 1.00 0.00 H new ATOM 0 HB3 GLU A 288 -6.045 -1.145 -7.116 1.00 0.00 H new ATOM 0 HG2 GLU A 288 -5.657 1.734 -8.001 1.00 0.00 H new ATOM 0 HG3 GLU A 288 -5.139 0.345 -8.936 1.00 0.00 H new ATOM 1064 N ALA A 289 -5.105 -0.290 -3.926 1.00 0.00 N ATOM 1065 CA ALA A 289 -4.760 -1.051 -2.732 1.00 0.00 C ATOM 1066 C ALA A 289 -5.842 -0.921 -1.665 1.00 0.00 C ATOM 1067 O ALA A 289 -5.998 -1.798 -0.814 1.00 0.00 O ATOM 1068 CB ALA A 289 -3.417 -0.592 -2.183 1.00 0.00 C ATOM 0 H ALA A 289 -4.366 0.328 -4.261 1.00 0.00 H new ATOM 0 HA ALA A 289 -4.686 -2.102 -3.011 1.00 0.00 H new ATOM 0 HB1 ALA A 289 -3.172 -1.169 -1.291 1.00 0.00 H new ATOM 0 HB2 ALA A 289 -2.645 -0.744 -2.937 1.00 0.00 H new ATOM 0 HB3 ALA A 289 -3.471 0.466 -1.927 1.00 0.00 H new ATOM 1074 N LEU A 290 -6.585 0.179 -1.715 1.00 0.00 N ATOM 1075 CA LEU A 290 -7.653 0.424 -0.752 1.00 0.00 C ATOM 1076 C LEU A 290 -8.861 -0.462 -1.040 1.00 0.00 C ATOM 1077 O LEU A 290 -9.328 -1.196 -0.169 1.00 0.00 O ATOM 1078 CB LEU A 290 -8.067 1.897 -0.785 1.00 0.00 C ATOM 1079 CG LEU A 290 -7.043 2.894 -0.242 1.00 0.00 C ATOM 1080 CD1 LEU A 290 -7.436 4.316 -0.611 1.00 0.00 C ATOM 1081 CD2 LEU A 290 -6.906 2.751 1.266 1.00 0.00 C ATOM 0 H LEU A 290 -6.468 0.915 -2.411 1.00 0.00 H new ATOM 0 HA LEU A 290 -7.276 0.180 0.241 1.00 0.00 H new ATOM 0 HB2 LEU A 290 -8.295 2.167 -1.816 1.00 0.00 H new ATOM 0 HB3 LEU A 290 -8.989 2.007 -0.215 1.00 0.00 H new ATOM 0 HG LEU A 290 -6.076 2.676 -0.696 1.00 0.00 H new ATOM 0 HD11 LEU A 290 -6.696 5.012 -0.216 1.00 0.00 H new ATOM 0 HD12 LEU A 290 -7.481 4.411 -1.696 1.00 0.00 H new ATOM 0 HD13 LEU A 290 -8.413 4.545 -0.186 1.00 0.00 H new ATOM 0 HD21 LEU A 290 -6.173 3.469 1.634 1.00 0.00 H new ATOM 0 HD22 LEU A 290 -7.870 2.942 1.739 1.00 0.00 H new ATOM 0 HD23 LEU A 290 -6.577 1.740 1.507 1.00 0.00 H new ATOM 1093 N LYS A 291 -9.362 -0.389 -2.269 1.00 0.00 N ATOM 1094 CA LYS A 291 -10.513 -1.187 -2.674 1.00 0.00 C ATOM 1095 C LYS A 291 -10.207 -2.678 -2.568 1.00 0.00 C ATOM 1096 O LYS A 291 -11.117 -3.504 -2.500 1.00 0.00 O ATOM 1097 CB LYS A 291 -10.920 -0.840 -4.108 1.00 0.00 C ATOM 1098 CG LYS A 291 -10.155 -1.621 -5.163 1.00 0.00 C ATOM 1099 CD LYS A 291 -10.692 -1.347 -6.558 1.00 0.00 C ATOM 1100 CE LYS A 291 -10.061 -0.102 -7.163 1.00 0.00 C ATOM 1101 NZ LYS A 291 -10.345 1.114 -6.352 1.00 0.00 N ATOM 0 H LYS A 291 -8.989 0.215 -3.002 1.00 0.00 H new ATOM 0 HA LYS A 291 -11.339 -0.955 -2.001 1.00 0.00 H new ATOM 0 HB2 LYS A 291 -11.987 -1.029 -4.230 1.00 0.00 H new ATOM 0 HB3 LYS A 291 -10.764 0.226 -4.273 1.00 0.00 H new ATOM 0 HG2 LYS A 291 -9.099 -1.355 -5.120 1.00 0.00 H new ATOM 0 HG3 LYS A 291 -10.224 -2.688 -4.949 1.00 0.00 H new ATOM 0 HD2 LYS A 291 -10.494 -2.205 -7.200 1.00 0.00 H new ATOM 0 HD3 LYS A 291 -11.774 -1.224 -6.515 1.00 0.00 H new ATOM 0 HE2 LYS A 291 -8.983 -0.243 -7.241 1.00 0.00 H new ATOM 0 HE3 LYS A 291 -10.438 0.041 -8.176 1.00 0.00 H new ATOM 0 HZ1 LYS A 291 -10.224 1.961 -6.943 1.00 0.00 H new ATOM 0 HZ2 LYS A 291 -11.322 1.075 -5.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 291 -9.687 1.156 -5.547 1.00 0.00 H new ATOM 1115 N ARG A 292 -8.921 -3.013 -2.553 1.00 0.00 N ATOM 1116 CA ARG A 292 -8.496 -4.404 -2.454 1.00 0.00 C ATOM 1117 C ARG A 292 -8.508 -4.875 -1.003 1.00 0.00 C ATOM 1118 O ARG A 292 -8.471 -6.074 -0.728 1.00 0.00 O ATOM 1119 CB ARG A 292 -7.095 -4.575 -3.045 1.00 0.00 C ATOM 1120 CG ARG A 292 -7.025 -4.291 -4.537 1.00 0.00 C ATOM 1121 CD ARG A 292 -5.610 -3.940 -4.971 1.00 0.00 C ATOM 1122 NE ARG A 292 -5.418 -4.118 -6.408 1.00 0.00 N ATOM 1123 CZ ARG A 292 -5.204 -5.298 -6.980 1.00 0.00 C ATOM 1124 NH1 ARG A 292 -5.155 -6.397 -6.240 1.00 0.00 N ATOM 1125 NH2 ARG A 292 -5.039 -5.379 -8.294 1.00 0.00 N ATOM 0 H ARG A 292 -8.156 -2.341 -2.608 1.00 0.00 H new ATOM 0 HA ARG A 292 -9.200 -5.013 -3.021 1.00 0.00 H new ATOM 0 HB2 ARG A 292 -6.406 -3.910 -2.524 1.00 0.00 H new ATOM 0 HB3 ARG A 292 -6.754 -5.594 -2.861 1.00 0.00 H new ATOM 0 HG2 ARG A 292 -7.371 -5.163 -5.091 1.00 0.00 H new ATOM 0 HG3 ARG A 292 -7.697 -3.469 -4.784 1.00 0.00 H new ATOM 0 HD2 ARG A 292 -5.394 -2.906 -4.702 1.00 0.00 H new ATOM 0 HD3 ARG A 292 -4.899 -4.565 -4.430 1.00 0.00 H new ATOM 0 HE ARG A 292 -5.450 -3.291 -7.005 1.00 0.00 H new ATOM 0 HH11 ARG A 292 -5.282 -6.338 -5.230 1.00 0.00 H new ATOM 0 HH12 ARG A 292 -4.991 -7.302 -6.681 1.00 0.00 H new ATOM 0 HH21 ARG A 292 -5.076 -4.535 -8.866 1.00 0.00 H new ATOM 0 HH22 ARG A 292 -4.875 -6.285 -8.732 1.00 0.00 H new ATOM 1139 N ASN A 293 -8.559 -3.922 -0.078 1.00 0.00 N ATOM 1140 CA ASN A 293 -8.575 -4.239 1.346 1.00 0.00 C ATOM 1141 C ASN A 293 -9.503 -5.416 1.631 1.00 0.00 C ATOM 1142 O ASN A 293 -10.473 -5.644 0.908 1.00 0.00 O ATOM 1143 CB ASN A 293 -9.017 -3.019 2.156 1.00 0.00 C ATOM 1144 CG ASN A 293 -10.519 -2.813 2.118 1.00 0.00 C ATOM 1145 OD1 ASN A 293 -11.168 -3.079 1.106 1.00 0.00 O ATOM 1146 ND2 ASN A 293 -11.079 -2.335 3.223 1.00 0.00 N ATOM 0 H ASN A 293 -8.590 -2.924 -0.289 1.00 0.00 H new ATOM 0 HA ASN A 293 -7.564 -4.517 1.642 1.00 0.00 H new ATOM 0 HB2 ASN A 293 -8.695 -3.137 3.191 1.00 0.00 H new ATOM 0 HB3 ASN A 293 -8.521 -2.129 1.768 1.00 0.00 H new ATOM 0 HD21 ASN A 293 -12.086 -2.174 3.256 1.00 0.00 H new ATOM 0 HD22 ASN A 293 -10.502 -2.129 4.039 1.00 0.00 H new ATOM 1153 N ARG A 294 -9.198 -6.160 2.689 1.00 0.00 N ATOM 1154 CA ARG A 294 -10.003 -7.314 3.069 1.00 0.00 C ATOM 1155 C ARG A 294 -9.927 -8.405 2.005 1.00 0.00 C ATOM 1156 O ARG A 294 -10.904 -9.110 1.754 1.00 0.00 O ATOM 1157 CB ARG A 294 -11.459 -6.898 3.284 1.00 0.00 C ATOM 1158 CG ARG A 294 -11.631 -5.793 4.314 1.00 0.00 C ATOM 1159 CD ARG A 294 -11.539 -6.335 5.732 1.00 0.00 C ATOM 1160 NE ARG A 294 -12.701 -7.146 6.085 1.00 0.00 N ATOM 1161 CZ ARG A 294 -12.859 -7.728 7.269 1.00 0.00 C ATOM 1162 NH1 ARG A 294 -11.933 -7.589 8.208 1.00 0.00 N ATOM 1163 NH2 ARG A 294 -13.944 -8.451 7.515 1.00 0.00 N ATOM 0 H ARG A 294 -8.399 -5.984 3.298 1.00 0.00 H new ATOM 0 HA ARG A 294 -9.604 -7.712 4.002 1.00 0.00 H new ATOM 0 HB2 ARG A 294 -11.877 -6.566 2.334 1.00 0.00 H new ATOM 0 HB3 ARG A 294 -12.034 -7.769 3.598 1.00 0.00 H new ATOM 0 HG2 ARG A 294 -10.866 -5.032 4.164 1.00 0.00 H new ATOM 0 HG3 ARG A 294 -12.596 -5.307 4.171 1.00 0.00 H new ATOM 0 HD2 ARG A 294 -10.634 -6.935 5.833 1.00 0.00 H new ATOM 0 HD3 ARG A 294 -11.450 -5.504 6.432 1.00 0.00 H new ATOM 0 HE ARG A 294 -13.431 -7.273 5.384 1.00 0.00 H new ATOM 0 HH11 ARG A 294 -11.097 -7.034 8.022 1.00 0.00 H new ATOM 0 HH12 ARG A 294 -12.056 -8.037 9.116 1.00 0.00 H new ATOM 0 HH21 ARG A 294 -14.658 -8.561 6.795 1.00 0.00 H new ATOM 0 HH22 ARG A 294 -14.064 -8.897 8.424 1.00 0.00 H new ATOM 1177 N MET A 295 -8.760 -8.538 1.383 1.00 0.00 N ATOM 1178 CA MET A 295 -8.556 -9.543 0.347 1.00 0.00 C ATOM 1179 C MET A 295 -7.778 -10.736 0.892 1.00 0.00 C ATOM 1180 O MET A 295 -7.477 -10.801 2.085 1.00 0.00 O ATOM 1181 CB MET A 295 -7.812 -8.935 -0.844 1.00 0.00 C ATOM 1182 CG MET A 295 -8.733 -8.367 -1.911 1.00 0.00 C ATOM 1183 SD MET A 295 -9.289 -9.617 -3.086 1.00 0.00 S ATOM 1184 CE MET A 295 -9.373 -8.652 -4.592 1.00 0.00 C ATOM 0 H MET A 295 -7.941 -7.962 1.579 1.00 0.00 H new ATOM 0 HA MET A 295 -9.535 -9.891 0.016 1.00 0.00 H new ATOM 0 HB2 MET A 295 -7.154 -8.144 -0.485 1.00 0.00 H new ATOM 0 HB3 MET A 295 -7.177 -9.698 -1.293 1.00 0.00 H new ATOM 0 HG2 MET A 295 -9.600 -7.913 -1.432 1.00 0.00 H new ATOM 0 HG3 MET A 295 -8.214 -7.574 -2.449 1.00 0.00 H new ATOM 0 HE1 MET A 295 -9.703 -9.288 -5.414 1.00 0.00 H new ATOM 0 HE2 MET A 295 -10.080 -7.833 -4.460 1.00 0.00 H new ATOM 0 HE3 MET A 295 -8.387 -8.247 -4.820 1.00 0.00 H new ATOM 1194 N LEU A 296 -7.457 -11.679 0.013 1.00 0.00 N ATOM 1195 CA LEU A 296 -6.714 -12.871 0.407 1.00 0.00 C ATOM 1196 C LEU A 296 -5.227 -12.709 0.109 1.00 0.00 C ATOM 1197 O LEU A 296 -4.846 -12.056 -0.863 1.00 0.00 O ATOM 1198 CB LEU A 296 -7.261 -14.100 -0.320 1.00 0.00 C ATOM 1199 CG LEU A 296 -8.385 -14.855 0.390 1.00 0.00 C ATOM 1200 CD1 LEU A 296 -8.767 -16.103 -0.392 1.00 0.00 C ATOM 1201 CD2 LEU A 296 -7.972 -15.218 1.808 1.00 0.00 C ATOM 0 H LEU A 296 -7.700 -11.641 -0.977 1.00 0.00 H new ATOM 0 HA LEU A 296 -6.837 -13.008 1.481 1.00 0.00 H new ATOM 0 HB2 LEU A 296 -7.623 -13.787 -1.299 1.00 0.00 H new ATOM 0 HB3 LEU A 296 -6.437 -14.793 -0.491 1.00 0.00 H new ATOM 0 HG LEU A 296 -9.257 -14.203 0.443 1.00 0.00 H new ATOM 0 HD11 LEU A 296 -9.568 -16.627 0.128 1.00 0.00 H new ATOM 0 HD12 LEU A 296 -9.106 -15.819 -1.388 1.00 0.00 H new ATOM 0 HD13 LEU A 296 -7.900 -16.758 -0.478 1.00 0.00 H new ATOM 0 HD21 LEU A 296 -8.785 -15.755 2.298 1.00 0.00 H new ATOM 0 HD22 LEU A 296 -7.085 -15.851 1.778 1.00 0.00 H new ATOM 0 HD23 LEU A 296 -7.750 -14.309 2.366 1.00 0.00 H new ATOM 1213 N MET A 297 -4.391 -13.310 0.949 1.00 0.00 N ATOM 1214 CA MET A 297 -2.945 -13.235 0.773 1.00 0.00 C ATOM 1215 C MET A 297 -2.244 -14.345 1.551 1.00 0.00 C ATOM 1216 O MET A 297 -2.171 -14.303 2.779 1.00 0.00 O ATOM 1217 CB MET A 297 -2.424 -11.870 1.228 1.00 0.00 C ATOM 1218 CG MET A 297 -0.949 -11.653 0.931 1.00 0.00 C ATOM 1219 SD MET A 297 -0.221 -10.353 1.946 1.00 0.00 S ATOM 1220 CE MET A 297 0.597 -9.366 0.695 1.00 0.00 C ATOM 0 H MET A 297 -4.690 -13.854 1.758 1.00 0.00 H new ATOM 0 HA MET A 297 -2.726 -13.364 -0.287 1.00 0.00 H new ATOM 0 HB2 MET A 297 -3.004 -11.087 0.739 1.00 0.00 H new ATOM 0 HB3 MET A 297 -2.589 -11.766 2.300 1.00 0.00 H new ATOM 0 HG2 MET A 297 -0.408 -12.584 1.097 1.00 0.00 H new ATOM 0 HG3 MET A 297 -0.828 -11.398 -0.122 1.00 0.00 H new ATOM 0 HE1 MET A 297 1.643 -9.227 0.967 1.00 0.00 H new ATOM 0 HE2 MET A 297 0.537 -9.875 -0.267 1.00 0.00 H new ATOM 0 HE3 MET A 297 0.109 -8.394 0.622 1.00 0.00 H new ATOM 1230 N ILE A 298 -1.732 -15.335 0.828 1.00 0.00 N ATOM 1231 CA ILE A 298 -1.037 -16.454 1.451 1.00 0.00 C ATOM 1232 C ILE A 298 -1.902 -17.112 2.521 1.00 0.00 C ATOM 1233 O ILE A 298 -1.429 -17.413 3.617 1.00 0.00 O ATOM 1234 CB ILE A 298 0.294 -16.008 2.086 1.00 0.00 C ATOM 1235 CG1 ILE A 298 1.079 -15.128 1.112 1.00 0.00 C ATOM 1236 CG2 ILE A 298 1.117 -17.219 2.496 1.00 0.00 C ATOM 1237 CD1 ILE A 298 2.144 -14.288 1.780 1.00 0.00 C ATOM 0 H ILE A 298 -1.785 -15.385 -0.189 1.00 0.00 H new ATOM 0 HA ILE A 298 -0.829 -17.175 0.660 1.00 0.00 H new ATOM 0 HB ILE A 298 0.076 -15.423 2.979 1.00 0.00 H new ATOM 0 HG12 ILE A 298 1.547 -15.762 0.359 1.00 0.00 H new ATOM 0 HG13 ILE A 298 0.385 -14.471 0.589 1.00 0.00 H new ATOM 0 HG21 ILE A 298 2.054 -16.888 2.943 1.00 0.00 H new ATOM 0 HG22 ILE A 298 0.558 -17.810 3.221 1.00 0.00 H new ATOM 0 HG23 ILE A 298 1.329 -17.829 1.618 1.00 0.00 H new ATOM 0 HD11 ILE A 298 2.660 -13.690 1.029 1.00 0.00 H new ATOM 0 HD12 ILE A 298 1.680 -13.628 2.513 1.00 0.00 H new ATOM 0 HD13 ILE A 298 2.861 -14.939 2.280 1.00 0.00 H new ATOM 1249 N GLN A 299 -3.171 -17.333 2.194 1.00 0.00 N ATOM 1250 CA GLN A 299 -4.102 -17.957 3.127 1.00 0.00 C ATOM 1251 C GLN A 299 -4.342 -17.060 4.337 1.00 0.00 C ATOM 1252 O GLN A 299 -4.669 -17.541 5.423 1.00 0.00 O ATOM 1253 CB GLN A 299 -3.568 -19.316 3.582 1.00 0.00 C ATOM 1254 CG GLN A 299 -3.149 -20.220 2.434 1.00 0.00 C ATOM 1255 CD GLN A 299 -3.142 -21.687 2.819 1.00 0.00 C ATOM 1256 OE1 GLN A 299 -3.672 -22.069 3.863 1.00 0.00 O ATOM 1257 NE2 GLN A 299 -2.541 -22.518 1.975 1.00 0.00 N ATOM 0 H GLN A 299 -3.578 -17.090 1.291 1.00 0.00 H new ATOM 0 HA GLN A 299 -5.051 -18.103 2.611 1.00 0.00 H new ATOM 0 HB2 GLN A 299 -2.714 -19.159 4.241 1.00 0.00 H new ATOM 0 HB3 GLN A 299 -4.335 -19.820 4.169 1.00 0.00 H new ATOM 0 HG2 GLN A 299 -3.827 -20.072 1.594 1.00 0.00 H new ATOM 0 HG3 GLN A 299 -2.154 -19.933 2.095 1.00 0.00 H new ATOM 0 HE21 GLN A 299 -2.115 -22.158 1.121 1.00 0.00 H new ATOM 0 HE22 GLN A 299 -2.506 -23.516 2.181 1.00 0.00 H new ATOM 1266 N ARG A 300 -4.178 -15.756 4.143 1.00 0.00 N ATOM 1267 CA ARG A 300 -4.376 -14.793 5.219 1.00 0.00 C ATOM 1268 C ARG A 300 -5.101 -13.550 4.711 1.00 0.00 C ATOM 1269 O ARG A 300 -5.004 -13.201 3.534 1.00 0.00 O ATOM 1270 CB ARG A 300 -3.031 -14.396 5.831 1.00 0.00 C ATOM 1271 CG ARG A 300 -2.602 -15.285 6.987 1.00 0.00 C ATOM 1272 CD ARG A 300 -3.432 -15.018 8.233 1.00 0.00 C ATOM 1273 NE ARG A 300 -4.621 -15.863 8.290 1.00 0.00 N ATOM 1274 CZ ARG A 300 -4.622 -17.099 8.777 1.00 0.00 C ATOM 1275 NH1 ARG A 300 -3.501 -17.630 9.247 1.00 0.00 N ATOM 1276 NH2 ARG A 300 -5.744 -17.806 8.795 1.00 0.00 N ATOM 0 H ARG A 300 -3.908 -15.342 3.251 1.00 0.00 H new ATOM 0 HA ARG A 300 -4.992 -15.265 5.985 1.00 0.00 H new ATOM 0 HB2 ARG A 300 -2.265 -14.427 5.056 1.00 0.00 H new ATOM 0 HB3 ARG A 300 -3.090 -13.365 6.179 1.00 0.00 H new ATOM 0 HG2 ARG A 300 -2.702 -16.332 6.699 1.00 0.00 H new ATOM 0 HG3 ARG A 300 -1.548 -15.114 7.207 1.00 0.00 H new ATOM 0 HD2 ARG A 300 -2.821 -15.191 9.119 1.00 0.00 H new ATOM 0 HD3 ARG A 300 -3.731 -13.970 8.252 1.00 0.00 H new ATOM 0 HE ARG A 300 -5.499 -15.484 7.936 1.00 0.00 H new ATOM 0 HH11 ARG A 300 -2.636 -17.089 9.235 1.00 0.00 H new ATOM 0 HH12 ARG A 300 -3.504 -18.579 9.621 1.00 0.00 H new ATOM 0 HH21 ARG A 300 -6.608 -17.401 8.435 1.00 0.00 H new ATOM 0 HH22 ARG A 300 -5.743 -18.755 9.169 1.00 0.00 H new ATOM 1290 N TYR A 301 -5.827 -12.888 5.604 1.00 0.00 N ATOM 1291 CA TYR A 301 -6.571 -11.686 5.246 1.00 0.00 C ATOM 1292 C TYR A 301 -5.783 -10.430 5.605 1.00 0.00 C ATOM 1293 O TYR A 301 -5.386 -10.239 6.755 1.00 0.00 O ATOM 1294 CB TYR A 301 -7.927 -11.671 5.953 1.00 0.00 C ATOM 1295 CG TYR A 301 -8.839 -12.803 5.537 1.00 0.00 C ATOM 1296 CD1 TYR A 301 -9.434 -12.817 4.282 1.00 0.00 C ATOM 1297 CD2 TYR A 301 -9.106 -13.858 6.401 1.00 0.00 C ATOM 1298 CE1 TYR A 301 -10.268 -13.849 3.899 1.00 0.00 C ATOM 1299 CE2 TYR A 301 -9.938 -14.895 6.025 1.00 0.00 C ATOM 1300 CZ TYR A 301 -10.517 -14.886 4.774 1.00 0.00 C ATOM 1301 OH TYR A 301 -11.347 -15.916 4.395 1.00 0.00 O ATOM 0 H TYR A 301 -5.917 -13.163 6.582 1.00 0.00 H new ATOM 0 HA TYR A 301 -6.731 -11.696 4.168 1.00 0.00 H new ATOM 0 HB2 TYR A 301 -7.766 -11.722 7.030 1.00 0.00 H new ATOM 0 HB3 TYR A 301 -8.423 -10.722 5.749 1.00 0.00 H new ATOM 0 HD1 TYR A 301 -9.241 -12.007 3.594 1.00 0.00 H new ATOM 0 HD2 TYR A 301 -8.656 -13.868 7.383 1.00 0.00 H new ATOM 0 HE1 TYR A 301 -10.723 -13.844 2.919 1.00 0.00 H new ATOM 0 HE2 TYR A 301 -10.134 -15.709 6.708 1.00 0.00 H new ATOM 0 HH TYR A 301 -11.416 -16.566 5.125 1.00 0.00 H new ATOM 1311 N VAL A 302 -5.560 -9.575 4.612 1.00 0.00 N ATOM 1312 CA VAL A 302 -4.822 -8.335 4.822 1.00 0.00 C ATOM 1313 C VAL A 302 -5.769 -7.149 4.967 1.00 0.00 C ATOM 1314 O VAL A 302 -6.822 -7.103 4.332 1.00 0.00 O ATOM 1315 CB VAL A 302 -3.845 -8.060 3.663 1.00 0.00 C ATOM 1316 CG1 VAL A 302 -2.607 -8.935 3.789 1.00 0.00 C ATOM 1317 CG2 VAL A 302 -4.532 -8.284 2.324 1.00 0.00 C ATOM 0 H VAL A 302 -5.880 -9.718 3.654 1.00 0.00 H new ATOM 0 HA VAL A 302 -4.254 -8.457 5.744 1.00 0.00 H new ATOM 0 HB VAL A 302 -3.530 -7.018 3.715 1.00 0.00 H new ATOM 0 HG11 VAL A 302 -1.929 -8.727 2.962 1.00 0.00 H new ATOM 0 HG12 VAL A 302 -2.105 -8.721 4.733 1.00 0.00 H new ATOM 0 HG13 VAL A 302 -2.899 -9.985 3.763 1.00 0.00 H new ATOM 0 HG21 VAL A 302 -3.828 -8.085 1.516 1.00 0.00 H new ATOM 0 HG22 VAL A 302 -4.876 -9.316 2.260 1.00 0.00 H new ATOM 0 HG23 VAL A 302 -5.385 -7.611 2.236 1.00 0.00 H new ATOM 1327 N GLU A 303 -5.385 -6.191 5.805 1.00 0.00 N ATOM 1328 CA GLU A 303 -6.201 -5.004 6.033 1.00 0.00 C ATOM 1329 C GLU A 303 -5.469 -3.745 5.577 1.00 0.00 C ATOM 1330 O GLU A 303 -4.586 -3.242 6.272 1.00 0.00 O ATOM 1331 CB GLU A 303 -6.568 -4.887 7.513 1.00 0.00 C ATOM 1332 CG GLU A 303 -7.906 -4.210 7.757 1.00 0.00 C ATOM 1333 CD GLU A 303 -7.980 -3.534 9.113 1.00 0.00 C ATOM 1334 OE1 GLU A 303 -7.048 -2.774 9.448 1.00 0.00 O ATOM 1335 OE2 GLU A 303 -8.969 -3.766 9.838 1.00 0.00 O ATOM 0 H GLU A 303 -4.515 -6.214 6.337 1.00 0.00 H new ATOM 0 HA GLU A 303 -7.115 -5.104 5.447 1.00 0.00 H new ATOM 0 HB2 GLU A 303 -6.589 -5.884 7.953 1.00 0.00 H new ATOM 0 HB3 GLU A 303 -5.788 -4.327 8.029 1.00 0.00 H new ATOM 0 HG2 GLU A 303 -8.082 -3.470 6.976 1.00 0.00 H new ATOM 0 HG3 GLU A 303 -8.703 -4.950 7.680 1.00 0.00 H new ATOM 1342 N VAL A 304 -5.842 -3.242 4.405 1.00 0.00 N ATOM 1343 CA VAL A 304 -5.223 -2.042 3.856 1.00 0.00 C ATOM 1344 C VAL A 304 -6.065 -0.806 4.149 1.00 0.00 C ATOM 1345 O VAL A 304 -7.274 -0.797 3.918 1.00 0.00 O ATOM 1346 CB VAL A 304 -5.018 -2.162 2.334 1.00 0.00 C ATOM 1347 CG1 VAL A 304 -4.288 -0.941 1.795 1.00 0.00 C ATOM 1348 CG2 VAL A 304 -4.261 -3.438 1.997 1.00 0.00 C ATOM 0 H VAL A 304 -6.570 -3.647 3.817 1.00 0.00 H new ATOM 0 HA VAL A 304 -4.251 -1.938 4.339 1.00 0.00 H new ATOM 0 HB VAL A 304 -5.997 -2.210 1.856 1.00 0.00 H new ATOM 0 HG11 VAL A 304 -4.152 -1.044 0.718 1.00 0.00 H new ATOM 0 HG12 VAL A 304 -4.874 -0.046 2.003 1.00 0.00 H new ATOM 0 HG13 VAL A 304 -3.314 -0.857 2.277 1.00 0.00 H new ATOM 0 HG21 VAL A 304 -4.125 -3.506 0.918 1.00 0.00 H new ATOM 0 HG22 VAL A 304 -3.286 -3.423 2.485 1.00 0.00 H new ATOM 0 HG23 VAL A 304 -4.828 -4.301 2.347 1.00 0.00 H new ATOM 1358 N SER A 305 -5.418 0.238 4.658 1.00 0.00 N ATOM 1359 CA SER A 305 -6.108 1.480 4.986 1.00 0.00 C ATOM 1360 C SER A 305 -5.135 2.655 4.995 1.00 0.00 C ATOM 1361 O SER A 305 -3.941 2.504 5.254 1.00 0.00 O ATOM 1362 CB SER A 305 -6.796 1.362 6.347 1.00 0.00 C ATOM 1363 OG SER A 305 -5.854 1.107 7.374 1.00 0.00 O ATOM 0 H SER A 305 -4.417 0.248 4.852 1.00 0.00 H new ATOM 0 HA SER A 305 -6.863 1.661 4.221 1.00 0.00 H new ATOM 0 HB2 SER A 305 -7.337 2.283 6.566 1.00 0.00 H new ATOM 0 HB3 SER A 305 -7.533 0.559 6.317 1.00 0.00 H new ATOM 0 HG SER A 305 -6.319 1.038 8.234 1.00 0.00 H new ATOM 1369 N PRO A 306 -5.657 3.856 4.706 1.00 0.00 N ATOM 1370 CA PRO A 306 -4.854 5.082 4.675 1.00 0.00 C ATOM 1371 C PRO A 306 -4.043 5.276 5.951 1.00 0.00 C ATOM 1372 O PRO A 306 -4.369 4.714 6.997 1.00 0.00 O ATOM 1373 CB PRO A 306 -5.902 6.189 4.533 1.00 0.00 C ATOM 1374 CG PRO A 306 -7.060 5.531 3.867 1.00 0.00 C ATOM 1375 CD PRO A 306 -7.073 4.110 4.388 1.00 0.00 C ATOM 0 HA PRO A 306 -4.118 5.067 3.871 1.00 0.00 H new ATOM 0 HB2 PRO A 306 -6.183 6.595 5.505 1.00 0.00 H new ATOM 0 HB3 PRO A 306 -5.522 7.019 3.938 1.00 0.00 H new ATOM 0 HG2 PRO A 306 -7.992 6.044 4.104 1.00 0.00 H new ATOM 0 HG3 PRO A 306 -6.952 5.550 2.783 1.00 0.00 H new ATOM 0 HD2 PRO A 306 -7.708 4.010 5.268 1.00 0.00 H new ATOM 0 HD3 PRO A 306 -7.450 3.411 3.642 1.00 0.00 H new ATOM 1383 N ALA A 307 -2.985 6.076 5.859 1.00 0.00 N ATOM 1384 CA ALA A 307 -2.129 6.346 7.008 1.00 0.00 C ATOM 1385 C ALA A 307 -1.763 7.824 7.084 1.00 0.00 C ATOM 1386 O ALA A 307 -1.949 8.571 6.123 1.00 0.00 O ATOM 1387 CB ALA A 307 -0.872 5.491 6.941 1.00 0.00 C ATOM 0 H ALA A 307 -2.700 6.548 5.001 1.00 0.00 H new ATOM 0 HA ALA A 307 -2.682 6.089 7.911 1.00 0.00 H new ATOM 0 HB1 ALA A 307 -0.242 5.702 7.805 1.00 0.00 H new ATOM 0 HB2 ALA A 307 -1.149 4.437 6.943 1.00 0.00 H new ATOM 0 HB3 ALA A 307 -0.324 5.721 6.027 1.00 0.00 H new ATOM 1393 N THR A 308 -1.242 8.242 8.234 1.00 0.00 N ATOM 1394 CA THR A 308 -0.852 9.631 8.436 1.00 0.00 C ATOM 1395 C THR A 308 0.640 9.746 8.730 1.00 0.00 C ATOM 1396 O THR A 308 1.249 8.820 9.265 1.00 0.00 O ATOM 1397 CB THR A 308 -1.642 10.274 9.592 1.00 0.00 C ATOM 1398 OG1 THR A 308 -1.608 9.422 10.742 1.00 0.00 O ATOM 1399 CG2 THR A 308 -3.085 10.528 9.185 1.00 0.00 C ATOM 0 H THR A 308 -1.081 7.637 9.039 1.00 0.00 H new ATOM 0 HA THR A 308 -1.080 10.161 7.511 1.00 0.00 H new ATOM 0 HB THR A 308 -1.176 11.229 9.834 1.00 0.00 H new ATOM 0 HG1 THR A 308 -2.111 9.839 11.473 1.00 0.00 H new ATOM 0 HG21 THR A 308 -3.623 10.982 10.017 1.00 0.00 H new ATOM 0 HG22 THR A 308 -3.108 11.200 8.327 1.00 0.00 H new ATOM 0 HG23 THR A 308 -3.559 9.584 8.918 1.00 0.00 H new ATOM 1407 N GLU A 309 1.222 10.888 8.376 1.00 0.00 N ATOM 1408 CA GLU A 309 2.643 11.122 8.602 1.00 0.00 C ATOM 1409 C GLU A 309 3.067 10.609 9.975 1.00 0.00 C ATOM 1410 O GLU A 309 4.069 9.905 10.105 1.00 0.00 O ATOM 1411 CB GLU A 309 2.962 12.614 8.482 1.00 0.00 C ATOM 1412 CG GLU A 309 4.435 12.938 8.668 1.00 0.00 C ATOM 1413 CD GLU A 309 4.794 14.325 8.172 1.00 0.00 C ATOM 1414 OE1 GLU A 309 4.400 14.671 7.039 1.00 0.00 O ATOM 1415 OE2 GLU A 309 5.468 15.065 8.919 1.00 0.00 O ATOM 0 H GLU A 309 0.732 11.664 7.932 1.00 0.00 H new ATOM 0 HA GLU A 309 3.201 10.576 7.841 1.00 0.00 H new ATOM 0 HB2 GLU A 309 2.642 12.968 7.502 1.00 0.00 H new ATOM 0 HB3 GLU A 309 2.381 13.162 9.224 1.00 0.00 H new ATOM 0 HG2 GLU A 309 4.691 12.857 9.724 1.00 0.00 H new ATOM 0 HG3 GLU A 309 5.036 12.199 8.137 1.00 0.00 H new ATOM 1422 N ARG A 310 2.298 10.968 10.998 1.00 0.00 N ATOM 1423 CA ARG A 310 2.594 10.546 12.362 1.00 0.00 C ATOM 1424 C ARG A 310 2.826 9.039 12.426 1.00 0.00 C ATOM 1425 O ARG A 310 3.771 8.575 13.064 1.00 0.00 O ATOM 1426 CB ARG A 310 1.450 10.937 13.299 1.00 0.00 C ATOM 1427 CG ARG A 310 1.887 11.149 14.739 1.00 0.00 C ATOM 1428 CD ARG A 310 0.920 12.053 15.488 1.00 0.00 C ATOM 1429 NE ARG A 310 1.273 13.463 15.353 1.00 0.00 N ATOM 1430 CZ ARG A 310 0.877 14.404 16.203 1.00 0.00 C ATOM 1431 NH1 ARG A 310 0.119 14.086 17.243 1.00 0.00 N ATOM 1432 NH2 ARG A 310 1.239 15.667 16.012 1.00 0.00 N ATOM 0 H ARG A 310 1.465 11.550 10.908 1.00 0.00 H new ATOM 0 HA ARG A 310 3.505 11.051 12.682 1.00 0.00 H new ATOM 0 HB2 ARG A 310 0.987 11.852 12.930 1.00 0.00 H new ATOM 0 HB3 ARG A 310 0.687 10.159 13.271 1.00 0.00 H new ATOM 0 HG2 ARG A 310 1.953 10.186 15.246 1.00 0.00 H new ATOM 0 HG3 ARG A 310 2.885 11.588 14.757 1.00 0.00 H new ATOM 0 HD2 ARG A 310 -0.090 11.895 15.111 1.00 0.00 H new ATOM 0 HD3 ARG A 310 0.913 11.781 16.543 1.00 0.00 H new ATOM 0 HE ARG A 310 1.855 13.741 14.563 1.00 0.00 H new ATOM 0 HH11 ARG A 310 -0.162 13.117 17.392 1.00 0.00 H new ATOM 0 HH12 ARG A 310 -0.184 14.811 17.894 1.00 0.00 H new ATOM 0 HH21 ARG A 310 1.821 15.915 15.212 1.00 0.00 H new ATOM 0 HH22 ARG A 310 0.935 16.389 16.665 1.00 0.00 H new ATOM 1446 N GLN A 311 1.958 8.283 11.763 1.00 0.00 N ATOM 1447 CA GLN A 311 2.069 6.829 11.747 1.00 0.00 C ATOM 1448 C GLN A 311 3.367 6.389 11.078 1.00 0.00 C ATOM 1449 O GLN A 311 4.110 5.571 11.621 1.00 0.00 O ATOM 1450 CB GLN A 311 0.873 6.213 11.019 1.00 0.00 C ATOM 1451 CG GLN A 311 -0.431 6.318 11.794 1.00 0.00 C ATOM 1452 CD GLN A 311 -1.554 5.524 11.157 1.00 0.00 C ATOM 1453 OE1 GLN A 311 -1.564 5.302 9.946 1.00 0.00 O ATOM 1454 NE2 GLN A 311 -2.509 5.090 11.972 1.00 0.00 N ATOM 0 H GLN A 311 1.171 8.652 11.230 1.00 0.00 H new ATOM 0 HA GLN A 311 2.077 6.480 12.779 1.00 0.00 H new ATOM 0 HB2 GLN A 311 0.753 6.705 10.054 1.00 0.00 H new ATOM 0 HB3 GLN A 311 1.083 5.163 10.817 1.00 0.00 H new ATOM 0 HG2 GLN A 311 -0.273 5.964 12.813 1.00 0.00 H new ATOM 0 HG3 GLN A 311 -0.725 7.365 11.863 1.00 0.00 H new ATOM 0 HE21 GLN A 311 -2.461 5.297 12.970 1.00 0.00 H new ATOM 0 HE22 GLN A 311 -3.290 4.550 11.600 1.00 0.00 H new ATOM 1463 N TRP A 312 3.634 6.937 9.899 1.00 0.00 N ATOM 1464 CA TRP A 312 4.843 6.601 9.156 1.00 0.00 C ATOM 1465 C TRP A 312 6.090 6.906 9.978 1.00 0.00 C ATOM 1466 O TRP A 312 6.971 6.059 10.127 1.00 0.00 O ATOM 1467 CB TRP A 312 4.887 7.373 7.836 1.00 0.00 C ATOM 1468 CG TRP A 312 6.079 7.039 6.991 1.00 0.00 C ATOM 1469 CD1 TRP A 312 7.270 7.707 6.954 1.00 0.00 C ATOM 1470 CD2 TRP A 312 6.195 5.955 6.062 1.00 0.00 C ATOM 1471 NE1 TRP A 312 8.119 7.104 6.057 1.00 0.00 N ATOM 1472 CE2 TRP A 312 7.484 6.027 5.497 1.00 0.00 C ATOM 1473 CE3 TRP A 312 5.337 4.931 5.654 1.00 0.00 C ATOM 1474 CZ2 TRP A 312 7.931 5.114 4.546 1.00 0.00 C ATOM 1475 CZ3 TRP A 312 5.782 4.026 4.710 1.00 0.00 C ATOM 1476 CH2 TRP A 312 7.070 4.121 4.165 1.00 0.00 C ATOM 0 H TRP A 312 3.030 7.616 9.436 1.00 0.00 H new ATOM 0 HA TRP A 312 4.823 5.532 8.944 1.00 0.00 H new ATOM 0 HB2 TRP A 312 3.979 7.163 7.270 1.00 0.00 H new ATOM 0 HB3 TRP A 312 4.890 8.442 8.049 1.00 0.00 H new ATOM 0 HD1 TRP A 312 7.509 8.580 7.543 1.00 0.00 H new ATOM 0 HE1 TRP A 312 9.068 7.409 5.843 1.00 0.00 H new ATOM 0 HE3 TRP A 312 4.343 4.848 6.069 1.00 0.00 H new ATOM 0 HZ2 TRP A 312 8.922 5.187 4.124 1.00 0.00 H new ATOM 0 HZ3 TRP A 312 5.126 3.231 4.386 1.00 0.00 H new ATOM 0 HH2 TRP A 312 7.389 3.397 3.430 1.00 0.00 H new ATOM 1487 N VAL A 313 6.159 8.122 10.512 1.00 0.00 N ATOM 1488 CA VAL A 313 7.298 8.538 11.322 1.00 0.00 C ATOM 1489 C VAL A 313 7.550 7.556 12.461 1.00 0.00 C ATOM 1490 O VAL A 313 8.634 6.983 12.571 1.00 0.00 O ATOM 1491 CB VAL A 313 7.085 9.945 11.909 1.00 0.00 C ATOM 1492 CG1 VAL A 313 8.249 10.330 12.810 1.00 0.00 C ATOM 1493 CG2 VAL A 313 6.904 10.965 10.795 1.00 0.00 C ATOM 0 H VAL A 313 5.439 8.836 10.398 1.00 0.00 H new ATOM 0 HA VAL A 313 8.166 8.556 10.663 1.00 0.00 H new ATOM 0 HB VAL A 313 6.177 9.934 12.512 1.00 0.00 H new ATOM 0 HG11 VAL A 313 8.081 11.328 13.216 1.00 0.00 H new ATOM 0 HG12 VAL A 313 8.328 9.614 13.628 1.00 0.00 H new ATOM 0 HG13 VAL A 313 9.173 10.324 12.233 1.00 0.00 H new ATOM 0 HG21 VAL A 313 6.755 11.954 11.228 1.00 0.00 H new ATOM 0 HG22 VAL A 313 7.792 10.976 10.164 1.00 0.00 H new ATOM 0 HG23 VAL A 313 6.035 10.697 10.194 1.00 0.00 H new ATOM 1503 N ALA A 314 6.542 7.368 13.306 1.00 0.00 N ATOM 1504 CA ALA A 314 6.654 6.454 14.436 1.00 0.00 C ATOM 1505 C ALA A 314 7.022 5.049 13.972 1.00 0.00 C ATOM 1506 O ALA A 314 7.778 4.343 14.638 1.00 0.00 O ATOM 1507 CB ALA A 314 5.352 6.428 15.224 1.00 0.00 C ATOM 0 H ALA A 314 5.639 7.836 13.230 1.00 0.00 H new ATOM 0 HA ALA A 314 7.452 6.814 15.085 1.00 0.00 H new ATOM 0 HB1 ALA A 314 5.449 5.741 16.065 1.00 0.00 H new ATOM 0 HB2 ALA A 314 5.132 7.429 15.596 1.00 0.00 H new ATOM 0 HB3 ALA A 314 4.541 6.095 14.576 1.00 0.00 H new ATOM 1513 N ALA A 315 6.481 4.649 12.825 1.00 0.00 N ATOM 1514 CA ALA A 315 6.755 3.329 12.272 1.00 0.00 C ATOM 1515 C ALA A 315 8.248 3.132 12.034 1.00 0.00 C ATOM 1516 O ALA A 315 8.792 2.060 12.298 1.00 0.00 O ATOM 1517 CB ALA A 315 5.981 3.129 10.977 1.00 0.00 C ATOM 0 H ALA A 315 5.851 5.220 12.262 1.00 0.00 H new ATOM 0 HA ALA A 315 6.428 2.583 12.997 1.00 0.00 H new ATOM 0 HB1 ALA A 315 6.195 2.139 10.575 1.00 0.00 H new ATOM 0 HB2 ALA A 315 4.913 3.218 11.174 1.00 0.00 H new ATOM 0 HB3 ALA A 315 6.280 3.887 10.253 1.00 0.00 H new ATOM 1523 N GLY A 316 8.906 4.173 11.532 1.00 0.00 N ATOM 1524 CA GLY A 316 10.330 4.092 11.266 1.00 0.00 C ATOM 1525 C GLY A 316 10.706 4.704 9.932 1.00 0.00 C ATOM 1526 O GLY A 316 11.594 4.206 9.240 1.00 0.00 O ATOM 0 H GLY A 316 8.478 5.071 11.305 1.00 0.00 H new ATOM 0 HA2 GLY A 316 10.875 4.600 12.062 1.00 0.00 H new ATOM 0 HA3 GLY A 316 10.641 3.047 11.284 1.00 0.00 H new