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+ -169:sc= 0.425 (180deg=-0.413) USER MOD Set 1.2: A 371 ASN : amide:sc= -0.0872 K(o=0.34,f=-7.1!) USER MOD Single : A 338 SER OG : rot 180:sc= 0 USER MOD Single : A 339 HIS : no HD1:sc= -0.0188 X(o=-0.019,f=-0.48) USER MOD Single : A 344 GLN : amide:sc= -0.518 X(o=-0.52,f=-0.79) USER MOD Single : A 347 LYS NZ :NH3+ 166:sc= -0.0345 (180deg=-0.239) USER MOD Single : A 350 GLN :FLIP amide:sc= -0.337 F(o=-1.7,f=-0.34) USER MOD Single : A 351 GLN : amide:sc= 0.0935 K(o=0.093,f=-1.9) USER MOD Single : A 357 SER OG : rot 86:sc= 1.2 USER MOD Single : A 361 GLN : amide:sc= -1.15 K(o=-1.1,f=-6.1!) USER MOD Single : A 362 LYS NZ :NH3+ 169:sc= 1.24 (180deg=1.21) USER MOD Single : A 364 MET CE :methyl -164:sc= -0.472 (180deg=-1.07) USER MOD Single : A 366 GLN : amide:sc= -0.24 X(o=-0.24,f=-0.06) USER MOD Single : A 372 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 373 MET CE :methyl -163:sc= -0.226 (180deg=-0.697) USER MOD Single : A 374 LYS NZ :NH3+ 144:sc= 0.845 (180deg=-1.57!) USER MOD Single : A 377 TYR OH : rot 180:sc= 0 USER MOD Single : A 379 LYS NZ :NH3+ -107:sc= -0.738 (180deg=-1.1!) USER MOD Single : A 380 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 382 GLN :FLIP amide:sc= -0.317 F(o=-1,f=-0.32) USER MOD Single : A 383 MET CE :methyl -165:sc= -0.0807 (180deg=-0.451) USER MOD Single : A 387 SER OG : rot 180:sc= 0 USER MOD Single : A 388 SER OG : rot 180:sc=-0.00124 USER MOD Single : A 390 HIS : no HD1:sc= -1.17 K(o=-1.2,f=-1.9!) USER MOD Single : A 392 LYS NZ :NH3+ 167:sc= -0.0146 (180deg=-0.184) USER MOD Single : A 396 THR OG1 : rot 84:sc= 1.23 USER MOD Single : A 397 THR OG1 : rot 78:sc= 1.19 USER MOD Single : A 398 SER OG : rot 78:sc= 1.26 USER MOD Single : A 399 ASN : amide:sc= 0.39 K(o=0.39,f=-1) USER MOD Single : A 405 MET CE :methyl -163:sc= -0.138 (180deg=-0.616) USER MOD Single : A 408 HIS : no HD1:sc= 0 X(o=0,f=-0.0062) USER MOD Single : A 409 LYS NZ :NH3+ -155:sc= 1.79 (180deg=1.56) USER MOD Single : A 410 ASN : amide:sc= 0.547 K(o=0.55,f=-4.2!) USER MOD Single : A 415 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 195 N PHE A 337 -14.423 -7.386 -1.541 1.00 0.00 N ATOM 196 CA PHE A 337 -15.195 -6.607 -0.569 1.00 0.00 C ATOM 197 C PHE A 337 -16.658 -6.441 -1.005 1.00 0.00 C ATOM 198 O PHE A 337 -17.400 -5.640 -0.438 1.00 0.00 O ATOM 199 CB PHE A 337 -14.550 -5.242 -0.312 1.00 0.00 C ATOM 200 CG PHE A 337 -13.226 -5.331 0.393 1.00 0.00 C ATOM 201 CD1 PHE A 337 -13.169 -5.528 1.764 1.00 0.00 C ATOM 202 CD2 PHE A 337 -12.040 -5.214 -0.310 1.00 0.00 C ATOM 203 CE1 PHE A 337 -11.955 -5.607 2.418 1.00 0.00 C ATOM 204 CE2 PHE A 337 -10.822 -5.293 0.338 1.00 0.00 C ATOM 205 CZ PHE A 337 -10.780 -5.490 1.704 1.00 0.00 C ATOM 0 HA PHE A 337 -15.189 -7.168 0.366 1.00 0.00 H new ATOM 0 HB2 PHE A 337 -14.413 -4.728 -1.264 1.00 0.00 H new ATOM 0 HB3 PHE A 337 -15.230 -4.633 0.284 1.00 0.00 H new ATOM 0 HD1 PHE A 337 -14.085 -5.621 2.328 1.00 0.00 H new ATOM 0 HD2 PHE A 337 -12.067 -5.059 -1.378 1.00 0.00 H new ATOM 0 HE1 PHE A 337 -11.925 -5.760 3.487 1.00 0.00 H new ATOM 0 HE2 PHE A 337 -9.904 -5.201 -0.223 1.00 0.00 H new ATOM 0 HZ PHE A 337 -9.829 -5.552 2.213 1.00 0.00 H new ATOM 215 N SER A 338 -17.078 -7.235 -1.986 1.00 0.00 N ATOM 216 CA SER A 338 -18.431 -7.166 -2.513 1.00 0.00 C ATOM 217 C SER A 338 -19.369 -7.926 -1.596 1.00 0.00 C ATOM 218 O SER A 338 -20.585 -7.741 -1.623 1.00 0.00 O ATOM 219 CB SER A 338 -18.476 -7.754 -3.923 1.00 0.00 C ATOM 220 OG SER A 338 -17.518 -7.130 -4.764 1.00 0.00 O ATOM 0 H SER A 338 -16.491 -7.939 -2.434 1.00 0.00 H new ATOM 0 HA SER A 338 -18.746 -6.124 -2.563 1.00 0.00 H new ATOM 0 HB2 SER A 338 -18.284 -8.826 -3.880 1.00 0.00 H new ATOM 0 HB3 SER A 338 -19.473 -7.625 -4.343 1.00 0.00 H new ATOM 0 HG SER A 338 -17.564 -7.523 -5.660 1.00 0.00 H new ATOM 226 N HIS A 339 -18.778 -8.776 -0.770 1.00 0.00 N ATOM 227 CA HIS A 339 -19.523 -9.525 0.229 1.00 0.00 C ATOM 228 C HIS A 339 -19.920 -8.618 1.393 1.00 0.00 C ATOM 229 O HIS A 339 -20.597 -9.043 2.327 1.00 0.00 O ATOM 230 CB HIS A 339 -18.695 -10.722 0.726 1.00 0.00 C ATOM 231 CG HIS A 339 -17.387 -10.358 1.371 1.00 0.00 C ATOM 232 ND1 HIS A 339 -16.210 -10.201 0.665 1.00 0.00 N ATOM 233 CD2 HIS A 339 -17.074 -10.134 2.669 1.00 0.00 C ATOM 234 CE1 HIS A 339 -15.234 -9.897 1.503 1.00 0.00 C ATOM 235 NE2 HIS A 339 -15.732 -9.849 2.721 1.00 0.00 N ATOM 0 H HIS A 339 -17.776 -8.965 -0.773 1.00 0.00 H new ATOM 0 HA HIS A 339 -20.435 -9.906 -0.230 1.00 0.00 H new ATOM 0 HB2 HIS A 339 -19.292 -11.287 1.442 1.00 0.00 H new ATOM 0 HB3 HIS A 339 -18.497 -11.384 -0.117 1.00 0.00 H new ATOM 0 HD2 HIS A 339 -17.754 -10.172 3.508 1.00 0.00 H new ATOM 0 HE1 HIS A 339 -14.203 -9.718 1.234 1.00 0.00 H new ATOM 0 HE2 HIS A 339 -15.205 -9.634 3.568 1.00 0.00 H new ATOM 244 N LEU A 340 -19.488 -7.364 1.325 1.00 0.00 N ATOM 245 CA LEU A 340 -19.832 -6.374 2.332 1.00 0.00 C ATOM 246 C LEU A 340 -20.864 -5.404 1.774 1.00 0.00 C ATOM 247 O LEU A 340 -20.765 -4.989 0.615 1.00 0.00 O ATOM 248 CB LEU A 340 -18.590 -5.588 2.762 1.00 0.00 C ATOM 249 CG LEU A 340 -17.464 -6.417 3.380 1.00 0.00 C ATOM 250 CD1 LEU A 340 -16.324 -5.511 3.811 1.00 0.00 C ATOM 251 CD2 LEU A 340 -17.977 -7.227 4.562 1.00 0.00 C ATOM 0 H LEU A 340 -18.894 -7.009 0.575 1.00 0.00 H new ATOM 0 HA LEU A 340 -20.243 -6.895 3.197 1.00 0.00 H new ATOM 0 HB2 LEU A 340 -18.195 -5.063 1.892 1.00 0.00 H new ATOM 0 HB3 LEU A 340 -18.894 -4.828 3.482 1.00 0.00 H new ATOM 0 HG LEU A 340 -17.094 -7.113 2.627 1.00 0.00 H new ATOM 0 HD11 LEU A 340 -15.528 -6.112 4.250 1.00 0.00 H new ATOM 0 HD12 LEU A 340 -15.938 -4.974 2.944 1.00 0.00 H new ATOM 0 HD13 LEU A 340 -16.687 -4.795 4.549 1.00 0.00 H new ATOM 0 HD21 LEU A 340 -17.159 -7.809 4.986 1.00 0.00 H new ATOM 0 HD22 LEU A 340 -18.374 -6.552 5.321 1.00 0.00 H new ATOM 0 HD23 LEU A 340 -18.766 -7.900 4.227 1.00 0.00 H new ATOM 263 N PRO A 341 -21.869 -5.037 2.584 1.00 0.00 N ATOM 264 CA PRO A 341 -22.857 -4.025 2.203 1.00 0.00 C ATOM 265 C PRO A 341 -22.182 -2.674 2.005 1.00 0.00 C ATOM 266 O PRO A 341 -21.191 -2.390 2.669 1.00 0.00 O ATOM 267 CB PRO A 341 -23.821 -3.975 3.396 1.00 0.00 C ATOM 268 CG PRO A 341 -23.566 -5.226 4.166 1.00 0.00 C ATOM 269 CD PRO A 341 -22.125 -5.573 3.931 1.00 0.00 C ATOM 0 HA PRO A 341 -23.362 -4.261 1.266 1.00 0.00 H new ATOM 0 HB2 PRO A 341 -23.640 -3.093 4.010 1.00 0.00 H new ATOM 0 HB3 PRO A 341 -24.857 -3.924 3.062 1.00 0.00 H new ATOM 0 HG2 PRO A 341 -23.763 -5.077 5.228 1.00 0.00 H new ATOM 0 HG3 PRO A 341 -24.220 -6.030 3.830 1.00 0.00 H new ATOM 0 HD2 PRO A 341 -21.474 -5.117 4.677 1.00 0.00 H new ATOM 0 HD3 PRO A 341 -21.957 -6.649 3.976 1.00 0.00 H new ATOM 277 N PRO A 342 -22.707 -1.829 1.099 1.00 0.00 N ATOM 278 CA PRO A 342 -22.086 -0.550 0.719 1.00 0.00 C ATOM 279 C PRO A 342 -21.536 0.241 1.909 1.00 0.00 C ATOM 280 O PRO A 342 -20.383 0.681 1.889 1.00 0.00 O ATOM 281 CB PRO A 342 -23.227 0.225 0.039 1.00 0.00 C ATOM 282 CG PRO A 342 -24.446 -0.636 0.157 1.00 0.00 C ATOM 283 CD PRO A 342 -23.958 -2.039 0.367 1.00 0.00 C ATOM 0 HA PRO A 342 -21.219 -0.713 0.080 1.00 0.00 H new ATOM 0 HB2 PRO A 342 -23.384 1.190 0.522 1.00 0.00 H new ATOM 0 HB3 PRO A 342 -22.992 0.426 -1.006 1.00 0.00 H new ATOM 0 HG2 PRO A 342 -25.070 -0.313 0.991 1.00 0.00 H new ATOM 0 HG3 PRO A 342 -25.057 -0.569 -0.743 1.00 0.00 H new ATOM 0 HD2 PRO A 342 -24.669 -2.635 0.939 1.00 0.00 H new ATOM 0 HD3 PRO A 342 -23.794 -2.558 -0.577 1.00 0.00 H new ATOM 291 N GLU A 343 -22.353 0.391 2.946 1.00 0.00 N ATOM 292 CA GLU A 343 -21.971 1.143 4.139 1.00 0.00 C ATOM 293 C GLU A 343 -20.735 0.532 4.803 1.00 0.00 C ATOM 294 O GLU A 343 -19.761 1.226 5.087 1.00 0.00 O ATOM 295 CB GLU A 343 -23.144 1.167 5.121 1.00 0.00 C ATOM 296 CG GLU A 343 -22.901 1.996 6.370 1.00 0.00 C ATOM 297 CD GLU A 343 -24.079 1.948 7.320 1.00 0.00 C ATOM 298 OE1 GLU A 343 -24.234 0.930 8.031 1.00 0.00 O ATOM 299 OE2 GLU A 343 -24.868 2.917 7.352 1.00 0.00 O ATOM 0 H GLU A 343 -23.293 -0.002 2.985 1.00 0.00 H new ATOM 0 HA GLU A 343 -21.721 2.162 3.845 1.00 0.00 H new ATOM 0 HB2 GLU A 343 -24.024 1.555 4.608 1.00 0.00 H new ATOM 0 HB3 GLU A 343 -23.374 0.144 5.418 1.00 0.00 H new ATOM 0 HG2 GLU A 343 -22.009 1.631 6.880 1.00 0.00 H new ATOM 0 HG3 GLU A 343 -22.706 3.030 6.087 1.00 0.00 H new ATOM 306 N GLN A 344 -20.771 -0.775 5.023 1.00 0.00 N ATOM 307 CA GLN A 344 -19.668 -1.470 5.679 1.00 0.00 C ATOM 308 C GLN A 344 -18.475 -1.601 4.736 1.00 0.00 C ATOM 309 O GLN A 344 -17.321 -1.616 5.169 1.00 0.00 O ATOM 310 CB GLN A 344 -20.118 -2.855 6.144 1.00 0.00 C ATOM 311 CG GLN A 344 -19.084 -3.582 6.985 1.00 0.00 C ATOM 312 CD GLN A 344 -19.579 -4.924 7.484 1.00 0.00 C ATOM 313 OE1 GLN A 344 -20.777 -5.125 7.693 1.00 0.00 O ATOM 314 NE2 GLN A 344 -18.662 -5.852 7.685 1.00 0.00 N ATOM 0 H GLN A 344 -21.551 -1.377 4.758 1.00 0.00 H new ATOM 0 HA GLN A 344 -19.363 -0.884 6.546 1.00 0.00 H new ATOM 0 HB2 GLN A 344 -21.037 -2.754 6.721 1.00 0.00 H new ATOM 0 HB3 GLN A 344 -20.355 -3.462 5.271 1.00 0.00 H new ATOM 0 HG2 GLN A 344 -18.179 -3.729 6.395 1.00 0.00 H new ATOM 0 HG3 GLN A 344 -18.811 -2.960 7.837 1.00 0.00 H new ATOM 0 HE21 GLN A 344 -17.680 -5.647 7.500 1.00 0.00 H new ATOM 0 HE22 GLN A 344 -18.935 -6.774 8.025 1.00 0.00 H new ATOM 323 N ARG A 345 -18.765 -1.688 3.446 1.00 0.00 N ATOM 324 CA ARG A 345 -17.738 -1.842 2.430 1.00 0.00 C ATOM 325 C ARG A 345 -16.791 -0.649 2.447 1.00 0.00 C ATOM 326 O ARG A 345 -15.588 -0.807 2.632 1.00 0.00 O ATOM 327 CB ARG A 345 -18.382 -1.985 1.050 1.00 0.00 C ATOM 328 CG ARG A 345 -17.413 -2.416 -0.040 1.00 0.00 C ATOM 329 CD ARG A 345 -18.109 -2.532 -1.387 1.00 0.00 C ATOM 330 NE ARG A 345 -19.248 -3.449 -1.344 1.00 0.00 N ATOM 331 CZ ARG A 345 -20.031 -3.716 -2.389 1.00 0.00 C ATOM 332 NH1 ARG A 345 -19.800 -3.149 -3.566 1.00 0.00 N ATOM 333 NH2 ARG A 345 -21.049 -4.555 -2.253 1.00 0.00 N ATOM 0 H ARG A 345 -19.715 -1.654 3.077 1.00 0.00 H new ATOM 0 HA ARG A 345 -17.165 -2.743 2.647 1.00 0.00 H new ATOM 0 HB2 ARG A 345 -19.192 -2.712 1.111 1.00 0.00 H new ATOM 0 HB3 ARG A 345 -18.830 -1.032 0.768 1.00 0.00 H new ATOM 0 HG2 ARG A 345 -16.598 -1.695 -0.111 1.00 0.00 H new ATOM 0 HG3 ARG A 345 -16.968 -3.375 0.225 1.00 0.00 H new ATOM 0 HD2 ARG A 345 -18.450 -1.546 -1.704 1.00 0.00 H new ATOM 0 HD3 ARG A 345 -17.395 -2.877 -2.134 1.00 0.00 H new ATOM 0 HE ARG A 345 -19.456 -3.913 -0.460 1.00 0.00 H new ATOM 0 HH11 ARG A 345 -19.018 -2.503 -3.676 1.00 0.00 H new ATOM 0 HH12 ARG A 345 -20.404 -3.359 -4.361 1.00 0.00 H new ATOM 0 HH21 ARG A 345 -21.231 -4.994 -1.350 1.00 0.00 H new ATOM 0 HH22 ARG A 345 -21.650 -4.761 -3.051 1.00 0.00 H new ATOM 347 N ARG A 346 -17.347 0.549 2.286 1.00 0.00 N ATOM 348 CA ARG A 346 -16.544 1.770 2.294 1.00 0.00 C ATOM 349 C ARG A 346 -15.853 1.951 3.641 1.00 0.00 C ATOM 350 O ARG A 346 -14.752 2.499 3.715 1.00 0.00 O ATOM 351 CB ARG A 346 -17.407 2.996 1.977 1.00 0.00 C ATOM 352 CG ARG A 346 -18.549 3.199 2.956 1.00 0.00 C ATOM 353 CD ARG A 346 -19.300 4.490 2.695 1.00 0.00 C ATOM 354 NE ARG A 346 -20.321 4.724 3.712 1.00 0.00 N ATOM 355 CZ ARG A 346 -21.235 5.689 3.652 1.00 0.00 C ATOM 356 NH1 ARG A 346 -21.239 6.553 2.644 1.00 0.00 N ATOM 357 NH2 ARG A 346 -22.136 5.802 4.619 1.00 0.00 N ATOM 0 H ARG A 346 -18.346 0.701 2.149 1.00 0.00 H new ATOM 0 HA ARG A 346 -15.783 1.674 1.520 1.00 0.00 H new ATOM 0 HB2 ARG A 346 -16.776 3.885 1.977 1.00 0.00 H new ATOM 0 HB3 ARG A 346 -17.814 2.894 0.971 1.00 0.00 H new ATOM 0 HG2 ARG A 346 -19.239 2.358 2.887 1.00 0.00 H new ATOM 0 HG3 ARG A 346 -18.157 3.207 3.973 1.00 0.00 H new ATOM 0 HD2 ARG A 346 -18.599 5.325 2.681 1.00 0.00 H new ATOM 0 HD3 ARG A 346 -19.767 4.449 1.711 1.00 0.00 H new ATOM 0 HE ARG A 346 -20.335 4.106 4.523 1.00 0.00 H new ATOM 0 HH11 ARG A 346 -20.537 6.480 1.907 1.00 0.00 H new ATOM 0 HH12 ARG A 346 -21.944 7.290 2.606 1.00 0.00 H new ATOM 0 HH21 ARG A 346 -22.126 5.151 5.404 1.00 0.00 H new ATOM 0 HH22 ARG A 346 -22.839 6.540 4.578 1.00 0.00 H new ATOM 371 N LYS A 347 -16.501 1.466 4.696 1.00 0.00 N ATOM 372 CA LYS A 347 -15.953 1.542 6.040 1.00 0.00 C ATOM 373 C LYS A 347 -14.641 0.768 6.119 1.00 0.00 C ATOM 374 O LYS A 347 -13.636 1.274 6.623 1.00 0.00 O ATOM 375 CB LYS A 347 -16.966 0.981 7.043 1.00 0.00 C ATOM 376 CG LYS A 347 -16.576 1.160 8.500 1.00 0.00 C ATOM 377 CD LYS A 347 -17.585 0.493 9.422 1.00 0.00 C ATOM 378 CE LYS A 347 -17.280 0.758 10.888 1.00 0.00 C ATOM 379 NZ LYS A 347 -17.392 2.199 11.231 1.00 0.00 N ATOM 0 H LYS A 347 -17.413 1.013 4.641 1.00 0.00 H new ATOM 0 HA LYS A 347 -15.752 2.585 6.286 1.00 0.00 H new ATOM 0 HB2 LYS A 347 -17.929 1.464 6.876 1.00 0.00 H new ATOM 0 HB3 LYS A 347 -17.104 -0.082 6.845 1.00 0.00 H new ATOM 0 HG2 LYS A 347 -15.587 0.735 8.670 1.00 0.00 H new ATOM 0 HG3 LYS A 347 -16.511 2.222 8.735 1.00 0.00 H new ATOM 0 HD2 LYS A 347 -18.585 0.857 9.188 1.00 0.00 H new ATOM 0 HD3 LYS A 347 -17.587 -0.582 9.241 1.00 0.00 H new ATOM 0 HE2 LYS A 347 -17.966 0.183 11.510 1.00 0.00 H new ATOM 0 HE3 LYS A 347 -16.273 0.409 11.117 1.00 0.00 H new ATOM 0 HZ1 LYS A 347 -17.412 2.309 12.265 1.00 0.00 H new ATOM 0 HZ2 LYS A 347 -16.575 2.713 10.844 1.00 0.00 H new ATOM 0 HZ3 LYS A 347 -18.268 2.586 10.825 1.00 0.00 H new ATOM 393 N ARG A 348 -14.653 -0.452 5.596 1.00 0.00 N ATOM 394 CA ARG A 348 -13.457 -1.284 5.557 1.00 0.00 C ATOM 395 C ARG A 348 -12.441 -0.732 4.566 1.00 0.00 C ATOM 396 O ARG A 348 -11.244 -0.716 4.845 1.00 0.00 O ATOM 397 CB ARG A 348 -13.811 -2.725 5.191 1.00 0.00 C ATOM 398 CG ARG A 348 -14.437 -3.512 6.330 1.00 0.00 C ATOM 399 CD ARG A 348 -13.477 -3.646 7.501 1.00 0.00 C ATOM 400 NE ARG A 348 -13.954 -4.595 8.503 1.00 0.00 N ATOM 401 CZ ARG A 348 -13.361 -4.798 9.677 1.00 0.00 C ATOM 402 NH1 ARG A 348 -12.311 -4.064 10.030 1.00 0.00 N ATOM 403 NH2 ARG A 348 -13.829 -5.719 10.509 1.00 0.00 N ATOM 0 H ARG A 348 -15.481 -0.888 5.191 1.00 0.00 H new ATOM 0 HA ARG A 348 -13.013 -1.273 6.552 1.00 0.00 H new ATOM 0 HB2 ARG A 348 -14.500 -2.716 4.346 1.00 0.00 H new ATOM 0 HB3 ARG A 348 -12.908 -3.238 4.861 1.00 0.00 H new ATOM 0 HG2 ARG A 348 -15.349 -3.015 6.660 1.00 0.00 H new ATOM 0 HG3 ARG A 348 -14.723 -4.502 5.976 1.00 0.00 H new ATOM 0 HD2 ARG A 348 -12.502 -3.968 7.134 1.00 0.00 H new ATOM 0 HD3 ARG A 348 -13.336 -2.670 7.966 1.00 0.00 H new ATOM 0 HE ARG A 348 -14.793 -5.135 8.290 1.00 0.00 H new ATOM 0 HH11 ARG A 348 -11.958 -3.343 9.401 1.00 0.00 H new ATOM 0 HH12 ARG A 348 -11.858 -4.221 10.930 1.00 0.00 H new ATOM 0 HH21 ARG A 348 -14.645 -6.273 10.249 1.00 0.00 H new ATOM 0 HH22 ARG A 348 -13.373 -5.873 11.408 1.00 0.00 H new ATOM 417 N LEU A 349 -12.926 -0.275 3.417 1.00 0.00 N ATOM 418 CA LEU A 349 -12.066 0.289 2.379 1.00 0.00 C ATOM 419 C LEU A 349 -11.238 1.452 2.918 1.00 0.00 C ATOM 420 O LEU A 349 -10.042 1.550 2.646 1.00 0.00 O ATOM 421 CB LEU A 349 -12.907 0.749 1.184 1.00 0.00 C ATOM 422 CG LEU A 349 -13.073 -0.270 0.048 1.00 0.00 C ATOM 423 CD1 LEU A 349 -13.503 -1.630 0.576 1.00 0.00 C ATOM 424 CD2 LEU A 349 -14.083 0.239 -0.965 1.00 0.00 C ATOM 0 H LEU A 349 -13.918 -0.284 3.178 1.00 0.00 H new ATOM 0 HA LEU A 349 -11.379 -0.492 2.052 1.00 0.00 H new ATOM 0 HB2 LEU A 349 -13.897 1.025 1.546 1.00 0.00 H new ATOM 0 HB3 LEU A 349 -12.455 1.652 0.773 1.00 0.00 H new ATOM 0 HG LEU A 349 -12.104 -0.391 -0.437 1.00 0.00 H new ATOM 0 HD11 LEU A 349 -13.611 -2.326 -0.256 1.00 0.00 H new ATOM 0 HD12 LEU A 349 -12.750 -2.006 1.269 1.00 0.00 H new ATOM 0 HD13 LEU A 349 -14.457 -1.534 1.094 1.00 0.00 H new ATOM 0 HD21 LEU A 349 -14.194 -0.491 -1.767 1.00 0.00 H new ATOM 0 HD22 LEU A 349 -15.045 0.389 -0.476 1.00 0.00 H new ATOM 0 HD23 LEU A 349 -13.736 1.185 -1.381 1.00 0.00 H new ATOM 436 N GLN A 350 -11.872 2.324 3.696 1.00 0.00 N ATOM 437 CA GLN A 350 -11.173 3.453 4.302 1.00 0.00 C ATOM 438 C GLN A 350 -10.086 2.977 5.256 1.00 0.00 C ATOM 439 O GLN A 350 -8.990 3.537 5.286 1.00 0.00 O ATOM 440 CB GLN A 350 -12.156 4.362 5.040 1.00 0.00 C ATOM 441 CG GLN A 350 -12.968 5.252 4.115 1.00 0.00 C ATOM 442 CD GLN A 350 -12.108 6.265 3.386 1.00 0.00 C ATOM 443 OE1 GLN A 350 -11.614 5.894 2.216 1.00 0.00 O flip ATOM 444 NE2 GLN A 350 -11.890 7.375 3.870 1.00 0.00 N flip ATOM 0 H GLN A 350 -12.865 2.271 3.921 1.00 0.00 H new ATOM 0 HA GLN A 350 -10.702 4.021 3.500 1.00 0.00 H new ATOM 0 HB2 GLN A 350 -12.836 3.747 5.629 1.00 0.00 H new ATOM 0 HB3 GLN A 350 -11.604 4.988 5.741 1.00 0.00 H new ATOM 0 HG2 GLN A 350 -13.492 4.633 3.387 1.00 0.00 H new ATOM 0 HG3 GLN A 350 -13.729 5.775 4.694 1.00 0.00 H new ATOM 0 HE21 GLN A 350 -12.289 7.624 4.775 1.00 0.00 H new ATOM 0 HE22 GLN A 350 -11.310 8.046 3.366 1.00 0.00 H new ATOM 453 N GLN A 351 -10.388 1.934 6.021 1.00 0.00 N ATOM 454 CA GLN A 351 -9.430 1.373 6.966 1.00 0.00 C ATOM 455 C GLN A 351 -8.293 0.674 6.230 1.00 0.00 C ATOM 456 O GLN A 351 -7.138 0.740 6.651 1.00 0.00 O ATOM 457 CB GLN A 351 -10.120 0.394 7.916 1.00 0.00 C ATOM 458 CG GLN A 351 -11.160 1.048 8.811 1.00 0.00 C ATOM 459 CD GLN A 351 -11.793 0.075 9.785 1.00 0.00 C ATOM 460 OE1 GLN A 351 -11.927 -1.117 9.502 1.00 0.00 O ATOM 461 NE2 GLN A 351 -12.195 0.579 10.940 1.00 0.00 N ATOM 0 H GLN A 351 -11.291 1.459 6.005 1.00 0.00 H new ATOM 0 HA GLN A 351 -9.014 2.193 7.551 1.00 0.00 H new ATOM 0 HB2 GLN A 351 -10.598 -0.392 7.331 1.00 0.00 H new ATOM 0 HB3 GLN A 351 -9.366 -0.087 8.540 1.00 0.00 H new ATOM 0 HG2 GLN A 351 -10.694 1.861 9.368 1.00 0.00 H new ATOM 0 HG3 GLN A 351 -11.939 1.492 8.191 1.00 0.00 H new ATOM 0 HE21 GLN A 351 -12.066 1.572 11.136 1.00 0.00 H new ATOM 0 HE22 GLN A 351 -12.634 -0.025 11.635 1.00 0.00 H new ATOM 470 N ARG A 352 -8.626 0.004 5.131 1.00 0.00 N ATOM 471 CA ARG A 352 -7.622 -0.645 4.298 1.00 0.00 C ATOM 472 C ARG A 352 -6.682 0.393 3.701 1.00 0.00 C ATOM 473 O ARG A 352 -5.464 0.282 3.829 1.00 0.00 O ATOM 474 CB ARG A 352 -8.275 -1.457 3.172 1.00 0.00 C ATOM 475 CG ARG A 352 -9.112 -2.643 3.642 1.00 0.00 C ATOM 476 CD ARG A 352 -8.286 -3.658 4.423 1.00 0.00 C ATOM 477 NE ARG A 352 -8.119 -3.280 5.829 1.00 0.00 N ATOM 478 CZ ARG A 352 -6.956 -3.299 6.481 1.00 0.00 C ATOM 479 NH1 ARG A 352 -5.840 -3.638 5.852 1.00 0.00 N ATOM 480 NH2 ARG A 352 -6.908 -2.973 7.768 1.00 0.00 N ATOM 0 H ARG A 352 -9.584 -0.103 4.797 1.00 0.00 H new ATOM 0 HA ARG A 352 -7.055 -1.327 4.931 1.00 0.00 H new ATOM 0 HB2 ARG A 352 -8.909 -0.793 2.585 1.00 0.00 H new ATOM 0 HB3 ARG A 352 -7.493 -1.823 2.506 1.00 0.00 H new ATOM 0 HG2 ARG A 352 -9.929 -2.284 4.268 1.00 0.00 H new ATOM 0 HG3 ARG A 352 -9.563 -3.132 2.779 1.00 0.00 H new ATOM 0 HD2 ARG A 352 -8.768 -4.634 4.367 1.00 0.00 H new ATOM 0 HD3 ARG A 352 -7.305 -3.759 3.958 1.00 0.00 H new ATOM 0 HE ARG A 352 -8.948 -2.982 6.343 1.00 0.00 H new ATOM 0 HH11 ARG A 352 -5.867 -3.886 4.863 1.00 0.00 H new ATOM 0 HH12 ARG A 352 -4.954 -3.650 6.357 1.00 0.00 H new ATOM 0 HH21 ARG A 352 -7.762 -2.708 8.259 1.00 0.00 H new ATOM 0 HH22 ARG A 352 -6.017 -2.988 8.265 1.00 0.00 H new ATOM 494 N ILE A 353 -7.257 1.410 3.065 1.00 0.00 N ATOM 495 CA ILE A 353 -6.474 2.486 2.467 1.00 0.00 C ATOM 496 C ILE A 353 -5.609 3.172 3.512 1.00 0.00 C ATOM 497 O ILE A 353 -4.424 3.405 3.286 1.00 0.00 O ATOM 498 CB ILE A 353 -7.375 3.537 1.783 1.00 0.00 C ATOM 499 CG1 ILE A 353 -8.088 2.918 0.584 1.00 0.00 C ATOM 500 CG2 ILE A 353 -6.560 4.752 1.348 1.00 0.00 C ATOM 501 CD1 ILE A 353 -9.046 3.864 -0.099 1.00 0.00 C ATOM 0 H ILE A 353 -8.266 1.511 2.951 1.00 0.00 H new ATOM 0 HA ILE A 353 -5.836 2.030 1.710 1.00 0.00 H new ATOM 0 HB ILE A 353 -8.122 3.870 2.504 1.00 0.00 H new ATOM 0 HG12 ILE A 353 -7.344 2.583 -0.138 1.00 0.00 H new ATOM 0 HG13 ILE A 353 -8.635 2.034 0.913 1.00 0.00 H new ATOM 0 HG21 ILE A 353 -7.217 5.478 0.869 1.00 0.00 H new ATOM 0 HG22 ILE A 353 -6.091 5.207 2.221 1.00 0.00 H new ATOM 0 HG23 ILE A 353 -5.789 4.440 0.643 1.00 0.00 H new ATOM 0 HD11 ILE A 353 -9.517 3.359 -0.942 1.00 0.00 H new ATOM 0 HD12 ILE A 353 -9.812 4.180 0.609 1.00 0.00 H new ATOM 0 HD13 ILE A 353 -8.501 4.737 -0.458 1.00 0.00 H new ATOM 513 N ASP A 354 -6.200 3.475 4.660 1.00 0.00 N ATOM 514 CA ASP A 354 -5.484 4.154 5.735 1.00 0.00 C ATOM 515 C ASP A 354 -4.272 3.342 6.173 1.00 0.00 C ATOM 516 O ASP A 354 -3.177 3.881 6.334 1.00 0.00 O ATOM 517 CB ASP A 354 -6.404 4.390 6.934 1.00 0.00 C ATOM 518 CG ASP A 354 -5.721 5.177 8.033 1.00 0.00 C ATOM 519 OD1 ASP A 354 -5.686 6.421 7.942 1.00 0.00 O ATOM 520 OD2 ASP A 354 -5.204 4.559 8.982 1.00 0.00 O ATOM 0 H ASP A 354 -7.175 3.262 4.872 1.00 0.00 H new ATOM 0 HA ASP A 354 -5.146 5.117 5.353 1.00 0.00 H new ATOM 0 HB2 ASP A 354 -7.295 4.925 6.606 1.00 0.00 H new ATOM 0 HB3 ASP A 354 -6.736 3.430 7.329 1.00 0.00 H new ATOM 525 N GLU A 355 -4.478 2.044 6.344 1.00 0.00 N ATOM 526 CA GLU A 355 -3.419 1.139 6.764 1.00 0.00 C ATOM 527 C GLU A 355 -2.343 1.022 5.687 1.00 0.00 C ATOM 528 O GLU A 355 -1.150 1.146 5.965 1.00 0.00 O ATOM 529 CB GLU A 355 -4.012 -0.239 7.065 1.00 0.00 C ATOM 530 CG GLU A 355 -2.998 -1.246 7.575 1.00 0.00 C ATOM 531 CD GLU A 355 -3.646 -2.532 8.034 1.00 0.00 C ATOM 532 OE1 GLU A 355 -4.194 -2.561 9.155 1.00 0.00 O ATOM 533 OE2 GLU A 355 -3.624 -3.518 7.274 1.00 0.00 O ATOM 0 H GLU A 355 -5.380 1.591 6.196 1.00 0.00 H new ATOM 0 HA GLU A 355 -2.955 1.540 7.665 1.00 0.00 H new ATOM 0 HB2 GLU A 355 -4.804 -0.129 7.805 1.00 0.00 H new ATOM 0 HB3 GLU A 355 -4.474 -0.631 6.159 1.00 0.00 H new ATOM 0 HG2 GLU A 355 -2.279 -1.466 6.786 1.00 0.00 H new ATOM 0 HG3 GLU A 355 -2.439 -0.808 8.402 1.00 0.00 H new ATOM 540 N LEU A 356 -2.779 0.806 4.458 1.00 0.00 N ATOM 541 CA LEU A 356 -1.867 0.605 3.343 1.00 0.00 C ATOM 542 C LEU A 356 -1.091 1.875 3.015 1.00 0.00 C ATOM 543 O LEU A 356 0.093 1.812 2.702 1.00 0.00 O ATOM 544 CB LEU A 356 -2.642 0.115 2.123 1.00 0.00 C ATOM 545 CG LEU A 356 -3.226 -1.287 2.269 1.00 0.00 C ATOM 546 CD1 LEU A 356 -4.246 -1.556 1.178 1.00 0.00 C ATOM 547 CD2 LEU A 356 -2.114 -2.327 2.233 1.00 0.00 C ATOM 0 H LEU A 356 -3.766 0.765 4.205 1.00 0.00 H new ATOM 0 HA LEU A 356 -1.138 -0.152 3.632 1.00 0.00 H new ATOM 0 HB2 LEU A 356 -3.453 0.814 1.918 1.00 0.00 H new ATOM 0 HB3 LEU A 356 -1.981 0.132 1.257 1.00 0.00 H new ATOM 0 HG LEU A 356 -3.732 -1.354 3.232 1.00 0.00 H new ATOM 0 HD11 LEU A 356 -4.651 -2.561 1.299 1.00 0.00 H new ATOM 0 HD12 LEU A 356 -5.054 -0.828 1.248 1.00 0.00 H new ATOM 0 HD13 LEU A 356 -3.766 -1.473 0.203 1.00 0.00 H new ATOM 0 HD21 LEU A 356 -2.544 -3.323 2.338 1.00 0.00 H new ATOM 0 HD22 LEU A 356 -1.583 -2.259 1.283 1.00 0.00 H new ATOM 0 HD23 LEU A 356 -1.418 -2.144 3.052 1.00 0.00 H new ATOM 559 N SER A 357 -1.752 3.023 3.097 1.00 0.00 N ATOM 560 CA SER A 357 -1.089 4.299 2.853 1.00 0.00 C ATOM 561 C SER A 357 -0.124 4.613 3.990 1.00 0.00 C ATOM 562 O SER A 357 0.908 5.251 3.790 1.00 0.00 O ATOM 563 CB SER A 357 -2.119 5.421 2.706 1.00 0.00 C ATOM 564 OG SER A 357 -3.069 5.109 1.700 1.00 0.00 O ATOM 0 H SER A 357 -2.742 3.097 3.330 1.00 0.00 H new ATOM 0 HA SER A 357 -0.526 4.226 1.923 1.00 0.00 H new ATOM 0 HB2 SER A 357 -2.629 5.579 3.656 1.00 0.00 H new ATOM 0 HB3 SER A 357 -1.613 6.354 2.457 1.00 0.00 H new ATOM 0 HG SER A 357 -3.795 4.578 2.089 1.00 0.00 H new ATOM 570 N ARG A 358 -0.468 4.146 5.183 1.00 0.00 N ATOM 571 CA ARG A 358 0.388 4.295 6.351 1.00 0.00 C ATOM 572 C ARG A 358 1.676 3.509 6.150 1.00 0.00 C ATOM 573 O ARG A 358 2.775 4.002 6.412 1.00 0.00 O ATOM 574 CB ARG A 358 -0.339 3.787 7.582 1.00 0.00 C ATOM 575 CG ARG A 358 0.062 4.492 8.858 1.00 0.00 C ATOM 576 CD ARG A 358 -0.543 3.790 10.048 1.00 0.00 C ATOM 577 NE ARG A 358 -1.999 3.676 9.944 1.00 0.00 N ATOM 578 CZ ARG A 358 -2.702 2.657 10.440 1.00 0.00 C ATOM 579 NH1 ARG A 358 -2.088 1.670 11.080 1.00 0.00 N ATOM 580 NH2 ARG A 358 -4.020 2.621 10.290 1.00 0.00 N ATOM 0 H ARG A 358 -1.343 3.656 5.367 1.00 0.00 H new ATOM 0 HA ARG A 358 0.632 5.349 6.487 1.00 0.00 H new ATOM 0 HB2 ARG A 358 -1.412 3.905 7.434 1.00 0.00 H new ATOM 0 HB3 ARG A 358 -0.148 2.719 7.691 1.00 0.00 H new ATOM 0 HG2 ARG A 358 1.148 4.508 8.948 1.00 0.00 H new ATOM 0 HG3 ARG A 358 -0.271 5.530 8.830 1.00 0.00 H new ATOM 0 HD2 ARG A 358 -0.108 2.795 10.140 1.00 0.00 H new ATOM 0 HD3 ARG A 358 -0.287 4.334 10.957 1.00 0.00 H new ATOM 0 HE ARG A 358 -2.506 4.420 9.464 1.00 0.00 H new ATOM 0 HH11 ARG A 358 -1.075 1.689 11.194 1.00 0.00 H new ATOM 0 HH12 ARG A 358 -2.629 0.893 11.458 1.00 0.00 H new ATOM 0 HH21 ARG A 358 -4.498 3.374 9.794 1.00 0.00 H new ATOM 0 HH22 ARG A 358 -4.555 1.841 10.670 1.00 0.00 H new ATOM 594 N GLU A 359 1.517 2.280 5.671 1.00 0.00 N ATOM 595 CA GLU A 359 2.642 1.409 5.361 1.00 0.00 C ATOM 596 C GLU A 359 3.425 1.977 4.178 1.00 0.00 C ATOM 597 O GLU A 359 4.656 1.954 4.153 1.00 0.00 O ATOM 598 CB GLU A 359 2.125 0.004 5.029 1.00 0.00 C ATOM 599 CG GLU A 359 3.189 -1.078 5.084 1.00 0.00 C ATOM 600 CD GLU A 359 3.708 -1.313 6.490 1.00 0.00 C ATOM 601 OE1 GLU A 359 3.021 -1.999 7.276 1.00 0.00 O ATOM 602 OE2 GLU A 359 4.802 -0.818 6.817 1.00 0.00 O ATOM 0 H GLU A 359 0.605 1.861 5.487 1.00 0.00 H new ATOM 0 HA GLU A 359 3.305 1.349 6.224 1.00 0.00 H new ATOM 0 HB2 GLU A 359 1.326 -0.251 5.725 1.00 0.00 H new ATOM 0 HB3 GLU A 359 1.686 0.016 4.031 1.00 0.00 H new ATOM 0 HG2 GLU A 359 2.777 -2.008 4.692 1.00 0.00 H new ATOM 0 HG3 GLU A 359 4.020 -0.799 4.436 1.00 0.00 H new ATOM 609 N LEU A 360 2.683 2.503 3.208 1.00 0.00 N ATOM 610 CA LEU A 360 3.262 3.106 2.014 1.00 0.00 C ATOM 611 C LEU A 360 4.153 4.286 2.383 1.00 0.00 C ATOM 612 O LEU A 360 5.275 4.405 1.895 1.00 0.00 O ATOM 613 CB LEU A 360 2.146 3.575 1.077 1.00 0.00 C ATOM 614 CG LEU A 360 2.602 4.060 -0.297 1.00 0.00 C ATOM 615 CD1 LEU A 360 3.102 2.898 -1.136 1.00 0.00 C ATOM 616 CD2 LEU A 360 1.473 4.788 -1.006 1.00 0.00 C ATOM 0 H LEU A 360 1.663 2.523 3.228 1.00 0.00 H new ATOM 0 HA LEU A 360 3.871 2.356 1.509 1.00 0.00 H new ATOM 0 HB2 LEU A 360 1.443 2.754 0.938 1.00 0.00 H new ATOM 0 HB3 LEU A 360 1.601 4.382 1.565 1.00 0.00 H new ATOM 0 HG LEU A 360 3.427 4.759 -0.159 1.00 0.00 H new ATOM 0 HD11 LEU A 360 3.422 3.265 -2.111 1.00 0.00 H new ATOM 0 HD12 LEU A 360 3.944 2.422 -0.633 1.00 0.00 H new ATOM 0 HD13 LEU A 360 2.300 2.172 -1.267 1.00 0.00 H new ATOM 0 HD21 LEU A 360 1.816 5.127 -1.984 1.00 0.00 H new ATOM 0 HD22 LEU A 360 0.627 4.112 -1.132 1.00 0.00 H new ATOM 0 HD23 LEU A 360 1.165 5.648 -0.412 1.00 0.00 H new ATOM 628 N GLN A 361 3.643 5.147 3.260 1.00 0.00 N ATOM 629 CA GLN A 361 4.377 6.323 3.720 1.00 0.00 C ATOM 630 C GLN A 361 5.732 5.930 4.301 1.00 0.00 C ATOM 631 O GLN A 361 6.716 6.661 4.172 1.00 0.00 O ATOM 632 CB GLN A 361 3.551 7.069 4.773 1.00 0.00 C ATOM 633 CG GLN A 361 4.208 8.337 5.298 1.00 0.00 C ATOM 634 CD GLN A 361 4.300 9.435 4.255 1.00 0.00 C ATOM 635 OE1 GLN A 361 4.394 9.172 3.056 1.00 0.00 O ATOM 636 NE2 GLN A 361 4.278 10.676 4.705 1.00 0.00 N ATOM 0 H GLN A 361 2.714 5.050 3.670 1.00 0.00 H new ATOM 0 HA GLN A 361 4.551 6.977 2.865 1.00 0.00 H new ATOM 0 HB2 GLN A 361 2.583 7.326 4.344 1.00 0.00 H new ATOM 0 HB3 GLN A 361 3.360 6.398 5.611 1.00 0.00 H new ATOM 0 HG2 GLN A 361 3.643 8.704 6.155 1.00 0.00 H new ATOM 0 HG3 GLN A 361 5.210 8.099 5.656 1.00 0.00 H new ATOM 0 HE21 GLN A 361 4.199 10.854 5.706 1.00 0.00 H new ATOM 0 HE22 GLN A 361 4.340 11.457 4.051 1.00 0.00 H new ATOM 645 N LYS A 362 5.775 4.766 4.930 1.00 0.00 N ATOM 646 CA LYS A 362 7.003 4.259 5.516 1.00 0.00 C ATOM 647 C LYS A 362 8.011 3.890 4.438 1.00 0.00 C ATOM 648 O LYS A 362 9.144 4.374 4.445 1.00 0.00 O ATOM 649 CB LYS A 362 6.716 3.036 6.379 1.00 0.00 C ATOM 650 CG LYS A 362 5.870 3.327 7.606 1.00 0.00 C ATOM 651 CD LYS A 362 5.418 2.043 8.283 1.00 0.00 C ATOM 652 CE LYS A 362 6.597 1.164 8.670 1.00 0.00 C ATOM 653 NZ LYS A 362 6.157 -0.182 9.108 1.00 0.00 N ATOM 0 H LYS A 362 4.968 4.153 5.047 1.00 0.00 H new ATOM 0 HA LYS A 362 7.425 5.050 6.136 1.00 0.00 H new ATOM 0 HB2 LYS A 362 6.209 2.287 5.771 1.00 0.00 H new ATOM 0 HB3 LYS A 362 7.663 2.600 6.699 1.00 0.00 H new ATOM 0 HG2 LYS A 362 6.443 3.930 8.311 1.00 0.00 H new ATOM 0 HG3 LYS A 362 4.999 3.915 7.318 1.00 0.00 H new ATOM 0 HD2 LYS A 362 4.838 2.286 9.173 1.00 0.00 H new ATOM 0 HD3 LYS A 362 4.758 1.492 7.613 1.00 0.00 H new ATOM 0 HE2 LYS A 362 7.273 1.067 7.820 1.00 0.00 H new ATOM 0 HE3 LYS A 362 7.159 1.642 9.472 1.00 0.00 H new ATOM 0 HZ1 LYS A 362 6.983 -0.809 9.185 1.00 0.00 H new ATOM 0 HZ2 LYS A 362 5.690 -0.110 10.034 1.00 0.00 H new ATOM 0 HZ3 LYS A 362 5.489 -0.572 8.413 1.00 0.00 H new ATOM 667 N GLU A 363 7.593 3.048 3.503 1.00 0.00 N ATOM 668 CA GLU A 363 8.517 2.493 2.527 1.00 0.00 C ATOM 669 C GLU A 363 8.833 3.477 1.401 1.00 0.00 C ATOM 670 O GLU A 363 9.897 3.392 0.796 1.00 0.00 O ATOM 671 CB GLU A 363 8.000 1.158 1.987 1.00 0.00 C ATOM 672 CG GLU A 363 7.849 0.115 3.085 1.00 0.00 C ATOM 673 CD GLU A 363 7.819 -1.311 2.575 1.00 0.00 C ATOM 674 OE1 GLU A 363 8.887 -1.825 2.171 1.00 0.00 O ATOM 675 OE2 GLU A 363 6.746 -1.948 2.635 1.00 0.00 O ATOM 0 H GLU A 363 6.627 2.737 3.401 1.00 0.00 H new ATOM 0 HA GLU A 363 9.459 2.305 3.041 1.00 0.00 H new ATOM 0 HB2 GLU A 363 7.037 1.313 1.500 1.00 0.00 H new ATOM 0 HB3 GLU A 363 8.686 0.786 1.226 1.00 0.00 H new ATOM 0 HG2 GLU A 363 8.674 0.221 3.790 1.00 0.00 H new ATOM 0 HG3 GLU A 363 6.930 0.313 3.637 1.00 0.00 H new ATOM 682 N MET A 364 7.935 4.419 1.127 1.00 0.00 N ATOM 683 CA MET A 364 8.238 5.472 0.157 1.00 0.00 C ATOM 684 C MET A 364 9.361 6.355 0.688 1.00 0.00 C ATOM 685 O MET A 364 10.302 6.693 -0.035 1.00 0.00 O ATOM 686 CB MET A 364 7.009 6.329 -0.157 1.00 0.00 C ATOM 687 CG MET A 364 5.936 5.599 -0.949 1.00 0.00 C ATOM 688 SD MET A 364 4.643 6.703 -1.559 1.00 0.00 S ATOM 689 CE MET A 364 4.052 7.432 -0.031 1.00 0.00 C ATOM 0 H MET A 364 7.009 4.478 1.552 1.00 0.00 H new ATOM 0 HA MET A 364 8.552 4.990 -0.769 1.00 0.00 H new ATOM 0 HB2 MET A 364 6.578 6.685 0.779 1.00 0.00 H new ATOM 0 HB3 MET A 364 7.325 7.209 -0.717 1.00 0.00 H new ATOM 0 HG2 MET A 364 6.399 5.088 -1.793 1.00 0.00 H new ATOM 0 HG3 MET A 364 5.485 4.832 -0.320 1.00 0.00 H new ATOM 0 HE1 MET A 364 3.086 7.907 -0.204 1.00 0.00 H new ATOM 0 HE2 MET A 364 3.944 6.654 0.725 1.00 0.00 H new ATOM 0 HE3 MET A 364 4.766 8.179 0.316 1.00 0.00 H new ATOM 699 N ASP A 365 9.258 6.708 1.963 1.00 0.00 N ATOM 700 CA ASP A 365 10.302 7.465 2.638 1.00 0.00 C ATOM 701 C ASP A 365 11.575 6.635 2.719 1.00 0.00 C ATOM 702 O ASP A 365 12.673 7.127 2.444 1.00 0.00 O ATOM 703 CB ASP A 365 9.844 7.856 4.045 1.00 0.00 C ATOM 704 CG ASP A 365 10.920 8.578 4.829 1.00 0.00 C ATOM 705 OD1 ASP A 365 11.028 9.816 4.700 1.00 0.00 O ATOM 706 OD2 ASP A 365 11.654 7.914 5.589 1.00 0.00 O ATOM 0 H ASP A 365 8.457 6.480 2.552 1.00 0.00 H new ATOM 0 HA ASP A 365 10.504 8.372 2.068 1.00 0.00 H new ATOM 0 HB2 ASP A 365 8.963 8.494 3.972 1.00 0.00 H new ATOM 0 HB3 ASP A 365 9.544 6.959 4.588 1.00 0.00 H new ATOM 711 N GLN A 366 11.405 5.366 3.080 1.00 0.00 N ATOM 712 CA GLN A 366 12.517 4.433 3.201 1.00 0.00 C ATOM 713 C GLN A 366 13.270 4.300 1.881 1.00 0.00 C ATOM 714 O GLN A 366 14.498 4.254 1.870 1.00 0.00 O ATOM 715 CB GLN A 366 12.013 3.058 3.647 1.00 0.00 C ATOM 716 CG GLN A 366 13.119 2.031 3.849 1.00 0.00 C ATOM 717 CD GLN A 366 14.092 2.426 4.940 1.00 0.00 C ATOM 718 OE1 GLN A 366 13.906 2.087 6.110 1.00 0.00 O ATOM 719 NE2 GLN A 366 15.135 3.150 4.567 1.00 0.00 N ATOM 0 H GLN A 366 10.495 4.958 3.296 1.00 0.00 H new ATOM 0 HA GLN A 366 13.202 4.827 3.952 1.00 0.00 H new ATOM 0 HB2 GLN A 366 11.460 3.170 4.579 1.00 0.00 H new ATOM 0 HB3 GLN A 366 11.311 2.680 2.903 1.00 0.00 H new ATOM 0 HG2 GLN A 366 12.674 1.068 4.097 1.00 0.00 H new ATOM 0 HG3 GLN A 366 13.663 1.900 2.913 1.00 0.00 H new ATOM 0 HE21 GLN A 366 15.252 3.409 3.587 1.00 0.00 H new ATOM 0 HE22 GLN A 366 15.822 3.449 5.259 1.00 0.00 H new ATOM 728 N LYS A 367 12.533 4.236 0.775 1.00 0.00 N ATOM 729 CA LYS A 367 13.152 4.107 -0.536 1.00 0.00 C ATOM 730 C LYS A 367 14.040 5.300 -0.823 1.00 0.00 C ATOM 731 O LYS A 367 15.210 5.140 -1.141 1.00 0.00 O ATOM 732 CB LYS A 367 12.105 3.980 -1.641 1.00 0.00 C ATOM 733 CG LYS A 367 12.724 3.703 -2.999 1.00 0.00 C ATOM 734 CD LYS A 367 11.696 3.715 -4.104 1.00 0.00 C ATOM 735 CE LYS A 367 12.378 3.781 -5.453 1.00 0.00 C ATOM 736 NZ LYS A 367 13.060 5.084 -5.665 1.00 0.00 N ATOM 0 H LYS A 367 11.514 4.271 0.762 1.00 0.00 H new ATOM 0 HA LYS A 367 13.753 3.198 -0.522 1.00 0.00 H new ATOM 0 HB2 LYS A 367 11.412 3.177 -1.390 1.00 0.00 H new ATOM 0 HB3 LYS A 367 11.522 4.899 -1.692 1.00 0.00 H new ATOM 0 HG2 LYS A 367 13.489 4.451 -3.208 1.00 0.00 H new ATOM 0 HG3 LYS A 367 13.223 2.734 -2.979 1.00 0.00 H new ATOM 0 HD2 LYS A 367 11.078 2.819 -4.045 1.00 0.00 H new ATOM 0 HD3 LYS A 367 11.031 4.570 -3.983 1.00 0.00 H new ATOM 0 HE2 LYS A 367 13.106 2.973 -5.532 1.00 0.00 H new ATOM 0 HE3 LYS A 367 11.641 3.624 -6.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 367 13.353 5.165 -6.660 1.00 0.00 H new ATOM 0 HZ2 LYS A 367 12.407 5.859 -5.432 1.00 0.00 H new ATOM 0 HZ3 LYS A 367 13.898 5.141 -5.052 1.00 0.00 H new ATOM 750 N ASP A 368 13.480 6.493 -0.689 1.00 0.00 N ATOM 751 CA ASP A 368 14.220 7.724 -0.953 1.00 0.00 C ATOM 752 C ASP A 368 15.431 7.834 -0.028 1.00 0.00 C ATOM 753 O ASP A 368 16.463 8.394 -0.400 1.00 0.00 O ATOM 754 CB ASP A 368 13.303 8.934 -0.768 1.00 0.00 C ATOM 755 CG ASP A 368 13.983 10.241 -1.111 1.00 0.00 C ATOM 756 OD1 ASP A 368 14.186 10.512 -2.314 1.00 0.00 O ATOM 757 OD2 ASP A 368 14.295 11.014 -0.180 1.00 0.00 O ATOM 0 H ASP A 368 12.513 6.638 -0.398 1.00 0.00 H new ATOM 0 HA ASP A 368 14.576 7.701 -1.983 1.00 0.00 H new ATOM 0 HB2 ASP A 368 12.419 8.814 -1.395 1.00 0.00 H new ATOM 0 HB3 ASP A 368 12.959 8.969 0.266 1.00 0.00 H new ATOM 762 N ALA A 369 15.296 7.290 1.177 1.00 0.00 N ATOM 763 CA ALA A 369 16.409 7.221 2.113 1.00 0.00 C ATOM 764 C ALA A 369 17.472 6.261 1.591 1.00 0.00 C ATOM 765 O ALA A 369 18.662 6.570 1.601 1.00 0.00 O ATOM 766 CB ALA A 369 15.925 6.788 3.491 1.00 0.00 C ATOM 0 H ALA A 369 14.425 6.890 1.527 1.00 0.00 H new ATOM 0 HA ALA A 369 16.850 8.214 2.205 1.00 0.00 H new ATOM 0 HB1 ALA A 369 16.771 6.742 4.176 1.00 0.00 H new ATOM 0 HB2 ALA A 369 15.195 7.507 3.863 1.00 0.00 H new ATOM 0 HB3 ALA A 369 15.461 5.804 3.421 1.00 0.00 H new ATOM 772 N LEU A 370 17.027 5.104 1.110 1.00 0.00 N ATOM 773 CA LEU A 370 17.924 4.113 0.525 1.00 0.00 C ATOM 774 C LEU A 370 18.560 4.656 -0.754 1.00 0.00 C ATOM 775 O LEU A 370 19.707 4.343 -1.071 1.00 0.00 O ATOM 776 CB LEU A 370 17.172 2.808 0.234 1.00 0.00 C ATOM 777 CG LEU A 370 16.620 2.078 1.461 1.00 0.00 C ATOM 778 CD1 LEU A 370 15.984 0.764 1.049 1.00 0.00 C ATOM 779 CD2 LEU A 370 17.716 1.841 2.490 1.00 0.00 C ATOM 0 H LEU A 370 16.045 4.829 1.114 1.00 0.00 H new ATOM 0 HA LEU A 370 18.715 3.902 1.244 1.00 0.00 H new ATOM 0 HB2 LEU A 370 16.343 3.029 -0.439 1.00 0.00 H new ATOM 0 HB3 LEU A 370 17.843 2.133 -0.297 1.00 0.00 H new ATOM 0 HG LEU A 370 15.857 2.707 1.919 1.00 0.00 H new ATOM 0 HD11 LEU A 370 15.596 0.255 1.931 1.00 0.00 H new ATOM 0 HD12 LEU A 370 15.168 0.957 0.353 1.00 0.00 H new ATOM 0 HD13 LEU A 370 16.731 0.134 0.566 1.00 0.00 H new ATOM 0 HD21 LEU A 370 17.299 1.321 3.352 1.00 0.00 H new ATOM 0 HD22 LEU A 370 18.506 1.234 2.047 1.00 0.00 H new ATOM 0 HD23 LEU A 370 18.129 2.798 2.808 1.00 0.00 H new ATOM 791 N ASN A 371 17.798 5.466 -1.481 1.00 0.00 N ATOM 792 CA ASN A 371 18.294 6.161 -2.664 1.00 0.00 C ATOM 793 C ASN A 371 19.544 6.967 -2.328 1.00 0.00 C ATOM 794 O ASN A 371 20.560 6.878 -3.022 1.00 0.00 O ATOM 795 CB ASN A 371 17.211 7.094 -3.226 1.00 0.00 C ATOM 796 CG ASN A 371 16.266 6.405 -4.197 1.00 0.00 C ATOM 797 OD1 ASN A 371 15.286 5.772 -3.806 1.00 0.00 O ATOM 798 ND2 ASN A 371 16.526 6.570 -5.477 1.00 0.00 N ATOM 0 H ASN A 371 16.820 5.659 -1.267 1.00 0.00 H new ATOM 0 HA ASN A 371 18.549 5.415 -3.417 1.00 0.00 H new ATOM 0 HB2 ASN A 371 16.633 7.507 -2.399 1.00 0.00 H new ATOM 0 HB3 ASN A 371 17.690 7.933 -3.730 1.00 0.00 H new ATOM 0 HD21 ASN A 371 15.906 6.167 -6.179 1.00 0.00 H new ATOM 0 HD22 ASN A 371 17.348 7.101 -5.766 1.00 0.00 H new ATOM 805 N LYS A 372 19.473 7.734 -1.247 1.00 0.00 N ATOM 806 CA LYS A 372 20.595 8.556 -0.820 1.00 0.00 C ATOM 807 C LYS A 372 21.671 7.696 -0.167 1.00 0.00 C ATOM 808 O LYS A 372 22.863 7.931 -0.354 1.00 0.00 O ATOM 809 CB LYS A 372 20.126 9.634 0.155 1.00 0.00 C ATOM 810 CG LYS A 372 21.200 10.651 0.507 1.00 0.00 C ATOM 811 CD LYS A 372 20.678 11.705 1.470 1.00 0.00 C ATOM 812 CE LYS A 372 19.489 12.458 0.891 1.00 0.00 C ATOM 813 NZ LYS A 372 18.961 13.475 1.835 1.00 0.00 N ATOM 0 H LYS A 372 18.649 7.803 -0.650 1.00 0.00 H new ATOM 0 HA LYS A 372 21.019 9.038 -1.701 1.00 0.00 H new ATOM 0 HB2 LYS A 372 19.272 10.156 -0.278 1.00 0.00 H new ATOM 0 HB3 LYS A 372 19.777 9.156 1.070 1.00 0.00 H new ATOM 0 HG2 LYS A 372 22.053 10.140 0.953 1.00 0.00 H new ATOM 0 HG3 LYS A 372 21.557 11.133 -0.403 1.00 0.00 H new ATOM 0 HD2 LYS A 372 20.386 11.230 2.407 1.00 0.00 H new ATOM 0 HD3 LYS A 372 21.476 12.410 1.705 1.00 0.00 H new ATOM 0 HE2 LYS A 372 19.786 12.945 -0.038 1.00 0.00 H new ATOM 0 HE3 LYS A 372 18.699 11.750 0.641 1.00 0.00 H new ATOM 0 HZ1 LYS A 372 18.152 13.964 1.401 1.00 0.00 H new ATOM 0 HZ2 LYS A 372 18.653 13.008 2.712 1.00 0.00 H new ATOM 0 HZ3 LYS A 372 19.707 14.166 2.054 1.00 0.00 H new ATOM 827 N MET A 373 21.235 6.696 0.593 1.00 0.00 N ATOM 828 CA MET A 373 22.149 5.766 1.246 1.00 0.00 C ATOM 829 C MET A 373 23.049 5.095 0.215 1.00 0.00 C ATOM 830 O MET A 373 24.267 5.045 0.380 1.00 0.00 O ATOM 831 CB MET A 373 21.366 4.707 2.026 1.00 0.00 C ATOM 832 CG MET A 373 22.246 3.742 2.806 1.00 0.00 C ATOM 833 SD MET A 373 21.295 2.486 3.685 1.00 0.00 S ATOM 834 CE MET A 373 20.303 3.511 4.767 1.00 0.00 C ATOM 0 H MET A 373 20.248 6.509 0.772 1.00 0.00 H new ATOM 0 HA MET A 373 22.771 6.327 1.944 1.00 0.00 H new ATOM 0 HB2 MET A 373 20.688 5.207 2.718 1.00 0.00 H new ATOM 0 HB3 MET A 373 20.749 4.139 1.330 1.00 0.00 H new ATOM 0 HG2 MET A 373 22.939 3.254 2.121 1.00 0.00 H new ATOM 0 HG3 MET A 373 22.848 4.303 3.521 1.00 0.00 H new ATOM 0 HE1 MET A 373 19.892 2.900 5.571 1.00 0.00 H new ATOM 0 HE2 MET A 373 20.924 4.300 5.191 1.00 0.00 H new ATOM 0 HE3 MET A 373 19.488 3.958 4.198 1.00 0.00 H new ATOM 844 N LYS A 374 22.438 4.595 -0.854 1.00 0.00 N ATOM 845 CA LYS A 374 23.183 3.989 -1.949 1.00 0.00 C ATOM 846 C LYS A 374 24.151 4.997 -2.540 1.00 0.00 C ATOM 847 O LYS A 374 25.308 4.685 -2.796 1.00 0.00 O ATOM 848 CB LYS A 374 22.228 3.492 -3.035 1.00 0.00 C ATOM 849 CG LYS A 374 22.925 2.809 -4.204 1.00 0.00 C ATOM 850 CD LYS A 374 21.945 2.483 -5.320 1.00 0.00 C ATOM 851 CE LYS A 374 21.480 3.738 -6.047 1.00 0.00 C ATOM 852 NZ LYS A 374 22.433 4.167 -7.102 1.00 0.00 N ATOM 0 H LYS A 374 21.426 4.598 -0.984 1.00 0.00 H new ATOM 0 HA LYS A 374 23.743 3.140 -1.558 1.00 0.00 H new ATOM 0 HB2 LYS A 374 21.519 2.794 -2.590 1.00 0.00 H new ATOM 0 HB3 LYS A 374 21.651 4.336 -3.412 1.00 0.00 H new ATOM 0 HG2 LYS A 374 23.714 3.456 -4.588 1.00 0.00 H new ATOM 0 HG3 LYS A 374 23.404 1.893 -3.859 1.00 0.00 H new ATOM 0 HD2 LYS A 374 22.416 1.804 -6.031 1.00 0.00 H new ATOM 0 HD3 LYS A 374 21.082 1.962 -4.906 1.00 0.00 H new ATOM 0 HE2 LYS A 374 20.504 3.554 -6.496 1.00 0.00 H new ATOM 0 HE3 LYS A 374 21.352 4.546 -5.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 374 21.905 4.554 -7.910 1.00 0.00 H new ATOM 0 HZ2 LYS A 374 23.067 4.898 -6.721 1.00 0.00 H new ATOM 0 HZ3 LYS A 374 22.996 3.350 -7.415 1.00 0.00 H new ATOM 866 N ASP A 375 23.665 6.216 -2.725 1.00 0.00 N ATOM 867 CA ASP A 375 24.465 7.290 -3.300 1.00 0.00 C ATOM 868 C ASP A 375 25.712 7.566 -2.459 1.00 0.00 C ATOM 869 O ASP A 375 26.769 7.919 -2.994 1.00 0.00 O ATOM 870 CB ASP A 375 23.613 8.553 -3.439 1.00 0.00 C ATOM 871 CG ASP A 375 24.410 9.746 -3.913 1.00 0.00 C ATOM 872 OD1 ASP A 375 24.979 9.689 -5.022 1.00 0.00 O ATOM 873 OD2 ASP A 375 24.491 10.742 -3.169 1.00 0.00 O ATOM 0 H ASP A 375 22.712 6.488 -2.483 1.00 0.00 H new ATOM 0 HA ASP A 375 24.801 6.978 -4.289 1.00 0.00 H new ATOM 0 HB2 ASP A 375 22.800 8.363 -4.140 1.00 0.00 H new ATOM 0 HB3 ASP A 375 23.156 8.786 -2.477 1.00 0.00 H new ATOM 878 N VAL A 376 25.594 7.395 -1.146 1.00 0.00 N ATOM 879 CA VAL A 376 26.748 7.510 -0.265 1.00 0.00 C ATOM 880 C VAL A 376 27.692 6.339 -0.486 1.00 0.00 C ATOM 881 O VAL A 376 28.874 6.534 -0.736 1.00 0.00 O ATOM 882 CB VAL A 376 26.355 7.559 1.229 1.00 0.00 C ATOM 883 CG1 VAL A 376 27.598 7.667 2.110 1.00 0.00 C ATOM 884 CG2 VAL A 376 25.403 8.716 1.500 1.00 0.00 C ATOM 0 H VAL A 376 24.717 7.178 -0.672 1.00 0.00 H new ATOM 0 HA VAL A 376 27.238 8.451 -0.514 1.00 0.00 H new ATOM 0 HB VAL A 376 25.840 6.630 1.475 1.00 0.00 H new ATOM 0 HG11 VAL A 376 27.300 7.700 3.158 1.00 0.00 H new ATOM 0 HG12 VAL A 376 28.239 6.801 1.942 1.00 0.00 H new ATOM 0 HG13 VAL A 376 28.144 8.577 1.859 1.00 0.00 H new ATOM 0 HG21 VAL A 376 25.140 8.731 2.558 1.00 0.00 H new ATOM 0 HG22 VAL A 376 25.887 9.656 1.233 1.00 0.00 H new ATOM 0 HG23 VAL A 376 24.499 8.591 0.903 1.00 0.00 H new ATOM 894 N TYR A 377 27.153 5.125 -0.421 1.00 0.00 N ATOM 895 CA TYR A 377 27.948 3.907 -0.593 1.00 0.00 C ATOM 896 C TYR A 377 28.669 3.890 -1.941 1.00 0.00 C ATOM 897 O TYR A 377 29.782 3.378 -2.050 1.00 0.00 O ATOM 898 CB TYR A 377 27.057 2.667 -0.480 1.00 0.00 C ATOM 899 CG TYR A 377 26.701 2.263 0.936 1.00 0.00 C ATOM 900 CD1 TYR A 377 26.052 3.135 1.801 1.00 0.00 C ATOM 901 CD2 TYR A 377 26.999 0.989 1.398 1.00 0.00 C ATOM 902 CE1 TYR A 377 25.713 2.749 3.086 1.00 0.00 C ATOM 903 CE2 TYR A 377 26.666 0.596 2.680 1.00 0.00 C ATOM 904 CZ TYR A 377 26.022 1.479 3.520 1.00 0.00 C ATOM 905 OH TYR A 377 25.690 1.088 4.798 1.00 0.00 O ATOM 0 H TYR A 377 26.162 4.955 -0.249 1.00 0.00 H new ATOM 0 HA TYR A 377 28.697 3.895 0.199 1.00 0.00 H new ATOM 0 HB2 TYR A 377 26.135 2.848 -1.033 1.00 0.00 H new ATOM 0 HB3 TYR A 377 27.560 1.831 -0.965 1.00 0.00 H new ATOM 0 HD1 TYR A 377 25.808 4.132 1.465 1.00 0.00 H new ATOM 0 HD2 TYR A 377 27.501 0.292 0.743 1.00 0.00 H new ATOM 0 HE1 TYR A 377 25.209 3.440 3.745 1.00 0.00 H new ATOM 0 HE2 TYR A 377 26.909 -0.399 3.023 1.00 0.00 H new ATOM 0 HH TYR A 377 25.978 0.162 4.942 1.00 0.00 H new ATOM 915 N GLU A 378 28.029 4.443 -2.961 1.00 0.00 N ATOM 916 CA GLU A 378 28.588 4.444 -4.308 1.00 0.00 C ATOM 917 C GLU A 378 29.784 5.376 -4.428 1.00 0.00 C ATOM 918 O GLU A 378 30.858 4.961 -4.863 1.00 0.00 O ATOM 919 CB GLU A 378 27.523 4.842 -5.331 1.00 0.00 C ATOM 920 CG GLU A 378 26.394 3.843 -5.459 1.00 0.00 C ATOM 921 CD GLU A 378 25.430 4.218 -6.557 1.00 0.00 C ATOM 922 OE1 GLU A 378 24.747 5.254 -6.429 1.00 0.00 O ATOM 923 OE2 GLU A 378 25.338 3.471 -7.553 1.00 0.00 O ATOM 0 H GLU A 378 27.120 4.898 -2.883 1.00 0.00 H new ATOM 0 HA GLU A 378 28.929 3.429 -4.513 1.00 0.00 H new ATOM 0 HB2 GLU A 378 27.108 5.811 -5.051 1.00 0.00 H new ATOM 0 HB3 GLU A 378 27.997 4.967 -6.305 1.00 0.00 H new ATOM 0 HG2 GLU A 378 26.806 2.854 -5.660 1.00 0.00 H new ATOM 0 HG3 GLU A 378 25.858 3.778 -4.512 1.00 0.00 H new ATOM 930 N LYS A 379 29.602 6.630 -4.052 1.00 0.00 N ATOM 931 CA LYS A 379 30.662 7.618 -4.204 1.00 0.00 C ATOM 932 C LYS A 379 31.640 7.535 -3.044 1.00 0.00 C ATOM 933 O LYS A 379 32.804 7.914 -3.168 1.00 0.00 O ATOM 934 CB LYS A 379 30.080 9.027 -4.303 1.00 0.00 C ATOM 935 CG LYS A 379 28.973 9.154 -5.339 1.00 0.00 C ATOM 936 CD LYS A 379 28.621 10.608 -5.621 1.00 0.00 C ATOM 937 CE LYS A 379 28.314 11.382 -4.348 1.00 0.00 C ATOM 938 NZ LYS A 379 27.204 10.774 -3.569 1.00 0.00 N ATOM 0 H LYS A 379 28.739 6.988 -3.643 1.00 0.00 H new ATOM 0 HA LYS A 379 31.197 7.400 -5.128 1.00 0.00 H new ATOM 0 HB2 LYS A 379 29.690 9.320 -3.328 1.00 0.00 H new ATOM 0 HB3 LYS A 379 30.880 9.726 -4.550 1.00 0.00 H new ATOM 0 HG2 LYS A 379 29.285 8.670 -6.265 1.00 0.00 H new ATOM 0 HG3 LYS A 379 28.086 8.627 -4.988 1.00 0.00 H new ATOM 0 HD2 LYS A 379 29.450 11.086 -6.144 1.00 0.00 H new ATOM 0 HD3 LYS A 379 27.758 10.649 -6.286 1.00 0.00 H new ATOM 0 HE2 LYS A 379 29.209 11.425 -3.727 1.00 0.00 H new ATOM 0 HE3 LYS A 379 28.054 12.409 -4.604 1.00 0.00 H new ATOM 0 HZ1 LYS A 379 26.353 11.365 -3.659 1.00 0.00 H new ATOM 0 HZ2 LYS A 379 27.004 9.821 -3.935 1.00 0.00 H new ATOM 0 HZ3 LYS A 379 27.477 10.710 -2.568 1.00 0.00 H new ATOM 952 N ASN A 380 31.162 7.025 -1.921 1.00 0.00 N ATOM 953 CA ASN A 380 31.985 6.865 -0.733 1.00 0.00 C ATOM 954 C ASN A 380 31.824 5.453 -0.164 1.00 0.00 C ATOM 955 O ASN A 380 31.089 5.246 0.805 1.00 0.00 O ATOM 956 CB ASN A 380 31.611 7.904 0.338 1.00 0.00 C ATOM 957 CG ASN A 380 31.824 9.337 -0.114 1.00 0.00 C ATOM 958 OD1 ASN A 380 32.931 9.868 -0.026 1.00 0.00 O ATOM 959 ND2 ASN A 380 30.759 9.984 -0.567 1.00 0.00 N ATOM 0 H ASN A 380 30.198 6.712 -1.807 1.00 0.00 H new ATOM 0 HA ASN A 380 33.025 7.021 -1.018 1.00 0.00 H new ATOM 0 HB2 ASN A 380 30.565 7.770 0.615 1.00 0.00 H new ATOM 0 HB3 ASN A 380 32.204 7.721 1.234 1.00 0.00 H new ATOM 0 HD21 ASN A 380 30.840 10.958 -0.858 1.00 0.00 H new ATOM 0 HD22 ASN A 380 29.859 9.507 -0.624 1.00 0.00 H new ATOM 966 N PRO A 381 32.501 4.459 -0.777 1.00 0.00 N ATOM 967 CA PRO A 381 32.503 3.056 -0.310 1.00 0.00 C ATOM 968 C PRO A 381 32.924 2.879 1.155 1.00 0.00 C ATOM 969 O PRO A 381 32.922 1.764 1.674 1.00 0.00 O ATOM 970 CB PRO A 381 33.521 2.377 -1.226 1.00 0.00 C ATOM 971 CG PRO A 381 33.520 3.197 -2.464 1.00 0.00 C ATOM 972 CD PRO A 381 33.277 4.612 -2.022 1.00 0.00 C ATOM 0 HA PRO A 381 31.497 2.639 -0.352 1.00 0.00 H new ATOM 0 HB2 PRO A 381 34.510 2.352 -0.769 1.00 0.00 H new ATOM 0 HB3 PRO A 381 33.240 1.345 -1.434 1.00 0.00 H new ATOM 0 HG2 PRO A 381 34.471 3.110 -2.990 1.00 0.00 H new ATOM 0 HG3 PRO A 381 32.743 2.864 -3.152 1.00 0.00 H new ATOM 0 HD2 PRO A 381 34.212 5.144 -1.848 1.00 0.00 H new ATOM 0 HD3 PRO A 381 32.724 5.177 -2.772 1.00 0.00 H new ATOM 980 N GLN A 382 33.294 3.974 1.811 1.00 0.00 N ATOM 981 CA GLN A 382 33.649 3.955 3.228 1.00 0.00 C ATOM 982 C GLN A 382 32.538 3.338 4.076 1.00 0.00 C ATOM 983 O GLN A 382 32.798 2.748 5.124 1.00 0.00 O ATOM 984 CB GLN A 382 33.932 5.372 3.717 1.00 0.00 C ATOM 985 CG GLN A 382 32.809 6.335 3.422 1.00 0.00 C ATOM 986 CD GLN A 382 33.142 7.757 3.819 1.00 0.00 C ATOM 987 OE1 GLN A 382 33.765 8.492 2.913 1.00 0.00 O flip ATOM 988 NE2 GLN A 382 32.856 8.186 4.934 1.00 0.00 N flip ATOM 0 H GLN A 382 33.356 4.896 1.379 1.00 0.00 H new ATOM 0 HA GLN A 382 34.544 3.342 3.336 1.00 0.00 H new ATOM 0 HB2 GLN A 382 34.111 5.350 4.792 1.00 0.00 H new ATOM 0 HB3 GLN A 382 34.847 5.736 3.249 1.00 0.00 H new ATOM 0 HG2 GLN A 382 32.579 6.304 2.357 1.00 0.00 H new ATOM 0 HG3 GLN A 382 31.912 6.014 3.952 1.00 0.00 H new ATOM 0 HE21 GLN A 382 32.375 7.585 5.604 1.00 0.00 H new ATOM 0 HE22 GLN A 382 33.100 9.143 5.190 1.00 0.00 H new ATOM 997 N MET A 383 31.302 3.477 3.617 1.00 0.00 N ATOM 998 CA MET A 383 30.152 2.992 4.365 1.00 0.00 C ATOM 999 C MET A 383 29.894 1.515 4.092 1.00 0.00 C ATOM 1000 O MET A 383 29.211 0.843 4.865 1.00 0.00 O ATOM 1001 CB MET A 383 28.912 3.815 4.024 1.00 0.00 C ATOM 1002 CG MET A 383 29.026 5.279 4.418 1.00 0.00 C ATOM 1003 SD MET A 383 29.415 5.501 6.166 1.00 0.00 S ATOM 1004 CE MET A 383 27.997 4.715 6.928 1.00 0.00 C ATOM 0 H MET A 383 31.070 3.922 2.729 1.00 0.00 H new ATOM 0 HA MET A 383 30.373 3.104 5.426 1.00 0.00 H new ATOM 0 HB2 MET A 383 28.726 3.749 2.952 1.00 0.00 H new ATOM 0 HB3 MET A 383 28.048 3.379 4.525 1.00 0.00 H new ATOM 0 HG2 MET A 383 29.799 5.754 3.815 1.00 0.00 H new ATOM 0 HG3 MET A 383 28.088 5.786 4.191 1.00 0.00 H new ATOM 0 HE1 MET A 383 27.947 4.995 7.980 1.00 0.00 H new ATOM 0 HE2 MET A 383 27.087 5.038 6.423 1.00 0.00 H new ATOM 0 HE3 MET A 383 28.093 3.632 6.845 1.00 0.00 H new ATOM 1014 N GLY A 384 30.448 1.009 3.003 1.00 0.00 N ATOM 1015 CA GLY A 384 30.251 -0.380 2.653 1.00 0.00 C ATOM 1016 C GLY A 384 30.129 -0.579 1.160 1.00 0.00 C ATOM 1017 O GLY A 384 30.675 0.199 0.377 1.00 0.00 O ATOM 0 H GLY A 384 31.032 1.537 2.354 1.00 0.00 H new ATOM 0 HA2 GLY A 384 31.086 -0.970 3.030 1.00 0.00 H new ATOM 0 HA3 GLY A 384 29.351 -0.753 3.143 1.00 0.00 H new ATOM 1021 N ASP A 385 29.404 -1.612 0.766 1.00 0.00 N ATOM 1022 CA ASP A 385 29.240 -1.933 -0.643 1.00 0.00 C ATOM 1023 C ASP A 385 27.836 -1.571 -1.102 1.00 0.00 C ATOM 1024 O ASP A 385 26.851 -1.996 -0.500 1.00 0.00 O ATOM 1025 CB ASP A 385 29.493 -3.425 -0.885 1.00 0.00 C ATOM 1026 CG ASP A 385 30.818 -3.888 -0.320 1.00 0.00 C ATOM 1027 OD1 ASP A 385 31.876 -3.469 -0.839 1.00 0.00 O ATOM 1028 OD2 ASP A 385 30.809 -4.662 0.659 1.00 0.00 O ATOM 0 H ASP A 385 28.919 -2.244 1.402 1.00 0.00 H new ATOM 0 HA ASP A 385 29.965 -1.354 -1.215 1.00 0.00 H new ATOM 0 HB2 ASP A 385 28.687 -4.004 -0.434 1.00 0.00 H new ATOM 0 HB3 ASP A 385 29.469 -3.625 -1.956 1.00 0.00 H new ATOM 1033 N PRO A 386 27.728 -0.776 -2.182 1.00 0.00 N ATOM 1034 CA PRO A 386 26.436 -0.348 -2.734 1.00 0.00 C ATOM 1035 C PRO A 386 25.562 -1.528 -3.140 1.00 0.00 C ATOM 1036 O PRO A 386 24.334 -1.432 -3.162 1.00 0.00 O ATOM 1037 CB PRO A 386 26.814 0.468 -3.972 1.00 0.00 C ATOM 1038 CG PRO A 386 28.234 0.865 -3.765 1.00 0.00 C ATOM 1039 CD PRO A 386 28.862 -0.223 -2.945 1.00 0.00 C ATOM 0 HA PRO A 386 25.856 0.211 -2.000 1.00 0.00 H new ATOM 0 HB2 PRO A 386 26.699 -0.122 -4.881 1.00 0.00 H new ATOM 0 HB3 PRO A 386 26.173 1.343 -4.077 1.00 0.00 H new ATOM 0 HG2 PRO A 386 28.749 0.979 -4.719 1.00 0.00 H new ATOM 0 HG3 PRO A 386 28.298 1.825 -3.252 1.00 0.00 H new ATOM 0 HD2 PRO A 386 29.330 -0.980 -3.574 1.00 0.00 H new ATOM 0 HD3 PRO A 386 29.637 0.168 -2.286 1.00 0.00 H new ATOM 1047 N SER A 387 26.205 -2.643 -3.456 1.00 0.00 N ATOM 1048 CA SER A 387 25.504 -3.845 -3.872 1.00 0.00 C ATOM 1049 C SER A 387 24.708 -4.451 -2.717 1.00 0.00 C ATOM 1050 O SER A 387 23.674 -5.077 -2.935 1.00 0.00 O ATOM 1051 CB SER A 387 26.506 -4.855 -4.427 1.00 0.00 C ATOM 1052 OG SER A 387 27.279 -4.269 -5.461 1.00 0.00 O ATOM 0 H SER A 387 27.220 -2.738 -3.431 1.00 0.00 H new ATOM 0 HA SER A 387 24.792 -3.580 -4.654 1.00 0.00 H new ATOM 0 HB2 SER A 387 27.161 -5.204 -3.628 1.00 0.00 H new ATOM 0 HB3 SER A 387 25.977 -5.728 -4.810 1.00 0.00 H new ATOM 0 HG SER A 387 27.918 -4.928 -5.805 1.00 0.00 H new ATOM 1058 N SER A 388 25.167 -4.224 -1.490 1.00 0.00 N ATOM 1059 CA SER A 388 24.483 -4.744 -0.311 1.00 0.00 C ATOM 1060 C SER A 388 23.151 -4.028 -0.103 1.00 0.00 C ATOM 1061 O SER A 388 22.275 -4.506 0.617 1.00 0.00 O ATOM 1062 CB SER A 388 25.365 -4.568 0.926 1.00 0.00 C ATOM 1063 OG SER A 388 26.664 -5.088 0.700 1.00 0.00 O ATOM 0 H SER A 388 26.008 -3.684 -1.286 1.00 0.00 H new ATOM 0 HA SER A 388 24.288 -5.805 -0.465 1.00 0.00 H new ATOM 0 HB2 SER A 388 25.432 -3.511 1.182 1.00 0.00 H new ATOM 0 HB3 SER A 388 24.909 -5.074 1.777 1.00 0.00 H new ATOM 0 HG SER A 388 27.211 -4.963 1.504 1.00 0.00 H new ATOM 1069 N LEU A 389 23.004 -2.878 -0.744 1.00 0.00 N ATOM 1070 CA LEU A 389 21.800 -2.079 -0.603 1.00 0.00 C ATOM 1071 C LEU A 389 20.809 -2.387 -1.714 1.00 0.00 C ATOM 1072 O LEU A 389 19.654 -1.965 -1.656 1.00 0.00 O ATOM 1073 CB LEU A 389 22.147 -0.594 -0.619 1.00 0.00 C ATOM 1074 CG LEU A 389 23.152 -0.149 0.443 1.00 0.00 C ATOM 1075 CD1 LEU A 389 23.462 1.323 0.281 1.00 0.00 C ATOM 1076 CD2 LEU A 389 22.626 -0.431 1.842 1.00 0.00 C ATOM 0 H LEU A 389 23.706 -2.478 -1.367 1.00 0.00 H new ATOM 0 HA LEU A 389 21.339 -2.331 0.352 1.00 0.00 H new ATOM 0 HB2 LEU A 389 22.545 -0.341 -1.602 1.00 0.00 H new ATOM 0 HB3 LEU A 389 21.229 -0.021 -0.490 1.00 0.00 H new ATOM 0 HG LEU A 389 24.071 -0.720 0.307 1.00 0.00 H new ATOM 0 HD11 LEU A 389 24.179 1.630 1.043 1.00 0.00 H new ATOM 0 HD12 LEU A 389 23.885 1.499 -0.708 1.00 0.00 H new ATOM 0 HD13 LEU A 389 22.545 1.902 0.391 1.00 0.00 H new ATOM 0 HD21 LEU A 389 23.360 -0.105 2.579 1.00 0.00 H new ATOM 0 HD22 LEU A 389 21.692 0.110 1.996 1.00 0.00 H new ATOM 0 HD23 LEU A 389 22.448 -1.500 1.955 1.00 0.00 H new ATOM 1088 N HIS A 390 21.255 -3.131 -2.718 1.00 0.00 N ATOM 1089 CA HIS A 390 20.401 -3.466 -3.852 1.00 0.00 C ATOM 1090 C HIS A 390 19.186 -4.295 -3.415 1.00 0.00 C ATOM 1091 O HIS A 390 18.059 -3.939 -3.747 1.00 0.00 O ATOM 1092 CB HIS A 390 21.190 -4.184 -4.955 1.00 0.00 C ATOM 1093 CG HIS A 390 22.129 -3.285 -5.708 1.00 0.00 C ATOM 1094 ND1 HIS A 390 23.190 -3.755 -6.450 1.00 0.00 N ATOM 1095 CD2 HIS A 390 22.154 -1.934 -5.837 1.00 0.00 C ATOM 1096 CE1 HIS A 390 23.826 -2.738 -7.002 1.00 0.00 C ATOM 1097 NE2 HIS A 390 23.218 -1.622 -6.646 1.00 0.00 N ATOM 0 H HIS A 390 22.199 -3.513 -2.771 1.00 0.00 H new ATOM 0 HA HIS A 390 20.030 -2.528 -4.266 1.00 0.00 H new ATOM 0 HB2 HIS A 390 21.760 -4.999 -4.510 1.00 0.00 H new ATOM 0 HB3 HIS A 390 20.488 -4.633 -5.658 1.00 0.00 H new ATOM 0 HD2 HIS A 390 21.465 -1.235 -5.387 1.00 0.00 H new ATOM 0 HE1 HIS A 390 24.697 -2.808 -7.637 1.00 0.00 H new ATOM 0 HE2 HIS A 390 23.494 -0.681 -6.926 1.00 0.00 H new ATOM 1106 N PRO A 391 19.375 -5.395 -2.647 1.00 0.00 N ATOM 1107 CA PRO A 391 18.247 -6.180 -2.124 1.00 0.00 C ATOM 1108 C PRO A 391 17.359 -5.357 -1.189 1.00 0.00 C ATOM 1109 O PRO A 391 16.176 -5.652 -1.012 1.00 0.00 O ATOM 1110 CB PRO A 391 18.917 -7.327 -1.358 1.00 0.00 C ATOM 1111 CG PRO A 391 20.302 -6.854 -1.087 1.00 0.00 C ATOM 1112 CD PRO A 391 20.668 -5.986 -2.253 1.00 0.00 C ATOM 0 HA PRO A 391 17.588 -6.522 -2.922 1.00 0.00 H new ATOM 0 HB2 PRO A 391 18.386 -7.545 -0.431 1.00 0.00 H new ATOM 0 HB3 PRO A 391 18.922 -8.245 -1.946 1.00 0.00 H new ATOM 0 HG2 PRO A 391 20.349 -6.295 -0.152 1.00 0.00 H new ATOM 0 HG3 PRO A 391 20.991 -7.693 -0.992 1.00 0.00 H new ATOM 0 HD2 PRO A 391 21.393 -5.221 -1.975 1.00 0.00 H new ATOM 0 HD3 PRO A 391 21.111 -6.565 -3.064 1.00 0.00 H new ATOM 1120 N LYS A 392 17.935 -4.319 -0.596 1.00 0.00 N ATOM 1121 CA LYS A 392 17.186 -3.429 0.277 1.00 0.00 C ATOM 1122 C LYS A 392 16.246 -2.552 -0.540 1.00 0.00 C ATOM 1123 O LYS A 392 15.055 -2.452 -0.242 1.00 0.00 O ATOM 1124 CB LYS A 392 18.131 -2.566 1.106 1.00 0.00 C ATOM 1125 CG LYS A 392 18.916 -3.363 2.130 1.00 0.00 C ATOM 1126 CD LYS A 392 19.834 -2.476 2.947 1.00 0.00 C ATOM 1127 CE LYS A 392 19.062 -1.507 3.837 1.00 0.00 C ATOM 1128 NZ LYS A 392 18.253 -2.214 4.865 1.00 0.00 N ATOM 0 H LYS A 392 18.919 -4.074 -0.705 1.00 0.00 H new ATOM 0 HA LYS A 392 16.591 -4.038 0.958 1.00 0.00 H new ATOM 0 HB2 LYS A 392 18.827 -2.056 0.440 1.00 0.00 H new ATOM 0 HB3 LYS A 392 17.555 -1.795 1.618 1.00 0.00 H new ATOM 0 HG2 LYS A 392 18.225 -3.882 2.795 1.00 0.00 H new ATOM 0 HG3 LYS A 392 19.505 -4.127 1.623 1.00 0.00 H new ATOM 0 HD2 LYS A 392 20.480 -3.098 3.566 1.00 0.00 H new ATOM 0 HD3 LYS A 392 20.482 -1.912 2.276 1.00 0.00 H new ATOM 0 HE2 LYS A 392 19.762 -0.831 4.329 1.00 0.00 H new ATOM 0 HE3 LYS A 392 18.406 -0.893 3.220 1.00 0.00 H new ATOM 0 HZ1 LYS A 392 17.924 -1.532 5.578 1.00 0.00 H new ATOM 0 HZ2 LYS A 392 17.432 -2.664 4.412 1.00 0.00 H new ATOM 0 HZ3 LYS A 392 18.836 -2.942 5.326 1.00 0.00 H new ATOM 1142 N ILE A 393 16.786 -1.933 -1.585 1.00 0.00 N ATOM 1143 CA ILE A 393 15.996 -1.079 -2.463 1.00 0.00 C ATOM 1144 C ILE A 393 14.999 -1.912 -3.265 1.00 0.00 C ATOM 1145 O ILE A 393 13.865 -1.488 -3.493 1.00 0.00 O ATOM 1146 CB ILE A 393 16.895 -0.277 -3.433 1.00 0.00 C ATOM 1147 CG1 ILE A 393 17.916 0.548 -2.647 1.00 0.00 C ATOM 1148 CG2 ILE A 393 16.049 0.631 -4.320 1.00 0.00 C ATOM 1149 CD1 ILE A 393 18.911 1.279 -3.522 1.00 0.00 C ATOM 0 H ILE A 393 17.770 -2.008 -1.844 1.00 0.00 H new ATOM 0 HA ILE A 393 15.456 -0.374 -1.831 1.00 0.00 H new ATOM 0 HB ILE A 393 17.430 -0.980 -4.072 1.00 0.00 H new ATOM 0 HG12 ILE A 393 17.386 1.274 -2.030 1.00 0.00 H new ATOM 0 HG13 ILE A 393 18.458 -0.111 -1.969 1.00 0.00 H new ATOM 0 HG21 ILE A 393 16.699 1.187 -4.996 1.00 0.00 H new ATOM 0 HG22 ILE A 393 15.353 0.026 -4.901 1.00 0.00 H new ATOM 0 HG23 ILE A 393 15.490 1.329 -3.697 1.00 0.00 H new ATOM 0 HD11 ILE A 393 19.602 1.842 -2.895 1.00 0.00 H new ATOM 0 HD12 ILE A 393 19.468 0.558 -4.120 1.00 0.00 H new ATOM 0 HD13 ILE A 393 18.380 1.965 -4.182 1.00 0.00 H new ATOM 1161 N ALA A 394 15.432 -3.103 -3.676 1.00 0.00 N ATOM 1162 CA ALA A 394 14.584 -4.022 -4.429 1.00 0.00 C ATOM 1163 C ALA A 394 13.281 -4.293 -3.689 1.00 0.00 C ATOM 1164 O ALA A 394 12.195 -4.083 -4.235 1.00 0.00 O ATOM 1165 CB ALA A 394 15.320 -5.326 -4.692 1.00 0.00 C ATOM 0 H ALA A 394 16.373 -3.455 -3.498 1.00 0.00 H new ATOM 0 HA ALA A 394 14.343 -3.554 -5.384 1.00 0.00 H new ATOM 0 HB1 ALA A 394 14.675 -6.001 -5.254 1.00 0.00 H new ATOM 0 HB2 ALA A 394 16.223 -5.124 -5.267 1.00 0.00 H new ATOM 0 HB3 ALA A 394 15.590 -5.789 -3.743 1.00 0.00 H new ATOM 1171 N GLU A 395 13.394 -4.749 -2.444 1.00 0.00 N ATOM 1172 CA GLU A 395 12.224 -4.994 -1.610 1.00 0.00 C ATOM 1173 C GLU A 395 11.407 -3.727 -1.454 1.00 0.00 C ATOM 1174 O GLU A 395 10.232 -3.693 -1.805 1.00 0.00 O ATOM 1175 CB GLU A 395 12.631 -5.497 -0.224 1.00 0.00 C ATOM 1176 CG GLU A 395 13.180 -6.907 -0.220 1.00 0.00 C ATOM 1177 CD GLU A 395 12.272 -7.879 -0.938 1.00 0.00 C ATOM 1178 OE1 GLU A 395 11.131 -8.083 -0.476 1.00 0.00 O ATOM 1179 OE2 GLU A 395 12.692 -8.432 -1.976 1.00 0.00 O ATOM 0 H GLU A 395 14.285 -4.956 -1.992 1.00 0.00 H new ATOM 0 HA GLU A 395 11.624 -5.758 -2.104 1.00 0.00 H new ATOM 0 HB2 GLU A 395 13.382 -4.824 0.190 1.00 0.00 H new ATOM 0 HB3 GLU A 395 11.765 -5.453 0.436 1.00 0.00 H new ATOM 0 HG2 GLU A 395 14.162 -6.913 -0.693 1.00 0.00 H new ATOM 0 HG3 GLU A 395 13.320 -7.237 0.809 1.00 0.00 H new ATOM 1186 N THR A 396 12.058 -2.688 -0.950 1.00 0.00 N ATOM 1187 CA THR A 396 11.412 -1.422 -0.653 1.00 0.00 C ATOM 1188 C THR A 396 10.568 -0.923 -1.829 1.00 0.00 C ATOM 1189 O THR A 396 9.383 -0.643 -1.670 1.00 0.00 O ATOM 1190 CB THR A 396 12.479 -0.378 -0.273 1.00 0.00 C ATOM 1191 OG1 THR A 396 13.230 -0.861 0.847 1.00 0.00 O ATOM 1192 CG2 THR A 396 11.864 0.960 0.084 1.00 0.00 C ATOM 0 H THR A 396 13.055 -2.702 -0.735 1.00 0.00 H new ATOM 0 HA THR A 396 10.734 -1.574 0.187 1.00 0.00 H new ATOM 0 HB THR A 396 13.124 -0.230 -1.139 1.00 0.00 H new ATOM 0 HG1 THR A 396 13.944 -1.453 0.531 1.00 0.00 H new ATOM 0 HG21 THR A 396 12.653 1.665 0.345 1.00 0.00 H new ATOM 0 HG22 THR A 396 11.304 1.342 -0.769 1.00 0.00 H new ATOM 0 HG23 THR A 396 11.192 0.837 0.933 1.00 0.00 H new ATOM 1200 N THR A 397 11.168 -0.861 -3.010 1.00 0.00 N ATOM 1201 CA THR A 397 10.475 -0.367 -4.191 1.00 0.00 C ATOM 1202 C THR A 397 9.319 -1.291 -4.587 1.00 0.00 C ATOM 1203 O THR A 397 8.210 -0.832 -4.866 1.00 0.00 O ATOM 1204 CB THR A 397 11.449 -0.229 -5.375 1.00 0.00 C ATOM 1205 OG1 THR A 397 12.623 0.480 -4.954 1.00 0.00 O ATOM 1206 CG2 THR A 397 10.799 0.507 -6.537 1.00 0.00 C ATOM 0 H THR A 397 12.133 -1.147 -3.175 1.00 0.00 H new ATOM 0 HA THR A 397 10.068 0.613 -3.942 1.00 0.00 H new ATOM 0 HB THR A 397 11.721 -1.229 -5.711 1.00 0.00 H new ATOM 0 HG1 THR A 397 13.205 -0.123 -4.446 1.00 0.00 H new ATOM 0 HG21 THR A 397 11.510 0.590 -7.359 1.00 0.00 H new ATOM 0 HG22 THR A 397 9.921 -0.045 -6.871 1.00 0.00 H new ATOM 0 HG23 THR A 397 10.500 1.504 -6.214 1.00 0.00 H new ATOM 1214 N SER A 398 9.575 -2.595 -4.581 1.00 0.00 N ATOM 1215 CA SER A 398 8.571 -3.571 -4.987 1.00 0.00 C ATOM 1216 C SER A 398 7.407 -3.608 -3.998 1.00 0.00 C ATOM 1217 O SER A 398 6.252 -3.803 -4.388 1.00 0.00 O ATOM 1218 CB SER A 398 9.210 -4.955 -5.113 1.00 0.00 C ATOM 1219 OG SER A 398 10.326 -4.914 -5.990 1.00 0.00 O ATOM 0 H SER A 398 10.468 -3.000 -4.300 1.00 0.00 H new ATOM 0 HA SER A 398 8.175 -3.272 -5.957 1.00 0.00 H new ATOM 0 HB2 SER A 398 9.526 -5.306 -4.131 1.00 0.00 H new ATOM 0 HB3 SER A 398 8.475 -5.668 -5.485 1.00 0.00 H new ATOM 0 HG SER A 398 11.096 -4.529 -5.522 1.00 0.00 H new ATOM 1225 N ASN A 399 7.714 -3.407 -2.722 1.00 0.00 N ATOM 1226 CA ASN A 399 6.692 -3.372 -1.685 1.00 0.00 C ATOM 1227 C ASN A 399 5.794 -2.159 -1.869 1.00 0.00 C ATOM 1228 O ASN A 399 4.585 -2.235 -1.661 1.00 0.00 O ATOM 1229 CB ASN A 399 7.323 -3.343 -0.291 1.00 0.00 C ATOM 1230 CG ASN A 399 8.068 -4.619 0.051 1.00 0.00 C ATOM 1231 OD1 ASN A 399 7.750 -5.696 -0.456 1.00 0.00 O ATOM 1232 ND2 ASN A 399 9.056 -4.508 0.925 1.00 0.00 N ATOM 0 H ASN A 399 8.665 -3.266 -2.381 1.00 0.00 H new ATOM 0 HA ASN A 399 6.093 -4.279 -1.774 1.00 0.00 H new ATOM 0 HB2 ASN A 399 8.011 -2.500 -0.227 1.00 0.00 H new ATOM 0 HB3 ASN A 399 6.543 -3.175 0.451 1.00 0.00 H new ATOM 0 HD21 ASN A 399 9.587 -5.334 1.202 1.00 0.00 H new ATOM 0 HD22 ASN A 399 9.287 -3.597 1.321 1.00 0.00 H new ATOM 1239 N ILE A 400 6.397 -1.046 -2.268 1.00 0.00 N ATOM 1240 CA ILE A 400 5.655 0.171 -2.568 1.00 0.00 C ATOM 1241 C ILE A 400 4.624 -0.089 -3.663 1.00 0.00 C ATOM 1242 O ILE A 400 3.449 0.250 -3.518 1.00 0.00 O ATOM 1243 CB ILE A 400 6.609 1.306 -3.005 1.00 0.00 C ATOM 1244 CG1 ILE A 400 7.522 1.698 -1.843 1.00 0.00 C ATOM 1245 CG2 ILE A 400 5.831 2.517 -3.502 1.00 0.00 C ATOM 1246 CD1 ILE A 400 8.636 2.644 -2.234 1.00 0.00 C ATOM 0 H ILE A 400 7.406 -0.962 -2.392 1.00 0.00 H new ATOM 0 HA ILE A 400 5.139 0.482 -1.660 1.00 0.00 H new ATOM 0 HB ILE A 400 7.220 0.940 -3.830 1.00 0.00 H new ATOM 0 HG12 ILE A 400 6.921 2.163 -1.062 1.00 0.00 H new ATOM 0 HG13 ILE A 400 7.958 0.795 -1.415 1.00 0.00 H new ATOM 0 HG21 ILE A 400 6.528 3.299 -3.802 1.00 0.00 H new ATOM 0 HG22 ILE A 400 5.218 2.230 -4.356 1.00 0.00 H new ATOM 0 HG23 ILE A 400 5.189 2.890 -2.704 1.00 0.00 H new ATOM 0 HD11 ILE A 400 9.241 2.876 -1.357 1.00 0.00 H new ATOM 0 HD12 ILE A 400 9.262 2.175 -2.993 1.00 0.00 H new ATOM 0 HD13 ILE A 400 8.209 3.564 -2.634 1.00 0.00 H new ATOM 1258 N GLU A 401 5.068 -0.720 -4.746 1.00 0.00 N ATOM 1259 CA GLU A 401 4.186 -1.042 -5.864 1.00 0.00 C ATOM 1260 C GLU A 401 3.055 -1.968 -5.418 1.00 0.00 C ATOM 1261 O GLU A 401 1.913 -1.831 -5.861 1.00 0.00 O ATOM 1262 CB GLU A 401 4.973 -1.703 -6.995 1.00 0.00 C ATOM 1263 CG GLU A 401 6.126 -0.861 -7.517 1.00 0.00 C ATOM 1264 CD GLU A 401 6.807 -1.502 -8.706 1.00 0.00 C ATOM 1265 OE1 GLU A 401 7.629 -2.424 -8.505 1.00 0.00 O ATOM 1266 OE2 GLU A 401 6.509 -1.100 -9.851 1.00 0.00 O ATOM 0 H GLU A 401 6.035 -1.019 -4.874 1.00 0.00 H new ATOM 0 HA GLU A 401 3.754 -0.109 -6.226 1.00 0.00 H new ATOM 0 HB2 GLU A 401 5.364 -2.658 -6.643 1.00 0.00 H new ATOM 0 HB3 GLU A 401 4.293 -1.921 -7.819 1.00 0.00 H new ATOM 0 HG2 GLU A 401 5.756 0.124 -7.800 1.00 0.00 H new ATOM 0 HG3 GLU A 401 6.854 -0.711 -6.720 1.00 0.00 H new ATOM 1273 N ARG A 402 3.381 -2.903 -4.532 1.00 0.00 N ATOM 1274 CA ARG A 402 2.404 -3.862 -4.030 1.00 0.00 C ATOM 1275 C ARG A 402 1.352 -3.160 -3.174 1.00 0.00 C ATOM 1276 O ARG A 402 0.164 -3.465 -3.253 1.00 0.00 O ATOM 1277 CB ARG A 402 3.106 -4.956 -3.221 1.00 0.00 C ATOM 1278 CG ARG A 402 2.179 -6.076 -2.775 1.00 0.00 C ATOM 1279 CD ARG A 402 2.930 -7.151 -2.006 1.00 0.00 C ATOM 1280 NE ARG A 402 3.940 -7.817 -2.827 1.00 0.00 N ATOM 1281 CZ ARG A 402 4.794 -8.728 -2.362 1.00 0.00 C ATOM 1282 NH1 ARG A 402 4.790 -9.056 -1.073 1.00 0.00 N ATOM 1283 NH2 ARG A 402 5.659 -9.304 -3.186 1.00 0.00 N ATOM 0 H ARG A 402 4.318 -3.017 -4.146 1.00 0.00 H new ATOM 0 HA ARG A 402 1.902 -4.322 -4.881 1.00 0.00 H new ATOM 0 HB2 ARG A 402 3.911 -5.380 -3.822 1.00 0.00 H new ATOM 0 HB3 ARG A 402 3.567 -4.506 -2.342 1.00 0.00 H new ATOM 0 HG2 ARG A 402 1.387 -5.666 -2.148 1.00 0.00 H new ATOM 0 HG3 ARG A 402 1.698 -6.520 -3.647 1.00 0.00 H new ATOM 0 HD2 ARG A 402 3.410 -6.704 -1.135 1.00 0.00 H new ATOM 0 HD3 ARG A 402 2.221 -7.891 -1.634 1.00 0.00 H new ATOM 0 HE ARG A 402 3.994 -7.569 -3.815 1.00 0.00 H new ATOM 0 HH11 ARG A 402 4.131 -8.610 -0.435 1.00 0.00 H new ATOM 0 HH12 ARG A 402 5.446 -9.754 -0.722 1.00 0.00 H new ATOM 0 HH21 ARG A 402 5.670 -9.049 -4.174 1.00 0.00 H new ATOM 0 HH22 ARG A 402 6.314 -10.002 -2.832 1.00 0.00 H new ATOM 1297 N LEU A 403 1.793 -2.209 -2.364 1.00 0.00 N ATOM 1298 CA LEU A 403 0.879 -1.432 -1.539 1.00 0.00 C ATOM 1299 C LEU A 403 -0.046 -0.587 -2.409 1.00 0.00 C ATOM 1300 O LEU A 403 -1.260 -0.573 -2.208 1.00 0.00 O ATOM 1301 CB LEU A 403 1.659 -0.531 -0.583 1.00 0.00 C ATOM 1302 CG LEU A 403 2.473 -1.264 0.482 1.00 0.00 C ATOM 1303 CD1 LEU A 403 3.337 -0.287 1.255 1.00 0.00 C ATOM 1304 CD2 LEU A 403 1.557 -2.018 1.432 1.00 0.00 C ATOM 0 H LEU A 403 2.776 -1.957 -2.260 1.00 0.00 H new ATOM 0 HA LEU A 403 0.273 -2.127 -0.957 1.00 0.00 H new ATOM 0 HB2 LEU A 403 2.334 0.094 -1.167 1.00 0.00 H new ATOM 0 HB3 LEU A 403 0.957 0.138 -0.085 1.00 0.00 H new ATOM 0 HG LEU A 403 3.121 -1.983 -0.019 1.00 0.00 H new ATOM 0 HD11 LEU A 403 3.910 -0.826 2.009 1.00 0.00 H new ATOM 0 HD12 LEU A 403 4.021 0.215 0.570 1.00 0.00 H new ATOM 0 HD13 LEU A 403 2.702 0.454 1.742 1.00 0.00 H new ATOM 0 HD21 LEU A 403 2.156 -2.533 2.183 1.00 0.00 H new ATOM 0 HD22 LEU A 403 0.885 -1.315 1.924 1.00 0.00 H new ATOM 0 HD23 LEU A 403 0.972 -2.747 0.871 1.00 0.00 H new ATOM 1316 N ARG A 404 0.538 0.093 -3.388 1.00 0.00 N ATOM 1317 CA ARG A 404 -0.215 0.982 -4.268 1.00 0.00 C ATOM 1318 C ARG A 404 -1.284 0.224 -5.048 1.00 0.00 C ATOM 1319 O ARG A 404 -2.378 0.744 -5.279 1.00 0.00 O ATOM 1320 CB ARG A 404 0.723 1.699 -5.243 1.00 0.00 C ATOM 1321 CG ARG A 404 1.725 2.615 -4.561 1.00 0.00 C ATOM 1322 CD ARG A 404 2.644 3.290 -5.567 1.00 0.00 C ATOM 1323 NE ARG A 404 1.924 4.215 -6.443 1.00 0.00 N ATOM 1324 CZ ARG A 404 2.521 5.111 -7.227 1.00 0.00 C ATOM 1325 NH1 ARG A 404 3.845 5.176 -7.282 1.00 0.00 N ATOM 1326 NH2 ARG A 404 1.792 5.934 -7.968 1.00 0.00 N ATOM 0 H ARG A 404 1.536 0.046 -3.594 1.00 0.00 H new ATOM 0 HA ARG A 404 -0.710 1.720 -3.637 1.00 0.00 H new ATOM 0 HB2 ARG A 404 1.263 0.955 -5.828 1.00 0.00 H new ATOM 0 HB3 ARG A 404 0.127 2.284 -5.944 1.00 0.00 H new ATOM 0 HG2 ARG A 404 1.193 3.374 -3.988 1.00 0.00 H new ATOM 0 HG3 ARG A 404 2.321 2.040 -3.852 1.00 0.00 H new ATOM 0 HD2 ARG A 404 3.426 3.831 -5.035 1.00 0.00 H new ATOM 0 HD3 ARG A 404 3.138 2.530 -6.172 1.00 0.00 H new ATOM 0 HE ARG A 404 0.905 4.171 -6.454 1.00 0.00 H new ATOM 0 HH11 ARG A 404 4.411 4.538 -6.722 1.00 0.00 H new ATOM 0 HH12 ARG A 404 4.297 5.864 -7.884 1.00 0.00 H new ATOM 0 HH21 ARG A 404 0.774 5.881 -7.938 1.00 0.00 H new ATOM 0 HH22 ARG A 404 2.249 6.620 -8.568 1.00 0.00 H new ATOM 1340 N MET A 405 -0.979 -1.007 -5.448 1.00 0.00 N ATOM 1341 CA MET A 405 -1.922 -1.797 -6.235 1.00 0.00 C ATOM 1342 C MET A 405 -3.099 -2.250 -5.373 1.00 0.00 C ATOM 1343 O MET A 405 -4.168 -2.568 -5.886 1.00 0.00 O ATOM 1344 CB MET A 405 -1.229 -3.005 -6.880 1.00 0.00 C ATOM 1345 CG MET A 405 -0.979 -4.167 -5.932 1.00 0.00 C ATOM 1346 SD MET A 405 -0.015 -5.493 -6.685 1.00 0.00 S ATOM 1347 CE MET A 405 -0.998 -5.858 -8.139 1.00 0.00 C ATOM 0 H MET A 405 -0.096 -1.476 -5.243 1.00 0.00 H new ATOM 0 HA MET A 405 -2.304 -1.162 -7.034 1.00 0.00 H new ATOM 0 HB2 MET A 405 -1.839 -3.356 -7.713 1.00 0.00 H new ATOM 0 HB3 MET A 405 -0.276 -2.681 -7.297 1.00 0.00 H new ATOM 0 HG2 MET A 405 -0.457 -3.802 -5.048 1.00 0.00 H new ATOM 0 HG3 MET A 405 -1.935 -4.566 -5.595 1.00 0.00 H new ATOM 0 HE1 MET A 405 -0.712 -6.832 -8.537 1.00 0.00 H new ATOM 0 HE2 MET A 405 -2.054 -5.872 -7.870 1.00 0.00 H new ATOM 0 HE3 MET A 405 -0.827 -5.092 -8.896 1.00 0.00 H new ATOM 1357 N GLU A 406 -2.897 -2.274 -4.062 1.00 0.00 N ATOM 1358 CA GLU A 406 -3.971 -2.600 -3.131 1.00 0.00 C ATOM 1359 C GLU A 406 -4.794 -1.358 -2.817 1.00 0.00 C ATOM 1360 O GLU A 406 -6.024 -1.410 -2.765 1.00 0.00 O ATOM 1361 CB GLU A 406 -3.405 -3.193 -1.840 1.00 0.00 C ATOM 1362 CG GLU A 406 -2.826 -4.584 -2.012 1.00 0.00 C ATOM 1363 CD GLU A 406 -3.845 -5.565 -2.549 1.00 0.00 C ATOM 1364 OE1 GLU A 406 -4.697 -6.037 -1.765 1.00 0.00 O ATOM 1365 OE2 GLU A 406 -3.802 -5.872 -3.756 1.00 0.00 O ATOM 0 H GLU A 406 -2.001 -2.072 -3.619 1.00 0.00 H new ATOM 0 HA GLU A 406 -4.616 -3.343 -3.601 1.00 0.00 H new ATOM 0 HB2 GLU A 406 -2.629 -2.531 -1.456 1.00 0.00 H new ATOM 0 HB3 GLU A 406 -4.195 -3.228 -1.090 1.00 0.00 H new ATOM 0 HG2 GLU A 406 -1.974 -4.540 -2.691 1.00 0.00 H new ATOM 0 HG3 GLU A 406 -2.451 -4.941 -1.053 1.00 0.00 H new ATOM 1372 N ILE A 407 -4.107 -0.240 -2.616 1.00 0.00 N ATOM 1373 CA ILE A 407 -4.772 1.029 -2.348 1.00 0.00 C ATOM 1374 C ILE A 407 -5.687 1.404 -3.508 1.00 0.00 C ATOM 1375 O ILE A 407 -6.848 1.764 -3.306 1.00 0.00 O ATOM 1376 CB ILE A 407 -3.752 2.167 -2.117 1.00 0.00 C ATOM 1377 CG1 ILE A 407 -2.825 1.824 -0.949 1.00 0.00 C ATOM 1378 CG2 ILE A 407 -4.473 3.483 -1.855 1.00 0.00 C ATOM 1379 CD1 ILE A 407 -1.719 2.834 -0.733 1.00 0.00 C ATOM 0 H ILE A 407 -3.089 -0.187 -2.634 1.00 0.00 H new ATOM 0 HA ILE A 407 -5.361 0.902 -1.440 1.00 0.00 H new ATOM 0 HB ILE A 407 -3.148 2.278 -3.017 1.00 0.00 H new ATOM 0 HG12 ILE A 407 -3.417 1.747 -0.037 1.00 0.00 H new ATOM 0 HG13 ILE A 407 -2.381 0.844 -1.125 1.00 0.00 H new ATOM 0 HG21 ILE A 407 -3.740 4.274 -1.694 1.00 0.00 H new ATOM 0 HG22 ILE A 407 -5.095 3.734 -2.714 1.00 0.00 H new ATOM 0 HG23 ILE A 407 -5.100 3.384 -0.969 1.00 0.00 H new ATOM 0 HD11 ILE A 407 -1.103 2.524 0.111 1.00 0.00 H new ATOM 0 HD12 ILE A 407 -1.102 2.895 -1.629 1.00 0.00 H new ATOM 0 HD13 ILE A 407 -2.154 3.811 -0.525 1.00 0.00 H new ATOM 1391 N HIS A 408 -5.159 1.280 -4.724 1.00 0.00 N ATOM 1392 CA HIS A 408 -5.897 1.648 -5.926 1.00 0.00 C ATOM 1393 C HIS A 408 -7.173 0.823 -6.069 1.00 0.00 C ATOM 1394 O HIS A 408 -8.187 1.330 -6.545 1.00 0.00 O ATOM 1395 CB HIS A 408 -5.015 1.482 -7.166 1.00 0.00 C ATOM 1396 CG HIS A 408 -5.660 1.944 -8.438 1.00 0.00 C ATOM 1397 ND1 HIS A 408 -5.711 1.174 -9.577 1.00 0.00 N ATOM 1398 CD2 HIS A 408 -6.274 3.110 -8.747 1.00 0.00 C ATOM 1399 CE1 HIS A 408 -6.324 1.844 -10.532 1.00 0.00 C ATOM 1400 NE2 HIS A 408 -6.677 3.021 -10.054 1.00 0.00 N ATOM 0 H HIS A 408 -4.219 0.926 -4.901 1.00 0.00 H new ATOM 0 HA HIS A 408 -6.183 2.696 -5.834 1.00 0.00 H new ATOM 0 HB2 HIS A 408 -4.089 2.037 -7.018 1.00 0.00 H new ATOM 0 HB3 HIS A 408 -4.744 0.431 -7.269 1.00 0.00 H new ATOM 0 HD2 HIS A 408 -6.419 3.953 -8.087 1.00 0.00 H new ATOM 0 HE1 HIS A 408 -6.506 1.489 -11.536 1.00 0.00 H new ATOM 0 HE2 HIS A 408 -7.170 3.748 -10.573 1.00 0.00 H new ATOM 1409 N LYS A 409 -7.122 -0.441 -5.651 1.00 0.00 N ATOM 1410 CA LYS A 409 -8.307 -1.295 -5.668 1.00 0.00 C ATOM 1411 C LYS A 409 -9.412 -0.664 -4.836 1.00 0.00 C ATOM 1412 O LYS A 409 -10.519 -0.433 -5.318 1.00 0.00 O ATOM 1413 CB LYS A 409 -8.006 -2.684 -5.102 1.00 0.00 C ATOM 1414 CG LYS A 409 -7.038 -3.508 -5.914 1.00 0.00 C ATOM 1415 CD LYS A 409 -6.936 -4.904 -5.332 1.00 0.00 C ATOM 1416 CE LYS A 409 -6.099 -5.812 -6.203 1.00 0.00 C ATOM 1417 NZ LYS A 409 -4.662 -5.438 -6.183 1.00 0.00 N ATOM 0 H LYS A 409 -6.278 -0.893 -5.299 1.00 0.00 H new ATOM 0 HA LYS A 409 -8.621 -1.398 -6.707 1.00 0.00 H new ATOM 0 HB2 LYS A 409 -7.606 -2.570 -4.094 1.00 0.00 H new ATOM 0 HB3 LYS A 409 -8.943 -3.234 -5.013 1.00 0.00 H new ATOM 0 HG2 LYS A 409 -7.371 -3.560 -6.951 1.00 0.00 H new ATOM 0 HG3 LYS A 409 -6.057 -3.033 -5.918 1.00 0.00 H new ATOM 0 HD2 LYS A 409 -6.499 -4.852 -4.335 1.00 0.00 H new ATOM 0 HD3 LYS A 409 -7.935 -5.326 -5.220 1.00 0.00 H new ATOM 0 HE2 LYS A 409 -6.210 -6.842 -5.864 1.00 0.00 H new ATOM 0 HE3 LYS A 409 -6.469 -5.773 -7.228 1.00 0.00 H new ATOM 0 HZ1 LYS A 409 -4.206 -5.765 -7.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 409 -4.573 -4.404 -6.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 409 -4.199 -5.882 -5.365 1.00 0.00 H new ATOM 1431 N ASN A 410 -9.081 -0.370 -3.586 1.00 0.00 N ATOM 1432 CA ASN A 410 -10.035 0.195 -2.643 1.00 0.00 C ATOM 1433 C ASN A 410 -10.547 1.547 -3.125 1.00 0.00 C ATOM 1434 O ASN A 410 -11.728 1.855 -2.980 1.00 0.00 O ATOM 1435 CB ASN A 410 -9.403 0.318 -1.253 1.00 0.00 C ATOM 1436 CG ASN A 410 -9.196 -1.029 -0.579 1.00 0.00 C ATOM 1437 OD1 ASN A 410 -10.060 -1.507 0.152 1.00 0.00 O ATOM 1438 ND2 ASN A 410 -8.048 -1.649 -0.815 1.00 0.00 N ATOM 0 H ASN A 410 -8.149 -0.516 -3.199 1.00 0.00 H new ATOM 0 HA ASN A 410 -10.888 -0.480 -2.577 1.00 0.00 H new ATOM 0 HB2 ASN A 410 -8.443 0.827 -1.339 1.00 0.00 H new ATOM 0 HB3 ASN A 410 -10.039 0.940 -0.623 1.00 0.00 H new ATOM 0 HD21 ASN A 410 -7.859 -2.554 -0.384 1.00 0.00 H new ATOM 0 HD22 ASN A 410 -7.354 -1.221 -1.428 1.00 0.00 H new ATOM 1445 N GLU A 411 -9.663 2.345 -3.718 1.00 0.00 N ATOM 1446 CA GLU A 411 -10.055 3.639 -4.270 1.00 0.00 C ATOM 1447 C GLU A 411 -11.030 3.459 -5.430 1.00 0.00 C ATOM 1448 O GLU A 411 -12.017 4.189 -5.548 1.00 0.00 O ATOM 1449 CB GLU A 411 -8.831 4.429 -4.737 1.00 0.00 C ATOM 1450 CG GLU A 411 -7.868 4.783 -3.617 1.00 0.00 C ATOM 1451 CD GLU A 411 -6.767 5.716 -4.072 1.00 0.00 C ATOM 1452 OE1 GLU A 411 -5.733 5.230 -4.570 1.00 0.00 O ATOM 1453 OE2 GLU A 411 -6.930 6.949 -3.928 1.00 0.00 O ATOM 0 H GLU A 411 -8.674 2.120 -3.828 1.00 0.00 H new ATOM 0 HA GLU A 411 -10.550 4.201 -3.478 1.00 0.00 H new ATOM 0 HB2 GLU A 411 -8.300 3.847 -5.490 1.00 0.00 H new ATOM 0 HB3 GLU A 411 -9.165 5.347 -5.220 1.00 0.00 H new ATOM 0 HG2 GLU A 411 -8.420 5.249 -2.801 1.00 0.00 H new ATOM 0 HG3 GLU A 411 -7.425 3.869 -3.221 1.00 0.00 H new ATOM 1460 N ALA A 412 -10.755 2.475 -6.278 1.00 0.00 N ATOM 1461 CA ALA A 412 -11.619 2.170 -7.410 1.00 0.00 C ATOM 1462 C ALA A 412 -12.989 1.707 -6.931 1.00 0.00 C ATOM 1463 O ALA A 412 -14.016 2.065 -7.512 1.00 0.00 O ATOM 1464 CB ALA A 412 -10.981 1.114 -8.298 1.00 0.00 C ATOM 0 H ALA A 412 -9.936 1.872 -6.201 1.00 0.00 H new ATOM 0 HA ALA A 412 -11.750 3.080 -7.995 1.00 0.00 H new ATOM 0 HB1 ALA A 412 -11.641 0.899 -9.139 1.00 0.00 H new ATOM 0 HB2 ALA A 412 -10.025 1.482 -8.672 1.00 0.00 H new ATOM 0 HB3 ALA A 412 -10.819 0.203 -7.721 1.00 0.00 H new ATOM 1470 N TRP A 413 -13.001 0.912 -5.869 1.00 0.00 N ATOM 1471 CA TRP A 413 -14.250 0.443 -5.289 1.00 0.00 C ATOM 1472 C TRP A 413 -14.980 1.583 -4.583 1.00 0.00 C ATOM 1473 O TRP A 413 -16.206 1.636 -4.598 1.00 0.00 O ATOM 1474 CB TRP A 413 -14.009 -0.725 -4.328 1.00 0.00 C ATOM 1475 CG TRP A 413 -13.496 -1.957 -5.014 1.00 0.00 C ATOM 1476 CD1 TRP A 413 -13.885 -2.437 -6.231 1.00 0.00 C ATOM 1477 CD2 TRP A 413 -12.512 -2.873 -4.518 1.00 0.00 C ATOM 1478 NE1 TRP A 413 -13.189 -3.583 -6.529 1.00 0.00 N ATOM 1479 CE2 TRP A 413 -12.343 -3.873 -5.494 1.00 0.00 C ATOM 1480 CE3 TRP A 413 -11.752 -2.942 -3.347 1.00 0.00 C ATOM 1481 CZ2 TRP A 413 -11.446 -4.925 -5.335 1.00 0.00 C ATOM 1482 CZ3 TRP A 413 -10.862 -3.987 -3.191 1.00 0.00 C ATOM 1483 CH2 TRP A 413 -10.716 -4.966 -4.179 1.00 0.00 C ATOM 0 H TRP A 413 -12.162 0.580 -5.394 1.00 0.00 H new ATOM 0 HA TRP A 413 -14.882 0.083 -6.101 1.00 0.00 H new ATOM 0 HB2 TRP A 413 -13.294 -0.418 -3.564 1.00 0.00 H new ATOM 0 HB3 TRP A 413 -14.941 -0.964 -3.815 1.00 0.00 H new ATOM 0 HD1 TRP A 413 -14.631 -1.982 -6.866 1.00 0.00 H new ATOM 0 HE1 TRP A 413 -13.287 -4.130 -7.384 1.00 0.00 H new ATOM 0 HE3 TRP A 413 -11.859 -2.192 -2.578 1.00 0.00 H new ATOM 0 HZ2 TRP A 413 -11.330 -5.682 -6.097 1.00 0.00 H new ATOM 0 HZ3 TRP A 413 -10.269 -4.049 -2.291 1.00 0.00 H new ATOM 0 HH2 TRP A 413 -10.012 -5.771 -4.026 1.00 0.00 H new ATOM 1494 N LEU A 414 -14.229 2.500 -3.973 1.00 0.00 N ATOM 1495 CA LEU A 414 -14.824 3.697 -3.378 1.00 0.00 C ATOM 1496 C LEU A 414 -15.573 4.491 -4.431 1.00 0.00 C ATOM 1497 O LEU A 414 -16.692 4.943 -4.199 1.00 0.00 O ATOM 1498 CB LEU A 414 -13.764 4.591 -2.735 1.00 0.00 C ATOM 1499 CG LEU A 414 -13.192 4.100 -1.408 1.00 0.00 C ATOM 1500 CD1 LEU A 414 -12.137 5.068 -0.911 1.00 0.00 C ATOM 1501 CD2 LEU A 414 -14.296 3.939 -0.371 1.00 0.00 C ATOM 0 H LEU A 414 -13.215 2.438 -3.878 1.00 0.00 H new ATOM 0 HA LEU A 414 -15.515 3.366 -2.603 1.00 0.00 H new ATOM 0 HB2 LEU A 414 -12.942 4.711 -3.440 1.00 0.00 H new ATOM 0 HB3 LEU A 414 -14.197 5.579 -2.578 1.00 0.00 H new ATOM 0 HG LEU A 414 -12.732 3.125 -1.567 1.00 0.00 H new ATOM 0 HD11 LEU A 414 -11.733 4.711 0.036 1.00 0.00 H new ATOM 0 HD12 LEU A 414 -11.334 5.139 -1.644 1.00 0.00 H new ATOM 0 HD13 LEU A 414 -12.584 6.051 -0.767 1.00 0.00 H new ATOM 0 HD21 LEU A 414 -13.866 3.588 0.567 1.00 0.00 H new ATOM 0 HD22 LEU A 414 -14.786 4.899 -0.209 1.00 0.00 H new ATOM 0 HD23 LEU A 414 -15.028 3.214 -0.728 1.00 0.00 H new ATOM 1513 N SER A 415 -14.950 4.633 -5.594 1.00 0.00 N ATOM 1514 CA SER A 415 -15.557 5.321 -6.725 1.00 0.00 C ATOM 1515 C SER A 415 -16.925 4.714 -7.049 1.00 0.00 C ATOM 1516 O SER A 415 -17.832 5.404 -7.526 1.00 0.00 O ATOM 1517 CB SER A 415 -14.626 5.230 -7.939 1.00 0.00 C ATOM 1518 OG SER A 415 -15.118 5.986 -9.031 1.00 0.00 O ATOM 0 H SER A 415 -14.013 4.276 -5.779 1.00 0.00 H new ATOM 0 HA SER A 415 -15.705 6.370 -6.468 1.00 0.00 H new ATOM 0 HB2 SER A 415 -13.634 5.589 -7.665 1.00 0.00 H new ATOM 0 HB3 SER A 415 -14.517 4.187 -8.237 1.00 0.00 H new ATOM 0 HG SER A 415 -14.500 5.908 -9.788 1.00 0.00 H new ATOM 1524 N GLU A 416 -17.068 3.423 -6.775 1.00 0.00 N ATOM 1525 CA GLU A 416 -18.326 2.728 -6.981 1.00 0.00 C ATOM 1526 C GLU A 416 -19.262 2.924 -5.791 1.00 0.00 C ATOM 1527 O GLU A 416 -20.412 3.318 -5.964 1.00 0.00 O ATOM 1528 CB GLU A 416 -18.079 1.234 -7.207 1.00 0.00 C ATOM 1529 CG GLU A 416 -17.326 0.926 -8.488 1.00 0.00 C ATOM 1530 CD GLU A 416 -18.069 1.399 -9.719 1.00 0.00 C ATOM 1531 OE1 GLU A 416 -19.134 0.827 -10.031 1.00 0.00 O ATOM 1532 OE2 GLU A 416 -17.602 2.356 -10.373 1.00 0.00 O ATOM 0 H GLU A 416 -16.320 2.835 -6.407 1.00 0.00 H new ATOM 0 HA GLU A 416 -18.801 3.150 -7.867 1.00 0.00 H new ATOM 0 HB2 GLU A 416 -17.518 0.836 -6.362 1.00 0.00 H new ATOM 0 HB3 GLU A 416 -19.037 0.715 -7.226 1.00 0.00 H new ATOM 0 HG2 GLU A 416 -16.345 1.401 -8.453 1.00 0.00 H new ATOM 0 HG3 GLU A 416 -17.158 -0.149 -8.558 1.00 0.00 H new ATOM 1539 N VAL A 417 -18.762 2.661 -4.584 1.00 0.00 N ATOM 1540 CA VAL A 417 -19.588 2.710 -3.377 1.00 0.00 C ATOM 1541 C VAL A 417 -20.103 4.113 -3.098 1.00 0.00 C ATOM 1542 O VAL A 417 -21.288 4.306 -2.825 1.00 0.00 O ATOM 1543 CB VAL A 417 -18.834 2.212 -2.124 1.00 0.00 C ATOM 1544 CG1 VAL A 417 -19.779 2.152 -0.932 1.00 0.00 C ATOM 1545 CG2 VAL A 417 -18.202 0.852 -2.370 1.00 0.00 C ATOM 0 H VAL A 417 -17.787 2.411 -4.415 1.00 0.00 H new ATOM 0 HA VAL A 417 -20.427 2.044 -3.577 1.00 0.00 H new ATOM 0 HB VAL A 417 -18.034 2.919 -1.905 1.00 0.00 H new ATOM 0 HG11 VAL A 417 -19.236 1.800 -0.055 1.00 0.00 H new ATOM 0 HG12 VAL A 417 -20.180 3.146 -0.735 1.00 0.00 H new ATOM 0 HG13 VAL A 417 -20.598 1.467 -1.151 1.00 0.00 H new ATOM 0 HG21 VAL A 417 -17.678 0.526 -1.471 1.00 0.00 H new ATOM 0 HG22 VAL A 417 -18.979 0.129 -2.619 1.00 0.00 H new ATOM 0 HG23 VAL A 417 -17.495 0.924 -3.196 1.00 0.00 H new ATOM 1555 N GLU A 418 -19.219 5.091 -3.180 1.00 0.00 N ATOM 1556 CA GLU A 418 -19.584 6.467 -2.875 1.00 0.00 C ATOM 1557 C GLU A 418 -20.610 6.975 -3.879 1.00 0.00 C ATOM 1558 O GLU A 418 -21.525 7.711 -3.522 1.00 0.00 O ATOM 1559 CB GLU A 418 -18.349 7.369 -2.858 1.00 0.00 C ATOM 1560 CG GLU A 418 -17.296 6.933 -1.852 1.00 0.00 C ATOM 1561 CD GLU A 418 -16.211 7.971 -1.650 1.00 0.00 C ATOM 1562 OE1 GLU A 418 -15.356 8.132 -2.544 1.00 0.00 O ATOM 1563 OE2 GLU A 418 -16.215 8.636 -0.593 1.00 0.00 O ATOM 0 H GLU A 418 -18.245 4.961 -3.454 1.00 0.00 H new ATOM 0 HA GLU A 418 -20.030 6.492 -1.881 1.00 0.00 H new ATOM 0 HB2 GLU A 418 -17.905 7.384 -3.854 1.00 0.00 H new ATOM 0 HB3 GLU A 418 -18.657 8.390 -2.631 1.00 0.00 H new ATOM 0 HG2 GLU A 418 -17.777 6.726 -0.896 1.00 0.00 H new ATOM 0 HG3 GLU A 418 -16.842 6.001 -2.189 1.00 0.00 H new