USER MOD reduce.3.24.130724 H: found=0, std=0, add=687, rem=0, adj=22 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 367 LYS NZ :NH3+ 167:sc= 0.809 (180deg=-0.106) USER MOD Set 1.2: A 397 THR OG1 : rot 72:sc= 1.02 USER MOD Set 2.1: A 387 SER OG : rot 33:sc= 0.0237 USER MOD Set 2.2: A 390 HIS : no HD1:sc= -1.97! X(o=-1.9!,f=-1.9) USER MOD Set 3.1: A 371 ASN : amide:sc= 0.658 K(o=1.4,f=-11!) USER MOD Set 3.2: A 374 LYS NZ :NH3+ -164:sc= 0.708 (180deg=-1.14) USER MOD Single : A 338 SER OG : rot 180:sc= 0 USER MOD Single : A 339 HIS : no HD1:sc= -0.032 X(o=-0.032,f=-0.088) USER MOD Single : A 344 GLN :FLIP amide:sc= -0.0238 F(o=-1.3!,f=-0.024) USER MOD Single : A 347 LYS NZ :NH3+ 167:sc= -0.0449 (180deg=-0.291) USER MOD Single : A 350 GLN :FLIP amide:sc= -0.209 F(o=-0.91,f=-0.21) USER MOD Single : A 351 GLN : amide:sc= -0.0968 K(o=-0.097,f=-1.2) USER MOD Single : A 357 SER OG : rot -87:sc= 1.3 USER MOD Single : A 361 GLN : amide:sc= -1.17 K(o=-1.2,f=-6.2!) USER MOD Single : A 362 LYS NZ :NH3+ -162:sc= 1.21 (180deg=0.932) USER MOD Single : A 364 MET CE :methyl -137:sc= -0.0871 (180deg=-1.77) USER MOD Single : A 366 GLN : amide:sc= -0.291 X(o=-0.29,f=-0.76) USER MOD Single : A 372 LYS NZ :NH3+ -170:sc= -0.0133 (180deg=-0.127) USER MOD Single : A 373 MET CE :methyl 152:sc= -0.082 (180deg=-1.32) USER MOD Single : A 377 TYR OH : rot 180:sc= 0 USER MOD Single : A 379 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 380 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 382 GLN : amide:sc= 0 K(o=0,f=-0.62) USER MOD Single : A 383 MET CE :methyl -119:sc= -1.28 (180deg=-1.63) USER MOD Single : A 388 SER OG : rot 180:sc= 0 USER MOD Single : A 392 LYS NZ :NH3+ -169:sc=-0.00821 (180deg=-0.126) USER MOD Single : A 396 THR OG1 : rot 88:sc= 1.23 USER MOD Single : A 398 SER OG : rot 69:sc= 1.23 USER MOD Single : A 399 ASN : amide:sc= 1.05 K(o=1,f=-0.77) USER MOD Single : A 405 MET CE :methyl -146:sc= 0 (180deg=-0.486) USER MOD Single : A 408 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 409 LYS NZ :NH3+ 173:sc= 1.26 (180deg=1.17) USER MOD Single : A 410 ASN : amide:sc= -0.284 K(o=-0.28,f=-3.7!) USER MOD Single : A 415 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 195 N PHE A 337 -14.499 -7.786 -1.146 1.00 0.00 N ATOM 196 CA PHE A 337 -15.390 -6.987 -0.306 1.00 0.00 C ATOM 197 C PHE A 337 -16.810 -7.053 -0.863 1.00 0.00 C ATOM 198 O PHE A 337 -17.544 -6.065 -0.868 1.00 0.00 O ATOM 199 CB PHE A 337 -14.901 -5.533 -0.218 1.00 0.00 C ATOM 200 CG PHE A 337 -13.546 -5.392 0.423 1.00 0.00 C ATOM 201 CD1 PHE A 337 -12.392 -5.624 -0.307 1.00 0.00 C ATOM 202 CD2 PHE A 337 -13.429 -5.027 1.753 1.00 0.00 C ATOM 203 CE1 PHE A 337 -11.149 -5.499 0.279 1.00 0.00 C ATOM 204 CE2 PHE A 337 -12.187 -4.901 2.345 1.00 0.00 C ATOM 205 CZ PHE A 337 -11.046 -5.136 1.606 1.00 0.00 C ATOM 0 HA PHE A 337 -15.387 -7.396 0.705 1.00 0.00 H new ATOM 0 HB2 PHE A 337 -14.865 -5.109 -1.221 1.00 0.00 H new ATOM 0 HB3 PHE A 337 -15.625 -4.948 0.349 1.00 0.00 H new ATOM 0 HD1 PHE A 337 -12.466 -5.906 -1.347 1.00 0.00 H new ATOM 0 HD2 PHE A 337 -14.319 -4.838 2.335 1.00 0.00 H new ATOM 0 HE1 PHE A 337 -10.257 -5.685 -0.301 1.00 0.00 H new ATOM 0 HE2 PHE A 337 -12.110 -4.619 3.385 1.00 0.00 H new ATOM 0 HZ PHE A 337 -10.074 -5.036 2.066 1.00 0.00 H new ATOM 215 N SER A 338 -17.180 -8.240 -1.328 1.00 0.00 N ATOM 216 CA SER A 338 -18.437 -8.444 -2.031 1.00 0.00 C ATOM 217 C SER A 338 -19.586 -8.695 -1.056 1.00 0.00 C ATOM 218 O SER A 338 -20.746 -8.435 -1.373 1.00 0.00 O ATOM 219 CB SER A 338 -18.290 -9.619 -2.999 1.00 0.00 C ATOM 220 OG SER A 338 -17.109 -9.484 -3.781 1.00 0.00 O ATOM 0 H SER A 338 -16.618 -9.085 -1.228 1.00 0.00 H new ATOM 0 HA SER A 338 -18.675 -7.539 -2.589 1.00 0.00 H new ATOM 0 HB2 SER A 338 -18.257 -10.554 -2.440 1.00 0.00 H new ATOM 0 HB3 SER A 338 -19.161 -9.669 -3.653 1.00 0.00 H new ATOM 0 HG SER A 338 -17.033 -10.246 -4.392 1.00 0.00 H new ATOM 226 N HIS A 339 -19.261 -9.188 0.135 1.00 0.00 N ATOM 227 CA HIS A 339 -20.281 -9.447 1.153 1.00 0.00 C ATOM 228 C HIS A 339 -20.570 -8.188 1.965 1.00 0.00 C ATOM 229 O HIS A 339 -21.124 -8.255 3.064 1.00 0.00 O ATOM 230 CB HIS A 339 -19.866 -10.603 2.084 1.00 0.00 C ATOM 231 CG HIS A 339 -18.589 -10.379 2.843 1.00 0.00 C ATOM 232 ND1 HIS A 339 -17.366 -10.839 2.409 1.00 0.00 N ATOM 233 CD2 HIS A 339 -18.352 -9.755 4.023 1.00 0.00 C ATOM 234 CE1 HIS A 339 -16.435 -10.509 3.284 1.00 0.00 C ATOM 235 NE2 HIS A 339 -17.006 -9.850 4.274 1.00 0.00 N ATOM 0 H HIS A 339 -18.309 -9.416 0.420 1.00 0.00 H new ATOM 0 HA HIS A 339 -21.193 -9.743 0.635 1.00 0.00 H new ATOM 0 HB2 HIS A 339 -20.670 -10.780 2.799 1.00 0.00 H new ATOM 0 HB3 HIS A 339 -19.763 -11.510 1.489 1.00 0.00 H new ATOM 0 HD2 HIS A 339 -19.087 -9.272 4.650 1.00 0.00 H new ATOM 0 HE1 HIS A 339 -15.383 -10.740 3.203 1.00 0.00 H new ATOM 0 HE2 HIS A 339 -16.526 -9.473 5.091 1.00 0.00 H new ATOM 244 N LEU A 340 -20.188 -7.044 1.422 1.00 0.00 N ATOM 245 CA LEU A 340 -20.395 -5.772 2.090 1.00 0.00 C ATOM 246 C LEU A 340 -21.277 -4.856 1.248 1.00 0.00 C ATOM 247 O LEU A 340 -20.924 -4.517 0.116 1.00 0.00 O ATOM 248 CB LEU A 340 -19.055 -5.082 2.353 1.00 0.00 C ATOM 249 CG LEU A 340 -18.060 -5.872 3.203 1.00 0.00 C ATOM 250 CD1 LEU A 340 -16.759 -5.105 3.337 1.00 0.00 C ATOM 251 CD2 LEU A 340 -18.638 -6.169 4.577 1.00 0.00 C ATOM 0 H LEU A 340 -19.730 -6.972 0.514 1.00 0.00 H new ATOM 0 HA LEU A 340 -20.892 -5.970 3.040 1.00 0.00 H new ATOM 0 HB2 LEU A 340 -18.588 -4.858 1.394 1.00 0.00 H new ATOM 0 HB3 LEU A 340 -19.248 -4.128 2.844 1.00 0.00 H new ATOM 0 HG LEU A 340 -17.862 -6.820 2.703 1.00 0.00 H new ATOM 0 HD11 LEU A 340 -16.059 -5.679 3.945 1.00 0.00 H new ATOM 0 HD12 LEU A 340 -16.330 -4.940 2.348 1.00 0.00 H new ATOM 0 HD13 LEU A 340 -16.951 -4.144 3.814 1.00 0.00 H new ATOM 0 HD21 LEU A 340 -17.912 -6.732 5.163 1.00 0.00 H new ATOM 0 HD22 LEU A 340 -18.867 -5.233 5.085 1.00 0.00 H new ATOM 0 HD23 LEU A 340 -19.550 -6.756 4.469 1.00 0.00 H new ATOM 263 N PRO A 341 -22.443 -4.461 1.781 1.00 0.00 N ATOM 264 CA PRO A 341 -23.299 -3.455 1.146 1.00 0.00 C ATOM 265 C PRO A 341 -22.605 -2.093 1.124 1.00 0.00 C ATOM 266 O PRO A 341 -21.737 -1.841 1.956 1.00 0.00 O ATOM 267 CB PRO A 341 -24.547 -3.413 2.040 1.00 0.00 C ATOM 268 CG PRO A 341 -24.485 -4.653 2.867 1.00 0.00 C ATOM 269 CD PRO A 341 -23.028 -4.968 3.030 1.00 0.00 C ATOM 0 HA PRO A 341 -23.533 -3.695 0.109 1.00 0.00 H new ATOM 0 HB2 PRO A 341 -24.550 -2.522 2.668 1.00 0.00 H new ATOM 0 HB3 PRO A 341 -25.458 -3.385 1.442 1.00 0.00 H new ATOM 0 HG2 PRO A 341 -24.962 -4.501 3.835 1.00 0.00 H new ATOM 0 HG3 PRO A 341 -25.010 -5.474 2.379 1.00 0.00 H new ATOM 0 HD2 PRO A 341 -22.603 -4.475 3.905 1.00 0.00 H new ATOM 0 HD3 PRO A 341 -22.857 -6.038 3.152 1.00 0.00 H new ATOM 277 N PRO A 342 -22.988 -1.202 0.185 1.00 0.00 N ATOM 278 CA PRO A 342 -22.322 0.092 -0.041 1.00 0.00 C ATOM 279 C PRO A 342 -21.836 0.789 1.235 1.00 0.00 C ATOM 280 O PRO A 342 -20.648 1.092 1.366 1.00 0.00 O ATOM 281 CB PRO A 342 -23.417 0.910 -0.713 1.00 0.00 C ATOM 282 CG PRO A 342 -24.181 -0.088 -1.511 1.00 0.00 C ATOM 283 CD PRO A 342 -24.123 -1.386 -0.741 1.00 0.00 C ATOM 0 HA PRO A 342 -21.409 -0.029 -0.623 1.00 0.00 H new ATOM 0 HB2 PRO A 342 -24.053 1.404 0.022 1.00 0.00 H new ATOM 0 HB3 PRO A 342 -22.998 1.691 -1.348 1.00 0.00 H new ATOM 0 HG2 PRO A 342 -25.213 0.235 -1.651 1.00 0.00 H new ATOM 0 HG3 PRO A 342 -23.747 -0.206 -2.504 1.00 0.00 H new ATOM 0 HD2 PRO A 342 -25.052 -1.572 -0.202 1.00 0.00 H new ATOM 0 HD3 PRO A 342 -23.963 -2.236 -1.404 1.00 0.00 H new ATOM 291 N GLU A 343 -22.746 1.015 2.178 1.00 0.00 N ATOM 292 CA GLU A 343 -22.422 1.751 3.400 1.00 0.00 C ATOM 293 C GLU A 343 -21.383 1.024 4.247 1.00 0.00 C ATOM 294 O GLU A 343 -20.467 1.641 4.789 1.00 0.00 O ATOM 295 CB GLU A 343 -23.681 1.982 4.229 1.00 0.00 C ATOM 296 CG GLU A 343 -24.705 2.868 3.548 1.00 0.00 C ATOM 297 CD GLU A 343 -25.972 2.990 4.358 1.00 0.00 C ATOM 298 OE1 GLU A 343 -26.031 3.861 5.251 1.00 0.00 O ATOM 299 OE2 GLU A 343 -26.908 2.201 4.116 1.00 0.00 O ATOM 0 H GLU A 343 -23.714 0.700 2.121 1.00 0.00 H new ATOM 0 HA GLU A 343 -21.999 2.708 3.095 1.00 0.00 H new ATOM 0 HB2 GLU A 343 -24.139 1.019 4.454 1.00 0.00 H new ATOM 0 HB3 GLU A 343 -23.401 2.432 5.182 1.00 0.00 H new ATOM 0 HG2 GLU A 343 -24.279 3.859 3.389 1.00 0.00 H new ATOM 0 HG3 GLU A 343 -24.941 2.461 2.565 1.00 0.00 H new ATOM 306 N GLN A 344 -21.520 -0.284 4.364 1.00 0.00 N ATOM 307 CA GLN A 344 -20.602 -1.062 5.179 1.00 0.00 C ATOM 308 C GLN A 344 -19.297 -1.302 4.426 1.00 0.00 C ATOM 309 O GLN A 344 -18.230 -1.444 5.027 1.00 0.00 O ATOM 310 CB GLN A 344 -21.246 -2.389 5.576 1.00 0.00 C ATOM 311 CG GLN A 344 -20.412 -3.208 6.547 1.00 0.00 C ATOM 312 CD GLN A 344 -21.106 -4.482 6.986 1.00 0.00 C ATOM 313 OE1 GLN A 344 -22.427 -4.442 7.063 1.00 0.00 O flip ATOM 314 NE2 GLN A 344 -20.459 -5.492 7.262 1.00 0.00 N flip ATOM 0 H GLN A 344 -22.253 -0.828 3.909 1.00 0.00 H new ATOM 0 HA GLN A 344 -20.376 -0.502 6.086 1.00 0.00 H new ATOM 0 HB2 GLN A 344 -22.219 -2.190 6.025 1.00 0.00 H new ATOM 0 HB3 GLN A 344 -21.424 -2.979 4.677 1.00 0.00 H new ATOM 0 HG2 GLN A 344 -19.461 -3.461 6.079 1.00 0.00 H new ATOM 0 HG3 GLN A 344 -20.185 -2.602 7.424 1.00 0.00 H new ATOM 0 HE21 GLN A 344 -19.442 -5.482 7.190 1.00 0.00 H new ATOM 0 HE22 GLN A 344 -20.940 -6.339 7.563 1.00 0.00 H new ATOM 323 N ARG A 345 -19.388 -1.328 3.104 1.00 0.00 N ATOM 324 CA ARG A 345 -18.223 -1.546 2.266 1.00 0.00 C ATOM 325 C ARG A 345 -17.260 -0.373 2.389 1.00 0.00 C ATOM 326 O ARG A 345 -16.089 -0.562 2.703 1.00 0.00 O ATOM 327 CB ARG A 345 -18.635 -1.741 0.807 1.00 0.00 C ATOM 328 CG ARG A 345 -17.562 -2.411 -0.033 1.00 0.00 C ATOM 329 CD ARG A 345 -18.019 -2.619 -1.464 1.00 0.00 C ATOM 330 NE ARG A 345 -17.127 -3.521 -2.191 1.00 0.00 N ATOM 331 CZ ARG A 345 -16.742 -3.339 -3.452 1.00 0.00 C ATOM 332 NH1 ARG A 345 -17.185 -2.298 -4.145 1.00 0.00 N ATOM 333 NH2 ARG A 345 -15.922 -4.211 -4.028 1.00 0.00 N ATOM 0 H ARG A 345 -20.260 -1.200 2.590 1.00 0.00 H new ATOM 0 HA ARG A 345 -17.721 -2.452 2.605 1.00 0.00 H new ATOM 0 HB2 ARG A 345 -19.544 -2.341 0.770 1.00 0.00 H new ATOM 0 HB3 ARG A 345 -18.876 -0.771 0.371 1.00 0.00 H new ATOM 0 HG2 ARG A 345 -16.659 -1.801 -0.024 1.00 0.00 H new ATOM 0 HG3 ARG A 345 -17.301 -3.372 0.409 1.00 0.00 H new ATOM 0 HD2 ARG A 345 -19.030 -3.026 -1.468 1.00 0.00 H new ATOM 0 HD3 ARG A 345 -18.061 -1.658 -1.976 1.00 0.00 H new ATOM 0 HE ARG A 345 -16.777 -4.343 -1.700 1.00 0.00 H new ATOM 0 HH11 ARG A 345 -17.824 -1.632 -3.712 1.00 0.00 H new ATOM 0 HH12 ARG A 345 -16.886 -2.164 -5.111 1.00 0.00 H new ATOM 0 HH21 ARG A 345 -15.588 -5.020 -3.504 1.00 0.00 H new ATOM 0 HH22 ARG A 345 -15.627 -4.072 -4.994 1.00 0.00 H new ATOM 347 N ARG A 346 -17.766 0.844 2.173 1.00 0.00 N ATOM 348 CA ARG A 346 -16.940 2.046 2.296 1.00 0.00 C ATOM 349 C ARG A 346 -16.342 2.148 3.692 1.00 0.00 C ATOM 350 O ARG A 346 -15.239 2.665 3.867 1.00 0.00 O ATOM 351 CB ARG A 346 -17.737 3.318 1.977 1.00 0.00 C ATOM 352 CG ARG A 346 -19.054 3.431 2.728 1.00 0.00 C ATOM 353 CD ARG A 346 -19.608 4.848 2.705 1.00 0.00 C ATOM 354 NE ARG A 346 -19.586 5.441 1.369 1.00 0.00 N ATOM 355 CZ ARG A 346 -20.504 6.294 0.913 1.00 0.00 C ATOM 356 NH1 ARG A 346 -21.576 6.583 1.638 1.00 0.00 N ATOM 357 NH2 ARG A 346 -20.350 6.850 -0.280 1.00 0.00 N ATOM 0 H ARG A 346 -18.736 1.022 1.914 1.00 0.00 H new ATOM 0 HA ARG A 346 -16.134 1.959 1.567 1.00 0.00 H new ATOM 0 HB2 ARG A 346 -17.122 4.187 2.211 1.00 0.00 H new ATOM 0 HB3 ARG A 346 -17.938 3.349 0.906 1.00 0.00 H new ATOM 0 HG2 ARG A 346 -19.782 2.751 2.286 1.00 0.00 H new ATOM 0 HG3 ARG A 346 -18.909 3.116 3.761 1.00 0.00 H new ATOM 0 HD2 ARG A 346 -20.632 4.839 3.077 1.00 0.00 H new ATOM 0 HD3 ARG A 346 -19.027 5.472 3.384 1.00 0.00 H new ATOM 0 HE ARG A 346 -18.820 5.186 0.746 1.00 0.00 H new ATOM 0 HH11 ARG A 346 -21.704 6.152 2.553 1.00 0.00 H new ATOM 0 HH12 ARG A 346 -22.272 7.237 1.280 1.00 0.00 H new ATOM 0 HH21 ARG A 346 -19.532 6.625 -0.846 1.00 0.00 H new ATOM 0 HH22 ARG A 346 -21.050 7.503 -0.633 1.00 0.00 H new ATOM 371 N LYS A 347 -17.065 1.629 4.676 1.00 0.00 N ATOM 372 CA LYS A 347 -16.600 1.631 6.053 1.00 0.00 C ATOM 373 C LYS A 347 -15.313 0.815 6.188 1.00 0.00 C ATOM 374 O LYS A 347 -14.340 1.267 6.790 1.00 0.00 O ATOM 375 CB LYS A 347 -17.692 1.083 6.975 1.00 0.00 C ATOM 376 CG LYS A 347 -17.305 1.061 8.442 1.00 0.00 C ATOM 377 CD LYS A 347 -18.453 0.597 9.321 1.00 0.00 C ATOM 378 CE LYS A 347 -18.030 0.502 10.777 1.00 0.00 C ATOM 379 NZ LYS A 347 -17.463 1.783 11.275 1.00 0.00 N ATOM 0 H LYS A 347 -17.981 1.200 4.543 1.00 0.00 H new ATOM 0 HA LYS A 347 -16.379 2.657 6.348 1.00 0.00 H new ATOM 0 HB2 LYS A 347 -18.591 1.687 6.856 1.00 0.00 H new ATOM 0 HB3 LYS A 347 -17.944 0.070 6.661 1.00 0.00 H new ATOM 0 HG2 LYS A 347 -16.450 0.400 8.582 1.00 0.00 H new ATOM 0 HG3 LYS A 347 -16.991 2.058 8.750 1.00 0.00 H new ATOM 0 HD2 LYS A 347 -19.289 1.290 9.227 1.00 0.00 H new ATOM 0 HD3 LYS A 347 -18.806 -0.376 8.978 1.00 0.00 H new ATOM 0 HE2 LYS A 347 -18.889 0.224 11.387 1.00 0.00 H new ATOM 0 HE3 LYS A 347 -17.290 -0.290 10.889 1.00 0.00 H new ATOM 0 HZ1 LYS A 347 -17.392 1.751 12.312 1.00 0.00 H new ATOM 0 HZ2 LYS A 347 -16.517 1.926 10.867 1.00 0.00 H new ATOM 0 HZ3 LYS A 347 -18.083 2.569 10.995 1.00 0.00 H new ATOM 393 N ARG A 348 -15.307 -0.381 5.606 1.00 0.00 N ATOM 394 CA ARG A 348 -14.123 -1.237 5.630 1.00 0.00 C ATOM 395 C ARG A 348 -13.040 -0.698 4.698 1.00 0.00 C ATOM 396 O ARG A 348 -11.849 -0.809 4.990 1.00 0.00 O ATOM 397 CB ARG A 348 -14.484 -2.670 5.234 1.00 0.00 C ATOM 398 CG ARG A 348 -15.185 -3.459 6.329 1.00 0.00 C ATOM 399 CD ARG A 348 -14.271 -3.688 7.524 1.00 0.00 C ATOM 400 NE ARG A 348 -14.872 -4.583 8.510 1.00 0.00 N ATOM 401 CZ ARG A 348 -14.225 -5.070 9.569 1.00 0.00 C ATOM 402 NH1 ARG A 348 -12.964 -4.724 9.802 1.00 0.00 N ATOM 403 NH2 ARG A 348 -14.844 -5.898 10.402 1.00 0.00 N ATOM 0 H ARG A 348 -16.106 -0.779 5.113 1.00 0.00 H new ATOM 0 HA ARG A 348 -13.735 -1.239 6.649 1.00 0.00 H new ATOM 0 HB2 ARG A 348 -15.126 -2.641 4.354 1.00 0.00 H new ATOM 0 HB3 ARG A 348 -13.574 -3.197 4.948 1.00 0.00 H new ATOM 0 HG2 ARG A 348 -16.078 -2.923 6.650 1.00 0.00 H new ATOM 0 HG3 ARG A 348 -15.515 -4.419 5.933 1.00 0.00 H new ATOM 0 HD2 ARG A 348 -13.325 -4.109 7.182 1.00 0.00 H new ATOM 0 HD3 ARG A 348 -14.043 -2.732 7.994 1.00 0.00 H new ATOM 0 HE ARG A 348 -15.847 -4.852 8.380 1.00 0.00 H new ATOM 0 HH11 ARG A 348 -12.486 -4.083 9.169 1.00 0.00 H new ATOM 0 HH12 ARG A 348 -12.474 -5.100 10.614 1.00 0.00 H new ATOM 0 HH21 ARG A 348 -15.815 -6.162 10.232 1.00 0.00 H new ATOM 0 HH22 ARG A 348 -14.349 -6.271 11.212 1.00 0.00 H new ATOM 417 N LEU A 349 -13.458 -0.116 3.582 1.00 0.00 N ATOM 418 CA LEU A 349 -12.527 0.469 2.621 1.00 0.00 C ATOM 419 C LEU A 349 -11.717 1.592 3.263 1.00 0.00 C ATOM 420 O LEU A 349 -10.507 1.684 3.063 1.00 0.00 O ATOM 421 CB LEU A 349 -13.279 0.992 1.395 1.00 0.00 C ATOM 422 CG LEU A 349 -13.456 -0.003 0.237 1.00 0.00 C ATOM 423 CD1 LEU A 349 -13.973 -1.347 0.722 1.00 0.00 C ATOM 424 CD2 LEU A 349 -14.408 0.567 -0.798 1.00 0.00 C ATOM 0 H LEU A 349 -14.440 -0.035 3.317 1.00 0.00 H new ATOM 0 HA LEU A 349 -11.837 -0.312 2.301 1.00 0.00 H new ATOM 0 HB2 LEU A 349 -14.266 1.326 1.714 1.00 0.00 H new ATOM 0 HB3 LEU A 349 -12.752 1.868 1.017 1.00 0.00 H new ATOM 0 HG LEU A 349 -12.476 -0.162 -0.212 1.00 0.00 H new ATOM 0 HD11 LEU A 349 -14.084 -2.022 -0.127 1.00 0.00 H new ATOM 0 HD12 LEU A 349 -13.266 -1.773 1.434 1.00 0.00 H new ATOM 0 HD13 LEU A 349 -14.940 -1.211 1.207 1.00 0.00 H new ATOM 0 HD21 LEU A 349 -14.527 -0.145 -1.614 1.00 0.00 H new ATOM 0 HD22 LEU A 349 -15.377 0.755 -0.336 1.00 0.00 H new ATOM 0 HD23 LEU A 349 -14.005 1.502 -1.188 1.00 0.00 H new ATOM 436 N GLN A 350 -12.384 2.434 4.046 1.00 0.00 N ATOM 437 CA GLN A 350 -11.705 3.514 4.757 1.00 0.00 C ATOM 438 C GLN A 350 -10.704 2.956 5.765 1.00 0.00 C ATOM 439 O GLN A 350 -9.635 3.530 5.973 1.00 0.00 O ATOM 440 CB GLN A 350 -12.714 4.417 5.467 1.00 0.00 C ATOM 441 CG GLN A 350 -13.553 5.260 4.523 1.00 0.00 C ATOM 442 CD GLN A 350 -12.723 6.258 3.741 1.00 0.00 C ATOM 443 OE1 GLN A 350 -12.256 5.856 2.571 1.00 0.00 O flip ATOM 444 NE2 GLN A 350 -12.503 7.383 4.187 1.00 0.00 N flip ATOM 0 H GLN A 350 -13.391 2.391 4.205 1.00 0.00 H new ATOM 0 HA GLN A 350 -11.164 4.108 4.021 1.00 0.00 H new ATOM 0 HB2 GLN A 350 -13.376 3.799 6.073 1.00 0.00 H new ATOM 0 HB3 GLN A 350 -12.179 5.077 6.150 1.00 0.00 H new ATOM 0 HG2 GLN A 350 -14.079 4.606 3.827 1.00 0.00 H new ATOM 0 HG3 GLN A 350 -14.312 5.793 5.095 1.00 0.00 H new ATOM 0 HE21 GLN A 350 -12.881 7.655 5.094 1.00 0.00 H new ATOM 0 HE22 GLN A 350 -11.942 8.044 3.650 1.00 0.00 H new ATOM 453 N GLN A 351 -11.057 1.834 6.382 1.00 0.00 N ATOM 454 CA GLN A 351 -10.168 1.163 7.327 1.00 0.00 C ATOM 455 C GLN A 351 -8.942 0.611 6.604 1.00 0.00 C ATOM 456 O GLN A 351 -7.821 0.670 7.116 1.00 0.00 O ATOM 457 CB GLN A 351 -10.909 0.032 8.043 1.00 0.00 C ATOM 458 CG GLN A 351 -12.076 0.507 8.891 1.00 0.00 C ATOM 459 CD GLN A 351 -12.869 -0.639 9.487 1.00 0.00 C ATOM 460 OE1 GLN A 351 -12.330 -1.713 9.754 1.00 0.00 O ATOM 461 NE2 GLN A 351 -14.156 -0.421 9.698 1.00 0.00 N ATOM 0 H GLN A 351 -11.954 1.368 6.245 1.00 0.00 H new ATOM 0 HA GLN A 351 -9.839 1.891 8.068 1.00 0.00 H new ATOM 0 HB2 GLN A 351 -11.276 -0.677 7.301 1.00 0.00 H new ATOM 0 HB3 GLN A 351 -10.205 -0.506 8.678 1.00 0.00 H new ATOM 0 HG2 GLN A 351 -11.702 1.141 9.695 1.00 0.00 H new ATOM 0 HG3 GLN A 351 -12.737 1.122 8.281 1.00 0.00 H new ATOM 0 HE21 GLN A 351 -14.565 0.483 9.463 1.00 0.00 H new ATOM 0 HE22 GLN A 351 -14.739 -1.157 10.096 1.00 0.00 H new ATOM 470 N ARG A 352 -9.170 0.071 5.412 1.00 0.00 N ATOM 471 CA ARG A 352 -8.091 -0.424 4.567 1.00 0.00 C ATOM 472 C ARG A 352 -7.179 0.715 4.131 1.00 0.00 C ATOM 473 O ARG A 352 -5.964 0.639 4.302 1.00 0.00 O ATOM 474 CB ARG A 352 -8.661 -1.140 3.338 1.00 0.00 C ATOM 475 CG ARG A 352 -9.047 -2.590 3.589 1.00 0.00 C ATOM 476 CD ARG A 352 -8.030 -3.546 2.978 1.00 0.00 C ATOM 477 NE ARG A 352 -8.026 -3.478 1.513 1.00 0.00 N ATOM 478 CZ ARG A 352 -7.062 -3.990 0.738 1.00 0.00 C ATOM 479 NH1 ARG A 352 -6.015 -4.601 1.280 1.00 0.00 N ATOM 480 NH2 ARG A 352 -7.155 -3.891 -0.586 1.00 0.00 N ATOM 0 H ARG A 352 -10.100 -0.035 5.007 1.00 0.00 H new ATOM 0 HA ARG A 352 -7.503 -1.134 5.149 1.00 0.00 H new ATOM 0 HB2 ARG A 352 -9.539 -0.597 2.989 1.00 0.00 H new ATOM 0 HB3 ARG A 352 -7.924 -1.105 2.536 1.00 0.00 H new ATOM 0 HG2 ARG A 352 -9.119 -2.769 4.662 1.00 0.00 H new ATOM 0 HG3 ARG A 352 -10.033 -2.785 3.166 1.00 0.00 H new ATOM 0 HD2 ARG A 352 -7.036 -3.307 3.355 1.00 0.00 H new ATOM 0 HD3 ARG A 352 -8.255 -4.565 3.293 1.00 0.00 H new ATOM 0 HE ARG A 352 -8.808 -3.010 1.055 1.00 0.00 H new ATOM 0 HH11 ARG A 352 -5.941 -4.683 2.294 1.00 0.00 H new ATOM 0 HH12 ARG A 352 -5.285 -4.988 0.682 1.00 0.00 H new ATOM 0 HH21 ARG A 352 -7.959 -3.426 -1.007 1.00 0.00 H new ATOM 0 HH22 ARG A 352 -6.422 -4.280 -1.179 1.00 0.00 H new ATOM 494 N ILE A 353 -7.771 1.771 3.582 1.00 0.00 N ATOM 495 CA ILE A 353 -7.008 2.927 3.122 1.00 0.00 C ATOM 496 C ILE A 353 -6.186 3.527 4.260 1.00 0.00 C ATOM 497 O ILE A 353 -5.018 3.864 4.075 1.00 0.00 O ATOM 498 CB ILE A 353 -7.930 4.012 2.519 1.00 0.00 C ATOM 499 CG1 ILE A 353 -8.654 3.464 1.286 1.00 0.00 C ATOM 500 CG2 ILE A 353 -7.131 5.257 2.154 1.00 0.00 C ATOM 501 CD1 ILE A 353 -9.615 4.446 0.651 1.00 0.00 C ATOM 0 H ILE A 353 -8.779 1.850 3.444 1.00 0.00 H new ATOM 0 HA ILE A 353 -6.333 2.575 2.342 1.00 0.00 H new ATOM 0 HB ILE A 353 -8.671 4.289 3.268 1.00 0.00 H new ATOM 0 HG12 ILE A 353 -7.913 3.165 0.545 1.00 0.00 H new ATOM 0 HG13 ILE A 353 -9.202 2.565 1.569 1.00 0.00 H new ATOM 0 HG21 ILE A 353 -7.799 6.007 1.732 1.00 0.00 H new ATOM 0 HG22 ILE A 353 -6.654 5.658 3.048 1.00 0.00 H new ATOM 0 HG23 ILE A 353 -6.367 4.997 1.421 1.00 0.00 H new ATOM 0 HD11 ILE A 353 -10.088 3.984 -0.215 1.00 0.00 H new ATOM 0 HD12 ILE A 353 -10.380 4.727 1.375 1.00 0.00 H new ATOM 0 HD13 ILE A 353 -9.070 5.336 0.335 1.00 0.00 H new ATOM 513 N ASP A 354 -6.794 3.634 5.435 1.00 0.00 N ATOM 514 CA ASP A 354 -6.110 4.151 6.620 1.00 0.00 C ATOM 515 C ASP A 354 -4.846 3.354 6.914 1.00 0.00 C ATOM 516 O ASP A 354 -3.782 3.919 7.176 1.00 0.00 O ATOM 517 CB ASP A 354 -7.042 4.099 7.831 1.00 0.00 C ATOM 518 CG ASP A 354 -6.340 4.482 9.115 1.00 0.00 C ATOM 519 OD1 ASP A 354 -6.206 5.693 9.386 1.00 0.00 O ATOM 520 OD2 ASP A 354 -5.927 3.574 9.864 1.00 0.00 O ATOM 0 H ASP A 354 -7.766 3.368 5.596 1.00 0.00 H new ATOM 0 HA ASP A 354 -5.829 5.185 6.421 1.00 0.00 H new ATOM 0 HB2 ASP A 354 -7.885 4.770 7.667 1.00 0.00 H new ATOM 0 HB3 ASP A 354 -7.450 3.093 7.929 1.00 0.00 H new ATOM 525 N GLU A 355 -4.973 2.039 6.858 1.00 0.00 N ATOM 526 CA GLU A 355 -3.853 1.143 7.097 1.00 0.00 C ATOM 527 C GLU A 355 -2.820 1.251 5.975 1.00 0.00 C ATOM 528 O GLU A 355 -1.631 1.454 6.220 1.00 0.00 O ATOM 529 CB GLU A 355 -4.368 -0.295 7.191 1.00 0.00 C ATOM 530 CG GLU A 355 -3.294 -1.316 7.509 1.00 0.00 C ATOM 531 CD GLU A 355 -2.639 -1.067 8.849 1.00 0.00 C ATOM 532 OE1 GLU A 355 -3.268 -1.365 9.886 1.00 0.00 O ATOM 533 OE2 GLU A 355 -1.481 -0.607 8.874 1.00 0.00 O ATOM 0 H GLU A 355 -5.850 1.564 6.647 1.00 0.00 H new ATOM 0 HA GLU A 355 -3.371 1.426 8.033 1.00 0.00 H new ATOM 0 HB2 GLU A 355 -5.140 -0.344 7.959 1.00 0.00 H new ATOM 0 HB3 GLU A 355 -4.841 -0.563 6.246 1.00 0.00 H new ATOM 0 HG2 GLU A 355 -3.732 -2.314 7.502 1.00 0.00 H new ATOM 0 HG3 GLU A 355 -2.535 -1.296 6.727 1.00 0.00 H new ATOM 540 N LEU A 356 -3.299 1.142 4.746 1.00 0.00 N ATOM 541 CA LEU A 356 -2.433 1.065 3.576 1.00 0.00 C ATOM 542 C LEU A 356 -1.675 2.363 3.325 1.00 0.00 C ATOM 543 O LEU A 356 -0.505 2.332 2.959 1.00 0.00 O ATOM 544 CB LEU A 356 -3.263 0.699 2.350 1.00 0.00 C ATOM 545 CG LEU A 356 -3.941 -0.669 2.422 1.00 0.00 C ATOM 546 CD1 LEU A 356 -4.985 -0.799 1.328 1.00 0.00 C ATOM 547 CD2 LEU A 356 -2.911 -1.785 2.313 1.00 0.00 C ATOM 0 H LEU A 356 -4.295 1.104 4.530 1.00 0.00 H new ATOM 0 HA LEU A 356 -1.688 0.293 3.769 1.00 0.00 H new ATOM 0 HB2 LEU A 356 -4.028 1.461 2.206 1.00 0.00 H new ATOM 0 HB3 LEU A 356 -2.619 0.724 1.471 1.00 0.00 H new ATOM 0 HG LEU A 356 -4.438 -0.757 3.388 1.00 0.00 H new ATOM 0 HD11 LEU A 356 -5.459 -1.778 1.392 1.00 0.00 H new ATOM 0 HD12 LEU A 356 -5.739 -0.022 1.451 1.00 0.00 H new ATOM 0 HD13 LEU A 356 -4.507 -0.690 0.354 1.00 0.00 H new ATOM 0 HD21 LEU A 356 -3.414 -2.751 2.366 1.00 0.00 H new ATOM 0 HD22 LEU A 356 -2.384 -1.702 1.362 1.00 0.00 H new ATOM 0 HD23 LEU A 356 -2.197 -1.702 3.132 1.00 0.00 H new ATOM 559 N SER A 357 -2.334 3.499 3.520 1.00 0.00 N ATOM 560 CA SER A 357 -1.716 4.789 3.238 1.00 0.00 C ATOM 561 C SER A 357 -0.488 5.019 4.115 1.00 0.00 C ATOM 562 O SER A 357 0.564 5.439 3.626 1.00 0.00 O ATOM 563 CB SER A 357 -2.728 5.924 3.418 1.00 0.00 C ATOM 564 OG SER A 357 -3.362 5.856 4.685 1.00 0.00 O ATOM 0 H SER A 357 -3.290 3.554 3.870 1.00 0.00 H new ATOM 0 HA SER A 357 -1.387 4.781 2.199 1.00 0.00 H new ATOM 0 HB2 SER A 357 -2.223 6.884 3.313 1.00 0.00 H new ATOM 0 HB3 SER A 357 -3.479 5.872 2.630 1.00 0.00 H new ATOM 0 HG SER A 357 -4.143 5.267 4.629 1.00 0.00 H new ATOM 570 N ARG A 358 -0.609 4.719 5.402 1.00 0.00 N ATOM 571 CA ARG A 358 0.502 4.901 6.321 1.00 0.00 C ATOM 572 C ARG A 358 1.559 3.827 6.101 1.00 0.00 C ATOM 573 O ARG A 358 2.757 4.099 6.185 1.00 0.00 O ATOM 574 CB ARG A 358 0.027 4.879 7.771 1.00 0.00 C ATOM 575 CG ARG A 358 1.125 5.224 8.765 1.00 0.00 C ATOM 576 CD ARG A 358 1.719 6.596 8.486 1.00 0.00 C ATOM 577 NE ARG A 358 2.780 6.940 9.429 1.00 0.00 N ATOM 578 CZ ARG A 358 3.518 8.045 9.343 1.00 0.00 C ATOM 579 NH1 ARG A 358 3.301 8.918 8.365 1.00 0.00 N ATOM 580 NH2 ARG A 358 4.471 8.281 10.238 1.00 0.00 N ATOM 0 H ARG A 358 -1.459 4.351 5.829 1.00 0.00 H new ATOM 0 HA ARG A 358 0.943 5.877 6.121 1.00 0.00 H new ATOM 0 HB2 ARG A 358 -0.795 5.585 7.888 1.00 0.00 H new ATOM 0 HB3 ARG A 358 -0.367 3.889 8.003 1.00 0.00 H new ATOM 0 HG2 ARG A 358 0.721 5.200 9.777 1.00 0.00 H new ATOM 0 HG3 ARG A 358 1.910 4.470 8.717 1.00 0.00 H new ATOM 0 HD2 ARG A 358 2.116 6.619 7.471 1.00 0.00 H new ATOM 0 HD3 ARG A 358 0.932 7.348 8.537 1.00 0.00 H new ATOM 0 HE ARG A 358 2.966 6.296 10.198 1.00 0.00 H new ATOM 0 HH11 ARG A 358 2.568 8.742 7.678 1.00 0.00 H new ATOM 0 HH12 ARG A 358 3.868 9.764 8.301 1.00 0.00 H new ATOM 0 HH21 ARG A 358 4.638 7.615 10.992 1.00 0.00 H new ATOM 0 HH22 ARG A 358 5.035 9.128 10.171 1.00 0.00 H new ATOM 594 N GLU A 359 1.111 2.612 5.812 1.00 0.00 N ATOM 595 CA GLU A 359 2.022 1.510 5.545 1.00 0.00 C ATOM 596 C GLU A 359 2.863 1.821 4.310 1.00 0.00 C ATOM 597 O GLU A 359 4.072 1.587 4.285 1.00 0.00 O ATOM 598 CB GLU A 359 1.237 0.211 5.346 1.00 0.00 C ATOM 599 CG GLU A 359 2.095 -1.040 5.429 1.00 0.00 C ATOM 600 CD GLU A 359 2.807 -1.166 6.761 1.00 0.00 C ATOM 601 OE1 GLU A 359 2.139 -1.463 7.774 1.00 0.00 O ATOM 602 OE2 GLU A 359 4.037 -0.979 6.807 1.00 0.00 O ATOM 0 H GLU A 359 0.123 2.366 5.757 1.00 0.00 H new ATOM 0 HA GLU A 359 2.687 1.382 6.399 1.00 0.00 H new ATOM 0 HB2 GLU A 359 0.451 0.153 6.099 1.00 0.00 H new ATOM 0 HB3 GLU A 359 0.745 0.240 4.374 1.00 0.00 H new ATOM 0 HG2 GLU A 359 1.469 -1.918 5.271 1.00 0.00 H new ATOM 0 HG3 GLU A 359 2.832 -1.025 4.626 1.00 0.00 H new ATOM 609 N LEU A 360 2.214 2.376 3.294 1.00 0.00 N ATOM 610 CA LEU A 360 2.896 2.777 2.076 1.00 0.00 C ATOM 611 C LEU A 360 3.852 3.932 2.363 1.00 0.00 C ATOM 612 O LEU A 360 4.973 3.956 1.855 1.00 0.00 O ATOM 613 CB LEU A 360 1.865 3.152 0.996 1.00 0.00 C ATOM 614 CG LEU A 360 2.430 3.588 -0.364 1.00 0.00 C ATOM 615 CD1 LEU A 360 2.741 5.072 -0.369 1.00 0.00 C ATOM 616 CD2 LEU A 360 3.662 2.773 -0.719 1.00 0.00 C ATOM 0 H LEU A 360 1.210 2.558 3.293 1.00 0.00 H new ATOM 0 HA LEU A 360 3.488 1.942 1.701 1.00 0.00 H new ATOM 0 HB2 LEU A 360 1.211 2.295 0.836 1.00 0.00 H new ATOM 0 HB3 LEU A 360 1.243 3.959 1.383 1.00 0.00 H new ATOM 0 HG LEU A 360 1.671 3.402 -1.124 1.00 0.00 H new ATOM 0 HD11 LEU A 360 3.140 5.357 -1.343 1.00 0.00 H new ATOM 0 HD12 LEU A 360 1.829 5.636 -0.171 1.00 0.00 H new ATOM 0 HD13 LEU A 360 3.478 5.292 0.403 1.00 0.00 H new ATOM 0 HD21 LEU A 360 4.047 3.097 -1.686 1.00 0.00 H new ATOM 0 HD22 LEU A 360 4.427 2.919 0.044 1.00 0.00 H new ATOM 0 HD23 LEU A 360 3.397 1.717 -0.770 1.00 0.00 H new ATOM 628 N GLN A 361 3.406 4.881 3.180 1.00 0.00 N ATOM 629 CA GLN A 361 4.246 6.010 3.572 1.00 0.00 C ATOM 630 C GLN A 361 5.565 5.514 4.156 1.00 0.00 C ATOM 631 O GLN A 361 6.634 6.035 3.834 1.00 0.00 O ATOM 632 CB GLN A 361 3.518 6.895 4.590 1.00 0.00 C ATOM 633 CG GLN A 361 4.356 8.059 5.106 1.00 0.00 C ATOM 634 CD GLN A 361 4.688 9.091 4.039 1.00 0.00 C ATOM 635 OE1 GLN A 361 4.802 8.778 2.851 1.00 0.00 O ATOM 636 NE2 GLN A 361 4.849 10.332 4.459 1.00 0.00 N ATOM 0 H GLN A 361 2.469 4.892 3.584 1.00 0.00 H new ATOM 0 HA GLN A 361 4.458 6.604 2.683 1.00 0.00 H new ATOM 0 HB2 GLN A 361 2.611 7.288 4.132 1.00 0.00 H new ATOM 0 HB3 GLN A 361 3.208 6.280 5.435 1.00 0.00 H new ATOM 0 HG2 GLN A 361 3.820 8.549 5.919 1.00 0.00 H new ATOM 0 HG3 GLN A 361 5.284 7.670 5.525 1.00 0.00 H new ATOM 0 HE21 GLN A 361 4.747 10.552 5.450 1.00 0.00 H new ATOM 0 HE22 GLN A 361 5.076 11.070 3.793 1.00 0.00 H new ATOM 645 N LYS A 362 5.476 4.489 4.995 1.00 0.00 N ATOM 646 CA LYS A 362 6.653 3.881 5.598 1.00 0.00 C ATOM 647 C LYS A 362 7.603 3.348 4.532 1.00 0.00 C ATOM 648 O LYS A 362 8.799 3.625 4.567 1.00 0.00 O ATOM 649 CB LYS A 362 6.237 2.740 6.529 1.00 0.00 C ATOM 650 CG LYS A 362 5.468 3.192 7.760 1.00 0.00 C ATOM 651 CD LYS A 362 4.760 2.024 8.428 1.00 0.00 C ATOM 652 CE LYS A 362 5.732 0.932 8.847 1.00 0.00 C ATOM 653 NZ LYS A 362 5.022 -0.314 9.225 1.00 0.00 N ATOM 0 H LYS A 362 4.594 4.060 5.274 1.00 0.00 H new ATOM 0 HA LYS A 362 7.172 4.650 6.171 1.00 0.00 H new ATOM 0 HB2 LYS A 362 5.623 2.034 5.969 1.00 0.00 H new ATOM 0 HB3 LYS A 362 7.130 2.202 6.849 1.00 0.00 H new ATOM 0 HG2 LYS A 362 6.153 3.658 8.468 1.00 0.00 H new ATOM 0 HG3 LYS A 362 4.737 3.950 7.477 1.00 0.00 H new ATOM 0 HD2 LYS A 362 4.217 2.382 9.303 1.00 0.00 H new ATOM 0 HD3 LYS A 362 4.021 1.608 7.743 1.00 0.00 H new ATOM 0 HE2 LYS A 362 6.422 0.725 8.029 1.00 0.00 H new ATOM 0 HE3 LYS A 362 6.331 1.280 9.689 1.00 0.00 H new ATOM 0 HZ1 LYS A 362 5.657 -0.920 9.783 1.00 0.00 H new ATOM 0 HZ2 LYS A 362 4.183 -0.077 9.792 1.00 0.00 H new ATOM 0 HZ3 LYS A 362 4.727 -0.820 8.366 1.00 0.00 H new ATOM 667 N GLU A 363 7.061 2.601 3.578 1.00 0.00 N ATOM 668 CA GLU A 363 7.876 1.958 2.554 1.00 0.00 C ATOM 669 C GLU A 363 8.445 2.971 1.561 1.00 0.00 C ATOM 670 O GLU A 363 9.602 2.864 1.156 1.00 0.00 O ATOM 671 CB GLU A 363 7.066 0.891 1.819 1.00 0.00 C ATOM 672 CG GLU A 363 6.580 -0.230 2.725 1.00 0.00 C ATOM 673 CD GLU A 363 7.714 -0.940 3.442 1.00 0.00 C ATOM 674 OE1 GLU A 363 8.150 -0.454 4.505 1.00 0.00 O ATOM 675 OE2 GLU A 363 8.165 -2.001 2.955 1.00 0.00 O ATOM 0 H GLU A 363 6.060 2.425 3.492 1.00 0.00 H new ATOM 0 HA GLU A 363 8.718 1.482 3.057 1.00 0.00 H new ATOM 0 HB2 GLU A 363 6.206 1.362 1.343 1.00 0.00 H new ATOM 0 HB3 GLU A 363 7.677 0.466 1.023 1.00 0.00 H new ATOM 0 HG2 GLU A 363 5.889 0.179 3.463 1.00 0.00 H new ATOM 0 HG3 GLU A 363 6.021 -0.954 2.132 1.00 0.00 H new ATOM 682 N MET A 364 7.641 3.959 1.171 1.00 0.00 N ATOM 683 CA MET A 364 8.106 4.980 0.234 1.00 0.00 C ATOM 684 C MET A 364 9.215 5.819 0.856 1.00 0.00 C ATOM 685 O MET A 364 10.205 6.148 0.198 1.00 0.00 O ATOM 686 CB MET A 364 6.967 5.894 -0.234 1.00 0.00 C ATOM 687 CG MET A 364 6.022 5.249 -1.238 1.00 0.00 C ATOM 688 SD MET A 364 5.375 6.434 -2.439 1.00 0.00 S ATOM 689 CE MET A 364 4.679 7.688 -1.361 1.00 0.00 C ATOM 0 H MET A 364 6.677 4.074 1.484 1.00 0.00 H new ATOM 0 HA MET A 364 8.496 4.455 -0.638 1.00 0.00 H new ATOM 0 HB2 MET A 364 6.392 6.214 0.635 1.00 0.00 H new ATOM 0 HB3 MET A 364 7.396 6.791 -0.680 1.00 0.00 H new ATOM 0 HG2 MET A 364 6.546 4.452 -1.765 1.00 0.00 H new ATOM 0 HG3 MET A 364 5.191 4.786 -0.705 1.00 0.00 H new ATOM 0 HE1 MET A 364 3.708 8.001 -1.746 1.00 0.00 H new ATOM 0 HE2 MET A 364 4.557 7.279 -0.358 1.00 0.00 H new ATOM 0 HE3 MET A 364 5.348 8.547 -1.323 1.00 0.00 H new ATOM 699 N ASP A 365 9.051 6.153 2.129 1.00 0.00 N ATOM 700 CA ASP A 365 10.052 6.927 2.851 1.00 0.00 C ATOM 701 C ASP A 365 11.286 6.069 3.111 1.00 0.00 C ATOM 702 O ASP A 365 12.418 6.557 3.087 1.00 0.00 O ATOM 703 CB ASP A 365 9.474 7.436 4.171 1.00 0.00 C ATOM 704 CG ASP A 365 10.374 8.439 4.862 1.00 0.00 C ATOM 705 OD1 ASP A 365 11.238 8.025 5.663 1.00 0.00 O ATOM 706 OD2 ASP A 365 10.203 9.655 4.627 1.00 0.00 O ATOM 0 H ASP A 365 8.233 5.900 2.684 1.00 0.00 H new ATOM 0 HA ASP A 365 10.341 7.785 2.244 1.00 0.00 H new ATOM 0 HB2 ASP A 365 8.504 7.895 3.983 1.00 0.00 H new ATOM 0 HB3 ASP A 365 9.303 6.590 4.837 1.00 0.00 H new ATOM 711 N GLN A 366 11.051 4.779 3.337 1.00 0.00 N ATOM 712 CA GLN A 366 12.124 3.820 3.574 1.00 0.00 C ATOM 713 C GLN A 366 13.013 3.696 2.343 1.00 0.00 C ATOM 714 O GLN A 366 14.237 3.654 2.453 1.00 0.00 O ATOM 715 CB GLN A 366 11.539 2.450 3.937 1.00 0.00 C ATOM 716 CG GLN A 366 12.572 1.431 4.394 1.00 0.00 C ATOM 717 CD GLN A 366 13.279 1.847 5.668 1.00 0.00 C ATOM 718 OE1 GLN A 366 12.719 2.557 6.504 1.00 0.00 O ATOM 719 NE2 GLN A 366 14.510 1.394 5.836 1.00 0.00 N ATOM 0 H GLN A 366 10.116 4.372 3.361 1.00 0.00 H new ATOM 0 HA GLN A 366 12.729 4.180 4.406 1.00 0.00 H new ATOM 0 HB2 GLN A 366 10.800 2.581 4.728 1.00 0.00 H new ATOM 0 HB3 GLN A 366 11.011 2.052 3.070 1.00 0.00 H new ATOM 0 HG2 GLN A 366 12.083 0.470 4.552 1.00 0.00 H new ATOM 0 HG3 GLN A 366 13.309 1.288 3.604 1.00 0.00 H new ATOM 0 HE21 GLN A 366 14.940 0.808 5.120 1.00 0.00 H new ATOM 0 HE22 GLN A 366 15.030 1.630 6.681 1.00 0.00 H new ATOM 728 N LYS A 367 12.391 3.650 1.167 1.00 0.00 N ATOM 729 CA LYS A 367 13.134 3.520 -0.080 1.00 0.00 C ATOM 730 C LYS A 367 14.041 4.721 -0.304 1.00 0.00 C ATOM 731 O LYS A 367 15.157 4.570 -0.794 1.00 0.00 O ATOM 732 CB LYS A 367 12.197 3.352 -1.279 1.00 0.00 C ATOM 733 CG LYS A 367 12.946 3.178 -2.593 1.00 0.00 C ATOM 734 CD LYS A 367 12.009 2.916 -3.757 1.00 0.00 C ATOM 735 CE LYS A 367 12.777 2.839 -5.068 1.00 0.00 C ATOM 736 NZ LYS A 367 11.921 2.374 -6.188 1.00 0.00 N ATOM 0 H LYS A 367 11.379 3.701 1.053 1.00 0.00 H new ATOM 0 HA LYS A 367 13.747 2.623 0.007 1.00 0.00 H new ATOM 0 HB2 LYS A 367 11.555 2.486 -1.114 1.00 0.00 H new ATOM 0 HB3 LYS A 367 11.545 4.223 -1.350 1.00 0.00 H new ATOM 0 HG2 LYS A 367 13.533 4.074 -2.796 1.00 0.00 H new ATOM 0 HG3 LYS A 367 13.649 2.350 -2.501 1.00 0.00 H new ATOM 0 HD2 LYS A 367 11.470 1.983 -3.592 1.00 0.00 H new ATOM 0 HD3 LYS A 367 11.263 3.709 -3.814 1.00 0.00 H new ATOM 0 HE2 LYS A 367 13.185 3.821 -5.307 1.00 0.00 H new ATOM 0 HE3 LYS A 367 13.623 2.162 -4.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 367 12.409 2.543 -7.091 1.00 0.00 H new ATOM 0 HZ2 LYS A 367 11.732 1.357 -6.081 1.00 0.00 H new ATOM 0 HZ3 LYS A 367 11.022 2.896 -6.177 1.00 0.00 H new ATOM 750 N ASP A 368 13.568 5.907 0.062 1.00 0.00 N ATOM 751 CA ASP A 368 14.368 7.118 -0.092 1.00 0.00 C ATOM 752 C ASP A 368 15.638 7.015 0.743 1.00 0.00 C ATOM 753 O ASP A 368 16.725 7.385 0.295 1.00 0.00 O ATOM 754 CB ASP A 368 13.573 8.358 0.322 1.00 0.00 C ATOM 755 CG ASP A 368 14.332 9.644 0.050 1.00 0.00 C ATOM 756 OD1 ASP A 368 15.101 10.087 0.929 1.00 0.00 O ATOM 757 OD2 ASP A 368 14.168 10.218 -1.048 1.00 0.00 O ATOM 0 H ASP A 368 12.643 6.056 0.464 1.00 0.00 H new ATOM 0 HA ASP A 368 14.634 7.217 -1.144 1.00 0.00 H new ATOM 0 HB2 ASP A 368 12.626 8.377 -0.217 1.00 0.00 H new ATOM 0 HB3 ASP A 368 13.335 8.297 1.384 1.00 0.00 H new ATOM 762 N ALA A 369 15.491 6.488 1.953 1.00 0.00 N ATOM 763 CA ALA A 369 16.624 6.263 2.836 1.00 0.00 C ATOM 764 C ALA A 369 17.548 5.200 2.258 1.00 0.00 C ATOM 765 O ALA A 369 18.767 5.372 2.225 1.00 0.00 O ATOM 766 CB ALA A 369 16.142 5.852 4.218 1.00 0.00 C ATOM 0 H ALA A 369 14.592 6.208 2.345 1.00 0.00 H new ATOM 0 HA ALA A 369 17.184 7.194 2.925 1.00 0.00 H new ATOM 0 HB1 ALA A 369 17.001 5.687 4.869 1.00 0.00 H new ATOM 0 HB2 ALA A 369 15.517 6.642 4.635 1.00 0.00 H new ATOM 0 HB3 ALA A 369 15.562 4.932 4.142 1.00 0.00 H new ATOM 772 N LEU A 370 16.955 4.107 1.786 1.00 0.00 N ATOM 773 CA LEU A 370 17.714 3.014 1.192 1.00 0.00 C ATOM 774 C LEU A 370 18.464 3.483 -0.050 1.00 0.00 C ATOM 775 O LEU A 370 19.616 3.114 -0.263 1.00 0.00 O ATOM 776 CB LEU A 370 16.792 1.843 0.829 1.00 0.00 C ATOM 777 CG LEU A 370 16.062 1.189 2.003 1.00 0.00 C ATOM 778 CD1 LEU A 370 15.302 -0.035 1.529 1.00 0.00 C ATOM 779 CD2 LEU A 370 17.038 0.813 3.107 1.00 0.00 C ATOM 0 H LEU A 370 15.946 3.956 1.804 1.00 0.00 H new ATOM 0 HA LEU A 370 18.439 2.675 1.932 1.00 0.00 H new ATOM 0 HB2 LEU A 370 16.049 2.197 0.114 1.00 0.00 H new ATOM 0 HB3 LEU A 370 17.384 1.081 0.323 1.00 0.00 H new ATOM 0 HG LEU A 370 15.352 1.909 2.410 1.00 0.00 H new ATOM 0 HD11 LEU A 370 14.786 -0.492 2.373 1.00 0.00 H new ATOM 0 HD12 LEU A 370 14.573 0.259 0.774 1.00 0.00 H new ATOM 0 HD13 LEU A 370 16.000 -0.753 1.098 1.00 0.00 H new ATOM 0 HD21 LEU A 370 16.495 0.350 3.931 1.00 0.00 H new ATOM 0 HD22 LEU A 370 17.775 0.110 2.718 1.00 0.00 H new ATOM 0 HD23 LEU A 370 17.545 1.709 3.465 1.00 0.00 H new ATOM 791 N ASN A 371 17.806 4.300 -0.859 1.00 0.00 N ATOM 792 CA ASN A 371 18.405 4.809 -2.084 1.00 0.00 C ATOM 793 C ASN A 371 19.550 5.762 -1.780 1.00 0.00 C ATOM 794 O ASN A 371 20.585 5.726 -2.446 1.00 0.00 O ATOM 795 CB ASN A 371 17.361 5.505 -2.954 1.00 0.00 C ATOM 796 CG ASN A 371 17.076 4.728 -4.223 1.00 0.00 C ATOM 797 OD1 ASN A 371 17.949 4.033 -4.747 1.00 0.00 O ATOM 798 ND2 ASN A 371 15.859 4.836 -4.728 1.00 0.00 N ATOM 0 H ASN A 371 16.854 4.625 -0.689 1.00 0.00 H new ATOM 0 HA ASN A 371 18.803 3.956 -2.633 1.00 0.00 H new ATOM 0 HB2 ASN A 371 16.438 5.626 -2.387 1.00 0.00 H new ATOM 0 HB3 ASN A 371 17.711 6.505 -3.211 1.00 0.00 H new ATOM 0 HD21 ASN A 371 15.615 4.334 -5.581 1.00 0.00 H new ATOM 0 HD22 ASN A 371 15.164 5.422 -4.264 1.00 0.00 H new ATOM 805 N LYS A 372 19.370 6.609 -0.773 1.00 0.00 N ATOM 806 CA LYS A 372 20.431 7.515 -0.348 1.00 0.00 C ATOM 807 C LYS A 372 21.619 6.715 0.161 1.00 0.00 C ATOM 808 O LYS A 372 22.767 6.995 -0.182 1.00 0.00 O ATOM 809 CB LYS A 372 19.940 8.458 0.750 1.00 0.00 C ATOM 810 CG LYS A 372 21.002 9.446 1.214 1.00 0.00 C ATOM 811 CD LYS A 372 20.537 10.242 2.425 1.00 0.00 C ATOM 812 CE LYS A 372 19.320 11.100 2.114 1.00 0.00 C ATOM 813 NZ LYS A 372 19.608 12.133 1.083 1.00 0.00 N ATOM 0 H LYS A 372 18.505 6.688 -0.238 1.00 0.00 H new ATOM 0 HA LYS A 372 20.732 8.114 -1.208 1.00 0.00 H new ATOM 0 HB2 LYS A 372 19.074 9.011 0.385 1.00 0.00 H new ATOM 0 HB3 LYS A 372 19.605 7.868 1.603 1.00 0.00 H new ATOM 0 HG2 LYS A 372 21.917 8.908 1.461 1.00 0.00 H new ATOM 0 HG3 LYS A 372 21.244 10.129 0.400 1.00 0.00 H new ATOM 0 HD2 LYS A 372 20.298 9.557 3.239 1.00 0.00 H new ATOM 0 HD3 LYS A 372 21.350 10.879 2.773 1.00 0.00 H new ATOM 0 HE2 LYS A 372 18.507 10.462 1.769 1.00 0.00 H new ATOM 0 HE3 LYS A 372 18.978 11.587 3.027 1.00 0.00 H new ATOM 0 HZ1 LYS A 372 18.810 12.798 1.025 1.00 0.00 H new ATOM 0 HZ2 LYS A 372 20.472 12.651 1.342 1.00 0.00 H new ATOM 0 HZ3 LYS A 372 19.744 11.674 0.160 1.00 0.00 H new ATOM 827 N MET A 373 21.328 5.709 0.975 1.00 0.00 N ATOM 828 CA MET A 373 22.357 4.832 1.506 1.00 0.00 C ATOM 829 C MET A 373 23.048 4.088 0.368 1.00 0.00 C ATOM 830 O MET A 373 24.267 3.923 0.375 1.00 0.00 O ATOM 831 CB MET A 373 21.744 3.850 2.508 1.00 0.00 C ATOM 832 CG MET A 373 22.761 2.949 3.189 1.00 0.00 C ATOM 833 SD MET A 373 22.054 1.990 4.544 1.00 0.00 S ATOM 834 CE MET A 373 20.765 1.082 3.695 1.00 0.00 C ATOM 0 H MET A 373 20.382 5.481 1.282 1.00 0.00 H new ATOM 0 HA MET A 373 23.104 5.431 2.027 1.00 0.00 H new ATOM 0 HB2 MET A 373 21.204 4.413 3.270 1.00 0.00 H new ATOM 0 HB3 MET A 373 21.012 3.229 1.992 1.00 0.00 H new ATOM 0 HG2 MET A 373 23.186 2.268 2.452 1.00 0.00 H new ATOM 0 HG3 MET A 373 23.580 3.558 3.571 1.00 0.00 H new ATOM 0 HE1 MET A 373 20.582 0.140 4.212 1.00 0.00 H new ATOM 0 HE2 MET A 373 19.850 1.674 3.684 1.00 0.00 H new ATOM 0 HE3 MET A 373 21.078 0.878 2.671 1.00 0.00 H new ATOM 844 N LYS A 374 22.262 3.662 -0.619 1.00 0.00 N ATOM 845 CA LYS A 374 22.802 3.024 -1.815 1.00 0.00 C ATOM 846 C LYS A 374 23.794 3.952 -2.501 1.00 0.00 C ATOM 847 O LYS A 374 24.888 3.539 -2.876 1.00 0.00 O ATOM 848 CB LYS A 374 21.678 2.665 -2.793 1.00 0.00 C ATOM 849 CG LYS A 374 22.154 1.883 -4.008 1.00 0.00 C ATOM 850 CD LYS A 374 21.051 1.693 -5.044 1.00 0.00 C ATOM 851 CE LYS A 374 21.015 2.824 -6.071 1.00 0.00 C ATOM 852 NZ LYS A 374 20.562 4.120 -5.494 1.00 0.00 N ATOM 0 H LYS A 374 21.246 3.748 -0.612 1.00 0.00 H new ATOM 0 HA LYS A 374 23.311 2.109 -1.512 1.00 0.00 H new ATOM 0 HB2 LYS A 374 20.924 2.080 -2.267 1.00 0.00 H new ATOM 0 HB3 LYS A 374 21.193 3.582 -3.129 1.00 0.00 H new ATOM 0 HG2 LYS A 374 22.994 2.405 -4.467 1.00 0.00 H new ATOM 0 HG3 LYS A 374 22.521 0.908 -3.688 1.00 0.00 H new ATOM 0 HD2 LYS A 374 21.199 0.743 -5.558 1.00 0.00 H new ATOM 0 HD3 LYS A 374 20.087 1.635 -4.538 1.00 0.00 H new ATOM 0 HE2 LYS A 374 22.010 2.951 -6.499 1.00 0.00 H new ATOM 0 HE3 LYS A 374 20.350 2.544 -6.888 1.00 0.00 H new ATOM 0 HZ1 LYS A 374 20.298 4.769 -6.263 1.00 0.00 H new ATOM 0 HZ2 LYS A 374 19.739 3.958 -4.880 1.00 0.00 H new ATOM 0 HZ3 LYS A 374 21.333 4.540 -4.936 1.00 0.00 H new ATOM 866 N ASP A 375 23.399 5.213 -2.640 1.00 0.00 N ATOM 867 CA ASP A 375 24.236 6.225 -3.276 1.00 0.00 C ATOM 868 C ASP A 375 25.570 6.356 -2.552 1.00 0.00 C ATOM 869 O ASP A 375 26.624 6.445 -3.184 1.00 0.00 O ATOM 870 CB ASP A 375 23.513 7.573 -3.285 1.00 0.00 C ATOM 871 CG ASP A 375 24.325 8.672 -3.940 1.00 0.00 C ATOM 872 OD1 ASP A 375 24.390 8.699 -5.187 1.00 0.00 O ATOM 873 OD2 ASP A 375 24.877 9.528 -3.214 1.00 0.00 O ATOM 0 H ASP A 375 22.496 5.561 -2.318 1.00 0.00 H new ATOM 0 HA ASP A 375 24.430 5.915 -4.303 1.00 0.00 H new ATOM 0 HB2 ASP A 375 22.564 7.467 -3.810 1.00 0.00 H new ATOM 0 HB3 ASP A 375 23.280 7.862 -2.260 1.00 0.00 H new ATOM 878 N VAL A 376 25.516 6.350 -1.224 1.00 0.00 N ATOM 879 CA VAL A 376 26.724 6.429 -0.419 1.00 0.00 C ATOM 880 C VAL A 376 27.607 5.210 -0.663 1.00 0.00 C ATOM 881 O VAL A 376 28.810 5.343 -0.817 1.00 0.00 O ATOM 882 CB VAL A 376 26.419 6.545 1.092 1.00 0.00 C ATOM 883 CG1 VAL A 376 27.712 6.703 1.885 1.00 0.00 C ATOM 884 CG2 VAL A 376 25.476 7.712 1.367 1.00 0.00 C ATOM 0 H VAL A 376 24.651 6.291 -0.687 1.00 0.00 H new ATOM 0 HA VAL A 376 27.247 7.335 -0.726 1.00 0.00 H new ATOM 0 HB VAL A 376 25.925 5.628 1.412 1.00 0.00 H new ATOM 0 HG11 VAL A 376 27.480 6.783 2.947 1.00 0.00 H new ATOM 0 HG12 VAL A 376 28.350 5.835 1.718 1.00 0.00 H new ATOM 0 HG13 VAL A 376 28.232 7.604 1.558 1.00 0.00 H new ATOM 0 HG21 VAL A 376 25.276 7.774 2.437 1.00 0.00 H new ATOM 0 HG22 VAL A 376 25.938 8.640 1.030 1.00 0.00 H new ATOM 0 HG23 VAL A 376 24.540 7.557 0.831 1.00 0.00 H new ATOM 894 N TYR A 377 26.999 4.030 -0.720 1.00 0.00 N ATOM 895 CA TYR A 377 27.738 2.793 -0.980 1.00 0.00 C ATOM 896 C TYR A 377 28.407 2.813 -2.354 1.00 0.00 C ATOM 897 O TYR A 377 29.536 2.350 -2.508 1.00 0.00 O ATOM 898 CB TYR A 377 26.810 1.577 -0.891 1.00 0.00 C ATOM 899 CG TYR A 377 26.601 1.040 0.508 1.00 0.00 C ATOM 900 CD1 TYR A 377 25.950 1.788 1.478 1.00 0.00 C ATOM 901 CD2 TYR A 377 27.037 -0.234 0.849 1.00 0.00 C ATOM 902 CE1 TYR A 377 25.742 1.285 2.747 1.00 0.00 C ATOM 903 CE2 TYR A 377 26.835 -0.742 2.116 1.00 0.00 C ATOM 904 CZ TYR A 377 26.186 0.021 3.060 1.00 0.00 C ATOM 905 OH TYR A 377 25.978 -0.482 4.322 1.00 0.00 O ATOM 0 H TYR A 377 25.996 3.901 -0.590 1.00 0.00 H new ATOM 0 HA TYR A 377 28.512 2.719 -0.216 1.00 0.00 H new ATOM 0 HB2 TYR A 377 25.841 1.846 -1.311 1.00 0.00 H new ATOM 0 HB3 TYR A 377 27.217 0.780 -1.514 1.00 0.00 H new ATOM 0 HD1 TYR A 377 25.600 2.781 1.237 1.00 0.00 H new ATOM 0 HD2 TYR A 377 27.543 -0.837 0.110 1.00 0.00 H new ATOM 0 HE1 TYR A 377 25.233 1.881 3.490 1.00 0.00 H new ATOM 0 HE2 TYR A 377 27.184 -1.733 2.366 1.00 0.00 H new ATOM 0 HH TYR A 377 26.351 -1.386 4.379 1.00 0.00 H new ATOM 915 N GLU A 378 27.701 3.335 -3.349 1.00 0.00 N ATOM 916 CA GLU A 378 28.212 3.362 -4.716 1.00 0.00 C ATOM 917 C GLU A 378 29.366 4.343 -4.856 1.00 0.00 C ATOM 918 O GLU A 378 30.409 4.014 -5.425 1.00 0.00 O ATOM 919 CB GLU A 378 27.105 3.737 -5.700 1.00 0.00 C ATOM 920 CG GLU A 378 25.919 2.793 -5.678 1.00 0.00 C ATOM 921 CD GLU A 378 24.852 3.187 -6.674 1.00 0.00 C ATOM 922 OE1 GLU A 378 24.114 4.157 -6.405 1.00 0.00 O ATOM 923 OE2 GLU A 378 24.750 2.526 -7.731 1.00 0.00 O ATOM 0 H GLU A 378 26.774 3.745 -3.237 1.00 0.00 H new ATOM 0 HA GLU A 378 28.575 2.360 -4.946 1.00 0.00 H new ATOM 0 HB2 GLU A 378 26.758 4.746 -5.475 1.00 0.00 H new ATOM 0 HB3 GLU A 378 27.520 3.760 -6.708 1.00 0.00 H new ATOM 0 HG2 GLU A 378 26.259 1.781 -5.895 1.00 0.00 H new ATOM 0 HG3 GLU A 378 25.489 2.777 -4.676 1.00 0.00 H new ATOM 930 N LYS A 379 29.174 5.549 -4.349 1.00 0.00 N ATOM 931 CA LYS A 379 30.185 6.589 -4.460 1.00 0.00 C ATOM 932 C LYS A 379 31.290 6.383 -3.433 1.00 0.00 C ATOM 933 O LYS A 379 32.447 6.733 -3.668 1.00 0.00 O ATOM 934 CB LYS A 379 29.548 7.968 -4.281 1.00 0.00 C ATOM 935 CG LYS A 379 28.493 8.285 -5.329 1.00 0.00 C ATOM 936 CD LYS A 379 27.842 9.636 -5.089 1.00 0.00 C ATOM 937 CE LYS A 379 28.851 10.770 -5.172 1.00 0.00 C ATOM 938 NZ LYS A 379 28.203 12.098 -5.013 1.00 0.00 N ATOM 0 H LYS A 379 28.327 5.833 -3.856 1.00 0.00 H new ATOM 0 HA LYS A 379 30.627 6.530 -5.455 1.00 0.00 H new ATOM 0 HB2 LYS A 379 29.095 8.025 -3.291 1.00 0.00 H new ATOM 0 HB3 LYS A 379 30.328 8.728 -4.319 1.00 0.00 H new ATOM 0 HG2 LYS A 379 28.950 8.273 -6.319 1.00 0.00 H new ATOM 0 HG3 LYS A 379 27.729 7.508 -5.321 1.00 0.00 H new ATOM 0 HD2 LYS A 379 27.054 9.796 -5.825 1.00 0.00 H new ATOM 0 HD3 LYS A 379 27.368 9.642 -4.108 1.00 0.00 H new ATOM 0 HE2 LYS A 379 29.608 10.640 -4.399 1.00 0.00 H new ATOM 0 HE3 LYS A 379 29.366 10.729 -6.132 1.00 0.00 H new ATOM 0 HZ1 LYS A 379 28.923 12.845 -5.075 1.00 0.00 H new ATOM 0 HZ2 LYS A 379 27.498 12.233 -5.766 1.00 0.00 H new ATOM 0 HZ3 LYS A 379 27.733 12.146 -4.086 1.00 0.00 H new ATOM 952 N ASN A 380 30.926 5.805 -2.299 1.00 0.00 N ATOM 953 CA ASN A 380 31.868 5.562 -1.218 1.00 0.00 C ATOM 954 C ASN A 380 31.718 4.139 -0.687 1.00 0.00 C ATOM 955 O ASN A 380 30.990 3.904 0.279 1.00 0.00 O ATOM 956 CB ASN A 380 31.653 6.560 -0.073 1.00 0.00 C ATOM 957 CG ASN A 380 31.866 8.000 -0.494 1.00 0.00 C ATOM 958 OD1 ASN A 380 32.979 8.519 -0.434 1.00 0.00 O ATOM 959 ND2 ASN A 380 30.795 8.663 -0.899 1.00 0.00 N ATOM 0 H ASN A 380 29.975 5.493 -2.103 1.00 0.00 H new ATOM 0 HA ASN A 380 32.874 5.692 -1.617 1.00 0.00 H new ATOM 0 HB2 ASN A 380 30.641 6.447 0.315 1.00 0.00 H new ATOM 0 HB3 ASN A 380 32.335 6.321 0.743 1.00 0.00 H new ATOM 0 HD21 ASN A 380 30.875 9.641 -1.176 1.00 0.00 H new ATOM 0 HD22 ASN A 380 29.889 8.196 -0.934 1.00 0.00 H new ATOM 966 N PRO A 381 32.411 3.167 -1.310 1.00 0.00 N ATOM 967 CA PRO A 381 32.397 1.757 -0.880 1.00 0.00 C ATOM 968 C PRO A 381 32.887 1.557 0.559 1.00 0.00 C ATOM 969 O PRO A 381 32.908 0.434 1.062 1.00 0.00 O ATOM 970 CB PRO A 381 33.344 1.061 -1.865 1.00 0.00 C ATOM 971 CG PRO A 381 34.143 2.156 -2.479 1.00 0.00 C ATOM 972 CD PRO A 381 33.242 3.354 -2.509 1.00 0.00 C ATOM 0 HA PRO A 381 31.383 1.358 -0.885 1.00 0.00 H new ATOM 0 HB2 PRO A 381 33.986 0.344 -1.354 1.00 0.00 H new ATOM 0 HB3 PRO A 381 32.788 0.508 -2.622 1.00 0.00 H new ATOM 0 HG2 PRO A 381 35.042 2.358 -1.896 1.00 0.00 H new ATOM 0 HG3 PRO A 381 34.468 1.886 -3.484 1.00 0.00 H new ATOM 0 HD2 PRO A 381 33.806 4.286 -2.469 1.00 0.00 H new ATOM 0 HD3 PRO A 381 32.640 3.385 -3.417 1.00 0.00 H new ATOM 980 N GLN A 382 33.291 2.650 1.202 1.00 0.00 N ATOM 981 CA GLN A 382 33.740 2.632 2.591 1.00 0.00 C ATOM 982 C GLN A 382 32.720 1.951 3.507 1.00 0.00 C ATOM 983 O GLN A 382 33.089 1.327 4.502 1.00 0.00 O ATOM 984 CB GLN A 382 33.987 4.063 3.077 1.00 0.00 C ATOM 985 CG GLN A 382 32.719 4.879 3.196 1.00 0.00 C ATOM 986 CD GLN A 382 32.956 6.276 3.731 1.00 0.00 C ATOM 987 OE1 GLN A 382 33.888 6.514 4.498 1.00 0.00 O ATOM 988 NE2 GLN A 382 32.105 7.208 3.338 1.00 0.00 N ATOM 0 H GLN A 382 33.316 3.575 0.773 1.00 0.00 H new ATOM 0 HA GLN A 382 34.667 2.060 2.632 1.00 0.00 H new ATOM 0 HB2 GLN A 382 34.482 4.030 4.047 1.00 0.00 H new ATOM 0 HB3 GLN A 382 34.669 4.561 2.388 1.00 0.00 H new ATOM 0 HG2 GLN A 382 32.246 4.948 2.217 1.00 0.00 H new ATOM 0 HG3 GLN A 382 32.021 4.359 3.852 1.00 0.00 H new ATOM 0 HE21 GLN A 382 31.345 6.969 2.701 1.00 0.00 H new ATOM 0 HE22 GLN A 382 32.208 8.166 3.672 1.00 0.00 H new ATOM 997 N MET A 383 31.439 2.062 3.161 1.00 0.00 N ATOM 998 CA MET A 383 30.375 1.513 3.996 1.00 0.00 C ATOM 999 C MET A 383 30.082 0.059 3.656 1.00 0.00 C ATOM 1000 O MET A 383 29.351 -0.614 4.380 1.00 0.00 O ATOM 1001 CB MET A 383 29.093 2.336 3.856 1.00 0.00 C ATOM 1002 CG MET A 383 29.183 3.725 4.462 1.00 0.00 C ATOM 1003 SD MET A 383 27.602 4.594 4.450 1.00 0.00 S ATOM 1004 CE MET A 383 26.594 3.501 5.449 1.00 0.00 C ATOM 0 H MET A 383 31.115 2.525 2.312 1.00 0.00 H new ATOM 0 HA MET A 383 30.726 1.561 5.027 1.00 0.00 H new ATOM 0 HB2 MET A 383 28.845 2.427 2.798 1.00 0.00 H new ATOM 0 HB3 MET A 383 28.273 1.796 4.330 1.00 0.00 H new ATOM 0 HG2 MET A 383 29.542 3.647 5.488 1.00 0.00 H new ATOM 0 HG3 MET A 383 29.919 4.310 3.911 1.00 0.00 H new ATOM 0 HE1 MET A 383 25.758 3.133 4.855 1.00 0.00 H new ATOM 0 HE2 MET A 383 27.197 2.659 5.788 1.00 0.00 H new ATOM 0 HE3 MET A 383 26.213 4.046 6.313 1.00 0.00 H new ATOM 1014 N GLY A 384 30.648 -0.426 2.562 1.00 0.00 N ATOM 1015 CA GLY A 384 30.400 -1.791 2.149 1.00 0.00 C ATOM 1016 C GLY A 384 30.165 -1.902 0.661 1.00 0.00 C ATOM 1017 O GLY A 384 30.680 -1.097 -0.117 1.00 0.00 O ATOM 0 H GLY A 384 31.274 0.101 1.953 1.00 0.00 H new ATOM 0 HA2 GLY A 384 31.250 -2.414 2.429 1.00 0.00 H new ATOM 0 HA3 GLY A 384 29.532 -2.178 2.682 1.00 0.00 H new ATOM 1021 N ASP A 385 29.387 -2.891 0.259 1.00 0.00 N ATOM 1022 CA ASP A 385 29.113 -3.123 -1.151 1.00 0.00 C ATOM 1023 C ASP A 385 27.646 -2.839 -1.465 1.00 0.00 C ATOM 1024 O ASP A 385 26.748 -3.413 -0.846 1.00 0.00 O ATOM 1025 CB ASP A 385 29.471 -4.562 -1.525 1.00 0.00 C ATOM 1026 CG ASP A 385 29.240 -4.856 -2.991 1.00 0.00 C ATOM 1027 OD1 ASP A 385 30.044 -4.395 -3.828 1.00 0.00 O ATOM 1028 OD2 ASP A 385 28.257 -5.548 -3.313 1.00 0.00 O ATOM 0 H ASP A 385 28.931 -3.550 0.891 1.00 0.00 H new ATOM 0 HA ASP A 385 29.727 -2.444 -1.743 1.00 0.00 H new ATOM 0 HB2 ASP A 385 30.517 -4.747 -1.281 1.00 0.00 H new ATOM 0 HB3 ASP A 385 28.877 -5.249 -0.922 1.00 0.00 H new ATOM 1033 N PRO A 386 27.388 -1.944 -2.437 1.00 0.00 N ATOM 1034 CA PRO A 386 26.031 -1.481 -2.767 1.00 0.00 C ATOM 1035 C PRO A 386 25.105 -2.593 -3.257 1.00 0.00 C ATOM 1036 O PRO A 386 23.881 -2.451 -3.225 1.00 0.00 O ATOM 1037 CB PRO A 386 26.254 -0.451 -3.880 1.00 0.00 C ATOM 1038 CG PRO A 386 27.608 -0.749 -4.430 1.00 0.00 C ATOM 1039 CD PRO A 386 28.408 -1.304 -3.289 1.00 0.00 C ATOM 0 HA PRO A 386 25.534 -1.082 -1.882 1.00 0.00 H new ATOM 0 HB2 PRO A 386 25.489 -0.535 -4.652 1.00 0.00 H new ATOM 0 HB3 PRO A 386 26.203 0.566 -3.490 1.00 0.00 H new ATOM 0 HG2 PRO A 386 27.547 -1.466 -5.248 1.00 0.00 H new ATOM 0 HG3 PRO A 386 28.073 0.152 -4.830 1.00 0.00 H new ATOM 0 HD2 PRO A 386 29.153 -2.022 -3.632 1.00 0.00 H new ATOM 0 HD3 PRO A 386 28.944 -0.519 -2.754 1.00 0.00 H new ATOM 1047 N SER A 387 25.683 -3.701 -3.701 1.00 0.00 N ATOM 1048 CA SER A 387 24.894 -4.810 -4.213 1.00 0.00 C ATOM 1049 C SER A 387 24.116 -5.478 -3.079 1.00 0.00 C ATOM 1050 O SER A 387 23.019 -5.995 -3.285 1.00 0.00 O ATOM 1051 CB SER A 387 25.795 -5.822 -4.924 1.00 0.00 C ATOM 1052 OG SER A 387 25.036 -6.830 -5.564 1.00 0.00 O ATOM 0 H SER A 387 26.691 -3.854 -3.717 1.00 0.00 H new ATOM 0 HA SER A 387 24.177 -4.424 -4.937 1.00 0.00 H new ATOM 0 HB2 SER A 387 26.413 -5.307 -5.660 1.00 0.00 H new ATOM 0 HB3 SER A 387 26.473 -6.278 -4.202 1.00 0.00 H new ATOM 0 HG SER A 387 24.186 -6.453 -5.873 1.00 0.00 H new ATOM 1058 N SER A 388 24.667 -5.412 -1.871 1.00 0.00 N ATOM 1059 CA SER A 388 24.042 -6.025 -0.706 1.00 0.00 C ATOM 1060 C SER A 388 22.726 -5.320 -0.362 1.00 0.00 C ATOM 1061 O SER A 388 21.885 -5.861 0.357 1.00 0.00 O ATOM 1062 CB SER A 388 25.003 -5.977 0.490 1.00 0.00 C ATOM 1063 OG SER A 388 24.558 -6.807 1.548 1.00 0.00 O ATOM 0 H SER A 388 25.548 -4.938 -1.674 1.00 0.00 H new ATOM 0 HA SER A 388 23.818 -7.066 -0.939 1.00 0.00 H new ATOM 0 HB2 SER A 388 25.997 -6.292 0.172 1.00 0.00 H new ATOM 0 HB3 SER A 388 25.093 -4.950 0.845 1.00 0.00 H new ATOM 0 HG SER A 388 25.192 -6.755 2.293 1.00 0.00 H new ATOM 1069 N LEU A 389 22.542 -4.119 -0.901 1.00 0.00 N ATOM 1070 CA LEU A 389 21.355 -3.327 -0.612 1.00 0.00 C ATOM 1071 C LEU A 389 20.258 -3.574 -1.645 1.00 0.00 C ATOM 1072 O LEU A 389 19.129 -3.114 -1.479 1.00 0.00 O ATOM 1073 CB LEU A 389 21.709 -1.840 -0.583 1.00 0.00 C ATOM 1074 CG LEU A 389 22.823 -1.449 0.390 1.00 0.00 C ATOM 1075 CD1 LEU A 389 23.095 0.042 0.307 1.00 0.00 C ATOM 1076 CD2 LEU A 389 22.462 -1.845 1.815 1.00 0.00 C ATOM 0 H LEU A 389 23.201 -3.674 -1.540 1.00 0.00 H new ATOM 0 HA LEU A 389 20.980 -3.632 0.365 1.00 0.00 H new ATOM 0 HB2 LEU A 389 22.003 -1.534 -1.587 1.00 0.00 H new ATOM 0 HB3 LEU A 389 20.812 -1.275 -0.328 1.00 0.00 H new ATOM 0 HG LEU A 389 23.728 -1.986 0.107 1.00 0.00 H new ATOM 0 HD11 LEU A 389 23.890 0.306 1.005 1.00 0.00 H new ATOM 0 HD12 LEU A 389 23.401 0.300 -0.707 1.00 0.00 H new ATOM 0 HD13 LEU A 389 22.189 0.592 0.563 1.00 0.00 H new ATOM 0 HD21 LEU A 389 23.269 -1.557 2.488 1.00 0.00 H new ATOM 0 HD22 LEU A 389 21.544 -1.338 2.112 1.00 0.00 H new ATOM 0 HD23 LEU A 389 22.314 -2.924 1.867 1.00 0.00 H new ATOM 1088 N HIS A 390 20.586 -4.313 -2.700 1.00 0.00 N ATOM 1089 CA HIS A 390 19.632 -4.569 -3.780 1.00 0.00 C ATOM 1090 C HIS A 390 18.407 -5.355 -3.291 1.00 0.00 C ATOM 1091 O HIS A 390 17.279 -4.927 -3.530 1.00 0.00 O ATOM 1092 CB HIS A 390 20.299 -5.292 -4.956 1.00 0.00 C ATOM 1093 CG HIS A 390 21.266 -4.438 -5.721 1.00 0.00 C ATOM 1094 ND1 HIS A 390 22.312 -4.956 -6.449 1.00 0.00 N ATOM 1095 CD2 HIS A 390 21.329 -3.094 -5.880 1.00 0.00 C ATOM 1096 CE1 HIS A 390 22.979 -3.971 -7.022 1.00 0.00 C ATOM 1097 NE2 HIS A 390 22.403 -2.830 -6.693 1.00 0.00 N ATOM 0 H HIS A 390 21.501 -4.745 -2.833 1.00 0.00 H new ATOM 0 HA HIS A 390 19.284 -3.596 -4.128 1.00 0.00 H new ATOM 0 HB2 HIS A 390 20.823 -6.171 -4.580 1.00 0.00 H new ATOM 0 HB3 HIS A 390 19.526 -5.649 -5.637 1.00 0.00 H new ATOM 0 HD2 HIS A 390 20.659 -2.366 -5.448 1.00 0.00 H new ATOM 0 HE1 HIS A 390 23.849 -4.080 -7.653 1.00 0.00 H new ATOM 0 HE2 HIS A 390 22.706 -1.904 -6.994 1.00 0.00 H new ATOM 1106 N PRO A 391 18.591 -6.502 -2.590 1.00 0.00 N ATOM 1107 CA PRO A 391 17.464 -7.285 -2.055 1.00 0.00 C ATOM 1108 C PRO A 391 16.578 -6.465 -1.118 1.00 0.00 C ATOM 1109 O PRO A 391 15.383 -6.734 -0.982 1.00 0.00 O ATOM 1110 CB PRO A 391 18.135 -8.433 -1.285 1.00 0.00 C ATOM 1111 CG PRO A 391 19.548 -8.003 -1.094 1.00 0.00 C ATOM 1112 CD PRO A 391 19.879 -7.148 -2.280 1.00 0.00 C ATOM 0 HA PRO A 391 16.804 -7.626 -2.852 1.00 0.00 H new ATOM 0 HB2 PRO A 391 17.643 -8.605 -0.328 1.00 0.00 H new ATOM 0 HB3 PRO A 391 18.080 -9.367 -1.844 1.00 0.00 H new ATOM 0 HG2 PRO A 391 19.665 -7.445 -0.165 1.00 0.00 H new ATOM 0 HG3 PRO A 391 20.214 -8.864 -1.035 1.00 0.00 H new ATOM 0 HD2 PRO A 391 20.652 -6.416 -2.047 1.00 0.00 H new ATOM 0 HD3 PRO A 391 20.245 -7.743 -3.117 1.00 0.00 H new ATOM 1120 N LYS A 392 17.168 -5.461 -0.478 1.00 0.00 N ATOM 1121 CA LYS A 392 16.418 -4.568 0.392 1.00 0.00 C ATOM 1122 C LYS A 392 15.474 -3.705 -0.435 1.00 0.00 C ATOM 1123 O LYS A 392 14.257 -3.735 -0.244 1.00 0.00 O ATOM 1124 CB LYS A 392 17.360 -3.673 1.202 1.00 0.00 C ATOM 1125 CG LYS A 392 18.223 -4.420 2.206 1.00 0.00 C ATOM 1126 CD LYS A 392 19.103 -3.460 2.992 1.00 0.00 C ATOM 1127 CE LYS A 392 19.934 -4.176 4.047 1.00 0.00 C ATOM 1128 NZ LYS A 392 19.090 -4.788 5.110 1.00 0.00 N ATOM 0 H LYS A 392 18.163 -5.247 -0.547 1.00 0.00 H new ATOM 0 HA LYS A 392 15.839 -5.177 1.086 1.00 0.00 H new ATOM 0 HB2 LYS A 392 18.009 -3.132 0.514 1.00 0.00 H new ATOM 0 HB3 LYS A 392 16.767 -2.928 1.733 1.00 0.00 H new ATOM 0 HG2 LYS A 392 17.587 -4.980 2.892 1.00 0.00 H new ATOM 0 HG3 LYS A 392 18.847 -5.146 1.685 1.00 0.00 H new ATOM 0 HD2 LYS A 392 19.766 -2.933 2.306 1.00 0.00 H new ATOM 0 HD3 LYS A 392 18.478 -2.708 3.473 1.00 0.00 H new ATOM 0 HE2 LYS A 392 20.533 -4.952 3.570 1.00 0.00 H new ATOM 0 HE3 LYS A 392 20.630 -3.469 4.500 1.00 0.00 H new ATOM 0 HZ1 LYS A 392 19.695 -5.100 5.897 1.00 0.00 H new ATOM 0 HZ2 LYS A 392 18.405 -4.086 5.457 1.00 0.00 H new ATOM 0 HZ3 LYS A 392 18.580 -5.606 4.720 1.00 0.00 H new ATOM 1142 N ILE A 393 16.045 -2.963 -1.377 1.00 0.00 N ATOM 1143 CA ILE A 393 15.281 -2.037 -2.205 1.00 0.00 C ATOM 1144 C ILE A 393 14.252 -2.783 -3.056 1.00 0.00 C ATOM 1145 O ILE A 393 13.148 -2.283 -3.285 1.00 0.00 O ATOM 1146 CB ILE A 393 16.210 -1.208 -3.120 1.00 0.00 C ATOM 1147 CG1 ILE A 393 17.302 -0.528 -2.289 1.00 0.00 C ATOM 1148 CG2 ILE A 393 15.410 -0.168 -3.894 1.00 0.00 C ATOM 1149 CD1 ILE A 393 18.307 0.245 -3.116 1.00 0.00 C ATOM 0 H ILE A 393 17.043 -2.985 -1.587 1.00 0.00 H new ATOM 0 HA ILE A 393 14.757 -1.358 -1.532 1.00 0.00 H new ATOM 0 HB ILE A 393 16.682 -1.882 -3.835 1.00 0.00 H new ATOM 0 HG12 ILE A 393 16.833 0.151 -1.576 1.00 0.00 H new ATOM 0 HG13 ILE A 393 17.829 -1.286 -1.709 1.00 0.00 H new ATOM 0 HG21 ILE A 393 16.081 0.406 -4.533 1.00 0.00 H new ATOM 0 HG22 ILE A 393 14.663 -0.668 -4.510 1.00 0.00 H new ATOM 0 HG23 ILE A 393 14.913 0.504 -3.194 1.00 0.00 H new ATOM 0 HD11 ILE A 393 19.048 0.698 -2.458 1.00 0.00 H new ATOM 0 HD12 ILE A 393 18.804 -0.432 -3.811 1.00 0.00 H new ATOM 0 HD13 ILE A 393 17.793 1.026 -3.676 1.00 0.00 H new ATOM 1161 N ALA A 394 14.613 -3.984 -3.503 1.00 0.00 N ATOM 1162 CA ALA A 394 13.714 -4.817 -4.299 1.00 0.00 C ATOM 1163 C ALA A 394 12.375 -5.018 -3.592 1.00 0.00 C ATOM 1164 O ALA A 394 11.320 -4.694 -4.141 1.00 0.00 O ATOM 1165 CB ALA A 394 14.361 -6.162 -4.595 1.00 0.00 C ATOM 0 H ALA A 394 15.526 -4.404 -3.326 1.00 0.00 H new ATOM 0 HA ALA A 394 13.524 -4.301 -5.240 1.00 0.00 H new ATOM 0 HB1 ALA A 394 13.679 -6.771 -5.189 1.00 0.00 H new ATOM 0 HB2 ALA A 394 15.286 -6.006 -5.151 1.00 0.00 H new ATOM 0 HB3 ALA A 394 14.582 -6.673 -3.658 1.00 0.00 H new ATOM 1171 N GLU A 395 12.425 -5.536 -2.368 1.00 0.00 N ATOM 1172 CA GLU A 395 11.215 -5.743 -1.578 1.00 0.00 C ATOM 1173 C GLU A 395 10.537 -4.419 -1.263 1.00 0.00 C ATOM 1174 O GLU A 395 9.314 -4.316 -1.309 1.00 0.00 O ATOM 1175 CB GLU A 395 11.528 -6.474 -0.276 1.00 0.00 C ATOM 1176 CG GLU A 395 11.098 -7.928 -0.278 1.00 0.00 C ATOM 1177 CD GLU A 395 11.332 -8.598 1.058 1.00 0.00 C ATOM 1178 OE1 GLU A 395 10.475 -8.463 1.955 1.00 0.00 O ATOM 1179 OE2 GLU A 395 12.376 -9.263 1.220 1.00 0.00 O ATOM 0 H GLU A 395 13.287 -5.819 -1.903 1.00 0.00 H new ATOM 0 HA GLU A 395 10.539 -6.356 -2.175 1.00 0.00 H new ATOM 0 HB2 GLU A 395 12.600 -6.421 -0.088 1.00 0.00 H new ATOM 0 HB3 GLU A 395 11.034 -5.959 0.548 1.00 0.00 H new ATOM 0 HG2 GLU A 395 10.040 -7.991 -0.533 1.00 0.00 H new ATOM 0 HG3 GLU A 395 11.646 -8.465 -1.052 1.00 0.00 H new ATOM 1186 N THR A 396 11.343 -3.412 -0.958 1.00 0.00 N ATOM 1187 CA THR A 396 10.831 -2.095 -0.614 1.00 0.00 C ATOM 1188 C THR A 396 9.946 -1.547 -1.736 1.00 0.00 C ATOM 1189 O THR A 396 8.811 -1.139 -1.494 1.00 0.00 O ATOM 1190 CB THR A 396 11.994 -1.125 -0.323 1.00 0.00 C ATOM 1191 OG1 THR A 396 12.877 -1.721 0.633 1.00 0.00 O ATOM 1192 CG2 THR A 396 11.495 0.204 0.223 1.00 0.00 C ATOM 0 H THR A 396 12.360 -3.484 -0.942 1.00 0.00 H new ATOM 0 HA THR A 396 10.223 -2.189 0.286 1.00 0.00 H new ATOM 0 HB THR A 396 12.515 -0.933 -1.261 1.00 0.00 H new ATOM 0 HG1 THR A 396 13.547 -2.262 0.166 1.00 0.00 H new ATOM 0 HG21 THR A 396 12.344 0.860 0.415 1.00 0.00 H new ATOM 0 HG22 THR A 396 10.833 0.671 -0.506 1.00 0.00 H new ATOM 0 HG23 THR A 396 10.950 0.034 1.151 1.00 0.00 H new ATOM 1200 N THR A 397 10.450 -1.581 -2.966 1.00 0.00 N ATOM 1201 CA THR A 397 9.687 -1.115 -4.117 1.00 0.00 C ATOM 1202 C THR A 397 8.488 -2.027 -4.383 1.00 0.00 C ATOM 1203 O THR A 397 7.411 -1.558 -4.757 1.00 0.00 O ATOM 1204 CB THR A 397 10.569 -1.039 -5.379 1.00 0.00 C ATOM 1205 OG1 THR A 397 11.742 -0.263 -5.102 1.00 0.00 O ATOM 1206 CG2 THR A 397 9.813 -0.413 -6.542 1.00 0.00 C ATOM 0 H THR A 397 11.383 -1.926 -3.190 1.00 0.00 H new ATOM 0 HA THR A 397 9.327 -0.113 -3.883 1.00 0.00 H new ATOM 0 HB THR A 397 10.851 -2.054 -5.657 1.00 0.00 H new ATOM 0 HG1 THR A 397 12.343 -0.774 -4.521 1.00 0.00 H new ATOM 0 HG21 THR A 397 10.461 -0.373 -7.418 1.00 0.00 H new ATOM 0 HG22 THR A 397 8.932 -1.014 -6.769 1.00 0.00 H new ATOM 0 HG23 THR A 397 9.503 0.597 -6.273 1.00 0.00 H new ATOM 1214 N SER A 398 8.677 -3.328 -4.173 1.00 0.00 N ATOM 1215 CA SER A 398 7.604 -4.297 -4.352 1.00 0.00 C ATOM 1216 C SER A 398 6.443 -3.997 -3.410 1.00 0.00 C ATOM 1217 O SER A 398 5.277 -4.042 -3.806 1.00 0.00 O ATOM 1218 CB SER A 398 8.122 -5.716 -4.110 1.00 0.00 C ATOM 1219 OG SER A 398 9.153 -6.048 -5.026 1.00 0.00 O ATOM 0 H SER A 398 9.565 -3.734 -3.878 1.00 0.00 H new ATOM 0 HA SER A 398 7.246 -4.222 -5.379 1.00 0.00 H new ATOM 0 HB2 SER A 398 8.497 -5.800 -3.090 1.00 0.00 H new ATOM 0 HB3 SER A 398 7.302 -6.427 -4.208 1.00 0.00 H new ATOM 0 HG SER A 398 9.951 -5.516 -4.827 1.00 0.00 H new ATOM 1225 N ASN A 399 6.770 -3.681 -2.161 1.00 0.00 N ATOM 1226 CA ASN A 399 5.757 -3.326 -1.178 1.00 0.00 C ATOM 1227 C ASN A 399 5.098 -2.016 -1.561 1.00 0.00 C ATOM 1228 O ASN A 399 3.884 -1.874 -1.457 1.00 0.00 O ATOM 1229 CB ASN A 399 6.354 -3.212 0.229 1.00 0.00 C ATOM 1230 CG ASN A 399 6.907 -4.526 0.746 1.00 0.00 C ATOM 1231 OD1 ASN A 399 6.460 -5.607 0.354 1.00 0.00 O ATOM 1232 ND2 ASN A 399 7.873 -4.440 1.645 1.00 0.00 N ATOM 0 H ASN A 399 7.727 -3.664 -1.808 1.00 0.00 H new ATOM 0 HA ASN A 399 5.012 -4.122 -1.166 1.00 0.00 H new ATOM 0 HB2 ASN A 399 7.150 -2.467 0.221 1.00 0.00 H new ATOM 0 HB3 ASN A 399 5.587 -2.852 0.915 1.00 0.00 H new ATOM 0 HD21 ASN A 399 8.277 -5.288 2.042 1.00 0.00 H new ATOM 0 HD22 ASN A 399 8.214 -3.525 1.942 1.00 0.00 H new ATOM 1239 N ILE A 400 5.905 -1.064 -2.020 1.00 0.00 N ATOM 1240 CA ILE A 400 5.393 0.223 -2.475 1.00 0.00 C ATOM 1241 C ILE A 400 4.335 0.035 -3.557 1.00 0.00 C ATOM 1242 O ILE A 400 3.211 0.515 -3.426 1.00 0.00 O ATOM 1243 CB ILE A 400 6.525 1.131 -3.011 1.00 0.00 C ATOM 1244 CG1 ILE A 400 7.460 1.540 -1.871 1.00 0.00 C ATOM 1245 CG2 ILE A 400 5.952 2.363 -3.702 1.00 0.00 C ATOM 1246 CD1 ILE A 400 8.660 2.343 -2.323 1.00 0.00 C ATOM 0 H ILE A 400 6.918 -1.161 -2.086 1.00 0.00 H new ATOM 0 HA ILE A 400 4.941 0.710 -1.611 1.00 0.00 H new ATOM 0 HB ILE A 400 7.098 0.567 -3.747 1.00 0.00 H new ATOM 0 HG12 ILE A 400 6.897 2.124 -1.144 1.00 0.00 H new ATOM 0 HG13 ILE A 400 7.807 0.643 -1.359 1.00 0.00 H new ATOM 0 HG21 ILE A 400 6.767 2.986 -4.070 1.00 0.00 H new ATOM 0 HG22 ILE A 400 5.326 2.053 -4.539 1.00 0.00 H new ATOM 0 HG23 ILE A 400 5.353 2.933 -2.992 1.00 0.00 H new ATOM 0 HD11 ILE A 400 9.275 2.596 -1.459 1.00 0.00 H new ATOM 0 HD12 ILE A 400 9.248 1.754 -3.027 1.00 0.00 H new ATOM 0 HD13 ILE A 400 8.323 3.259 -2.809 1.00 0.00 H new ATOM 1258 N GLU A 401 4.697 -0.688 -4.609 1.00 0.00 N ATOM 1259 CA GLU A 401 3.789 -0.934 -5.720 1.00 0.00 C ATOM 1260 C GLU A 401 2.530 -1.662 -5.259 1.00 0.00 C ATOM 1261 O GLU A 401 1.423 -1.326 -5.682 1.00 0.00 O ATOM 1262 CB GLU A 401 4.498 -1.731 -6.815 1.00 0.00 C ATOM 1263 CG GLU A 401 5.522 -0.913 -7.582 1.00 0.00 C ATOM 1264 CD GLU A 401 4.887 0.239 -8.334 1.00 0.00 C ATOM 1265 OE1 GLU A 401 4.346 0.008 -9.434 1.00 0.00 O ATOM 1266 OE2 GLU A 401 4.915 1.384 -7.830 1.00 0.00 O ATOM 0 H GLU A 401 5.617 -1.115 -4.716 1.00 0.00 H new ATOM 0 HA GLU A 401 3.484 0.031 -6.126 1.00 0.00 H new ATOM 0 HB2 GLU A 401 4.993 -2.592 -6.366 1.00 0.00 H new ATOM 0 HB3 GLU A 401 3.755 -2.118 -7.513 1.00 0.00 H new ATOM 0 HG2 GLU A 401 6.268 -0.525 -6.888 1.00 0.00 H new ATOM 0 HG3 GLU A 401 6.047 -1.559 -8.286 1.00 0.00 H new ATOM 1273 N ARG A 402 2.699 -2.643 -4.378 1.00 0.00 N ATOM 1274 CA ARG A 402 1.562 -3.375 -3.837 1.00 0.00 C ATOM 1275 C ARG A 402 0.648 -2.451 -3.039 1.00 0.00 C ATOM 1276 O ARG A 402 -0.554 -2.390 -3.285 1.00 0.00 O ATOM 1277 CB ARG A 402 2.022 -4.530 -2.943 1.00 0.00 C ATOM 1278 CG ARG A 402 0.881 -5.144 -2.145 1.00 0.00 C ATOM 1279 CD ARG A 402 1.349 -6.253 -1.224 1.00 0.00 C ATOM 1280 NE ARG A 402 0.298 -6.641 -0.283 1.00 0.00 N ATOM 1281 CZ ARG A 402 -0.674 -7.510 -0.557 1.00 0.00 C ATOM 1282 NH1 ARG A 402 -0.704 -8.138 -1.728 1.00 0.00 N ATOM 1283 NH2 ARG A 402 -1.612 -7.755 0.346 1.00 0.00 N ATOM 0 H ARG A 402 3.607 -2.947 -4.026 1.00 0.00 H new ATOM 0 HA ARG A 402 1.008 -3.782 -4.683 1.00 0.00 H new ATOM 0 HB2 ARG A 402 2.484 -5.300 -3.560 1.00 0.00 H new ATOM 0 HB3 ARG A 402 2.788 -4.170 -2.256 1.00 0.00 H new ATOM 0 HG2 ARG A 402 0.395 -4.367 -1.555 1.00 0.00 H new ATOM 0 HG3 ARG A 402 0.132 -5.538 -2.832 1.00 0.00 H new ATOM 0 HD2 ARG A 402 1.648 -7.118 -1.816 1.00 0.00 H new ATOM 0 HD3 ARG A 402 2.230 -5.924 -0.673 1.00 0.00 H new ATOM 0 HE ARG A 402 0.310 -6.218 0.645 1.00 0.00 H new ATOM 0 HH11 ARG A 402 0.020 -7.956 -2.423 1.00 0.00 H new ATOM 0 HH12 ARG A 402 -1.451 -8.802 -1.932 1.00 0.00 H new ATOM 0 HH21 ARG A 402 -1.589 -7.279 1.248 1.00 0.00 H new ATOM 0 HH22 ARG A 402 -2.358 -8.420 0.139 1.00 0.00 H new ATOM 1297 N LEU A 403 1.224 -1.731 -2.091 1.00 0.00 N ATOM 1298 CA LEU A 403 0.447 -0.892 -1.192 1.00 0.00 C ATOM 1299 C LEU A 403 -0.230 0.250 -1.942 1.00 0.00 C ATOM 1300 O LEU A 403 -1.374 0.591 -1.649 1.00 0.00 O ATOM 1301 CB LEU A 403 1.333 -0.352 -0.072 1.00 0.00 C ATOM 1302 CG LEU A 403 1.950 -1.423 0.834 1.00 0.00 C ATOM 1303 CD1 LEU A 403 2.940 -0.801 1.797 1.00 0.00 C ATOM 1304 CD2 LEU A 403 0.869 -2.168 1.599 1.00 0.00 C ATOM 0 H LEU A 403 2.230 -1.710 -1.923 1.00 0.00 H new ATOM 0 HA LEU A 403 -0.338 -1.507 -0.752 1.00 0.00 H new ATOM 0 HB2 LEU A 403 2.137 0.236 -0.515 1.00 0.00 H new ATOM 0 HB3 LEU A 403 0.743 0.328 0.543 1.00 0.00 H new ATOM 0 HG LEU A 403 2.480 -2.136 0.203 1.00 0.00 H new ATOM 0 HD11 LEU A 403 3.367 -1.577 2.432 1.00 0.00 H new ATOM 0 HD12 LEU A 403 3.736 -0.313 1.235 1.00 0.00 H new ATOM 0 HD13 LEU A 403 2.430 -0.065 2.418 1.00 0.00 H new ATOM 0 HD21 LEU A 403 1.329 -2.924 2.236 1.00 0.00 H new ATOM 0 HD22 LEU A 403 0.310 -1.465 2.216 1.00 0.00 H new ATOM 0 HD23 LEU A 403 0.192 -2.651 0.894 1.00 0.00 H new ATOM 1316 N ARG A 404 0.464 0.824 -2.920 1.00 0.00 N ATOM 1317 CA ARG A 404 -0.106 1.909 -3.713 1.00 0.00 C ATOM 1318 C ARG A 404 -1.301 1.421 -4.519 1.00 0.00 C ATOM 1319 O ARG A 404 -2.335 2.089 -4.571 1.00 0.00 O ATOM 1320 CB ARG A 404 0.934 2.524 -4.651 1.00 0.00 C ATOM 1321 CG ARG A 404 2.013 3.314 -3.935 1.00 0.00 C ATOM 1322 CD ARG A 404 2.989 3.943 -4.916 1.00 0.00 C ATOM 1323 NE ARG A 404 2.370 4.993 -5.726 1.00 0.00 N ATOM 1324 CZ ARG A 404 2.742 5.285 -6.974 1.00 0.00 C ATOM 1325 NH1 ARG A 404 3.684 4.567 -7.578 1.00 0.00 N ATOM 1326 NH2 ARG A 404 2.162 6.291 -7.617 1.00 0.00 N ATOM 0 H ARG A 404 1.414 0.559 -3.181 1.00 0.00 H new ATOM 0 HA ARG A 404 -0.437 2.679 -3.016 1.00 0.00 H new ATOM 0 HB2 ARG A 404 1.403 1.728 -5.230 1.00 0.00 H new ATOM 0 HB3 ARG A 404 0.428 3.179 -5.360 1.00 0.00 H new ATOM 0 HG2 ARG A 404 1.552 4.094 -3.329 1.00 0.00 H new ATOM 0 HG3 ARG A 404 2.554 2.658 -3.253 1.00 0.00 H new ATOM 0 HD2 ARG A 404 3.832 4.362 -4.367 1.00 0.00 H new ATOM 0 HD3 ARG A 404 3.388 3.170 -5.572 1.00 0.00 H new ATOM 0 HE ARG A 404 1.610 5.533 -5.313 1.00 0.00 H new ATOM 0 HH11 ARG A 404 4.126 3.789 -7.087 1.00 0.00 H new ATOM 0 HH12 ARG A 404 3.965 4.794 -8.532 1.00 0.00 H new ATOM 0 HH21 ARG A 404 1.434 6.838 -7.157 1.00 0.00 H new ATOM 0 HH22 ARG A 404 2.444 6.517 -8.571 1.00 0.00 H new ATOM 1340 N MET A 405 -1.169 0.254 -5.145 1.00 0.00 N ATOM 1341 CA MET A 405 -2.266 -0.291 -5.931 1.00 0.00 C ATOM 1342 C MET A 405 -3.408 -0.704 -5.010 1.00 0.00 C ATOM 1343 O MET A 405 -4.576 -0.564 -5.363 1.00 0.00 O ATOM 1344 CB MET A 405 -1.814 -1.472 -6.805 1.00 0.00 C ATOM 1345 CG MET A 405 -1.607 -2.777 -6.052 1.00 0.00 C ATOM 1346 SD MET A 405 -1.145 -4.140 -7.137 1.00 0.00 S ATOM 1347 CE MET A 405 -1.095 -5.498 -5.969 1.00 0.00 C ATOM 0 H MET A 405 -0.327 -0.322 -5.123 1.00 0.00 H new ATOM 0 HA MET A 405 -2.616 0.489 -6.607 1.00 0.00 H new ATOM 0 HB2 MET A 405 -2.557 -1.633 -7.587 1.00 0.00 H new ATOM 0 HB3 MET A 405 -0.882 -1.203 -7.302 1.00 0.00 H new ATOM 0 HG2 MET A 405 -0.831 -2.638 -5.299 1.00 0.00 H new ATOM 0 HG3 MET A 405 -2.524 -3.035 -5.521 1.00 0.00 H new ATOM 0 HE1 MET A 405 -0.312 -6.198 -6.259 1.00 0.00 H new ATOM 0 HE2 MET A 405 -0.886 -5.112 -4.971 1.00 0.00 H new ATOM 0 HE3 MET A 405 -2.057 -6.011 -5.966 1.00 0.00 H new ATOM 1357 N GLU A 406 -3.065 -1.186 -3.816 1.00 0.00 N ATOM 1358 CA GLU A 406 -4.061 -1.534 -2.811 1.00 0.00 C ATOM 1359 C GLU A 406 -4.903 -0.317 -2.452 1.00 0.00 C ATOM 1360 O GLU A 406 -6.130 -0.400 -2.387 1.00 0.00 O ATOM 1361 CB GLU A 406 -3.388 -2.104 -1.561 1.00 0.00 C ATOM 1362 CG GLU A 406 -2.988 -3.564 -1.693 1.00 0.00 C ATOM 1363 CD GLU A 406 -4.172 -4.501 -1.566 1.00 0.00 C ATOM 1364 OE1 GLU A 406 -5.084 -4.441 -2.416 1.00 0.00 O ATOM 1365 OE2 GLU A 406 -4.201 -5.304 -0.612 1.00 0.00 O ATOM 0 H GLU A 406 -2.101 -1.344 -3.523 1.00 0.00 H new ATOM 0 HA GLU A 406 -4.716 -2.298 -3.228 1.00 0.00 H new ATOM 0 HB2 GLU A 406 -2.501 -1.513 -1.336 1.00 0.00 H new ATOM 0 HB3 GLU A 406 -4.066 -1.998 -0.714 1.00 0.00 H new ATOM 0 HG2 GLU A 406 -2.506 -3.720 -2.658 1.00 0.00 H new ATOM 0 HG3 GLU A 406 -2.252 -3.807 -0.927 1.00 0.00 H new ATOM 1372 N ILE A 407 -4.242 0.814 -2.233 1.00 0.00 N ATOM 1373 CA ILE A 407 -4.941 2.066 -1.970 1.00 0.00 C ATOM 1374 C ILE A 407 -5.886 2.388 -3.123 1.00 0.00 C ATOM 1375 O ILE A 407 -7.071 2.650 -2.914 1.00 0.00 O ATOM 1376 CB ILE A 407 -3.956 3.243 -1.777 1.00 0.00 C ATOM 1377 CG1 ILE A 407 -3.009 2.962 -0.607 1.00 0.00 C ATOM 1378 CG2 ILE A 407 -4.714 4.545 -1.545 1.00 0.00 C ATOM 1379 CD1 ILE A 407 -1.919 4.001 -0.441 1.00 0.00 C ATOM 0 H ILE A 407 -3.225 0.890 -2.232 1.00 0.00 H new ATOM 0 HA ILE A 407 -5.506 1.937 -1.047 1.00 0.00 H new ATOM 0 HB ILE A 407 -3.364 3.347 -2.686 1.00 0.00 H new ATOM 0 HG12 ILE A 407 -3.590 2.908 0.314 1.00 0.00 H new ATOM 0 HG13 ILE A 407 -2.548 1.985 -0.751 1.00 0.00 H new ATOM 0 HG21 ILE A 407 -4.004 5.361 -1.411 1.00 0.00 H new ATOM 0 HG22 ILE A 407 -5.349 4.754 -2.406 1.00 0.00 H new ATOM 0 HG23 ILE A 407 -5.332 4.452 -0.652 1.00 0.00 H new ATOM 0 HD11 ILE A 407 -1.288 3.734 0.407 1.00 0.00 H new ATOM 0 HD12 ILE A 407 -1.313 4.040 -1.346 1.00 0.00 H new ATOM 0 HD13 ILE A 407 -2.371 4.977 -0.265 1.00 0.00 H new ATOM 1391 N HIS A 408 -5.356 2.320 -4.342 1.00 0.00 N ATOM 1392 CA HIS A 408 -6.126 2.635 -5.542 1.00 0.00 C ATOM 1393 C HIS A 408 -7.330 1.709 -5.688 1.00 0.00 C ATOM 1394 O HIS A 408 -8.414 2.150 -6.057 1.00 0.00 O ATOM 1395 CB HIS A 408 -5.236 2.539 -6.787 1.00 0.00 C ATOM 1396 CG HIS A 408 -5.965 2.808 -8.072 1.00 0.00 C ATOM 1397 ND1 HIS A 408 -6.179 1.846 -9.035 1.00 0.00 N ATOM 1398 CD2 HIS A 408 -6.533 3.941 -8.544 1.00 0.00 C ATOM 1399 CE1 HIS A 408 -6.846 2.375 -10.043 1.00 0.00 C ATOM 1400 NE2 HIS A 408 -7.075 3.645 -9.770 1.00 0.00 N ATOM 0 H HIS A 408 -4.390 2.048 -4.525 1.00 0.00 H new ATOM 0 HA HIS A 408 -6.494 3.656 -5.443 1.00 0.00 H new ATOM 0 HB2 HIS A 408 -4.414 3.248 -6.691 1.00 0.00 H new ATOM 0 HB3 HIS A 408 -4.795 1.543 -6.831 1.00 0.00 H new ATOM 0 HD2 HIS A 408 -6.556 4.900 -8.048 1.00 0.00 H new ATOM 0 HE1 HIS A 408 -7.152 1.856 -10.939 1.00 0.00 H new ATOM 0 HE2 HIS A 408 -7.574 4.300 -10.372 1.00 0.00 H new ATOM 1409 N LYS A 409 -7.128 0.427 -5.405 1.00 0.00 N ATOM 1410 CA LYS A 409 -8.201 -0.557 -5.485 1.00 0.00 C ATOM 1411 C LYS A 409 -9.350 -0.177 -4.563 1.00 0.00 C ATOM 1412 O LYS A 409 -10.508 -0.183 -4.975 1.00 0.00 O ATOM 1413 CB LYS A 409 -7.673 -1.950 -5.136 1.00 0.00 C ATOM 1414 CG LYS A 409 -6.753 -2.527 -6.201 1.00 0.00 C ATOM 1415 CD LYS A 409 -5.922 -3.680 -5.664 1.00 0.00 C ATOM 1416 CE LYS A 409 -6.791 -4.813 -5.151 1.00 0.00 C ATOM 1417 NZ LYS A 409 -5.983 -5.853 -4.470 1.00 0.00 N ATOM 0 H LYS A 409 -6.228 0.044 -5.117 1.00 0.00 H new ATOM 0 HA LYS A 409 -8.576 -0.573 -6.508 1.00 0.00 H new ATOM 0 HB2 LYS A 409 -7.136 -1.901 -4.189 1.00 0.00 H new ATOM 0 HB3 LYS A 409 -8.516 -2.625 -4.989 1.00 0.00 H new ATOM 0 HG2 LYS A 409 -7.347 -2.871 -7.047 1.00 0.00 H new ATOM 0 HG3 LYS A 409 -6.092 -1.744 -6.573 1.00 0.00 H new ATOM 0 HD2 LYS A 409 -5.267 -4.053 -6.451 1.00 0.00 H new ATOM 0 HD3 LYS A 409 -5.281 -3.321 -4.859 1.00 0.00 H new ATOM 0 HE2 LYS A 409 -7.535 -4.418 -4.459 1.00 0.00 H new ATOM 0 HE3 LYS A 409 -7.335 -5.260 -5.983 1.00 0.00 H new ATOM 0 HZ1 LYS A 409 -6.616 -6.551 -4.029 1.00 0.00 H new ATOM 0 HZ2 LYS A 409 -5.373 -6.329 -5.165 1.00 0.00 H new ATOM 0 HZ3 LYS A 409 -5.393 -5.410 -3.737 1.00 0.00 H new ATOM 1431 N ASN A 410 -9.028 0.184 -3.327 1.00 0.00 N ATOM 1432 CA ASN A 410 -10.052 0.586 -2.367 1.00 0.00 C ATOM 1433 C ASN A 410 -10.771 1.840 -2.845 1.00 0.00 C ATOM 1434 O ASN A 410 -11.986 1.959 -2.702 1.00 0.00 O ATOM 1435 CB ASN A 410 -9.458 0.823 -0.976 1.00 0.00 C ATOM 1436 CG ASN A 410 -9.076 -0.463 -0.264 1.00 0.00 C ATOM 1437 OD1 ASN A 410 -9.896 -1.089 0.405 1.00 0.00 O ATOM 1438 ND2 ASN A 410 -7.824 -0.863 -0.392 1.00 0.00 N ATOM 0 H ASN A 410 -8.074 0.207 -2.966 1.00 0.00 H new ATOM 0 HA ASN A 410 -10.769 -0.231 -2.294 1.00 0.00 H new ATOM 0 HB2 ASN A 410 -8.576 1.456 -1.067 1.00 0.00 H new ATOM 0 HB3 ASN A 410 -10.180 1.368 -0.367 1.00 0.00 H new ATOM 0 HD21 ASN A 410 -7.511 -1.716 0.072 1.00 0.00 H new ATOM 0 HD22 ASN A 410 -7.170 -0.319 -0.955 1.00 0.00 H new ATOM 1445 N GLU A 411 -10.021 2.764 -3.435 1.00 0.00 N ATOM 1446 CA GLU A 411 -10.602 3.992 -3.963 1.00 0.00 C ATOM 1447 C GLU A 411 -11.487 3.689 -5.171 1.00 0.00 C ATOM 1448 O GLU A 411 -12.491 4.360 -5.402 1.00 0.00 O ATOM 1449 CB GLU A 411 -9.506 4.992 -4.341 1.00 0.00 C ATOM 1450 CG GLU A 411 -8.598 5.363 -3.179 1.00 0.00 C ATOM 1451 CD GLU A 411 -7.585 6.429 -3.543 1.00 0.00 C ATOM 1452 OE1 GLU A 411 -6.781 6.204 -4.472 1.00 0.00 O ATOM 1453 OE2 GLU A 411 -7.592 7.505 -2.907 1.00 0.00 O ATOM 0 H GLU A 411 -9.012 2.686 -3.559 1.00 0.00 H new ATOM 0 HA GLU A 411 -11.219 4.439 -3.184 1.00 0.00 H new ATOM 0 HB2 GLU A 411 -8.902 4.570 -5.144 1.00 0.00 H new ATOM 0 HB3 GLU A 411 -9.970 5.897 -4.733 1.00 0.00 H new ATOM 0 HG2 GLU A 411 -9.207 5.716 -2.346 1.00 0.00 H new ATOM 0 HG3 GLU A 411 -8.073 4.472 -2.835 1.00 0.00 H new ATOM 1460 N ALA A 412 -11.114 2.667 -5.929 1.00 0.00 N ATOM 1461 CA ALA A 412 -11.894 2.236 -7.081 1.00 0.00 C ATOM 1462 C ALA A 412 -13.211 1.614 -6.640 1.00 0.00 C ATOM 1463 O ALA A 412 -14.244 1.795 -7.288 1.00 0.00 O ATOM 1464 CB ALA A 412 -11.097 1.253 -7.925 1.00 0.00 C ATOM 0 H ALA A 412 -10.270 2.118 -5.765 1.00 0.00 H new ATOM 0 HA ALA A 412 -12.118 3.113 -7.688 1.00 0.00 H new ATOM 0 HB1 ALA A 412 -11.694 0.941 -8.782 1.00 0.00 H new ATOM 0 HB2 ALA A 412 -10.183 1.732 -8.275 1.00 0.00 H new ATOM 0 HB3 ALA A 412 -10.842 0.380 -7.324 1.00 0.00 H new ATOM 1470 N TRP A 413 -13.173 0.886 -5.534 1.00 0.00 N ATOM 1471 CA TRP A 413 -14.383 0.303 -4.974 1.00 0.00 C ATOM 1472 C TRP A 413 -15.237 1.393 -4.336 1.00 0.00 C ATOM 1473 O TRP A 413 -16.461 1.281 -4.280 1.00 0.00 O ATOM 1474 CB TRP A 413 -14.047 -0.788 -3.955 1.00 0.00 C ATOM 1475 CG TRP A 413 -13.225 -1.906 -4.525 1.00 0.00 C ATOM 1476 CD1 TRP A 413 -13.346 -2.469 -5.763 1.00 0.00 C ATOM 1477 CD2 TRP A 413 -12.159 -2.601 -3.870 1.00 0.00 C ATOM 1478 NE1 TRP A 413 -12.411 -3.462 -5.922 1.00 0.00 N ATOM 1479 CE2 TRP A 413 -11.670 -3.561 -4.775 1.00 0.00 C ATOM 1480 CE3 TRP A 413 -11.565 -2.500 -2.609 1.00 0.00 C ATOM 1481 CZ2 TRP A 413 -10.618 -4.411 -4.459 1.00 0.00 C ATOM 1482 CZ3 TRP A 413 -10.519 -3.346 -2.297 1.00 0.00 C ATOM 1483 CH2 TRP A 413 -10.053 -4.290 -3.220 1.00 0.00 C ATOM 0 H TRP A 413 -12.322 0.686 -5.009 1.00 0.00 H new ATOM 0 HA TRP A 413 -14.949 -0.162 -5.781 1.00 0.00 H new ATOM 0 HB2 TRP A 413 -13.508 -0.341 -3.120 1.00 0.00 H new ATOM 0 HB3 TRP A 413 -14.974 -1.197 -3.554 1.00 0.00 H new ATOM 0 HD1 TRP A 413 -14.071 -2.176 -6.508 1.00 0.00 H new ATOM 0 HE1 TRP A 413 -12.288 -4.033 -6.758 1.00 0.00 H new ATOM 0 HE3 TRP A 413 -11.918 -1.774 -1.892 1.00 0.00 H new ATOM 0 HZ2 TRP A 413 -10.259 -5.142 -5.168 1.00 0.00 H new ATOM 0 HZ3 TRP A 413 -10.053 -3.278 -1.325 1.00 0.00 H new ATOM 0 HH2 TRP A 413 -9.231 -4.935 -2.948 1.00 0.00 H new ATOM 1494 N LEU A 414 -14.586 2.456 -3.863 1.00 0.00 N ATOM 1495 CA LEU A 414 -15.300 3.630 -3.369 1.00 0.00 C ATOM 1496 C LEU A 414 -16.094 4.272 -4.498 1.00 0.00 C ATOM 1497 O LEU A 414 -17.199 4.763 -4.288 1.00 0.00 O ATOM 1498 CB LEU A 414 -14.338 4.660 -2.763 1.00 0.00 C ATOM 1499 CG LEU A 414 -13.731 4.285 -1.409 1.00 0.00 C ATOM 1500 CD1 LEU A 414 -12.770 5.367 -0.940 1.00 0.00 C ATOM 1501 CD2 LEU A 414 -14.824 4.069 -0.374 1.00 0.00 C ATOM 0 H LEU A 414 -13.570 2.527 -3.812 1.00 0.00 H new ATOM 0 HA LEU A 414 -15.981 3.299 -2.585 1.00 0.00 H new ATOM 0 HB2 LEU A 414 -13.526 4.831 -3.470 1.00 0.00 H new ATOM 0 HB3 LEU A 414 -14.869 5.605 -2.653 1.00 0.00 H new ATOM 0 HG LEU A 414 -13.178 3.353 -1.528 1.00 0.00 H new ATOM 0 HD11 LEU A 414 -12.347 5.085 0.024 1.00 0.00 H new ATOM 0 HD12 LEU A 414 -11.968 5.482 -1.669 1.00 0.00 H new ATOM 0 HD13 LEU A 414 -13.306 6.311 -0.839 1.00 0.00 H new ATOM 0 HD21 LEU A 414 -14.373 3.803 0.582 1.00 0.00 H new ATOM 0 HD22 LEU A 414 -15.403 4.985 -0.260 1.00 0.00 H new ATOM 0 HD23 LEU A 414 -15.481 3.263 -0.701 1.00 0.00 H new ATOM 1513 N SER A 415 -15.525 4.249 -5.699 1.00 0.00 N ATOM 1514 CA SER A 415 -16.211 4.751 -6.881 1.00 0.00 C ATOM 1515 C SER A 415 -17.496 3.963 -7.120 1.00 0.00 C ATOM 1516 O SER A 415 -18.511 4.517 -7.551 1.00 0.00 O ATOM 1517 CB SER A 415 -15.293 4.651 -8.099 1.00 0.00 C ATOM 1518 OG SER A 415 -14.044 5.273 -7.847 1.00 0.00 O ATOM 0 H SER A 415 -14.588 3.887 -5.878 1.00 0.00 H new ATOM 0 HA SER A 415 -16.471 5.797 -6.721 1.00 0.00 H new ATOM 0 HB2 SER A 415 -15.136 3.603 -8.355 1.00 0.00 H new ATOM 0 HB3 SER A 415 -15.771 5.122 -8.958 1.00 0.00 H new ATOM 0 HG SER A 415 -13.474 5.194 -8.640 1.00 0.00 H new ATOM 1524 N GLU A 416 -17.448 2.670 -6.817 1.00 0.00 N ATOM 1525 CA GLU A 416 -18.616 1.812 -6.935 1.00 0.00 C ATOM 1526 C GLU A 416 -19.654 2.186 -5.882 1.00 0.00 C ATOM 1527 O GLU A 416 -20.858 2.180 -6.152 1.00 0.00 O ATOM 1528 CB GLU A 416 -18.226 0.341 -6.775 1.00 0.00 C ATOM 1529 CG GLU A 416 -17.242 -0.156 -7.820 1.00 0.00 C ATOM 1530 CD GLU A 416 -16.969 -1.639 -7.691 1.00 0.00 C ATOM 1531 OE1 GLU A 416 -16.401 -2.057 -6.664 1.00 0.00 O ATOM 1532 OE2 GLU A 416 -17.341 -2.402 -8.608 1.00 0.00 O ATOM 0 H GLU A 416 -16.608 2.194 -6.487 1.00 0.00 H new ATOM 0 HA GLU A 416 -19.044 1.955 -7.927 1.00 0.00 H new ATOM 0 HB2 GLU A 416 -17.793 0.197 -5.785 1.00 0.00 H new ATOM 0 HB3 GLU A 416 -19.128 -0.270 -6.820 1.00 0.00 H new ATOM 0 HG2 GLU A 416 -17.635 0.054 -8.815 1.00 0.00 H new ATOM 0 HG3 GLU A 416 -16.305 0.393 -7.725 1.00 0.00 H new ATOM 1539 N VAL A 417 -19.179 2.526 -4.686 1.00 0.00 N ATOM 1540 CA VAL A 417 -20.063 2.903 -3.590 1.00 0.00 C ATOM 1541 C VAL A 417 -20.699 4.266 -3.843 1.00 0.00 C ATOM 1542 O VAL A 417 -21.915 4.424 -3.737 1.00 0.00 O ATOM 1543 CB VAL A 417 -19.325 2.948 -2.232 1.00 0.00 C ATOM 1544 CG1 VAL A 417 -20.297 3.309 -1.122 1.00 0.00 C ATOM 1545 CG2 VAL A 417 -18.642 1.623 -1.924 1.00 0.00 C ATOM 0 H VAL A 417 -18.186 2.548 -4.453 1.00 0.00 H new ATOM 0 HA VAL A 417 -20.835 2.134 -3.544 1.00 0.00 H new ATOM 0 HB VAL A 417 -18.552 3.714 -2.295 1.00 0.00 H new ATOM 0 HG11 VAL A 417 -19.767 3.338 -0.170 1.00 0.00 H new ATOM 0 HG12 VAL A 417 -20.733 4.287 -1.324 1.00 0.00 H new ATOM 0 HG13 VAL A 417 -21.089 2.561 -1.074 1.00 0.00 H new ATOM 0 HG21 VAL A 417 -18.133 1.691 -0.962 1.00 0.00 H new ATOM 0 HG22 VAL A 417 -19.388 0.830 -1.885 1.00 0.00 H new ATOM 0 HG23 VAL A 417 -17.915 1.399 -2.704 1.00 0.00 H new ATOM 1555 N GLU A 418 -19.873 5.240 -4.196 1.00 0.00 N ATOM 1556 CA GLU A 418 -20.345 6.603 -4.433 1.00 0.00 C ATOM 1557 C GLU A 418 -21.269 6.661 -5.641 1.00 0.00 C ATOM 1558 O GLU A 418 -22.130 7.533 -5.730 1.00 0.00 O ATOM 1559 CB GLU A 418 -19.169 7.564 -4.621 1.00 0.00 C ATOM 1560 CG GLU A 418 -18.357 7.779 -3.355 1.00 0.00 C ATOM 1561 CD GLU A 418 -17.257 8.804 -3.535 1.00 0.00 C ATOM 1562 OE1 GLU A 418 -17.560 10.017 -3.526 1.00 0.00 O ATOM 1563 OE2 GLU A 418 -16.083 8.405 -3.681 1.00 0.00 O ATOM 0 H GLU A 418 -18.869 5.115 -4.326 1.00 0.00 H new ATOM 0 HA GLU A 418 -20.909 6.913 -3.554 1.00 0.00 H new ATOM 0 HB2 GLU A 418 -18.515 7.177 -5.402 1.00 0.00 H new ATOM 0 HB3 GLU A 418 -19.547 8.525 -4.969 1.00 0.00 H new ATOM 0 HG2 GLU A 418 -19.021 8.101 -2.553 1.00 0.00 H new ATOM 0 HG3 GLU A 418 -17.918 6.831 -3.044 1.00 0.00 H new