USER MOD reduce.3.24.130724 H: found=0, std=0, add=687, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 688 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 380 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Set 1.2: A 382 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Set 2.1: A 377 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 383 MET CE :methyl -176:sc= -1.37 (180deg=-1.42) USER MOD Single : A 338 SER OG : rot 180:sc= 0 USER MOD Single : A 339 HIS : no HD1:sc= -0.0689 X(o=-0.069,f=0) USER MOD Single : A 344 GLN : amide:sc= -3.36! K(o=-3.4!,f=-0.56) USER MOD Single : A 347 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 350 GLN : amide:sc= -3.12 K(o=-3.1,f=-0.79) USER MOD Single : A 351 GLN : amide:sc= 0.625 K(o=0.62,f=0) USER MOD Single : A 357 SER OG : rot 75:sc= 1.24 USER MOD Single : A 361 GLN : amide:sc= -0.0461 X(o=-0.046,f=-0.55) USER MOD Single : A 362 LYS NZ :NH3+ -133:sc= -0.0389 (180deg=-1.3!) USER MOD Single : A 364 MET CE :methyl -148:sc= -0.0199 (180deg=-0.994) USER MOD Single : A 366 GLN : amide:sc= -0.13 X(o=-0.13,f=-0.082) USER MOD Single : A 367 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 371 ASN : amide:sc= -1.59 X(o=-1.6,f=-1.8!) USER MOD Single : A 372 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 373 MET CE :methyl -168:sc= -0.162 (180deg=-0.535) USER MOD Single : A 374 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 379 LYS NZ :NH3+ -134:sc= 1.05 (180deg=-0.215) USER MOD Single : A 387 SER OG : rot 93:sc= 1.25 USER MOD Single : A 388 SER OG : rot 180:sc=0.000467 USER MOD Single : A 390 HIS : no HD1:sc= -2.33! K(o=-2.3!,f=-1.5) USER MOD Single : A 392 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 396 THR OG1 : rot 70:sc= 1.3 USER MOD Single : A 397 THR OG1 : rot 76:sc= 1.22 USER MOD Single : A 398 SER OG : rot 77:sc= 0.592 USER MOD Single : A 399 ASN : amide:sc= 0.944 K(o=0.94,f=-7.3!) USER MOD Single : A 405 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 408 HIS : no HE2:sc= 1.12 K(o=1.1,f=-3.4!) USER MOD Single : A 409 LYS NZ :NH3+ -119:sc= -0.317 (180deg=-1.58) USER MOD Single : A 410 ASN : amide:sc= 1.2 K(o=1.2,f=-0.083) USER MOD Single : A 415 SER OG : rot 76:sc= 0.447 USER MOD ----------------------------------------------------------------- ATOM 195 N PHE A 337 -14.883 -5.767 5.156 1.00 0.00 N ATOM 196 CA PHE A 337 -15.852 -4.846 5.759 1.00 0.00 C ATOM 197 C PHE A 337 -17.179 -4.805 4.992 1.00 0.00 C ATOM 198 O PHE A 337 -17.872 -3.787 5.008 1.00 0.00 O ATOM 199 CB PHE A 337 -15.278 -3.426 5.851 1.00 0.00 C ATOM 200 CG PHE A 337 -14.075 -3.295 6.742 1.00 0.00 C ATOM 201 CD1 PHE A 337 -14.212 -3.306 8.119 1.00 0.00 C ATOM 202 CD2 PHE A 337 -12.810 -3.143 6.199 1.00 0.00 C ATOM 203 CE1 PHE A 337 -13.110 -3.172 8.940 1.00 0.00 C ATOM 204 CE2 PHE A 337 -11.702 -3.010 7.016 1.00 0.00 C ATOM 205 CZ PHE A 337 -11.853 -3.022 8.388 1.00 0.00 C ATOM 0 HA PHE A 337 -16.051 -5.227 6.761 1.00 0.00 H new ATOM 0 HB2 PHE A 337 -15.010 -3.091 4.849 1.00 0.00 H new ATOM 0 HB3 PHE A 337 -16.057 -2.756 6.214 1.00 0.00 H new ATOM 0 HD1 PHE A 337 -15.193 -3.421 8.557 1.00 0.00 H new ATOM 0 HD2 PHE A 337 -12.687 -3.128 5.126 1.00 0.00 H new ATOM 0 HE1 PHE A 337 -13.231 -3.184 10.013 1.00 0.00 H new ATOM 0 HE2 PHE A 337 -10.720 -2.897 6.581 1.00 0.00 H new ATOM 0 HZ PHE A 337 -10.990 -2.914 9.028 1.00 0.00 H new ATOM 215 N SER A 338 -17.545 -5.900 4.333 1.00 0.00 N ATOM 216 CA SER A 338 -18.823 -5.964 3.624 1.00 0.00 C ATOM 217 C SER A 338 -19.978 -6.016 4.621 1.00 0.00 C ATOM 218 O SER A 338 -21.128 -5.735 4.280 1.00 0.00 O ATOM 219 CB SER A 338 -18.872 -7.182 2.700 1.00 0.00 C ATOM 220 OG SER A 338 -17.768 -7.191 1.812 1.00 0.00 O ATOM 0 H SER A 338 -16.982 -6.749 4.274 1.00 0.00 H new ATOM 0 HA SER A 338 -18.920 -5.066 3.014 1.00 0.00 H new ATOM 0 HB2 SER A 338 -18.872 -8.095 3.296 1.00 0.00 H new ATOM 0 HB3 SER A 338 -19.801 -7.174 2.130 1.00 0.00 H new ATOM 0 HG SER A 338 -17.820 -7.980 1.233 1.00 0.00 H new ATOM 226 N HIS A 339 -19.658 -6.362 5.866 1.00 0.00 N ATOM 227 CA HIS A 339 -20.653 -6.396 6.933 1.00 0.00 C ATOM 228 C HIS A 339 -21.065 -4.979 7.335 1.00 0.00 C ATOM 229 O HIS A 339 -21.981 -4.791 8.130 1.00 0.00 O ATOM 230 CB HIS A 339 -20.123 -7.166 8.157 1.00 0.00 C ATOM 231 CG HIS A 339 -18.954 -6.526 8.853 1.00 0.00 C ATOM 232 ND1 HIS A 339 -17.647 -6.897 8.631 1.00 0.00 N ATOM 233 CD2 HIS A 339 -18.905 -5.542 9.780 1.00 0.00 C ATOM 234 CE1 HIS A 339 -16.849 -6.172 9.388 1.00 0.00 C ATOM 235 NE2 HIS A 339 -17.585 -5.339 10.097 1.00 0.00 N ATOM 0 H HIS A 339 -18.717 -6.623 6.160 1.00 0.00 H new ATOM 0 HA HIS A 339 -21.531 -6.918 6.554 1.00 0.00 H new ATOM 0 HB2 HIS A 339 -20.935 -7.281 8.875 1.00 0.00 H new ATOM 0 HB3 HIS A 339 -19.834 -8.168 7.840 1.00 0.00 H new ATOM 0 HD2 HIS A 339 -19.750 -5.013 10.195 1.00 0.00 H new ATOM 0 HE1 HIS A 339 -15.772 -6.247 9.422 1.00 0.00 H new ATOM 0 HE2 HIS A 339 -17.232 -4.657 10.769 1.00 0.00 H new ATOM 244 N LEU A 340 -20.372 -3.986 6.790 1.00 0.00 N ATOM 245 CA LEU A 340 -20.670 -2.594 7.085 1.00 0.00 C ATOM 246 C LEU A 340 -21.517 -1.980 5.981 1.00 0.00 C ATOM 247 O LEU A 340 -21.254 -2.199 4.797 1.00 0.00 O ATOM 248 CB LEU A 340 -19.379 -1.786 7.238 1.00 0.00 C ATOM 249 CG LEU A 340 -18.498 -2.173 8.423 1.00 0.00 C ATOM 250 CD1 LEU A 340 -17.293 -1.252 8.507 1.00 0.00 C ATOM 251 CD2 LEU A 340 -19.295 -2.130 9.715 1.00 0.00 C ATOM 0 H LEU A 340 -19.598 -4.122 6.140 1.00 0.00 H new ATOM 0 HA LEU A 340 -21.226 -2.565 8.022 1.00 0.00 H new ATOM 0 HB2 LEU A 340 -18.795 -1.891 6.324 1.00 0.00 H new ATOM 0 HB3 LEU A 340 -19.640 -0.732 7.330 1.00 0.00 H new ATOM 0 HG LEU A 340 -18.144 -3.193 8.274 1.00 0.00 H new ATOM 0 HD11 LEU A 340 -16.674 -1.540 9.357 1.00 0.00 H new ATOM 0 HD12 LEU A 340 -16.710 -1.331 7.590 1.00 0.00 H new ATOM 0 HD13 LEU A 340 -17.630 -0.223 8.635 1.00 0.00 H new ATOM 0 HD21 LEU A 340 -18.651 -2.409 10.549 1.00 0.00 H new ATOM 0 HD22 LEU A 340 -19.678 -1.122 9.873 1.00 0.00 H new ATOM 0 HD23 LEU A 340 -20.129 -2.829 9.651 1.00 0.00 H new ATOM 263 N PRO A 341 -22.551 -1.214 6.359 1.00 0.00 N ATOM 264 CA PRO A 341 -23.367 -0.472 5.399 1.00 0.00 C ATOM 265 C PRO A 341 -22.537 0.592 4.684 1.00 0.00 C ATOM 266 O PRO A 341 -21.645 1.180 5.290 1.00 0.00 O ATOM 267 CB PRO A 341 -24.457 0.174 6.261 1.00 0.00 C ATOM 268 CG PRO A 341 -23.926 0.162 7.653 1.00 0.00 C ATOM 269 CD PRO A 341 -23.008 -1.020 7.746 1.00 0.00 C ATOM 0 HA PRO A 341 -23.775 -1.110 4.615 1.00 0.00 H new ATOM 0 HB2 PRO A 341 -24.667 1.191 5.930 1.00 0.00 H new ATOM 0 HB3 PRO A 341 -25.392 -0.383 6.193 1.00 0.00 H new ATOM 0 HG2 PRO A 341 -23.392 1.087 7.873 1.00 0.00 H new ATOM 0 HG3 PRO A 341 -24.737 0.082 8.377 1.00 0.00 H new ATOM 0 HD2 PRO A 341 -22.173 -0.827 8.420 1.00 0.00 H new ATOM 0 HD3 PRO A 341 -23.526 -1.901 8.124 1.00 0.00 H new ATOM 277 N PRO A 342 -22.832 0.849 3.395 1.00 0.00 N ATOM 278 CA PRO A 342 -22.034 1.725 2.522 1.00 0.00 C ATOM 279 C PRO A 342 -21.442 2.955 3.215 1.00 0.00 C ATOM 280 O PRO A 342 -20.224 3.149 3.214 1.00 0.00 O ATOM 281 CB PRO A 342 -23.049 2.150 1.470 1.00 0.00 C ATOM 282 CG PRO A 342 -23.943 0.969 1.322 1.00 0.00 C ATOM 283 CD PRO A 342 -23.997 0.298 2.673 1.00 0.00 C ATOM 0 HA PRO A 342 -21.155 1.204 2.143 1.00 0.00 H new ATOM 0 HB2 PRO A 342 -23.605 3.032 1.787 1.00 0.00 H new ATOM 0 HB3 PRO A 342 -22.563 2.402 0.527 1.00 0.00 H new ATOM 0 HG2 PRO A 342 -24.939 1.275 1.001 1.00 0.00 H new ATOM 0 HG3 PRO A 342 -23.560 0.285 0.565 1.00 0.00 H new ATOM 0 HD2 PRO A 342 -24.929 0.521 3.192 1.00 0.00 H new ATOM 0 HD3 PRO A 342 -23.934 -0.786 2.582 1.00 0.00 H new ATOM 291 N GLU A 343 -22.297 3.771 3.819 1.00 0.00 N ATOM 292 CA GLU A 343 -21.863 5.033 4.416 1.00 0.00 C ATOM 293 C GLU A 343 -20.870 4.813 5.557 1.00 0.00 C ATOM 294 O GLU A 343 -19.912 5.571 5.713 1.00 0.00 O ATOM 295 CB GLU A 343 -23.071 5.815 4.915 1.00 0.00 C ATOM 296 CG GLU A 343 -24.080 6.122 3.822 1.00 0.00 C ATOM 297 CD GLU A 343 -25.289 6.857 4.347 1.00 0.00 C ATOM 298 OE1 GLU A 343 -26.163 6.210 4.962 1.00 0.00 O ATOM 299 OE2 GLU A 343 -25.370 8.085 4.156 1.00 0.00 O ATOM 0 H GLU A 343 -23.296 3.584 3.910 1.00 0.00 H new ATOM 0 HA GLU A 343 -21.352 5.606 3.643 1.00 0.00 H new ATOM 0 HB2 GLU A 343 -23.562 5.247 5.705 1.00 0.00 H new ATOM 0 HB3 GLU A 343 -22.731 6.750 5.360 1.00 0.00 H new ATOM 0 HG2 GLU A 343 -23.602 6.721 3.047 1.00 0.00 H new ATOM 0 HG3 GLU A 343 -24.399 5.191 3.353 1.00 0.00 H new ATOM 306 N GLN A 344 -21.093 3.776 6.349 1.00 0.00 N ATOM 307 CA GLN A 344 -20.204 3.468 7.459 1.00 0.00 C ATOM 308 C GLN A 344 -18.968 2.735 6.945 1.00 0.00 C ATOM 309 O GLN A 344 -17.867 2.890 7.476 1.00 0.00 O ATOM 310 CB GLN A 344 -20.930 2.612 8.498 1.00 0.00 C ATOM 311 CG GLN A 344 -20.284 2.642 9.870 1.00 0.00 C ATOM 312 CD GLN A 344 -21.066 1.840 10.887 1.00 0.00 C ATOM 313 OE1 GLN A 344 -21.985 2.351 11.522 1.00 0.00 O ATOM 314 NE2 GLN A 344 -20.689 0.590 11.071 1.00 0.00 N ATOM 0 H GLN A 344 -21.879 3.135 6.245 1.00 0.00 H new ATOM 0 HA GLN A 344 -19.894 4.400 7.932 1.00 0.00 H new ATOM 0 HB2 GLN A 344 -21.961 2.956 8.584 1.00 0.00 H new ATOM 0 HB3 GLN A 344 -20.966 1.581 8.146 1.00 0.00 H new ATOM 0 HG2 GLN A 344 -19.270 2.248 9.801 1.00 0.00 H new ATOM 0 HG3 GLN A 344 -20.202 3.675 10.209 1.00 0.00 H new ATOM 0 HE21 GLN A 344 -19.921 0.203 10.523 1.00 0.00 H new ATOM 0 HE22 GLN A 344 -21.166 0.010 11.761 1.00 0.00 H new ATOM 323 N ARG A 345 -19.166 1.952 5.893 1.00 0.00 N ATOM 324 CA ARG A 345 -18.096 1.172 5.290 1.00 0.00 C ATOM 325 C ARG A 345 -17.021 2.089 4.723 1.00 0.00 C ATOM 326 O ARG A 345 -15.841 1.932 5.029 1.00 0.00 O ATOM 327 CB ARG A 345 -18.657 0.269 4.188 1.00 0.00 C ATOM 328 CG ARG A 345 -17.657 -0.751 3.667 1.00 0.00 C ATOM 329 CD ARG A 345 -18.263 -1.625 2.584 1.00 0.00 C ATOM 330 NE ARG A 345 -17.365 -2.710 2.190 1.00 0.00 N ATOM 331 CZ ARG A 345 -17.518 -3.447 1.092 1.00 0.00 C ATOM 332 NH1 ARG A 345 -18.511 -3.191 0.246 1.00 0.00 N ATOM 333 NH2 ARG A 345 -16.674 -4.440 0.840 1.00 0.00 N ATOM 0 H ARG A 345 -20.071 1.840 5.435 1.00 0.00 H new ATOM 0 HA ARG A 345 -17.646 0.547 6.061 1.00 0.00 H new ATOM 0 HB2 ARG A 345 -19.532 -0.256 4.571 1.00 0.00 H new ATOM 0 HB3 ARG A 345 -18.995 0.890 3.358 1.00 0.00 H new ATOM 0 HG2 ARG A 345 -16.782 -0.235 3.272 1.00 0.00 H new ATOM 0 HG3 ARG A 345 -17.313 -1.377 4.490 1.00 0.00 H new ATOM 0 HD2 ARG A 345 -19.204 -2.044 2.941 1.00 0.00 H new ATOM 0 HD3 ARG A 345 -18.497 -1.013 1.713 1.00 0.00 H new ATOM 0 HE ARG A 345 -16.570 -2.915 2.796 1.00 0.00 H new ATOM 0 HH11 ARG A 345 -19.160 -2.427 0.437 1.00 0.00 H new ATOM 0 HH12 ARG A 345 -18.624 -3.758 -0.594 1.00 0.00 H new ATOM 0 HH21 ARG A 345 -15.910 -4.637 1.487 1.00 0.00 H new ATOM 0 HH22 ARG A 345 -16.789 -5.006 -0.001 1.00 0.00 H new ATOM 347 N ARG A 346 -17.435 3.066 3.916 1.00 0.00 N ATOM 348 CA ARG A 346 -16.491 4.000 3.303 1.00 0.00 C ATOM 349 C ARG A 346 -15.717 4.769 4.366 1.00 0.00 C ATOM 350 O ARG A 346 -14.552 5.108 4.169 1.00 0.00 O ATOM 351 CB ARG A 346 -17.197 4.979 2.354 1.00 0.00 C ATOM 352 CG ARG A 346 -18.276 5.830 3.009 1.00 0.00 C ATOM 353 CD ARG A 346 -18.930 6.765 2.002 1.00 0.00 C ATOM 354 NE ARG A 346 -19.969 7.601 2.606 1.00 0.00 N ATOM 355 CZ ARG A 346 -20.746 8.436 1.913 1.00 0.00 C ATOM 356 NH1 ARG A 346 -20.611 8.539 0.598 1.00 0.00 N ATOM 357 NH2 ARG A 346 -21.657 9.172 2.537 1.00 0.00 N ATOM 0 H ARG A 346 -18.412 3.231 3.673 1.00 0.00 H new ATOM 0 HA ARG A 346 -15.789 3.408 2.716 1.00 0.00 H new ATOM 0 HB2 ARG A 346 -16.450 5.639 1.913 1.00 0.00 H new ATOM 0 HB3 ARG A 346 -17.645 4.413 1.537 1.00 0.00 H new ATOM 0 HG2 ARG A 346 -19.033 5.183 3.453 1.00 0.00 H new ATOM 0 HG3 ARG A 346 -17.840 6.413 3.820 1.00 0.00 H new ATOM 0 HD2 ARG A 346 -18.168 7.404 1.556 1.00 0.00 H new ATOM 0 HD3 ARG A 346 -19.365 6.177 1.194 1.00 0.00 H new ATOM 0 HE ARG A 346 -20.107 7.542 3.615 1.00 0.00 H new ATOM 0 HH11 ARG A 346 -19.911 7.979 0.112 1.00 0.00 H new ATOM 0 HH12 ARG A 346 -21.207 9.179 0.073 1.00 0.00 H new ATOM 0 HH21 ARG A 346 -21.765 9.100 3.549 1.00 0.00 H new ATOM 0 HH22 ARG A 346 -22.249 9.809 2.005 1.00 0.00 H new ATOM 371 N LYS A 347 -16.362 5.019 5.499 1.00 0.00 N ATOM 372 CA LYS A 347 -15.729 5.743 6.589 1.00 0.00 C ATOM 373 C LYS A 347 -14.553 4.943 7.145 1.00 0.00 C ATOM 374 O LYS A 347 -13.481 5.490 7.394 1.00 0.00 O ATOM 375 CB LYS A 347 -16.748 6.041 7.690 1.00 0.00 C ATOM 376 CG LYS A 347 -16.197 6.892 8.823 1.00 0.00 C ATOM 377 CD LYS A 347 -17.292 7.295 9.794 1.00 0.00 C ATOM 378 CE LYS A 347 -16.754 8.179 10.905 1.00 0.00 C ATOM 379 NZ LYS A 347 -17.842 8.699 11.776 1.00 0.00 N ATOM 0 H LYS A 347 -17.322 4.730 5.685 1.00 0.00 H new ATOM 0 HA LYS A 347 -15.349 6.690 6.206 1.00 0.00 H new ATOM 0 HB2 LYS A 347 -17.606 6.550 7.250 1.00 0.00 H new ATOM 0 HB3 LYS A 347 -17.112 5.099 8.100 1.00 0.00 H new ATOM 0 HG2 LYS A 347 -15.423 6.337 9.354 1.00 0.00 H new ATOM 0 HG3 LYS A 347 -15.725 7.785 8.413 1.00 0.00 H new ATOM 0 HD2 LYS A 347 -18.080 7.823 9.257 1.00 0.00 H new ATOM 0 HD3 LYS A 347 -17.744 6.402 10.225 1.00 0.00 H new ATOM 0 HE2 LYS A 347 -16.045 7.612 11.509 1.00 0.00 H new ATOM 0 HE3 LYS A 347 -16.206 9.015 10.471 1.00 0.00 H new ATOM 0 HZ1 LYS A 347 -17.433 9.298 12.522 1.00 0.00 H new ATOM 0 HZ2 LYS A 347 -18.505 9.261 11.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 347 -18.349 7.902 12.211 1.00 0.00 H new ATOM 393 N ARG A 348 -14.758 3.645 7.321 1.00 0.00 N ATOM 394 CA ARG A 348 -13.697 2.763 7.799 1.00 0.00 C ATOM 395 C ARG A 348 -12.639 2.548 6.719 1.00 0.00 C ATOM 396 O ARG A 348 -11.441 2.641 6.986 1.00 0.00 O ATOM 397 CB ARG A 348 -14.273 1.413 8.233 1.00 0.00 C ATOM 398 CG ARG A 348 -15.089 1.468 9.514 1.00 0.00 C ATOM 399 CD ARG A 348 -14.235 1.879 10.702 1.00 0.00 C ATOM 400 NE ARG A 348 -14.934 1.699 11.972 1.00 0.00 N ATOM 401 CZ ARG A 348 -14.386 1.944 13.162 1.00 0.00 C ATOM 402 NH1 ARG A 348 -13.149 2.416 13.241 1.00 0.00 N ATOM 403 NH2 ARG A 348 -15.073 1.714 14.274 1.00 0.00 N ATOM 0 H ARG A 348 -15.647 3.178 7.141 1.00 0.00 H new ATOM 0 HA ARG A 348 -13.228 3.242 8.658 1.00 0.00 H new ATOM 0 HB2 ARG A 348 -14.901 1.024 7.432 1.00 0.00 H new ATOM 0 HB3 ARG A 348 -13.453 0.707 8.367 1.00 0.00 H new ATOM 0 HG2 ARG A 348 -15.910 2.175 9.393 1.00 0.00 H new ATOM 0 HG3 ARG A 348 -15.534 0.492 9.705 1.00 0.00 H new ATOM 0 HD2 ARG A 348 -13.317 1.291 10.708 1.00 0.00 H new ATOM 0 HD3 ARG A 348 -13.944 2.924 10.594 1.00 0.00 H new ATOM 0 HE ARG A 348 -15.898 1.366 11.947 1.00 0.00 H new ATOM 0 HH11 ARG A 348 -12.615 2.592 12.390 1.00 0.00 H new ATOM 0 HH12 ARG A 348 -12.732 2.603 14.153 1.00 0.00 H new ATOM 0 HH21 ARG A 348 -16.024 1.348 14.220 1.00 0.00 H new ATOM 0 HH22 ARG A 348 -14.650 1.903 15.183 1.00 0.00 H new ATOM 417 N LEU A 349 -13.099 2.274 5.503 1.00 0.00 N ATOM 418 CA LEU A 349 -12.211 2.009 4.373 1.00 0.00 C ATOM 419 C LEU A 349 -11.248 3.166 4.135 1.00 0.00 C ATOM 420 O LEU A 349 -10.041 2.961 4.031 1.00 0.00 O ATOM 421 CB LEU A 349 -13.028 1.745 3.105 1.00 0.00 C ATOM 422 CG LEU A 349 -13.389 0.279 2.836 1.00 0.00 C ATOM 423 CD1 LEU A 349 -13.979 -0.387 4.068 1.00 0.00 C ATOM 424 CD2 LEU A 349 -14.366 0.190 1.677 1.00 0.00 C ATOM 0 H LEU A 349 -14.091 2.229 5.272 1.00 0.00 H new ATOM 0 HA LEU A 349 -11.624 1.123 4.616 1.00 0.00 H new ATOM 0 HB2 LEU A 349 -13.951 2.322 3.164 1.00 0.00 H new ATOM 0 HB3 LEU A 349 -12.469 2.125 2.250 1.00 0.00 H new ATOM 0 HG LEU A 349 -12.471 -0.250 2.579 1.00 0.00 H new ATOM 0 HD11 LEU A 349 -14.222 -1.425 3.839 1.00 0.00 H new ATOM 0 HD12 LEU A 349 -13.254 -0.355 4.881 1.00 0.00 H new ATOM 0 HD13 LEU A 349 -14.884 0.140 4.368 1.00 0.00 H new ATOM 0 HD21 LEU A 349 -14.617 -0.854 1.492 1.00 0.00 H new ATOM 0 HD22 LEU A 349 -15.272 0.744 1.922 1.00 0.00 H new ATOM 0 HD23 LEU A 349 -13.910 0.617 0.784 1.00 0.00 H new ATOM 436 N GLN A 350 -11.783 4.379 4.065 1.00 0.00 N ATOM 437 CA GLN A 350 -10.960 5.561 3.832 1.00 0.00 C ATOM 438 C GLN A 350 -9.911 5.734 4.923 1.00 0.00 C ATOM 439 O GLN A 350 -8.777 6.110 4.638 1.00 0.00 O ATOM 440 CB GLN A 350 -11.827 6.813 3.738 1.00 0.00 C ATOM 441 CG GLN A 350 -12.524 6.973 2.397 1.00 0.00 C ATOM 442 CD GLN A 350 -11.549 7.229 1.263 1.00 0.00 C ATOM 443 OE1 GLN A 350 -11.201 8.375 0.974 1.00 0.00 O ATOM 444 NE2 GLN A 350 -11.102 6.169 0.611 1.00 0.00 N ATOM 0 H GLN A 350 -12.780 4.570 4.166 1.00 0.00 H new ATOM 0 HA GLN A 350 -10.443 5.417 2.883 1.00 0.00 H new ATOM 0 HB2 GLN A 350 -12.578 6.784 4.527 1.00 0.00 H new ATOM 0 HB3 GLN A 350 -11.206 7.689 3.922 1.00 0.00 H new ATOM 0 HG2 GLN A 350 -13.100 6.073 2.181 1.00 0.00 H new ATOM 0 HG3 GLN A 350 -13.233 7.799 2.456 1.00 0.00 H new ATOM 0 HE21 GLN A 350 -11.414 5.236 0.880 1.00 0.00 H new ATOM 0 HE22 GLN A 350 -10.446 6.285 -0.161 1.00 0.00 H new ATOM 453 N GLN A 351 -10.283 5.441 6.162 1.00 0.00 N ATOM 454 CA GLN A 351 -9.354 5.557 7.278 1.00 0.00 C ATOM 455 C GLN A 351 -8.243 4.518 7.169 1.00 0.00 C ATOM 456 O GLN A 351 -7.080 4.818 7.443 1.00 0.00 O ATOM 457 CB GLN A 351 -10.087 5.421 8.611 1.00 0.00 C ATOM 458 CG GLN A 351 -11.025 6.579 8.897 1.00 0.00 C ATOM 459 CD GLN A 351 -11.733 6.447 10.227 1.00 0.00 C ATOM 460 OE1 GLN A 351 -11.237 6.903 11.256 1.00 0.00 O ATOM 461 NE2 GLN A 351 -12.905 5.833 10.215 1.00 0.00 N ATOM 0 H GLN A 351 -11.217 5.123 6.419 1.00 0.00 H new ATOM 0 HA GLN A 351 -8.901 6.547 7.237 1.00 0.00 H new ATOM 0 HB2 GLN A 351 -10.656 4.492 8.612 1.00 0.00 H new ATOM 0 HB3 GLN A 351 -9.355 5.347 9.415 1.00 0.00 H new ATOM 0 HG2 GLN A 351 -10.459 7.511 8.883 1.00 0.00 H new ATOM 0 HG3 GLN A 351 -11.767 6.645 8.101 1.00 0.00 H new ATOM 0 HE21 GLN A 351 -13.281 5.469 9.340 1.00 0.00 H new ATOM 0 HE22 GLN A 351 -13.432 5.724 11.081 1.00 0.00 H new ATOM 470 N ARG A 352 -8.601 3.304 6.760 1.00 0.00 N ATOM 471 CA ARG A 352 -7.612 2.254 6.533 1.00 0.00 C ATOM 472 C ARG A 352 -6.681 2.643 5.391 1.00 0.00 C ATOM 473 O ARG A 352 -5.461 2.536 5.509 1.00 0.00 O ATOM 474 CB ARG A 352 -8.292 0.917 6.218 1.00 0.00 C ATOM 475 CG ARG A 352 -9.000 0.287 7.409 1.00 0.00 C ATOM 476 CD ARG A 352 -8.019 -0.083 8.514 1.00 0.00 C ATOM 477 NE ARG A 352 -7.044 -1.089 8.079 1.00 0.00 N ATOM 478 CZ ARG A 352 -5.730 -1.006 8.303 1.00 0.00 C ATOM 479 NH1 ARG A 352 -5.224 0.022 8.974 1.00 0.00 N ATOM 480 NH2 ARG A 352 -4.918 -1.966 7.874 1.00 0.00 N ATOM 0 H ARG A 352 -9.565 3.023 6.579 1.00 0.00 H new ATOM 0 HA ARG A 352 -7.029 2.137 7.447 1.00 0.00 H new ATOM 0 HB2 ARG A 352 -9.015 1.069 5.417 1.00 0.00 H new ATOM 0 HB3 ARG A 352 -7.543 0.220 5.843 1.00 0.00 H new ATOM 0 HG2 ARG A 352 -9.744 0.981 7.800 1.00 0.00 H new ATOM 0 HG3 ARG A 352 -9.536 -0.605 7.084 1.00 0.00 H new ATOM 0 HD2 ARG A 352 -7.492 0.812 8.843 1.00 0.00 H new ATOM 0 HD3 ARG A 352 -8.570 -0.463 9.374 1.00 0.00 H new ATOM 0 HE ARG A 352 -7.392 -1.904 7.573 1.00 0.00 H new ATOM 0 HH11 ARG A 352 -5.840 0.756 9.323 1.00 0.00 H new ATOM 0 HH12 ARG A 352 -4.219 0.077 9.141 1.00 0.00 H new ATOM 0 HH21 ARG A 352 -5.298 -2.769 7.372 1.00 0.00 H new ATOM 0 HH22 ARG A 352 -3.915 -1.900 8.046 1.00 0.00 H new ATOM 494 N ILE A 353 -7.269 3.105 4.293 1.00 0.00 N ATOM 495 CA ILE A 353 -6.509 3.555 3.133 1.00 0.00 C ATOM 496 C ILE A 353 -5.564 4.688 3.515 1.00 0.00 C ATOM 497 O ILE A 353 -4.379 4.656 3.189 1.00 0.00 O ATOM 498 CB ILE A 353 -7.453 4.025 2.004 1.00 0.00 C ATOM 499 CG1 ILE A 353 -8.298 2.853 1.510 1.00 0.00 C ATOM 500 CG2 ILE A 353 -6.665 4.640 0.853 1.00 0.00 C ATOM 501 CD1 ILE A 353 -9.412 3.256 0.572 1.00 0.00 C ATOM 0 H ILE A 353 -8.280 3.178 4.182 1.00 0.00 H new ATOM 0 HA ILE A 353 -5.923 2.710 2.772 1.00 0.00 H new ATOM 0 HB ILE A 353 -8.114 4.794 2.404 1.00 0.00 H new ATOM 0 HG12 ILE A 353 -7.650 2.138 1.003 1.00 0.00 H new ATOM 0 HG13 ILE A 353 -8.728 2.339 2.370 1.00 0.00 H new ATOM 0 HG21 ILE A 353 -7.354 4.962 0.072 1.00 0.00 H new ATOM 0 HG22 ILE A 353 -6.101 5.499 1.216 1.00 0.00 H new ATOM 0 HG23 ILE A 353 -5.977 3.899 0.447 1.00 0.00 H new ATOM 0 HD11 ILE A 353 -9.967 2.370 0.264 1.00 0.00 H new ATOM 0 HD12 ILE A 353 -10.084 3.947 1.081 1.00 0.00 H new ATOM 0 HD13 ILE A 353 -8.989 3.742 -0.307 1.00 0.00 H new ATOM 513 N ASP A 354 -6.099 5.678 4.218 1.00 0.00 N ATOM 514 CA ASP A 354 -5.322 6.829 4.666 1.00 0.00 C ATOM 515 C ASP A 354 -4.186 6.402 5.591 1.00 0.00 C ATOM 516 O ASP A 354 -3.047 6.843 5.434 1.00 0.00 O ATOM 517 CB ASP A 354 -6.237 7.824 5.381 1.00 0.00 C ATOM 518 CG ASP A 354 -5.481 8.986 5.985 1.00 0.00 C ATOM 519 OD1 ASP A 354 -4.979 9.834 5.220 1.00 0.00 O ATOM 520 OD2 ASP A 354 -5.393 9.060 7.230 1.00 0.00 O ATOM 0 H ASP A 354 -7.081 5.707 4.494 1.00 0.00 H new ATOM 0 HA ASP A 354 -4.881 7.306 3.791 1.00 0.00 H new ATOM 0 HB2 ASP A 354 -6.975 8.204 4.675 1.00 0.00 H new ATOM 0 HB3 ASP A 354 -6.786 7.306 6.167 1.00 0.00 H new ATOM 525 N GLU A 355 -4.509 5.529 6.541 1.00 0.00 N ATOM 526 CA GLU A 355 -3.528 5.016 7.495 1.00 0.00 C ATOM 527 C GLU A 355 -2.372 4.352 6.755 1.00 0.00 C ATOM 528 O GLU A 355 -1.202 4.638 7.007 1.00 0.00 O ATOM 529 CB GLU A 355 -4.194 3.998 8.429 1.00 0.00 C ATOM 530 CG GLU A 355 -3.322 3.559 9.597 1.00 0.00 C ATOM 531 CD GLU A 355 -3.032 4.687 10.567 1.00 0.00 C ATOM 532 OE1 GLU A 355 -3.876 4.957 11.448 1.00 0.00 O ATOM 533 OE2 GLU A 355 -1.955 5.308 10.462 1.00 0.00 O ATOM 0 H GLU A 355 -5.450 5.159 6.672 1.00 0.00 H new ATOM 0 HA GLU A 355 -3.142 5.848 8.084 1.00 0.00 H new ATOM 0 HB2 GLU A 355 -5.116 4.429 8.820 1.00 0.00 H new ATOM 0 HB3 GLU A 355 -4.475 3.119 7.849 1.00 0.00 H new ATOM 0 HG2 GLU A 355 -3.816 2.746 10.129 1.00 0.00 H new ATOM 0 HG3 GLU A 355 -2.381 3.164 9.214 1.00 0.00 H new ATOM 540 N LEU A 356 -2.723 3.479 5.824 1.00 0.00 N ATOM 541 CA LEU A 356 -1.741 2.729 5.064 1.00 0.00 C ATOM 542 C LEU A 356 -0.964 3.630 4.112 1.00 0.00 C ATOM 543 O LEU A 356 0.234 3.454 3.934 1.00 0.00 O ATOM 544 CB LEU A 356 -2.435 1.608 4.294 1.00 0.00 C ATOM 545 CG LEU A 356 -3.063 0.527 5.173 1.00 0.00 C ATOM 546 CD1 LEU A 356 -3.977 -0.368 4.350 1.00 0.00 C ATOM 547 CD2 LEU A 356 -1.977 -0.294 5.855 1.00 0.00 C ATOM 0 H LEU A 356 -3.691 3.273 5.576 1.00 0.00 H new ATOM 0 HA LEU A 356 -1.024 2.297 5.762 1.00 0.00 H new ATOM 0 HB2 LEU A 356 -3.212 2.043 3.666 1.00 0.00 H new ATOM 0 HB3 LEU A 356 -1.711 1.140 3.627 1.00 0.00 H new ATOM 0 HG LEU A 356 -3.665 1.011 5.942 1.00 0.00 H new ATOM 0 HD11 LEU A 356 -4.415 -1.131 4.993 1.00 0.00 H new ATOM 0 HD12 LEU A 356 -4.772 0.232 3.907 1.00 0.00 H new ATOM 0 HD13 LEU A 356 -3.401 -0.847 3.559 1.00 0.00 H new ATOM 0 HD21 LEU A 356 -2.438 -1.061 6.478 1.00 0.00 H new ATOM 0 HD22 LEU A 356 -1.351 -0.769 5.099 1.00 0.00 H new ATOM 0 HD23 LEU A 356 -1.364 0.359 6.476 1.00 0.00 H new ATOM 559 N SER A 357 -1.643 4.599 3.511 1.00 0.00 N ATOM 560 CA SER A 357 -1.000 5.504 2.567 1.00 0.00 C ATOM 561 C SER A 357 0.015 6.402 3.270 1.00 0.00 C ATOM 562 O SER A 357 1.107 6.636 2.755 1.00 0.00 O ATOM 563 CB SER A 357 -2.047 6.350 1.841 1.00 0.00 C ATOM 564 OG SER A 357 -2.930 5.532 1.090 1.00 0.00 O ATOM 0 H SER A 357 -2.636 4.778 3.660 1.00 0.00 H new ATOM 0 HA SER A 357 -0.466 4.901 1.833 1.00 0.00 H new ATOM 0 HB2 SER A 357 -2.614 6.934 2.566 1.00 0.00 H new ATOM 0 HB3 SER A 357 -1.551 7.059 1.179 1.00 0.00 H new ATOM 0 HG SER A 357 -3.558 5.087 1.696 1.00 0.00 H new ATOM 570 N ARG A 358 -0.345 6.891 4.450 1.00 0.00 N ATOM 571 CA ARG A 358 0.555 7.720 5.244 1.00 0.00 C ATOM 572 C ARG A 358 1.771 6.912 5.689 1.00 0.00 C ATOM 573 O ARG A 358 2.905 7.392 5.648 1.00 0.00 O ATOM 574 CB ARG A 358 -0.191 8.273 6.455 1.00 0.00 C ATOM 575 CG ARG A 358 0.678 9.054 7.425 1.00 0.00 C ATOM 576 CD ARG A 358 -0.164 9.685 8.522 1.00 0.00 C ATOM 577 NE ARG A 358 -1.029 8.703 9.180 1.00 0.00 N ATOM 578 CZ ARG A 358 -2.349 8.626 8.990 1.00 0.00 C ATOM 579 NH1 ARG A 358 -2.965 9.498 8.200 1.00 0.00 N ATOM 580 NH2 ARG A 358 -3.053 7.674 9.590 1.00 0.00 N ATOM 0 H ARG A 358 -1.256 6.728 4.880 1.00 0.00 H new ATOM 0 HA ARG A 358 0.905 8.552 4.632 1.00 0.00 H new ATOM 0 HB2 ARG A 358 -0.996 8.920 6.106 1.00 0.00 H new ATOM 0 HB3 ARG A 358 -0.656 7.445 6.989 1.00 0.00 H new ATOM 0 HG2 ARG A 358 1.422 8.391 7.868 1.00 0.00 H new ATOM 0 HG3 ARG A 358 1.223 9.830 6.887 1.00 0.00 H new ATOM 0 HD2 ARG A 358 0.490 10.146 9.262 1.00 0.00 H new ATOM 0 HD3 ARG A 358 -0.776 10.481 8.098 1.00 0.00 H new ATOM 0 HE ARG A 358 -0.598 8.038 9.822 1.00 0.00 H new ATOM 0 HH11 ARG A 358 -2.430 10.231 7.735 1.00 0.00 H new ATOM 0 HH12 ARG A 358 -3.973 9.434 8.059 1.00 0.00 H new ATOM 0 HH21 ARG A 358 -2.586 7.000 10.197 1.00 0.00 H new ATOM 0 HH22 ARG A 358 -4.061 7.616 9.444 1.00 0.00 H new ATOM 594 N GLU A 359 1.520 5.679 6.106 1.00 0.00 N ATOM 595 CA GLU A 359 2.581 4.765 6.498 1.00 0.00 C ATOM 596 C GLU A 359 3.475 4.458 5.293 1.00 0.00 C ATOM 597 O GLU A 359 4.699 4.570 5.362 1.00 0.00 O ATOM 598 CB GLU A 359 1.965 3.473 7.055 1.00 0.00 C ATOM 599 CG GLU A 359 2.966 2.531 7.709 1.00 0.00 C ATOM 600 CD GLU A 359 3.616 3.140 8.931 1.00 0.00 C ATOM 601 OE1 GLU A 359 3.072 2.982 10.041 1.00 0.00 O ATOM 602 OE2 GLU A 359 4.676 3.781 8.794 1.00 0.00 O ATOM 0 H GLU A 359 0.581 5.287 6.182 1.00 0.00 H new ATOM 0 HA GLU A 359 3.192 5.227 7.273 1.00 0.00 H new ATOM 0 HB2 GLU A 359 1.200 3.735 7.786 1.00 0.00 H new ATOM 0 HB3 GLU A 359 1.463 2.945 6.244 1.00 0.00 H new ATOM 0 HG2 GLU A 359 2.461 1.607 7.992 1.00 0.00 H new ATOM 0 HG3 GLU A 359 3.736 2.264 6.986 1.00 0.00 H new ATOM 609 N LEU A 360 2.832 4.110 4.184 1.00 0.00 N ATOM 610 CA LEU A 360 3.516 3.746 2.948 1.00 0.00 C ATOM 611 C LEU A 360 4.335 4.913 2.396 1.00 0.00 C ATOM 612 O LEU A 360 5.422 4.709 1.858 1.00 0.00 O ATOM 613 CB LEU A 360 2.479 3.256 1.919 1.00 0.00 C ATOM 614 CG LEU A 360 3.004 2.837 0.538 1.00 0.00 C ATOM 615 CD1 LEU A 360 3.171 4.040 -0.370 1.00 0.00 C ATOM 616 CD2 LEU A 360 4.307 2.060 0.666 1.00 0.00 C ATOM 0 H LEU A 360 1.815 4.072 4.117 1.00 0.00 H new ATOM 0 HA LEU A 360 4.219 2.940 3.159 1.00 0.00 H new ATOM 0 HB2 LEU A 360 1.950 2.407 2.351 1.00 0.00 H new ATOM 0 HB3 LEU A 360 1.745 4.049 1.775 1.00 0.00 H new ATOM 0 HG LEU A 360 2.265 2.178 0.082 1.00 0.00 H new ATOM 0 HD11 LEU A 360 3.544 3.714 -1.341 1.00 0.00 H new ATOM 0 HD12 LEU A 360 2.209 4.535 -0.499 1.00 0.00 H new ATOM 0 HD13 LEU A 360 3.881 4.737 0.076 1.00 0.00 H new ATOM 0 HD21 LEU A 360 4.659 1.774 -0.325 1.00 0.00 H new ATOM 0 HD22 LEU A 360 5.057 2.685 1.151 1.00 0.00 H new ATOM 0 HD23 LEU A 360 4.139 1.164 1.264 1.00 0.00 H new ATOM 628 N GLN A 361 3.807 6.125 2.515 1.00 0.00 N ATOM 629 CA GLN A 361 4.511 7.321 2.053 1.00 0.00 C ATOM 630 C GLN A 361 5.933 7.360 2.607 1.00 0.00 C ATOM 631 O GLN A 361 6.886 7.636 1.880 1.00 0.00 O ATOM 632 CB GLN A 361 3.745 8.585 2.466 1.00 0.00 C ATOM 633 CG GLN A 361 4.450 9.886 2.103 1.00 0.00 C ATOM 634 CD GLN A 361 4.727 10.021 0.615 1.00 0.00 C ATOM 635 OE1 GLN A 361 3.984 9.505 -0.223 1.00 0.00 O ATOM 636 NE2 GLN A 361 5.804 10.712 0.276 1.00 0.00 N ATOM 0 H GLN A 361 2.892 6.309 2.928 1.00 0.00 H new ATOM 0 HA GLN A 361 4.567 7.285 0.965 1.00 0.00 H new ATOM 0 HB2 GLN A 361 2.763 8.572 1.993 1.00 0.00 H new ATOM 0 HB3 GLN A 361 3.581 8.562 3.543 1.00 0.00 H new ATOM 0 HG2 GLN A 361 3.838 10.727 2.430 1.00 0.00 H new ATOM 0 HG3 GLN A 361 5.392 9.946 2.648 1.00 0.00 H new ATOM 0 HE21 GLN A 361 6.394 11.124 0.999 1.00 0.00 H new ATOM 0 HE22 GLN A 361 6.044 10.833 -0.708 1.00 0.00 H new ATOM 645 N LYS A 362 6.069 7.047 3.888 1.00 0.00 N ATOM 646 CA LYS A 362 7.374 7.037 4.534 1.00 0.00 C ATOM 647 C LYS A 362 8.189 5.825 4.089 1.00 0.00 C ATOM 648 O LYS A 362 9.407 5.906 3.948 1.00 0.00 O ATOM 649 CB LYS A 362 7.215 7.039 6.054 1.00 0.00 C ATOM 650 CG LYS A 362 6.483 8.262 6.580 1.00 0.00 C ATOM 651 CD LYS A 362 6.323 8.235 8.096 1.00 0.00 C ATOM 652 CE LYS A 362 5.484 7.055 8.567 1.00 0.00 C ATOM 653 NZ LYS A 362 6.296 5.820 8.753 1.00 0.00 N ATOM 0 H LYS A 362 5.292 6.797 4.500 1.00 0.00 H new ATOM 0 HA LYS A 362 7.909 7.939 4.236 1.00 0.00 H new ATOM 0 HB2 LYS A 362 6.674 6.142 6.357 1.00 0.00 H new ATOM 0 HB3 LYS A 362 8.201 6.988 6.516 1.00 0.00 H new ATOM 0 HG2 LYS A 362 7.028 9.161 6.291 1.00 0.00 H new ATOM 0 HG3 LYS A 362 5.499 8.322 6.114 1.00 0.00 H new ATOM 0 HD2 LYS A 362 7.307 8.187 8.562 1.00 0.00 H new ATOM 0 HD3 LYS A 362 5.858 9.164 8.427 1.00 0.00 H new ATOM 0 HE2 LYS A 362 4.997 7.311 9.508 1.00 0.00 H new ATOM 0 HE3 LYS A 362 4.694 6.861 7.841 1.00 0.00 H new ATOM 0 HZ1 LYS A 362 5.813 5.016 8.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 362 7.231 5.950 8.316 1.00 0.00 H new ATOM 0 HZ3 LYS A 362 6.412 5.630 9.769 1.00 0.00 H new ATOM 667 N GLU A 363 7.509 4.708 3.852 1.00 0.00 N ATOM 668 CA GLU A 363 8.172 3.493 3.390 1.00 0.00 C ATOM 669 C GLU A 363 8.764 3.702 1.996 1.00 0.00 C ATOM 670 O GLU A 363 9.891 3.288 1.720 1.00 0.00 O ATOM 671 CB GLU A 363 7.193 2.315 3.369 1.00 0.00 C ATOM 672 CG GLU A 363 6.536 2.031 4.712 1.00 0.00 C ATOM 673 CD GLU A 363 7.538 1.753 5.813 1.00 0.00 C ATOM 674 OE1 GLU A 363 8.079 0.629 5.865 1.00 0.00 O ATOM 675 OE2 GLU A 363 7.791 2.654 6.638 1.00 0.00 O ATOM 0 H GLU A 363 6.500 4.619 3.972 1.00 0.00 H new ATOM 0 HA GLU A 363 8.979 3.264 4.086 1.00 0.00 H new ATOM 0 HB2 GLU A 363 6.416 2.515 2.631 1.00 0.00 H new ATOM 0 HB3 GLU A 363 7.723 1.421 3.039 1.00 0.00 H new ATOM 0 HG2 GLU A 363 5.919 2.884 4.996 1.00 0.00 H new ATOM 0 HG3 GLU A 363 5.869 1.175 4.610 1.00 0.00 H new ATOM 682 N MET A 364 7.999 4.350 1.120 1.00 0.00 N ATOM 683 CA MET A 364 8.473 4.658 -0.225 1.00 0.00 C ATOM 684 C MET A 364 9.557 5.728 -0.176 1.00 0.00 C ATOM 685 O MET A 364 10.514 5.698 -0.950 1.00 0.00 O ATOM 686 CB MET A 364 7.328 5.121 -1.135 1.00 0.00 C ATOM 687 CG MET A 364 6.346 4.021 -1.523 1.00 0.00 C ATOM 688 SD MET A 364 5.438 4.412 -3.034 1.00 0.00 S ATOM 689 CE MET A 364 4.797 6.043 -2.651 1.00 0.00 C ATOM 0 H MET A 364 7.051 4.671 1.318 1.00 0.00 H new ATOM 0 HA MET A 364 8.889 3.741 -0.642 1.00 0.00 H new ATOM 0 HB2 MET A 364 6.781 5.919 -0.632 1.00 0.00 H new ATOM 0 HB3 MET A 364 7.753 5.549 -2.043 1.00 0.00 H new ATOM 0 HG2 MET A 364 6.888 3.085 -1.660 1.00 0.00 H new ATOM 0 HG3 MET A 364 5.640 3.864 -0.708 1.00 0.00 H new ATOM 0 HE1 MET A 364 3.834 6.181 -3.144 1.00 0.00 H new ATOM 0 HE2 MET A 364 4.670 6.140 -1.573 1.00 0.00 H new ATOM 0 HE3 MET A 364 5.497 6.801 -3.004 1.00 0.00 H new ATOM 699 N ASP A 365 9.402 6.673 0.743 1.00 0.00 N ATOM 700 CA ASP A 365 10.401 7.715 0.949 1.00 0.00 C ATOM 701 C ASP A 365 11.714 7.103 1.422 1.00 0.00 C ATOM 702 O ASP A 365 12.796 7.519 1.005 1.00 0.00 O ATOM 703 CB ASP A 365 9.903 8.738 1.972 1.00 0.00 C ATOM 704 CG ASP A 365 10.942 9.791 2.295 1.00 0.00 C ATOM 705 OD1 ASP A 365 11.023 10.799 1.563 1.00 0.00 O ATOM 706 OD2 ASP A 365 11.679 9.620 3.285 1.00 0.00 O ATOM 0 H ASP A 365 8.592 6.739 1.359 1.00 0.00 H new ATOM 0 HA ASP A 365 10.570 8.222 -0.001 1.00 0.00 H new ATOM 0 HB2 ASP A 365 9.006 9.224 1.588 1.00 0.00 H new ATOM 0 HB3 ASP A 365 9.618 8.221 2.888 1.00 0.00 H new ATOM 711 N GLN A 366 11.603 6.102 2.286 1.00 0.00 N ATOM 712 CA GLN A 366 12.763 5.387 2.791 1.00 0.00 C ATOM 713 C GLN A 366 13.534 4.735 1.647 1.00 0.00 C ATOM 714 O GLN A 366 14.765 4.727 1.644 1.00 0.00 O ATOM 715 CB GLN A 366 12.330 4.324 3.805 1.00 0.00 C ATOM 716 CG GLN A 366 13.489 3.568 4.436 1.00 0.00 C ATOM 717 CD GLN A 366 14.422 4.474 5.215 1.00 0.00 C ATOM 718 OE1 GLN A 366 14.232 4.698 6.411 1.00 0.00 O ATOM 719 NE2 GLN A 366 15.436 4.999 4.544 1.00 0.00 N ATOM 0 H GLN A 366 10.712 5.766 2.653 1.00 0.00 H new ATOM 0 HA GLN A 366 13.418 6.103 3.286 1.00 0.00 H new ATOM 0 HB2 GLN A 366 11.749 4.803 4.593 1.00 0.00 H new ATOM 0 HB3 GLN A 366 11.670 3.611 3.310 1.00 0.00 H new ATOM 0 HG2 GLN A 366 13.097 2.799 5.101 1.00 0.00 H new ATOM 0 HG3 GLN A 366 14.053 3.057 3.655 1.00 0.00 H new ATOM 0 HE21 GLN A 366 15.556 4.787 3.554 1.00 0.00 H new ATOM 0 HE22 GLN A 366 16.096 5.615 5.018 1.00 0.00 H new ATOM 728 N LYS A 367 12.804 4.201 0.672 1.00 0.00 N ATOM 729 CA LYS A 367 13.430 3.559 -0.476 1.00 0.00 C ATOM 730 C LYS A 367 14.198 4.580 -1.302 1.00 0.00 C ATOM 731 O LYS A 367 15.304 4.307 -1.756 1.00 0.00 O ATOM 732 CB LYS A 367 12.390 2.861 -1.355 1.00 0.00 C ATOM 733 CG LYS A 367 13.008 2.020 -2.464 1.00 0.00 C ATOM 734 CD LYS A 367 11.964 1.540 -3.458 1.00 0.00 C ATOM 735 CE LYS A 367 12.593 0.712 -4.568 1.00 0.00 C ATOM 736 NZ LYS A 367 11.651 0.486 -5.694 1.00 0.00 N ATOM 0 H LYS A 367 11.784 4.201 0.655 1.00 0.00 H new ATOM 0 HA LYS A 367 14.123 2.807 -0.098 1.00 0.00 H new ATOM 0 HB2 LYS A 367 11.765 2.223 -0.730 1.00 0.00 H new ATOM 0 HB3 LYS A 367 11.736 3.612 -1.799 1.00 0.00 H new ATOM 0 HG2 LYS A 367 13.764 2.606 -2.986 1.00 0.00 H new ATOM 0 HG3 LYS A 367 13.516 1.160 -2.028 1.00 0.00 H new ATOM 0 HD2 LYS A 367 11.212 0.945 -2.939 1.00 0.00 H new ATOM 0 HD3 LYS A 367 11.449 2.398 -3.890 1.00 0.00 H new ATOM 0 HE2 LYS A 367 13.485 1.218 -4.937 1.00 0.00 H new ATOM 0 HE3 LYS A 367 12.915 -0.249 -4.166 1.00 0.00 H new ATOM 0 HZ1 LYS A 367 12.119 -0.082 -6.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 367 10.811 -0.020 -5.348 1.00 0.00 H new ATOM 0 HZ3 LYS A 367 11.363 1.401 -6.095 1.00 0.00 H new ATOM 750 N ASP A 368 13.610 5.761 -1.477 1.00 0.00 N ATOM 751 CA ASP A 368 14.253 6.841 -2.227 1.00 0.00 C ATOM 752 C ASP A 368 15.601 7.180 -1.609 1.00 0.00 C ATOM 753 O ASP A 368 16.600 7.353 -2.311 1.00 0.00 O ATOM 754 CB ASP A 368 13.362 8.089 -2.243 1.00 0.00 C ATOM 755 CG ASP A 368 13.963 9.234 -3.043 1.00 0.00 C ATOM 756 OD1 ASP A 368 14.717 10.046 -2.465 1.00 0.00 O ATOM 757 OD2 ASP A 368 13.668 9.337 -4.255 1.00 0.00 O ATOM 0 H ASP A 368 12.688 5.996 -1.110 1.00 0.00 H new ATOM 0 HA ASP A 368 14.404 6.504 -3.252 1.00 0.00 H new ATOM 0 HB2 ASP A 368 12.390 7.830 -2.663 1.00 0.00 H new ATOM 0 HB3 ASP A 368 13.189 8.419 -1.219 1.00 0.00 H new ATOM 762 N ALA A 369 15.620 7.250 -0.285 1.00 0.00 N ATOM 763 CA ALA A 369 16.835 7.546 0.453 1.00 0.00 C ATOM 764 C ALA A 369 17.854 6.425 0.297 1.00 0.00 C ATOM 765 O ALA A 369 19.038 6.679 0.081 1.00 0.00 O ATOM 766 CB ALA A 369 16.519 7.773 1.924 1.00 0.00 C ATOM 0 H ALA A 369 14.799 7.104 0.302 1.00 0.00 H new ATOM 0 HA ALA A 369 17.268 8.458 0.042 1.00 0.00 H new ATOM 0 HB1 ALA A 369 17.440 7.994 2.464 1.00 0.00 H new ATOM 0 HB2 ALA A 369 15.830 8.612 2.023 1.00 0.00 H new ATOM 0 HB3 ALA A 369 16.060 6.876 2.340 1.00 0.00 H new ATOM 772 N LEU A 370 17.388 5.187 0.395 1.00 0.00 N ATOM 773 CA LEU A 370 18.270 4.030 0.284 1.00 0.00 C ATOM 774 C LEU A 370 18.797 3.875 -1.141 1.00 0.00 C ATOM 775 O LEU A 370 19.950 3.488 -1.345 1.00 0.00 O ATOM 776 CB LEU A 370 17.548 2.753 0.727 1.00 0.00 C ATOM 777 CG LEU A 370 17.076 2.735 2.183 1.00 0.00 C ATOM 778 CD1 LEU A 370 16.505 1.374 2.535 1.00 0.00 C ATOM 779 CD2 LEU A 370 18.212 3.094 3.129 1.00 0.00 C ATOM 0 H LEU A 370 16.407 4.957 0.551 1.00 0.00 H new ATOM 0 HA LEU A 370 19.121 4.195 0.945 1.00 0.00 H new ATOM 0 HB2 LEU A 370 16.683 2.603 0.081 1.00 0.00 H new ATOM 0 HB3 LEU A 370 18.215 1.906 0.569 1.00 0.00 H new ATOM 0 HG LEU A 370 16.293 3.484 2.295 1.00 0.00 H new ATOM 0 HD11 LEU A 370 16.173 1.376 3.573 1.00 0.00 H new ATOM 0 HD12 LEU A 370 15.658 1.155 1.884 1.00 0.00 H new ATOM 0 HD13 LEU A 370 17.272 0.612 2.401 1.00 0.00 H new ATOM 0 HD21 LEU A 370 17.850 3.074 4.157 1.00 0.00 H new ATOM 0 HD22 LEU A 370 19.022 2.373 3.015 1.00 0.00 H new ATOM 0 HD23 LEU A 370 18.580 4.093 2.893 1.00 0.00 H new ATOM 791 N ASN A 371 17.954 4.180 -2.121 1.00 0.00 N ATOM 792 CA ASN A 371 18.362 4.154 -3.523 1.00 0.00 C ATOM 793 C ASN A 371 19.477 5.156 -3.763 1.00 0.00 C ATOM 794 O ASN A 371 20.502 4.825 -4.362 1.00 0.00 O ATOM 795 CB ASN A 371 17.185 4.472 -4.452 1.00 0.00 C ATOM 796 CG ASN A 371 16.200 3.327 -4.583 1.00 0.00 C ATOM 797 OD1 ASN A 371 16.566 2.156 -4.480 1.00 0.00 O ATOM 798 ND2 ASN A 371 14.941 3.658 -4.822 1.00 0.00 N ATOM 0 H ASN A 371 16.982 4.449 -1.971 1.00 0.00 H new ATOM 0 HA ASN A 371 18.717 3.148 -3.746 1.00 0.00 H new ATOM 0 HB2 ASN A 371 16.662 5.351 -4.077 1.00 0.00 H new ATOM 0 HB3 ASN A 371 17.569 4.727 -5.440 1.00 0.00 H new ATOM 0 HD21 ASN A 371 14.234 2.931 -4.928 1.00 0.00 H new ATOM 0 HD22 ASN A 371 14.678 4.640 -4.900 1.00 0.00 H new ATOM 805 N LYS A 372 19.274 6.379 -3.284 1.00 0.00 N ATOM 806 CA LYS A 372 20.279 7.426 -3.406 1.00 0.00 C ATOM 807 C LYS A 372 21.545 7.034 -2.662 1.00 0.00 C ATOM 808 O LYS A 372 22.651 7.195 -3.176 1.00 0.00 O ATOM 809 CB LYS A 372 19.747 8.751 -2.861 1.00 0.00 C ATOM 810 CG LYS A 372 20.771 9.873 -2.909 1.00 0.00 C ATOM 811 CD LYS A 372 20.222 11.167 -2.340 1.00 0.00 C ATOM 812 CE LYS A 372 19.041 11.670 -3.147 1.00 0.00 C ATOM 813 NZ LYS A 372 18.561 12.986 -2.661 1.00 0.00 N ATOM 0 H LYS A 372 18.420 6.669 -2.807 1.00 0.00 H new ATOM 0 HA LYS A 372 20.512 7.551 -4.463 1.00 0.00 H new ATOM 0 HB2 LYS A 372 18.868 9.045 -3.434 1.00 0.00 H new ATOM 0 HB3 LYS A 372 19.422 8.608 -1.830 1.00 0.00 H new ATOM 0 HG2 LYS A 372 21.658 9.578 -2.349 1.00 0.00 H new ATOM 0 HG3 LYS A 372 21.084 10.034 -3.941 1.00 0.00 H new ATOM 0 HD2 LYS A 372 19.917 11.011 -1.305 1.00 0.00 H new ATOM 0 HD3 LYS A 372 21.007 11.924 -2.330 1.00 0.00 H new ATOM 0 HE2 LYS A 372 19.326 11.752 -4.196 1.00 0.00 H new ATOM 0 HE3 LYS A 372 18.229 10.945 -3.093 1.00 0.00 H new ATOM 0 HZ1 LYS A 372 17.753 13.296 -3.238 1.00 0.00 H new ATOM 0 HZ2 LYS A 372 18.265 12.902 -1.668 1.00 0.00 H new ATOM 0 HZ3 LYS A 372 19.328 13.684 -2.736 1.00 0.00 H new ATOM 827 N MET A 373 21.365 6.519 -1.451 1.00 0.00 N ATOM 828 CA MET A 373 22.473 6.054 -0.629 1.00 0.00 C ATOM 829 C MET A 373 23.335 5.061 -1.398 1.00 0.00 C ATOM 830 O MET A 373 24.541 5.257 -1.545 1.00 0.00 O ATOM 831 CB MET A 373 21.937 5.398 0.645 1.00 0.00 C ATOM 832 CG MET A 373 23.023 4.873 1.569 1.00 0.00 C ATOM 833 SD MET A 373 22.356 3.954 2.972 1.00 0.00 S ATOM 834 CE MET A 373 21.332 5.206 3.741 1.00 0.00 C ATOM 0 H MET A 373 20.450 6.413 -1.014 1.00 0.00 H new ATOM 0 HA MET A 373 23.089 6.913 -0.362 1.00 0.00 H new ATOM 0 HB2 MET A 373 21.330 6.123 1.188 1.00 0.00 H new ATOM 0 HB3 MET A 373 21.279 4.574 0.369 1.00 0.00 H new ATOM 0 HG2 MET A 373 23.696 4.228 1.004 1.00 0.00 H new ATOM 0 HG3 MET A 373 23.618 5.709 1.937 1.00 0.00 H new ATOM 0 HE1 MET A 373 21.022 4.866 4.729 1.00 0.00 H new ATOM 0 HE2 MET A 373 21.899 6.132 3.837 1.00 0.00 H new ATOM 0 HE3 MET A 373 20.450 5.383 3.125 1.00 0.00 H new ATOM 844 N LYS A 374 22.705 4.007 -1.904 1.00 0.00 N ATOM 845 CA LYS A 374 23.417 2.980 -2.652 1.00 0.00 C ATOM 846 C LYS A 374 24.058 3.575 -3.898 1.00 0.00 C ATOM 847 O LYS A 374 25.183 3.232 -4.250 1.00 0.00 O ATOM 848 CB LYS A 374 22.468 1.848 -3.045 1.00 0.00 C ATOM 849 CG LYS A 374 23.173 0.678 -3.712 1.00 0.00 C ATOM 850 CD LYS A 374 22.193 -0.381 -4.184 1.00 0.00 C ATOM 851 CE LYS A 374 21.292 0.140 -5.293 1.00 0.00 C ATOM 852 NZ LYS A 374 20.434 -0.932 -5.857 1.00 0.00 N ATOM 0 H LYS A 374 21.703 3.842 -1.809 1.00 0.00 H new ATOM 0 HA LYS A 374 24.201 2.575 -2.012 1.00 0.00 H new ATOM 0 HB2 LYS A 374 21.950 1.492 -2.155 1.00 0.00 H new ATOM 0 HB3 LYS A 374 21.708 2.239 -3.721 1.00 0.00 H new ATOM 0 HG2 LYS A 374 23.753 1.040 -4.561 1.00 0.00 H new ATOM 0 HG3 LYS A 374 23.879 0.232 -3.011 1.00 0.00 H new ATOM 0 HD2 LYS A 374 22.743 -1.252 -4.541 1.00 0.00 H new ATOM 0 HD3 LYS A 374 21.582 -0.712 -3.344 1.00 0.00 H new ATOM 0 HE2 LYS A 374 20.664 0.941 -4.904 1.00 0.00 H new ATOM 0 HE3 LYS A 374 21.904 0.571 -6.086 1.00 0.00 H new ATOM 0 HZ1 LYS A 374 19.835 -0.537 -6.610 1.00 0.00 H new ATOM 0 HZ2 LYS A 374 21.033 -1.685 -6.251 1.00 0.00 H new ATOM 0 HZ3 LYS A 374 19.832 -1.326 -5.106 1.00 0.00 H new ATOM 866 N ASP A 375 23.335 4.484 -4.543 1.00 0.00 N ATOM 867 CA ASP A 375 23.819 5.153 -5.748 1.00 0.00 C ATOM 868 C ASP A 375 25.134 5.877 -5.477 1.00 0.00 C ATOM 869 O ASP A 375 26.056 5.844 -6.295 1.00 0.00 O ATOM 870 CB ASP A 375 22.767 6.144 -6.251 1.00 0.00 C ATOM 871 CG ASP A 375 23.154 6.792 -7.561 1.00 0.00 C ATOM 872 OD1 ASP A 375 23.058 6.119 -8.610 1.00 0.00 O ATOM 873 OD2 ASP A 375 23.548 7.974 -7.550 1.00 0.00 O ATOM 0 H ASP A 375 22.403 4.777 -4.249 1.00 0.00 H new ATOM 0 HA ASP A 375 23.997 4.398 -6.514 1.00 0.00 H new ATOM 0 HB2 ASP A 375 21.816 5.626 -6.374 1.00 0.00 H new ATOM 0 HB3 ASP A 375 22.614 6.918 -5.499 1.00 0.00 H new ATOM 878 N VAL A 376 25.223 6.520 -4.317 1.00 0.00 N ATOM 879 CA VAL A 376 26.448 7.204 -3.924 1.00 0.00 C ATOM 880 C VAL A 376 27.562 6.195 -3.678 1.00 0.00 C ATOM 881 O VAL A 376 28.692 6.404 -4.101 1.00 0.00 O ATOM 882 CB VAL A 376 26.265 8.065 -2.655 1.00 0.00 C ATOM 883 CG1 VAL A 376 27.552 8.805 -2.324 1.00 0.00 C ATOM 884 CG2 VAL A 376 25.118 9.047 -2.825 1.00 0.00 C ATOM 0 H VAL A 376 24.466 6.581 -3.637 1.00 0.00 H new ATOM 0 HA VAL A 376 26.711 7.867 -4.748 1.00 0.00 H new ATOM 0 HB VAL A 376 26.022 7.399 -1.827 1.00 0.00 H new ATOM 0 HG11 VAL A 376 27.405 9.407 -1.427 1.00 0.00 H new ATOM 0 HG12 VAL A 376 28.352 8.085 -2.151 1.00 0.00 H new ATOM 0 HG13 VAL A 376 27.823 9.454 -3.156 1.00 0.00 H new ATOM 0 HG21 VAL A 376 25.010 9.641 -1.918 1.00 0.00 H new ATOM 0 HG22 VAL A 376 25.325 9.706 -3.668 1.00 0.00 H new ATOM 0 HG23 VAL A 376 24.194 8.499 -3.012 1.00 0.00 H new ATOM 894 N TYR A 377 27.231 5.096 -3.008 1.00 0.00 N ATOM 895 CA TYR A 377 28.212 4.059 -2.688 1.00 0.00 C ATOM 896 C TYR A 377 28.756 3.383 -3.947 1.00 0.00 C ATOM 897 O TYR A 377 29.907 2.953 -3.974 1.00 0.00 O ATOM 898 CB TYR A 377 27.604 3.007 -1.759 1.00 0.00 C ATOM 899 CG TYR A 377 27.587 3.401 -0.296 1.00 0.00 C ATOM 900 CD1 TYR A 377 26.710 4.367 0.180 1.00 0.00 C ATOM 901 CD2 TYR A 377 28.447 2.797 0.609 1.00 0.00 C ATOM 902 CE1 TYR A 377 26.692 4.719 1.516 1.00 0.00 C ATOM 903 CE2 TYR A 377 28.433 3.142 1.947 1.00 0.00 C ATOM 904 CZ TYR A 377 27.554 4.103 2.396 1.00 0.00 C ATOM 905 OH TYR A 377 27.539 4.448 3.728 1.00 0.00 O ATOM 0 H TYR A 377 26.288 4.898 -2.674 1.00 0.00 H new ATOM 0 HA TYR A 377 29.043 4.550 -2.181 1.00 0.00 H new ATOM 0 HB2 TYR A 377 26.583 2.803 -2.080 1.00 0.00 H new ATOM 0 HB3 TYR A 377 28.164 2.078 -1.866 1.00 0.00 H new ATOM 0 HD1 TYR A 377 26.031 4.851 -0.506 1.00 0.00 H new ATOM 0 HD2 TYR A 377 29.139 2.044 0.262 1.00 0.00 H new ATOM 0 HE1 TYR A 377 26.005 5.474 1.869 1.00 0.00 H new ATOM 0 HE2 TYR A 377 29.109 2.660 2.638 1.00 0.00 H new ATOM 0 HH TYR A 377 28.208 3.919 4.211 1.00 0.00 H new ATOM 915 N GLU A 378 27.928 3.282 -4.979 1.00 0.00 N ATOM 916 CA GLU A 378 28.363 2.696 -6.242 1.00 0.00 C ATOM 917 C GLU A 378 29.378 3.598 -6.930 1.00 0.00 C ATOM 918 O GLU A 378 30.423 3.141 -7.387 1.00 0.00 O ATOM 919 CB GLU A 378 27.174 2.463 -7.178 1.00 0.00 C ATOM 920 CG GLU A 378 26.128 1.515 -6.624 1.00 0.00 C ATOM 921 CD GLU A 378 25.006 1.256 -7.608 1.00 0.00 C ATOM 922 OE1 GLU A 378 24.101 2.106 -7.731 1.00 0.00 O ATOM 923 OE2 GLU A 378 25.029 0.200 -8.272 1.00 0.00 O ATOM 0 H GLU A 378 26.958 3.596 -4.968 1.00 0.00 H new ATOM 0 HA GLU A 378 28.828 1.736 -6.017 1.00 0.00 H new ATOM 0 HB2 GLU A 378 26.702 3.421 -7.395 1.00 0.00 H new ATOM 0 HB3 GLU A 378 27.542 2.068 -8.125 1.00 0.00 H new ATOM 0 HG2 GLU A 378 26.602 0.570 -6.360 1.00 0.00 H new ATOM 0 HG3 GLU A 378 25.714 1.931 -5.706 1.00 0.00 H new ATOM 930 N LYS A 379 29.064 4.881 -6.993 1.00 0.00 N ATOM 931 CA LYS A 379 29.933 5.847 -7.649 1.00 0.00 C ATOM 932 C LYS A 379 31.100 6.222 -6.743 1.00 0.00 C ATOM 933 O LYS A 379 32.154 6.656 -7.213 1.00 0.00 O ATOM 934 CB LYS A 379 29.133 7.092 -8.036 1.00 0.00 C ATOM 935 CG LYS A 379 27.963 6.784 -8.958 1.00 0.00 C ATOM 936 CD LYS A 379 27.146 8.021 -9.295 1.00 0.00 C ATOM 937 CE LYS A 379 26.565 8.676 -8.052 1.00 0.00 C ATOM 938 NZ LYS A 379 25.548 9.703 -8.396 1.00 0.00 N ATOM 0 H LYS A 379 28.212 5.280 -6.598 1.00 0.00 H new ATOM 0 HA LYS A 379 30.338 5.394 -8.554 1.00 0.00 H new ATOM 0 HB2 LYS A 379 28.759 7.572 -7.132 1.00 0.00 H new ATOM 0 HB3 LYS A 379 29.796 7.806 -8.525 1.00 0.00 H new ATOM 0 HG2 LYS A 379 28.338 6.338 -9.879 1.00 0.00 H new ATOM 0 HG3 LYS A 379 27.317 6.044 -8.486 1.00 0.00 H new ATOM 0 HD2 LYS A 379 27.775 8.738 -9.822 1.00 0.00 H new ATOM 0 HD3 LYS A 379 26.337 7.748 -9.973 1.00 0.00 H new ATOM 0 HE2 LYS A 379 26.113 7.914 -7.417 1.00 0.00 H new ATOM 0 HE3 LYS A 379 27.367 9.137 -7.475 1.00 0.00 H new ATOM 0 HZ1 LYS A 379 25.721 10.563 -7.838 1.00 0.00 H new ATOM 0 HZ2 LYS A 379 25.612 9.929 -9.409 1.00 0.00 H new ATOM 0 HZ3 LYS A 379 24.598 9.336 -8.182 1.00 0.00 H new ATOM 952 N ASN A 380 30.907 6.044 -5.445 1.00 0.00 N ATOM 953 CA ASN A 380 31.926 6.373 -4.459 1.00 0.00 C ATOM 954 C ASN A 380 32.076 5.260 -3.428 1.00 0.00 C ATOM 955 O ASN A 380 31.537 5.356 -2.321 1.00 0.00 O ATOM 956 CB ASN A 380 31.590 7.681 -3.730 1.00 0.00 C ATOM 957 CG ASN A 380 31.553 8.886 -4.645 1.00 0.00 C ATOM 958 OD1 ASN A 380 32.564 9.558 -4.850 1.00 0.00 O ATOM 959 ND2 ASN A 380 30.381 9.177 -5.191 1.00 0.00 N ATOM 0 H ASN A 380 30.046 5.670 -5.047 1.00 0.00 H new ATOM 0 HA ASN A 380 32.864 6.492 -5.001 1.00 0.00 H new ATOM 0 HB2 ASN A 380 30.622 7.577 -3.239 1.00 0.00 H new ATOM 0 HB3 ASN A 380 32.328 7.852 -2.946 1.00 0.00 H new ATOM 0 HD21 ASN A 380 30.292 9.985 -5.808 1.00 0.00 H new ATOM 0 HD22 ASN A 380 29.568 8.593 -4.995 1.00 0.00 H new ATOM 966 N PRO A 381 32.816 4.187 -3.769 1.00 0.00 N ATOM 967 CA PRO A 381 33.152 3.116 -2.817 1.00 0.00 C ATOM 968 C PRO A 381 33.952 3.643 -1.624 1.00 0.00 C ATOM 969 O PRO A 381 34.228 2.914 -0.673 1.00 0.00 O ATOM 970 CB PRO A 381 34.000 2.145 -3.644 1.00 0.00 C ATOM 971 CG PRO A 381 33.647 2.436 -5.060 1.00 0.00 C ATOM 972 CD PRO A 381 33.348 3.907 -5.113 1.00 0.00 C ATOM 0 HA PRO A 381 32.261 2.656 -2.390 1.00 0.00 H new ATOM 0 HB2 PRO A 381 35.064 2.297 -3.463 1.00 0.00 H new ATOM 0 HB3 PRO A 381 33.778 1.109 -3.387 1.00 0.00 H new ATOM 0 HG2 PRO A 381 34.469 2.180 -5.729 1.00 0.00 H new ATOM 0 HG3 PRO A 381 32.784 1.850 -5.376 1.00 0.00 H new ATOM 0 HD2 PRO A 381 34.243 4.493 -5.323 1.00 0.00 H new ATOM 0 HD3 PRO A 381 32.622 4.143 -5.891 1.00 0.00 H new ATOM 980 N GLN A 382 34.319 4.919 -1.694 1.00 0.00 N ATOM 981 CA GLN A 382 34.989 5.606 -0.599 1.00 0.00 C ATOM 982 C GLN A 382 34.180 5.514 0.689 1.00 0.00 C ATOM 983 O GLN A 382 34.742 5.448 1.781 1.00 0.00 O ATOM 984 CB GLN A 382 35.199 7.080 -0.953 1.00 0.00 C ATOM 985 CG GLN A 382 36.205 7.307 -2.068 1.00 0.00 C ATOM 986 CD GLN A 382 36.414 8.778 -2.365 1.00 0.00 C ATOM 987 OE1 GLN A 382 37.258 9.431 -1.754 1.00 0.00 O ATOM 988 NE2 GLN A 382 35.656 9.310 -3.310 1.00 0.00 N ATOM 0 H GLN A 382 34.159 5.505 -2.513 1.00 0.00 H new ATOM 0 HA GLN A 382 35.952 5.120 -0.443 1.00 0.00 H new ATOM 0 HB2 GLN A 382 34.243 7.513 -1.246 1.00 0.00 H new ATOM 0 HB3 GLN A 382 35.531 7.614 -0.063 1.00 0.00 H new ATOM 0 HG2 GLN A 382 37.158 6.856 -1.792 1.00 0.00 H new ATOM 0 HG3 GLN A 382 35.863 6.802 -2.971 1.00 0.00 H new ATOM 0 HE21 GLN A 382 34.967 8.735 -3.795 1.00 0.00 H new ATOM 0 HE22 GLN A 382 35.761 10.295 -3.554 1.00 0.00 H new ATOM 997 N MET A 383 32.859 5.499 0.553 1.00 0.00 N ATOM 998 CA MET A 383 31.972 5.479 1.709 1.00 0.00 C ATOM 999 C MET A 383 31.777 4.064 2.240 1.00 0.00 C ATOM 1000 O MET A 383 31.333 3.879 3.371 1.00 0.00 O ATOM 1001 CB MET A 383 30.617 6.090 1.354 1.00 0.00 C ATOM 1002 CG MET A 383 30.685 7.574 1.038 1.00 0.00 C ATOM 1003 SD MET A 383 29.082 8.267 0.593 1.00 0.00 S ATOM 1004 CE MET A 383 28.136 7.936 2.077 1.00 0.00 C ATOM 0 H MET A 383 32.379 5.500 -0.347 1.00 0.00 H new ATOM 0 HA MET A 383 32.441 6.075 2.492 1.00 0.00 H new ATOM 0 HB2 MET A 383 30.204 5.562 0.495 1.00 0.00 H new ATOM 0 HB3 MET A 383 29.929 5.935 2.185 1.00 0.00 H new ATOM 0 HG2 MET A 383 31.079 8.107 1.903 1.00 0.00 H new ATOM 0 HG3 MET A 383 31.385 7.735 0.218 1.00 0.00 H new ATOM 0 HE1 MET A 383 27.102 8.245 1.925 1.00 0.00 H new ATOM 0 HE2 MET A 383 28.168 6.869 2.298 1.00 0.00 H new ATOM 0 HE3 MET A 383 28.562 8.493 2.912 1.00 0.00 H new ATOM 1014 N GLY A 384 32.106 3.072 1.426 1.00 0.00 N ATOM 1015 CA GLY A 384 31.941 1.698 1.847 1.00 0.00 C ATOM 1016 C GLY A 384 31.571 0.775 0.704 1.00 0.00 C ATOM 1017 O GLY A 384 32.196 0.802 -0.355 1.00 0.00 O ATOM 0 H GLY A 384 32.483 3.194 0.486 1.00 0.00 H new ATOM 0 HA2 GLY A 384 32.867 1.349 2.305 1.00 0.00 H new ATOM 0 HA3 GLY A 384 31.168 1.648 2.614 1.00 0.00 H new ATOM 1021 N ASP A 385 30.546 -0.036 0.919 1.00 0.00 N ATOM 1022 CA ASP A 385 30.141 -1.038 -0.055 1.00 0.00 C ATOM 1023 C ASP A 385 28.639 -0.969 -0.336 1.00 0.00 C ATOM 1024 O ASP A 385 27.823 -1.037 0.582 1.00 0.00 O ATOM 1025 CB ASP A 385 30.521 -2.427 0.461 1.00 0.00 C ATOM 1026 CG ASP A 385 29.793 -3.533 -0.262 1.00 0.00 C ATOM 1027 OD1 ASP A 385 30.163 -3.849 -1.411 1.00 0.00 O ATOM 1028 OD2 ASP A 385 28.840 -4.090 0.316 1.00 0.00 O ATOM 0 H ASP A 385 29.976 -0.019 1.765 1.00 0.00 H new ATOM 0 HA ASP A 385 30.660 -0.839 -0.993 1.00 0.00 H new ATOM 0 HB2 ASP A 385 31.596 -2.571 0.349 1.00 0.00 H new ATOM 0 HB3 ASP A 385 30.300 -2.488 1.527 1.00 0.00 H new ATOM 1033 N PRO A 386 28.259 -0.825 -1.615 1.00 0.00 N ATOM 1034 CA PRO A 386 26.851 -0.761 -2.023 1.00 0.00 C ATOM 1035 C PRO A 386 26.147 -2.118 -1.964 1.00 0.00 C ATOM 1036 O PRO A 386 24.916 -2.187 -1.974 1.00 0.00 O ATOM 1037 CB PRO A 386 26.925 -0.264 -3.467 1.00 0.00 C ATOM 1038 CG PRO A 386 28.258 -0.712 -3.957 1.00 0.00 C ATOM 1039 CD PRO A 386 29.175 -0.684 -2.764 1.00 0.00 C ATOM 0 HA PRO A 386 26.271 -0.120 -1.359 1.00 0.00 H new ATOM 0 HB2 PRO A 386 26.120 -0.683 -4.071 1.00 0.00 H new ATOM 0 HB3 PRO A 386 26.829 0.821 -3.517 1.00 0.00 H new ATOM 0 HG2 PRO A 386 28.200 -1.715 -4.380 1.00 0.00 H new ATOM 0 HG3 PRO A 386 28.624 -0.054 -4.745 1.00 0.00 H new ATOM 0 HD2 PRO A 386 29.902 -1.496 -2.799 1.00 0.00 H new ATOM 0 HD3 PRO A 386 29.739 0.247 -2.714 1.00 0.00 H new ATOM 1047 N SER A 387 26.923 -3.192 -1.897 1.00 0.00 N ATOM 1048 CA SER A 387 26.368 -4.539 -1.886 1.00 0.00 C ATOM 1049 C SER A 387 25.608 -4.799 -0.588 1.00 0.00 C ATOM 1050 O SER A 387 24.505 -5.346 -0.599 1.00 0.00 O ATOM 1051 CB SER A 387 27.486 -5.566 -2.054 1.00 0.00 C ATOM 1052 OG SER A 387 28.429 -5.129 -3.018 1.00 0.00 O ATOM 0 H SER A 387 27.941 -3.156 -1.849 1.00 0.00 H new ATOM 0 HA SER A 387 25.670 -4.632 -2.718 1.00 0.00 H new ATOM 0 HB2 SER A 387 27.984 -5.728 -1.098 1.00 0.00 H new ATOM 0 HB3 SER A 387 27.064 -6.523 -2.359 1.00 0.00 H new ATOM 0 HG SER A 387 29.153 -4.643 -2.571 1.00 0.00 H new ATOM 1058 N SER A 388 26.195 -4.380 0.525 1.00 0.00 N ATOM 1059 CA SER A 388 25.586 -4.554 1.840 1.00 0.00 C ATOM 1060 C SER A 388 24.314 -3.716 1.985 1.00 0.00 C ATOM 1061 O SER A 388 23.524 -3.918 2.907 1.00 0.00 O ATOM 1062 CB SER A 388 26.597 -4.193 2.934 1.00 0.00 C ATOM 1063 OG SER A 388 27.171 -2.917 2.700 1.00 0.00 O ATOM 0 H SER A 388 27.101 -3.912 0.544 1.00 0.00 H new ATOM 0 HA SER A 388 25.301 -5.601 1.947 1.00 0.00 H new ATOM 0 HB2 SER A 388 26.103 -4.200 3.906 1.00 0.00 H new ATOM 0 HB3 SER A 388 27.383 -4.947 2.970 1.00 0.00 H new ATOM 0 HG SER A 388 27.811 -2.711 3.413 1.00 0.00 H new ATOM 1069 N LEU A 389 24.110 -2.783 1.063 1.00 0.00 N ATOM 1070 CA LEU A 389 22.927 -1.933 1.086 1.00 0.00 C ATOM 1071 C LEU A 389 21.779 -2.568 0.305 1.00 0.00 C ATOM 1072 O LEU A 389 20.654 -2.069 0.324 1.00 0.00 O ATOM 1073 CB LEU A 389 23.251 -0.556 0.505 1.00 0.00 C ATOM 1074 CG LEU A 389 24.338 0.225 1.243 1.00 0.00 C ATOM 1075 CD1 LEU A 389 24.611 1.542 0.540 1.00 0.00 C ATOM 1076 CD2 LEU A 389 23.937 0.469 2.690 1.00 0.00 C ATOM 0 H LEU A 389 24.749 -2.596 0.290 1.00 0.00 H new ATOM 0 HA LEU A 389 22.616 -1.820 2.124 1.00 0.00 H new ATOM 0 HB2 LEU A 389 23.558 -0.681 -0.533 1.00 0.00 H new ATOM 0 HB3 LEU A 389 22.339 0.041 0.498 1.00 0.00 H new ATOM 0 HG LEU A 389 25.252 -0.369 1.237 1.00 0.00 H new ATOM 0 HD11 LEU A 389 25.387 2.087 1.077 1.00 0.00 H new ATOM 0 HD12 LEU A 389 24.943 1.348 -0.480 1.00 0.00 H new ATOM 0 HD13 LEU A 389 23.699 2.138 0.517 1.00 0.00 H new ATOM 0 HD21 LEU A 389 24.725 1.026 3.197 1.00 0.00 H new ATOM 0 HD22 LEU A 389 23.011 1.042 2.719 1.00 0.00 H new ATOM 0 HD23 LEU A 389 23.788 -0.487 3.192 1.00 0.00 H new ATOM 1088 N HIS A 390 22.065 -3.675 -0.373 1.00 0.00 N ATOM 1089 CA HIS A 390 21.053 -4.362 -1.173 1.00 0.00 C ATOM 1090 C HIS A 390 19.922 -4.917 -0.296 1.00 0.00 C ATOM 1091 O HIS A 390 18.753 -4.638 -0.565 1.00 0.00 O ATOM 1092 CB HIS A 390 21.672 -5.481 -2.026 1.00 0.00 C ATOM 1093 CG HIS A 390 22.581 -4.982 -3.109 1.00 0.00 C ATOM 1094 ND1 HIS A 390 23.566 -5.754 -3.687 1.00 0.00 N ATOM 1095 CD2 HIS A 390 22.645 -3.778 -3.725 1.00 0.00 C ATOM 1096 CE1 HIS A 390 24.193 -5.044 -4.607 1.00 0.00 C ATOM 1097 NE2 HIS A 390 23.655 -3.844 -4.650 1.00 0.00 N ATOM 0 H HIS A 390 22.985 -4.115 -0.386 1.00 0.00 H new ATOM 0 HA HIS A 390 20.624 -3.621 -1.848 1.00 0.00 H new ATOM 0 HB2 HIS A 390 22.231 -6.154 -1.376 1.00 0.00 H new ATOM 0 HB3 HIS A 390 20.871 -6.067 -2.477 1.00 0.00 H new ATOM 0 HD2 HIS A 390 22.016 -2.923 -3.525 1.00 0.00 H new ATOM 0 HE1 HIS A 390 25.011 -5.390 -5.222 1.00 0.00 H new ATOM 0 HE2 HIS A 390 23.942 -3.087 -5.270 1.00 0.00 H new ATOM 1106 N PRO A 391 20.233 -5.694 0.773 1.00 0.00 N ATOM 1107 CA PRO A 391 19.205 -6.234 1.670 1.00 0.00 C ATOM 1108 C PRO A 391 18.349 -5.141 2.309 1.00 0.00 C ATOM 1109 O PRO A 391 17.166 -5.355 2.590 1.00 0.00 O ATOM 1110 CB PRO A 391 20.000 -6.989 2.745 1.00 0.00 C ATOM 1111 CG PRO A 391 21.398 -6.488 2.624 1.00 0.00 C ATOM 1112 CD PRO A 391 21.581 -6.132 1.179 1.00 0.00 C ATOM 0 HA PRO A 391 18.501 -6.866 1.128 1.00 0.00 H new ATOM 0 HB2 PRO A 391 19.598 -6.796 3.740 1.00 0.00 H new ATOM 0 HB3 PRO A 391 19.953 -8.066 2.585 1.00 0.00 H new ATOM 0 HG2 PRO A 391 21.559 -5.620 3.264 1.00 0.00 H new ATOM 0 HG3 PRO A 391 22.114 -7.249 2.933 1.00 0.00 H new ATOM 0 HD2 PRO A 391 22.319 -5.341 1.049 1.00 0.00 H new ATOM 0 HD3 PRO A 391 21.922 -6.985 0.593 1.00 0.00 H new ATOM 1120 N LYS A 392 18.947 -3.968 2.519 1.00 0.00 N ATOM 1121 CA LYS A 392 18.230 -2.834 3.095 1.00 0.00 C ATOM 1122 C LYS A 392 17.118 -2.375 2.160 1.00 0.00 C ATOM 1123 O LYS A 392 15.976 -2.186 2.578 1.00 0.00 O ATOM 1124 CB LYS A 392 19.178 -1.666 3.380 1.00 0.00 C ATOM 1125 CG LYS A 392 20.135 -1.907 4.537 1.00 0.00 C ATOM 1126 CD LYS A 392 20.900 -0.639 4.892 1.00 0.00 C ATOM 1127 CE LYS A 392 21.731 -0.818 6.154 1.00 0.00 C ATOM 1128 NZ LYS A 392 22.413 0.442 6.558 1.00 0.00 N ATOM 0 H LYS A 392 19.925 -3.780 2.299 1.00 0.00 H new ATOM 0 HA LYS A 392 17.794 -3.164 4.038 1.00 0.00 H new ATOM 0 HB2 LYS A 392 19.758 -1.456 2.481 1.00 0.00 H new ATOM 0 HB3 LYS A 392 18.586 -0.776 3.592 1.00 0.00 H new ATOM 0 HG2 LYS A 392 19.578 -2.254 5.407 1.00 0.00 H new ATOM 0 HG3 LYS A 392 20.838 -2.697 4.273 1.00 0.00 H new ATOM 0 HD2 LYS A 392 21.552 -0.363 4.063 1.00 0.00 H new ATOM 0 HD3 LYS A 392 20.198 0.183 5.032 1.00 0.00 H new ATOM 0 HE2 LYS A 392 21.088 -1.158 6.966 1.00 0.00 H new ATOM 0 HE3 LYS A 392 22.476 -1.597 5.990 1.00 0.00 H new ATOM 0 HZ1 LYS A 392 22.968 0.275 7.422 1.00 0.00 H new ATOM 0 HZ2 LYS A 392 23.047 0.754 5.795 1.00 0.00 H new ATOM 0 HZ3 LYS A 392 21.702 1.179 6.740 1.00 0.00 H new ATOM 1142 N ILE A 393 17.456 -2.201 0.889 1.00 0.00 N ATOM 1143 CA ILE A 393 16.479 -1.784 -0.107 1.00 0.00 C ATOM 1144 C ILE A 393 15.472 -2.901 -0.359 1.00 0.00 C ATOM 1145 O ILE A 393 14.286 -2.647 -0.583 1.00 0.00 O ATOM 1146 CB ILE A 393 17.161 -1.382 -1.434 1.00 0.00 C ATOM 1147 CG1 ILE A 393 18.179 -0.267 -1.183 1.00 0.00 C ATOM 1148 CG2 ILE A 393 16.124 -0.933 -2.459 1.00 0.00 C ATOM 1149 CD1 ILE A 393 18.929 0.170 -2.422 1.00 0.00 C ATOM 0 H ILE A 393 18.398 -2.342 0.524 1.00 0.00 H new ATOM 0 HA ILE A 393 15.958 -0.910 0.285 1.00 0.00 H new ATOM 0 HB ILE A 393 17.681 -2.252 -1.834 1.00 0.00 H new ATOM 0 HG12 ILE A 393 17.662 0.595 -0.760 1.00 0.00 H new ATOM 0 HG13 ILE A 393 18.897 -0.606 -0.436 1.00 0.00 H new ATOM 0 HG21 ILE A 393 16.625 -0.654 -3.386 1.00 0.00 H new ATOM 0 HG22 ILE A 393 15.428 -1.749 -2.654 1.00 0.00 H new ATOM 0 HG23 ILE A 393 15.576 -0.074 -2.070 1.00 0.00 H new ATOM 0 HD11 ILE A 393 19.631 0.962 -2.162 1.00 0.00 H new ATOM 0 HD12 ILE A 393 19.476 -0.678 -2.834 1.00 0.00 H new ATOM 0 HD13 ILE A 393 18.222 0.541 -3.164 1.00 0.00 H new ATOM 1161 N ALA A 394 15.954 -4.138 -0.295 1.00 0.00 N ATOM 1162 CA ALA A 394 15.113 -5.308 -0.504 1.00 0.00 C ATOM 1163 C ALA A 394 13.928 -5.325 0.459 1.00 0.00 C ATOM 1164 O ALA A 394 12.774 -5.362 0.028 1.00 0.00 O ATOM 1165 CB ALA A 394 15.935 -6.579 -0.359 1.00 0.00 C ATOM 0 H ALA A 394 16.931 -4.355 -0.098 1.00 0.00 H new ATOM 0 HA ALA A 394 14.714 -5.257 -1.517 1.00 0.00 H new ATOM 0 HB1 ALA A 394 15.295 -7.447 -0.518 1.00 0.00 H new ATOM 0 HB2 ALA A 394 16.737 -6.580 -1.097 1.00 0.00 H new ATOM 0 HB3 ALA A 394 16.364 -6.623 0.642 1.00 0.00 H new ATOM 1171 N GLU A 395 14.210 -5.270 1.759 1.00 0.00 N ATOM 1172 CA GLU A 395 13.155 -5.310 2.768 1.00 0.00 C ATOM 1173 C GLU A 395 12.260 -4.081 2.652 1.00 0.00 C ATOM 1174 O GLU A 395 11.042 -4.170 2.807 1.00 0.00 O ATOM 1175 CB GLU A 395 13.742 -5.404 4.180 1.00 0.00 C ATOM 1176 CG GLU A 395 14.594 -4.209 4.581 1.00 0.00 C ATOM 1177 CD GLU A 395 15.085 -4.290 6.009 1.00 0.00 C ATOM 1178 OE1 GLU A 395 14.260 -4.155 6.938 1.00 0.00 O ATOM 1179 OE2 GLU A 395 16.301 -4.469 6.212 1.00 0.00 O ATOM 0 H GLU A 395 15.155 -5.198 2.137 1.00 0.00 H new ATOM 0 HA GLU A 395 12.555 -6.203 2.589 1.00 0.00 H new ATOM 0 HB2 GLU A 395 12.926 -5.510 4.895 1.00 0.00 H new ATOM 0 HB3 GLU A 395 14.347 -6.308 4.251 1.00 0.00 H new ATOM 0 HG2 GLU A 395 15.451 -4.139 3.911 1.00 0.00 H new ATOM 0 HG3 GLU A 395 14.013 -3.296 4.453 1.00 0.00 H new ATOM 1186 N THR A 396 12.873 -2.943 2.353 1.00 0.00 N ATOM 1187 CA THR A 396 12.153 -1.693 2.190 1.00 0.00 C ATOM 1188 C THR A 396 11.144 -1.799 1.048 1.00 0.00 C ATOM 1189 O THR A 396 10.011 -1.334 1.162 1.00 0.00 O ATOM 1190 CB THR A 396 13.145 -0.540 1.937 1.00 0.00 C ATOM 1191 OG1 THR A 396 14.041 -0.441 3.051 1.00 0.00 O ATOM 1192 CG2 THR A 396 12.440 0.794 1.742 1.00 0.00 C ATOM 0 H THR A 396 13.881 -2.864 2.218 1.00 0.00 H new ATOM 0 HA THR A 396 11.603 -1.483 3.108 1.00 0.00 H new ATOM 0 HB THR A 396 13.689 -0.764 1.019 1.00 0.00 H new ATOM 0 HG1 THR A 396 14.640 -1.217 3.059 1.00 0.00 H new ATOM 0 HG21 THR A 396 13.180 1.575 1.567 1.00 0.00 H new ATOM 0 HG22 THR A 396 11.771 0.730 0.884 1.00 0.00 H new ATOM 0 HG23 THR A 396 11.863 1.035 2.635 1.00 0.00 H new ATOM 1200 N THR A 397 11.552 -2.448 -0.035 1.00 0.00 N ATOM 1201 CA THR A 397 10.673 -2.661 -1.173 1.00 0.00 C ATOM 1202 C THR A 397 9.535 -3.613 -0.804 1.00 0.00 C ATOM 1203 O THR A 397 8.380 -3.382 -1.163 1.00 0.00 O ATOM 1204 CB THR A 397 11.456 -3.226 -2.374 1.00 0.00 C ATOM 1205 OG1 THR A 397 12.560 -2.360 -2.678 1.00 0.00 O ATOM 1206 CG2 THR A 397 10.563 -3.360 -3.598 1.00 0.00 C ATOM 0 H THR A 397 12.489 -2.836 -0.147 1.00 0.00 H new ATOM 0 HA THR A 397 10.251 -1.696 -1.453 1.00 0.00 H new ATOM 0 HB THR A 397 11.823 -4.217 -2.107 1.00 0.00 H new ATOM 0 HG1 THR A 397 13.273 -2.495 -2.019 1.00 0.00 H new ATOM 0 HG21 THR A 397 11.143 -3.761 -4.429 1.00 0.00 H new ATOM 0 HG22 THR A 397 9.737 -4.034 -3.373 1.00 0.00 H new ATOM 0 HG23 THR A 397 10.169 -2.381 -3.870 1.00 0.00 H new ATOM 1214 N SER A 398 9.869 -4.667 -0.064 1.00 0.00 N ATOM 1215 CA SER A 398 8.881 -5.639 0.387 1.00 0.00 C ATOM 1216 C SER A 398 7.818 -4.965 1.253 1.00 0.00 C ATOM 1217 O SER A 398 6.628 -5.263 1.136 1.00 0.00 O ATOM 1218 CB SER A 398 9.572 -6.750 1.173 1.00 0.00 C ATOM 1219 OG SER A 398 10.631 -7.318 0.419 1.00 0.00 O ATOM 0 H SER A 398 10.823 -4.869 0.237 1.00 0.00 H new ATOM 0 HA SER A 398 8.390 -6.069 -0.486 1.00 0.00 H new ATOM 0 HB2 SER A 398 9.960 -6.351 2.110 1.00 0.00 H new ATOM 0 HB3 SER A 398 8.848 -7.523 1.431 1.00 0.00 H new ATOM 0 HG SER A 398 11.402 -6.713 0.430 1.00 0.00 H new ATOM 1225 N ASN A 399 8.264 -4.054 2.113 1.00 0.00 N ATOM 1226 CA ASN A 399 7.359 -3.280 2.956 1.00 0.00 C ATOM 1227 C ASN A 399 6.429 -2.439 2.095 1.00 0.00 C ATOM 1228 O ASN A 399 5.219 -2.400 2.320 1.00 0.00 O ATOM 1229 CB ASN A 399 8.150 -2.371 3.904 1.00 0.00 C ATOM 1230 CG ASN A 399 8.970 -3.141 4.921 1.00 0.00 C ATOM 1231 OD1 ASN A 399 8.610 -4.243 5.329 1.00 0.00 O ATOM 1232 ND2 ASN A 399 10.081 -2.561 5.338 1.00 0.00 N ATOM 0 H ASN A 399 9.251 -3.833 2.244 1.00 0.00 H new ATOM 0 HA ASN A 399 6.766 -3.975 3.550 1.00 0.00 H new ATOM 0 HB2 ASN A 399 8.813 -1.735 3.318 1.00 0.00 H new ATOM 0 HB3 ASN A 399 7.457 -1.712 4.428 1.00 0.00 H new ATOM 0 HD21 ASN A 399 10.675 -3.029 6.023 1.00 0.00 H new ATOM 0 HD22 ASN A 399 10.345 -1.645 4.975 1.00 0.00 H new ATOM 1239 N ILE A 400 7.008 -1.782 1.096 1.00 0.00 N ATOM 1240 CA ILE A 400 6.248 -0.969 0.156 1.00 0.00 C ATOM 1241 C ILE A 400 5.160 -1.794 -0.523 1.00 0.00 C ATOM 1242 O ILE A 400 3.978 -1.454 -0.456 1.00 0.00 O ATOM 1243 CB ILE A 400 7.178 -0.357 -0.915 1.00 0.00 C ATOM 1244 CG1 ILE A 400 8.129 0.648 -0.268 1.00 0.00 C ATOM 1245 CG2 ILE A 400 6.377 0.302 -2.029 1.00 0.00 C ATOM 1246 CD1 ILE A 400 9.188 1.173 -1.209 1.00 0.00 C ATOM 0 H ILE A 400 8.012 -1.798 0.916 1.00 0.00 H new ATOM 0 HA ILE A 400 5.778 -0.164 0.721 1.00 0.00 H new ATOM 0 HB ILE A 400 7.763 -1.161 -1.361 1.00 0.00 H new ATOM 0 HG12 ILE A 400 7.550 1.487 0.118 1.00 0.00 H new ATOM 0 HG13 ILE A 400 8.615 0.177 0.586 1.00 0.00 H new ATOM 0 HG21 ILE A 400 7.059 0.723 -2.767 1.00 0.00 H new ATOM 0 HG22 ILE A 400 5.739 -0.441 -2.507 1.00 0.00 H new ATOM 0 HG23 ILE A 400 5.758 1.096 -1.611 1.00 0.00 H new ATOM 0 HD11 ILE A 400 9.826 1.881 -0.680 1.00 0.00 H new ATOM 0 HD12 ILE A 400 9.793 0.343 -1.576 1.00 0.00 H new ATOM 0 HD13 ILE A 400 8.710 1.674 -2.051 1.00 0.00 H new ATOM 1258 N GLU A 401 5.566 -2.892 -1.146 1.00 0.00 N ATOM 1259 CA GLU A 401 4.641 -3.767 -1.857 1.00 0.00 C ATOM 1260 C GLU A 401 3.577 -4.332 -0.915 1.00 0.00 C ATOM 1261 O GLU A 401 2.458 -4.630 -1.336 1.00 0.00 O ATOM 1262 CB GLU A 401 5.414 -4.906 -2.524 1.00 0.00 C ATOM 1263 CG GLU A 401 6.416 -4.436 -3.569 1.00 0.00 C ATOM 1264 CD GLU A 401 5.754 -3.903 -4.824 1.00 0.00 C ATOM 1265 OE1 GLU A 401 5.418 -2.700 -4.871 1.00 0.00 O ATOM 1266 OE2 GLU A 401 5.568 -4.688 -5.778 1.00 0.00 O ATOM 0 H GLU A 401 6.538 -3.201 -1.174 1.00 0.00 H new ATOM 0 HA GLU A 401 4.133 -3.179 -2.621 1.00 0.00 H new ATOM 0 HB2 GLU A 401 5.941 -5.473 -1.757 1.00 0.00 H new ATOM 0 HB3 GLU A 401 4.705 -5.588 -2.994 1.00 0.00 H new ATOM 0 HG2 GLU A 401 7.045 -3.657 -3.137 1.00 0.00 H new ATOM 0 HG3 GLU A 401 7.072 -5.265 -3.835 1.00 0.00 H new ATOM 1273 N ARG A 402 3.928 -4.468 0.359 1.00 0.00 N ATOM 1274 CA ARG A 402 3.001 -4.987 1.355 1.00 0.00 C ATOM 1275 C ARG A 402 1.882 -3.989 1.620 1.00 0.00 C ATOM 1276 O ARG A 402 0.708 -4.314 1.475 1.00 0.00 O ATOM 1277 CB ARG A 402 3.727 -5.303 2.662 1.00 0.00 C ATOM 1278 CG ARG A 402 2.832 -5.956 3.705 1.00 0.00 C ATOM 1279 CD ARG A 402 3.545 -6.110 5.038 1.00 0.00 C ATOM 1280 NE ARG A 402 3.840 -4.818 5.659 1.00 0.00 N ATOM 1281 CZ ARG A 402 5.068 -4.402 5.970 1.00 0.00 C ATOM 1282 NH1 ARG A 402 6.121 -5.147 5.662 1.00 0.00 N ATOM 1283 NH2 ARG A 402 5.239 -3.235 6.580 1.00 0.00 N ATOM 0 H ARG A 402 4.849 -4.226 0.725 1.00 0.00 H new ATOM 0 HA ARG A 402 2.570 -5.907 0.960 1.00 0.00 H new ATOM 0 HB2 ARG A 402 4.569 -5.963 2.452 1.00 0.00 H new ATOM 0 HB3 ARG A 402 4.139 -4.381 3.073 1.00 0.00 H new ATOM 0 HG2 ARG A 402 1.932 -5.356 3.840 1.00 0.00 H new ATOM 0 HG3 ARG A 402 2.511 -6.935 3.348 1.00 0.00 H new ATOM 0 HD2 ARG A 402 2.927 -6.703 5.712 1.00 0.00 H new ATOM 0 HD3 ARG A 402 4.474 -6.661 4.890 1.00 0.00 H new ATOM 0 HE ARG A 402 3.058 -4.197 5.867 1.00 0.00 H new ATOM 0 HH11 ARG A 402 5.992 -6.040 5.186 1.00 0.00 H new ATOM 0 HH12 ARG A 402 7.060 -4.827 5.901 1.00 0.00 H new ATOM 0 HH21 ARG A 402 4.431 -2.657 6.811 1.00 0.00 H new ATOM 0 HH22 ARG A 402 6.178 -2.917 6.818 1.00 0.00 H new ATOM 1297 N LEU A 403 2.243 -2.773 2.015 1.00 0.00 N ATOM 1298 CA LEU A 403 1.248 -1.750 2.282 1.00 0.00 C ATOM 1299 C LEU A 403 0.439 -1.409 1.039 1.00 0.00 C ATOM 1300 O LEU A 403 -0.773 -1.228 1.117 1.00 0.00 O ATOM 1301 CB LEU A 403 1.880 -0.485 2.843 1.00 0.00 C ATOM 1302 CG LEU A 403 2.185 -0.546 4.331 1.00 0.00 C ATOM 1303 CD1 LEU A 403 3.628 -0.913 4.576 1.00 0.00 C ATOM 1304 CD2 LEU A 403 1.838 0.764 5.002 1.00 0.00 C ATOM 0 H LEU A 403 3.209 -2.477 2.155 1.00 0.00 H new ATOM 0 HA LEU A 403 0.574 -2.166 3.031 1.00 0.00 H new ATOM 0 HB2 LEU A 403 2.805 -0.284 2.302 1.00 0.00 H new ATOM 0 HB3 LEU A 403 1.212 0.355 2.655 1.00 0.00 H new ATOM 0 HG LEU A 403 1.565 -1.327 4.770 1.00 0.00 H new ATOM 0 HD11 LEU A 403 3.817 -0.949 5.649 1.00 0.00 H new ATOM 0 HD12 LEU A 403 3.834 -1.890 4.138 1.00 0.00 H new ATOM 0 HD13 LEU A 403 4.276 -0.166 4.118 1.00 0.00 H new ATOM 0 HD21 LEU A 403 2.064 0.699 6.066 1.00 0.00 H new ATOM 0 HD22 LEU A 403 2.423 1.568 4.555 1.00 0.00 H new ATOM 0 HD23 LEU A 403 0.776 0.971 4.869 1.00 0.00 H new ATOM 1316 N ARG A 404 1.105 -1.336 -0.108 1.00 0.00 N ATOM 1317 CA ARG A 404 0.445 -0.930 -1.343 1.00 0.00 C ATOM 1318 C ARG A 404 -0.668 -1.895 -1.740 1.00 0.00 C ATOM 1319 O ARG A 404 -1.687 -1.471 -2.286 1.00 0.00 O ATOM 1320 CB ARG A 404 1.446 -0.784 -2.489 1.00 0.00 C ATOM 1321 CG ARG A 404 2.413 0.375 -2.305 1.00 0.00 C ATOM 1322 CD ARG A 404 3.162 0.682 -3.589 1.00 0.00 C ATOM 1323 NE ARG A 404 2.270 1.214 -4.616 1.00 0.00 N ATOM 1324 CZ ARG A 404 2.560 1.247 -5.915 1.00 0.00 C ATOM 1325 NH1 ARG A 404 3.714 0.762 -6.361 1.00 0.00 N ATOM 1326 NH2 ARG A 404 1.688 1.766 -6.769 1.00 0.00 N ATOM 0 H ARG A 404 2.097 -1.552 -0.208 1.00 0.00 H new ATOM 0 HA ARG A 404 -0.006 0.043 -1.149 1.00 0.00 H new ATOM 0 HB2 ARG A 404 2.014 -1.709 -2.585 1.00 0.00 H new ATOM 0 HB3 ARG A 404 0.900 -0.647 -3.423 1.00 0.00 H new ATOM 0 HG2 ARG A 404 1.865 1.260 -1.981 1.00 0.00 H new ATOM 0 HG3 ARG A 404 3.125 0.135 -1.515 1.00 0.00 H new ATOM 0 HD2 ARG A 404 3.955 1.402 -3.386 1.00 0.00 H new ATOM 0 HD3 ARG A 404 3.642 -0.225 -3.957 1.00 0.00 H new ATOM 0 HE ARG A 404 1.367 1.584 -4.319 1.00 0.00 H new ATOM 0 HH11 ARG A 404 4.385 0.361 -5.707 1.00 0.00 H new ATOM 0 HH12 ARG A 404 3.928 0.791 -7.358 1.00 0.00 H new ATOM 0 HH21 ARG A 404 0.801 2.137 -6.429 1.00 0.00 H new ATOM 0 HH22 ARG A 404 1.905 1.794 -7.765 1.00 0.00 H new ATOM 1340 N MET A 405 -0.489 -3.183 -1.463 1.00 0.00 N ATOM 1341 CA MET A 405 -1.526 -4.159 -1.786 1.00 0.00 C ATOM 1342 C MET A 405 -2.689 -4.030 -0.809 1.00 0.00 C ATOM 1343 O MET A 405 -3.845 -4.261 -1.166 1.00 0.00 O ATOM 1344 CB MET A 405 -0.983 -5.594 -1.790 1.00 0.00 C ATOM 1345 CG MET A 405 -0.599 -6.125 -0.419 1.00 0.00 C ATOM 1346 SD MET A 405 -0.230 -7.889 -0.435 1.00 0.00 S ATOM 1347 CE MET A 405 0.152 -8.165 1.294 1.00 0.00 C ATOM 0 H MET A 405 0.346 -3.571 -1.024 1.00 0.00 H new ATOM 0 HA MET A 405 -1.879 -3.945 -2.795 1.00 0.00 H new ATOM 0 HB2 MET A 405 -1.736 -6.253 -2.223 1.00 0.00 H new ATOM 0 HB3 MET A 405 -0.109 -5.637 -2.440 1.00 0.00 H new ATOM 0 HG2 MET A 405 0.271 -5.579 -0.053 1.00 0.00 H new ATOM 0 HG3 MET A 405 -1.413 -5.934 0.281 1.00 0.00 H new ATOM 0 HE1 MET A 405 0.402 -9.215 1.448 1.00 0.00 H new ATOM 0 HE2 MET A 405 1.000 -7.544 1.583 1.00 0.00 H new ATOM 0 HE3 MET A 405 -0.713 -7.905 1.904 1.00 0.00 H new ATOM 1357 N GLU A 406 -2.381 -3.631 0.420 1.00 0.00 N ATOM 1358 CA GLU A 406 -3.407 -3.403 1.426 1.00 0.00 C ATOM 1359 C GLU A 406 -4.200 -2.149 1.078 1.00 0.00 C ATOM 1360 O GLU A 406 -5.417 -2.099 1.254 1.00 0.00 O ATOM 1361 CB GLU A 406 -2.780 -3.268 2.816 1.00 0.00 C ATOM 1362 CG GLU A 406 -2.017 -4.502 3.271 1.00 0.00 C ATOM 1363 CD GLU A 406 -2.905 -5.718 3.437 1.00 0.00 C ATOM 1364 OE1 GLU A 406 -3.104 -6.456 2.452 1.00 0.00 O ATOM 1365 OE2 GLU A 406 -3.396 -5.950 4.565 1.00 0.00 O ATOM 0 H GLU A 406 -1.428 -3.459 0.742 1.00 0.00 H new ATOM 0 HA GLU A 406 -4.082 -4.259 1.439 1.00 0.00 H new ATOM 0 HB2 GLU A 406 -2.103 -2.414 2.817 1.00 0.00 H new ATOM 0 HB3 GLU A 406 -3.567 -3.052 3.539 1.00 0.00 H new ATOM 0 HG2 GLU A 406 -1.234 -4.726 2.546 1.00 0.00 H new ATOM 0 HG3 GLU A 406 -1.522 -4.288 4.218 1.00 0.00 H new ATOM 1372 N ILE A 407 -3.503 -1.138 0.580 1.00 0.00 N ATOM 1373 CA ILE A 407 -4.151 0.067 0.084 1.00 0.00 C ATOM 1374 C ILE A 407 -5.059 -0.280 -1.088 1.00 0.00 C ATOM 1375 O ILE A 407 -6.237 0.076 -1.107 1.00 0.00 O ATOM 1376 CB ILE A 407 -3.116 1.120 -0.371 1.00 0.00 C ATOM 1377 CG1 ILE A 407 -2.205 1.505 0.796 1.00 0.00 C ATOM 1378 CG2 ILE A 407 -3.819 2.350 -0.931 1.00 0.00 C ATOM 1379 CD1 ILE A 407 -1.077 2.438 0.410 1.00 0.00 C ATOM 0 H ILE A 407 -2.486 -1.129 0.509 1.00 0.00 H new ATOM 0 HA ILE A 407 -4.737 0.490 0.900 1.00 0.00 H new ATOM 0 HB ILE A 407 -2.502 0.688 -1.161 1.00 0.00 H new ATOM 0 HG12 ILE A 407 -2.806 1.978 1.573 1.00 0.00 H new ATOM 0 HG13 ILE A 407 -1.782 0.598 1.229 1.00 0.00 H new ATOM 0 HG21 ILE A 407 -3.075 3.082 -1.247 1.00 0.00 H new ATOM 0 HG22 ILE A 407 -4.431 2.062 -1.786 1.00 0.00 H new ATOM 0 HG23 ILE A 407 -4.455 2.788 -0.161 1.00 0.00 H new ATOM 0 HD11 ILE A 407 -0.475 2.665 1.290 1.00 0.00 H new ATOM 0 HD12 ILE A 407 -0.451 1.960 -0.344 1.00 0.00 H new ATOM 0 HD13 ILE A 407 -1.491 3.362 0.005 1.00 0.00 H new ATOM 1391 N HIS A 408 -4.497 -1.014 -2.045 1.00 0.00 N ATOM 1392 CA HIS A 408 -5.221 -1.433 -3.240 1.00 0.00 C ATOM 1393 C HIS A 408 -6.493 -2.187 -2.890 1.00 0.00 C ATOM 1394 O HIS A 408 -7.553 -1.931 -3.463 1.00 0.00 O ATOM 1395 CB HIS A 408 -4.338 -2.326 -4.114 1.00 0.00 C ATOM 1396 CG HIS A 408 -3.563 -1.585 -5.154 1.00 0.00 C ATOM 1397 ND1 HIS A 408 -2.308 -1.061 -4.936 1.00 0.00 N ATOM 1398 CD2 HIS A 408 -3.873 -1.296 -6.436 1.00 0.00 C ATOM 1399 CE1 HIS A 408 -1.880 -0.479 -6.041 1.00 0.00 C ATOM 1400 NE2 HIS A 408 -2.811 -0.608 -6.967 1.00 0.00 N ATOM 0 H HIS A 408 -3.529 -1.334 -2.013 1.00 0.00 H new ATOM 0 HA HIS A 408 -5.491 -0.529 -3.786 1.00 0.00 H new ATOM 0 HB2 HIS A 408 -3.641 -2.868 -3.474 1.00 0.00 H new ATOM 0 HB3 HIS A 408 -4.965 -3.070 -4.605 1.00 0.00 H new ATOM 0 HD1 HIS A 408 -1.791 -1.114 -4.059 1.00 0.00 H new ATOM 0 HD2 HIS A 408 -4.787 -1.558 -6.948 1.00 0.00 H new ATOM 0 HE1 HIS A 408 -0.929 0.018 -6.166 1.00 0.00 H new ATOM 1409 N LYS A 409 -6.383 -3.112 -1.948 1.00 0.00 N ATOM 1410 CA LYS A 409 -7.498 -3.975 -1.605 1.00 0.00 C ATOM 1411 C LYS A 409 -8.649 -3.169 -1.000 1.00 0.00 C ATOM 1412 O LYS A 409 -9.812 -3.432 -1.292 1.00 0.00 O ATOM 1413 CB LYS A 409 -7.037 -5.095 -0.659 1.00 0.00 C ATOM 1414 CG LYS A 409 -6.960 -4.710 0.809 1.00 0.00 C ATOM 1415 CD LYS A 409 -6.291 -5.790 1.657 1.00 0.00 C ATOM 1416 CE LYS A 409 -6.994 -7.140 1.559 1.00 0.00 C ATOM 1417 NZ LYS A 409 -6.528 -7.948 0.399 1.00 0.00 N ATOM 0 H LYS A 409 -5.534 -3.282 -1.410 1.00 0.00 H new ATOM 0 HA LYS A 409 -7.871 -4.438 -2.519 1.00 0.00 H new ATOM 0 HB2 LYS A 409 -7.719 -5.939 -0.762 1.00 0.00 H new ATOM 0 HB3 LYS A 409 -6.054 -5.439 -0.980 1.00 0.00 H new ATOM 0 HG2 LYS A 409 -6.405 -3.777 0.909 1.00 0.00 H new ATOM 0 HG3 LYS A 409 -7.965 -4.525 1.187 1.00 0.00 H new ATOM 0 HD2 LYS A 409 -5.254 -5.902 1.342 1.00 0.00 H new ATOM 0 HD3 LYS A 409 -6.275 -5.469 2.699 1.00 0.00 H new ATOM 0 HE2 LYS A 409 -6.825 -7.701 2.478 1.00 0.00 H new ATOM 0 HE3 LYS A 409 -8.069 -6.980 1.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 409 -7.328 -8.132 -0.240 1.00 0.00 H new ATOM 0 HZ2 LYS A 409 -5.789 -7.426 -0.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 409 -6.141 -8.852 0.738 1.00 0.00 H new ATOM 1431 N ASN A 410 -8.321 -2.166 -0.187 1.00 0.00 N ATOM 1432 CA ASN A 410 -9.343 -1.322 0.427 1.00 0.00 C ATOM 1433 C ASN A 410 -9.960 -0.392 -0.610 1.00 0.00 C ATOM 1434 O ASN A 410 -11.161 -0.117 -0.581 1.00 0.00 O ATOM 1435 CB ASN A 410 -8.765 -0.502 1.588 1.00 0.00 C ATOM 1436 CG ASN A 410 -8.596 -1.309 2.866 1.00 0.00 C ATOM 1437 OD1 ASN A 410 -9.518 -1.412 3.672 1.00 0.00 O ATOM 1438 ND2 ASN A 410 -7.412 -1.867 3.072 1.00 0.00 N ATOM 0 H ASN A 410 -7.363 -1.920 0.060 1.00 0.00 H new ATOM 0 HA ASN A 410 -10.118 -1.977 0.825 1.00 0.00 H new ATOM 0 HB2 ASN A 410 -7.798 -0.096 1.292 1.00 0.00 H new ATOM 0 HB3 ASN A 410 -9.419 0.347 1.786 1.00 0.00 H new ATOM 0 HD21 ASN A 410 -7.242 -2.404 3.923 1.00 0.00 H new ATOM 0 HD22 ASN A 410 -6.670 -1.760 2.380 1.00 0.00 H new ATOM 1445 N GLU A 411 -9.131 0.074 -1.535 1.00 0.00 N ATOM 1446 CA GLU A 411 -9.585 0.942 -2.617 1.00 0.00 C ATOM 1447 C GLU A 411 -10.603 0.237 -3.506 1.00 0.00 C ATOM 1448 O GLU A 411 -11.500 0.876 -4.061 1.00 0.00 O ATOM 1449 CB GLU A 411 -8.391 1.408 -3.452 1.00 0.00 C ATOM 1450 CG GLU A 411 -7.601 2.531 -2.804 1.00 0.00 C ATOM 1451 CD GLU A 411 -8.294 3.872 -2.930 1.00 0.00 C ATOM 1452 OE1 GLU A 411 -9.456 4.000 -2.491 1.00 0.00 O ATOM 1453 OE2 GLU A 411 -7.682 4.810 -3.483 1.00 0.00 O ATOM 0 H GLU A 411 -8.133 -0.136 -1.558 1.00 0.00 H new ATOM 0 HA GLU A 411 -10.073 1.808 -2.171 1.00 0.00 H new ATOM 0 HB2 GLU A 411 -7.727 0.561 -3.627 1.00 0.00 H new ATOM 0 HB3 GLU A 411 -8.747 1.740 -4.427 1.00 0.00 H new ATOM 0 HG2 GLU A 411 -7.448 2.302 -1.749 1.00 0.00 H new ATOM 0 HG3 GLU A 411 -6.615 2.590 -3.264 1.00 0.00 H new ATOM 1460 N ALA A 412 -10.466 -1.078 -3.629 1.00 0.00 N ATOM 1461 CA ALA A 412 -11.374 -1.870 -4.447 1.00 0.00 C ATOM 1462 C ALA A 412 -12.808 -1.769 -3.935 1.00 0.00 C ATOM 1463 O ALA A 412 -13.739 -1.542 -4.708 1.00 0.00 O ATOM 1464 CB ALA A 412 -10.925 -3.323 -4.481 1.00 0.00 C ATOM 0 H ALA A 412 -9.732 -1.619 -3.171 1.00 0.00 H new ATOM 0 HA ALA A 412 -11.350 -1.470 -5.461 1.00 0.00 H new ATOM 0 HB1 ALA A 412 -11.614 -3.902 -5.096 1.00 0.00 H new ATOM 0 HB2 ALA A 412 -9.922 -3.384 -4.903 1.00 0.00 H new ATOM 0 HB3 ALA A 412 -10.917 -3.725 -3.468 1.00 0.00 H new ATOM 1470 N TRP A 413 -12.979 -1.914 -2.627 1.00 0.00 N ATOM 1471 CA TRP A 413 -14.307 -1.869 -2.027 1.00 0.00 C ATOM 1472 C TRP A 413 -14.784 -0.432 -1.905 1.00 0.00 C ATOM 1473 O TRP A 413 -15.984 -0.162 -1.904 1.00 0.00 O ATOM 1474 CB TRP A 413 -14.299 -2.535 -0.653 1.00 0.00 C ATOM 1475 CG TRP A 413 -13.552 -3.826 -0.636 1.00 0.00 C ATOM 1476 CD1 TRP A 413 -13.755 -4.905 -1.448 1.00 0.00 C ATOM 1477 CD2 TRP A 413 -12.478 -4.173 0.236 1.00 0.00 C ATOM 1478 NE1 TRP A 413 -12.855 -5.895 -1.142 1.00 0.00 N ATOM 1479 CE2 TRP A 413 -12.063 -5.470 -0.109 1.00 0.00 C ATOM 1480 CE3 TRP A 413 -11.822 -3.509 1.275 1.00 0.00 C ATOM 1481 CZ2 TRP A 413 -11.019 -6.113 0.542 1.00 0.00 C ATOM 1482 CZ3 TRP A 413 -10.788 -4.150 1.923 1.00 0.00 C ATOM 1483 CH2 TRP A 413 -10.394 -5.441 1.554 1.00 0.00 C ATOM 0 H TRP A 413 -12.219 -2.063 -1.964 1.00 0.00 H new ATOM 0 HA TRP A 413 -14.993 -2.415 -2.675 1.00 0.00 H new ATOM 0 HB2 TRP A 413 -13.853 -1.854 0.072 1.00 0.00 H new ATOM 0 HB3 TRP A 413 -15.326 -2.712 -0.335 1.00 0.00 H new ATOM 0 HD1 TRP A 413 -14.511 -4.970 -2.216 1.00 0.00 H new ATOM 0 HE1 TRP A 413 -12.787 -6.800 -1.608 1.00 0.00 H new ATOM 0 HE3 TRP A 413 -12.119 -2.512 1.565 1.00 0.00 H new ATOM 0 HZ2 TRP A 413 -10.712 -7.109 0.259 1.00 0.00 H new ATOM 0 HZ3 TRP A 413 -10.273 -3.648 2.729 1.00 0.00 H new ATOM 0 HH2 TRP A 413 -9.579 -5.916 2.080 1.00 0.00 H new ATOM 1494 N LEU A 414 -13.835 0.490 -1.801 1.00 0.00 N ATOM 1495 CA LEU A 414 -14.151 1.908 -1.744 1.00 0.00 C ATOM 1496 C LEU A 414 -14.893 2.317 -3.013 1.00 0.00 C ATOM 1497 O LEU A 414 -15.925 2.985 -2.951 1.00 0.00 O ATOM 1498 CB LEU A 414 -12.870 2.725 -1.565 1.00 0.00 C ATOM 1499 CG LEU A 414 -13.060 4.165 -1.071 1.00 0.00 C ATOM 1500 CD1 LEU A 414 -13.436 5.100 -2.211 1.00 0.00 C ATOM 1501 CD2 LEU A 414 -14.110 4.228 0.030 1.00 0.00 C ATOM 0 H LEU A 414 -12.838 0.278 -1.754 1.00 0.00 H new ATOM 0 HA LEU A 414 -14.796 2.105 -0.888 1.00 0.00 H new ATOM 0 HB2 LEU A 414 -12.223 2.202 -0.861 1.00 0.00 H new ATOM 0 HB3 LEU A 414 -12.344 2.755 -2.519 1.00 0.00 H new ATOM 0 HG LEU A 414 -12.106 4.497 -0.662 1.00 0.00 H new ATOM 0 HD11 LEU A 414 -13.563 6.112 -1.825 1.00 0.00 H new ATOM 0 HD12 LEU A 414 -12.646 5.094 -2.962 1.00 0.00 H new ATOM 0 HD13 LEU A 414 -14.369 4.765 -2.664 1.00 0.00 H new ATOM 0 HD21 LEU A 414 -14.226 5.259 0.363 1.00 0.00 H new ATOM 0 HD22 LEU A 414 -15.062 3.861 -0.354 1.00 0.00 H new ATOM 0 HD23 LEU A 414 -13.794 3.609 0.870 1.00 0.00 H new ATOM 1513 N SER A 415 -14.378 1.874 -4.157 1.00 0.00 N ATOM 1514 CA SER A 415 -15.004 2.151 -5.443 1.00 0.00 C ATOM 1515 C SER A 415 -16.413 1.561 -5.501 1.00 0.00 C ATOM 1516 O SER A 415 -17.311 2.129 -6.128 1.00 0.00 O ATOM 1517 CB SER A 415 -14.144 1.577 -6.570 1.00 0.00 C ATOM 1518 OG SER A 415 -12.813 2.058 -6.484 1.00 0.00 O ATOM 0 H SER A 415 -13.524 1.319 -4.217 1.00 0.00 H new ATOM 0 HA SER A 415 -15.084 3.231 -5.566 1.00 0.00 H new ATOM 0 HB2 SER A 415 -14.146 0.488 -6.516 1.00 0.00 H new ATOM 0 HB3 SER A 415 -14.572 1.849 -7.535 1.00 0.00 H new ATOM 0 HG SER A 415 -12.343 1.593 -5.760 1.00 0.00 H new ATOM 1524 N GLU A 416 -16.599 0.429 -4.829 1.00 0.00 N ATOM 1525 CA GLU A 416 -17.898 -0.232 -4.775 1.00 0.00 C ATOM 1526 C GLU A 416 -18.900 0.615 -4.002 1.00 0.00 C ATOM 1527 O GLU A 416 -20.041 0.787 -4.429 1.00 0.00 O ATOM 1528 CB GLU A 416 -17.773 -1.610 -4.122 1.00 0.00 C ATOM 1529 CG GLU A 416 -16.907 -2.580 -4.904 1.00 0.00 C ATOM 1530 CD GLU A 416 -17.445 -2.833 -6.294 1.00 0.00 C ATOM 1531 OE1 GLU A 416 -18.382 -3.646 -6.432 1.00 0.00 O ATOM 1532 OE2 GLU A 416 -16.940 -2.218 -7.254 1.00 0.00 O ATOM 0 H GLU A 416 -15.862 -0.051 -4.312 1.00 0.00 H new ATOM 0 HA GLU A 416 -18.256 -0.356 -5.797 1.00 0.00 H new ATOM 0 HB2 GLU A 416 -17.358 -1.492 -3.121 1.00 0.00 H new ATOM 0 HB3 GLU A 416 -18.768 -2.038 -4.005 1.00 0.00 H new ATOM 0 HG2 GLU A 416 -15.894 -2.184 -4.975 1.00 0.00 H new ATOM 0 HG3 GLU A 416 -16.843 -3.524 -4.364 1.00 0.00 H new ATOM 1539 N VAL A 417 -18.458 1.154 -2.870 1.00 0.00 N ATOM 1540 CA VAL A 417 -19.314 1.981 -2.029 1.00 0.00 C ATOM 1541 C VAL A 417 -19.729 3.250 -2.761 1.00 0.00 C ATOM 1542 O VAL A 417 -20.854 3.731 -2.609 1.00 0.00 O ATOM 1543 CB VAL A 417 -18.623 2.355 -0.701 1.00 0.00 C ATOM 1544 CG1 VAL A 417 -19.539 3.218 0.150 1.00 0.00 C ATOM 1545 CG2 VAL A 417 -18.209 1.104 0.059 1.00 0.00 C ATOM 0 H VAL A 417 -17.510 1.032 -2.514 1.00 0.00 H new ATOM 0 HA VAL A 417 -20.201 1.390 -1.800 1.00 0.00 H new ATOM 0 HB VAL A 417 -17.725 2.928 -0.931 1.00 0.00 H new ATOM 0 HG11 VAL A 417 -19.036 3.473 1.083 1.00 0.00 H new ATOM 0 HG12 VAL A 417 -19.784 4.132 -0.391 1.00 0.00 H new ATOM 0 HG13 VAL A 417 -20.455 2.670 0.370 1.00 0.00 H new ATOM 0 HG21 VAL A 417 -17.724 1.389 0.992 1.00 0.00 H new ATOM 0 HG22 VAL A 417 -19.091 0.503 0.278 1.00 0.00 H new ATOM 0 HG23 VAL A 417 -17.515 0.523 -0.548 1.00 0.00 H new ATOM 1555 N GLU A 418 -18.825 3.771 -3.578 1.00 0.00 N ATOM 1556 CA GLU A 418 -19.110 4.954 -4.379 1.00 0.00 C ATOM 1557 C GLU A 418 -20.267 4.682 -5.335 1.00 0.00 C ATOM 1558 O GLU A 418 -21.028 5.582 -5.675 1.00 0.00 O ATOM 1559 CB GLU A 418 -17.870 5.383 -5.163 1.00 0.00 C ATOM 1560 CG GLU A 418 -16.683 5.728 -4.279 1.00 0.00 C ATOM 1561 CD GLU A 418 -15.482 6.188 -5.073 1.00 0.00 C ATOM 1562 OE1 GLU A 418 -14.775 5.336 -5.644 1.00 0.00 O ATOM 1563 OE2 GLU A 418 -15.239 7.410 -5.132 1.00 0.00 O ATOM 0 H GLU A 418 -17.886 3.393 -3.704 1.00 0.00 H new ATOM 0 HA GLU A 418 -19.393 5.763 -3.706 1.00 0.00 H new ATOM 0 HB2 GLU A 418 -17.585 4.581 -5.844 1.00 0.00 H new ATOM 0 HB3 GLU A 418 -18.119 6.249 -5.777 1.00 0.00 H new ATOM 0 HG2 GLU A 418 -16.972 6.511 -3.578 1.00 0.00 H new ATOM 0 HG3 GLU A 418 -16.410 4.855 -3.687 1.00 0.00 H new