USER MOD reduce.3.24.130724 H: found=0, std=0, add=572, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 573 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 451 ASN : amide:sc= -0.0223 K(o=-0.34,f=-8.1!) USER MOD Set 1.2: A 454 SER OG : rot 180:sc= -0.315 USER MOD Set 2.1: A 429 SER OG : rot 90:sc= -2.35! USER MOD Set 2.2: A 448 SER OG : rot 110:sc= 0.164 USER MOD Single : A 395 LYS NZ :NH3+ 161:sc= -0.0457 (180deg=-0.331) USER MOD Single : A 402 ASN : amide:sc= -6.1! C(o=-6.1!,f=-9.6!) USER MOD Single : A 406 TYR OH : rot 180:sc= -0.17 USER MOD Single : A 407 HIS :FLIP no HD1:sc= -0.624 F(o=-2.4!,f=-0.62) USER MOD Single : A 410 GLN : amide:sc= 0 X(o=0,f=-0.22) USER MOD Single : A 415 GLN : amide:sc= -0.0295 K(o=-0.029,f=-2.6!) USER MOD Single : A 419 GLN : amide:sc= 0 K(o=0,f=-0.62) USER MOD Single : A 420 MET CE :methyl -136:sc= -0.581 (180deg=-3.25!) USER MOD Single : A 422 MET CE :methyl -107:sc= -1.87 (180deg=-3.51!) USER MOD Single : A 426 ASN : amide:sc= -0.104 X(o=-0.1,f=-0.1) USER MOD Single : A 431 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 443 CYS SG : rot 180:sc= -0.0215 USER MOD Single : A 449 TYR OH : rot -113:sc= 1.12 USER MOD Single : A 456 GLN : amide:sc= -0.48 X(o=-0.48,f=-0.062) USER MOD Single : A 460 GLN : amide:sc= -0.019 X(o=-0.019,f=-0.23) USER MOD Single : A 461 SER OG : rot 180:sc= 0 USER MOD Single : A 462 MET CE :methyl -119:sc= -0.352 (180deg=-4.27!) USER MOD Single : A 463 ASN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 466 GLN : amide:sc= -0.324 X(o=-0.32,f=-0.64) USER MOD Single : A 469 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 470 LYS NZ :NH3+ 139:sc= -0.784 (180deg=-2.23!) USER MOD Single : A 473 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 475 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 477 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 225 N LYS A 395 9.283 4.636 4.231 1.00 0.00 N ATOM 226 CA LYS A 395 8.995 6.050 4.023 1.00 0.00 C ATOM 227 C LYS A 395 7.558 6.249 3.553 1.00 0.00 C ATOM 228 O LYS A 395 6.893 5.299 3.141 1.00 0.00 O ATOM 229 CB LYS A 395 9.965 6.643 2.998 1.00 0.00 C ATOM 230 CG LYS A 395 11.425 6.367 3.311 1.00 0.00 C ATOM 231 CD LYS A 395 12.294 6.492 2.071 1.00 0.00 C ATOM 232 CE LYS A 395 12.566 7.948 1.725 1.00 0.00 C ATOM 233 NZ LYS A 395 13.449 8.601 2.732 1.00 0.00 N ATOM 0 HA LYS A 395 9.122 6.565 4.975 1.00 0.00 H new ATOM 0 HB2 LYS A 395 9.731 6.239 2.013 1.00 0.00 H new ATOM 0 HB3 LYS A 395 9.811 7.721 2.946 1.00 0.00 H new ATOM 0 HG2 LYS A 395 11.773 7.065 4.072 1.00 0.00 H new ATOM 0 HG3 LYS A 395 11.526 5.365 3.728 1.00 0.00 H new ATOM 0 HD2 LYS A 395 13.239 5.973 2.234 1.00 0.00 H new ATOM 0 HD3 LYS A 395 11.802 6.003 1.230 1.00 0.00 H new ATOM 0 HE2 LYS A 395 13.031 8.007 0.741 1.00 0.00 H new ATOM 0 HE3 LYS A 395 11.622 8.489 1.664 1.00 0.00 H new ATOM 0 HZ1 LYS A 395 13.870 9.458 2.321 1.00 0.00 H new ATOM 0 HZ2 LYS A 395 12.889 8.858 3.570 1.00 0.00 H new ATOM 0 HZ3 LYS A 395 14.205 7.943 3.009 1.00 0.00 H new ATOM 247 N GLU A 396 7.086 7.490 3.617 1.00 0.00 N ATOM 248 CA GLU A 396 5.726 7.812 3.197 1.00 0.00 C ATOM 249 C GLU A 396 5.734 8.857 2.086 1.00 0.00 C ATOM 250 O GLU A 396 6.792 9.282 1.625 1.00 0.00 O ATOM 251 CB GLU A 396 4.909 8.321 4.386 1.00 0.00 C ATOM 252 CG GLU A 396 5.479 9.576 5.023 1.00 0.00 C ATOM 253 CD GLU A 396 5.033 9.754 6.462 1.00 0.00 C ATOM 254 OE1 GLU A 396 5.502 8.987 7.329 1.00 0.00 O ATOM 255 OE2 GLU A 396 4.213 10.661 6.720 1.00 0.00 O ATOM 0 H GLU A 396 7.624 8.288 3.955 1.00 0.00 H new ATOM 0 HA GLU A 396 5.266 6.902 2.813 1.00 0.00 H new ATOM 0 HB2 GLU A 396 3.890 8.522 4.056 1.00 0.00 H new ATOM 0 HB3 GLU A 396 4.851 7.535 5.139 1.00 0.00 H new ATOM 0 HG2 GLU A 396 6.568 9.535 4.986 1.00 0.00 H new ATOM 0 HG3 GLU A 396 5.173 10.445 4.441 1.00 0.00 H new ATOM 262 N GLY A 397 4.543 9.268 1.659 1.00 0.00 N ATOM 263 CA GLY A 397 4.434 10.259 0.605 1.00 0.00 C ATOM 264 C GLY A 397 4.067 11.631 1.134 1.00 0.00 C ATOM 265 O GLY A 397 4.187 11.911 2.327 1.00 0.00 O ATOM 0 H GLY A 397 3.652 8.932 2.025 1.00 0.00 H new ATOM 0 HA2 GLY A 397 5.381 10.321 0.070 1.00 0.00 H new ATOM 0 HA3 GLY A 397 3.682 9.938 -0.115 1.00 0.00 H new ATOM 269 N PRO A 398 3.610 12.514 0.235 1.00 0.00 N ATOM 270 CA PRO A 398 3.216 13.880 0.596 1.00 0.00 C ATOM 271 C PRO A 398 2.272 13.913 1.793 1.00 0.00 C ATOM 272 O PRO A 398 1.606 12.925 2.097 1.00 0.00 O ATOM 273 CB PRO A 398 2.503 14.386 -0.661 1.00 0.00 C ATOM 274 CG PRO A 398 3.076 13.579 -1.774 1.00 0.00 C ATOM 275 CD PRO A 398 3.441 12.248 -1.203 1.00 0.00 C ATOM 0 HA PRO A 398 4.072 14.487 0.892 1.00 0.00 H new ATOM 0 HB2 PRO A 398 1.424 14.248 -0.587 1.00 0.00 H new ATOM 0 HB3 PRO A 398 2.678 15.451 -0.814 1.00 0.00 H new ATOM 0 HG2 PRO A 398 2.353 13.467 -2.582 1.00 0.00 H new ATOM 0 HG3 PRO A 398 3.952 14.071 -2.196 1.00 0.00 H new ATOM 0 HD2 PRO A 398 2.661 11.508 -1.384 1.00 0.00 H new ATOM 0 HD3 PRO A 398 4.357 11.860 -1.648 1.00 0.00 H new ATOM 283 N GLU A 399 2.222 15.057 2.469 1.00 0.00 N ATOM 284 CA GLU A 399 1.360 15.219 3.634 1.00 0.00 C ATOM 285 C GLU A 399 -0.111 15.156 3.234 1.00 0.00 C ATOM 286 O GLU A 399 -0.763 16.185 3.060 1.00 0.00 O ATOM 287 CB GLU A 399 1.654 16.548 4.334 1.00 0.00 C ATOM 288 CG GLU A 399 0.798 16.790 5.565 1.00 0.00 C ATOM 289 CD GLU A 399 1.405 17.811 6.506 1.00 0.00 C ATOM 290 OE1 GLU A 399 1.137 19.017 6.324 1.00 0.00 O ATOM 291 OE2 GLU A 399 2.149 17.406 7.423 1.00 0.00 O ATOM 0 H GLU A 399 2.768 15.885 2.230 1.00 0.00 H new ATOM 0 HA GLU A 399 1.567 14.401 4.324 1.00 0.00 H new ATOM 0 HB2 GLU A 399 2.705 16.572 4.622 1.00 0.00 H new ATOM 0 HB3 GLU A 399 1.498 17.363 3.628 1.00 0.00 H new ATOM 0 HG2 GLU A 399 -0.190 17.130 5.255 1.00 0.00 H new ATOM 0 HG3 GLU A 399 0.659 15.849 6.097 1.00 0.00 H new ATOM 298 N GLY A 400 -0.628 13.939 3.091 1.00 0.00 N ATOM 299 CA GLY A 400 -2.018 13.763 2.713 1.00 0.00 C ATOM 300 C GLY A 400 -2.240 12.513 1.885 1.00 0.00 C ATOM 301 O GLY A 400 -3.367 12.035 1.761 1.00 0.00 O ATOM 0 H GLY A 400 -0.109 13.072 3.230 1.00 0.00 H new ATOM 0 HA2 GLY A 400 -2.632 13.713 3.612 1.00 0.00 H new ATOM 0 HA3 GLY A 400 -2.351 14.633 2.147 1.00 0.00 H new ATOM 305 N ALA A 401 -1.163 11.984 1.315 1.00 0.00 N ATOM 306 CA ALA A 401 -1.244 10.783 0.493 1.00 0.00 C ATOM 307 C ALA A 401 -0.659 9.578 1.223 1.00 0.00 C ATOM 308 O ALA A 401 0.475 9.620 1.698 1.00 0.00 O ATOM 309 CB ALA A 401 -0.529 10.998 -0.831 1.00 0.00 C ATOM 0 H ALA A 401 -0.223 12.369 1.407 1.00 0.00 H new ATOM 0 HA ALA A 401 -2.296 10.580 0.295 1.00 0.00 H new ATOM 0 HB1 ALA A 401 -0.598 10.092 -1.433 1.00 0.00 H new ATOM 0 HB2 ALA A 401 -0.995 11.826 -1.366 1.00 0.00 H new ATOM 0 HB3 ALA A 401 0.520 11.230 -0.645 1.00 0.00 H new ATOM 315 N ASN A 402 -1.441 8.507 1.310 1.00 0.00 N ATOM 316 CA ASN A 402 -1.000 7.291 1.984 1.00 0.00 C ATOM 317 C ASN A 402 -1.798 6.082 1.503 1.00 0.00 C ATOM 318 O ASN A 402 -2.802 6.226 0.804 1.00 0.00 O ATOM 319 CB ASN A 402 -1.145 7.442 3.499 1.00 0.00 C ATOM 320 CG ASN A 402 -1.128 8.892 3.940 1.00 0.00 C ATOM 321 OD1 ASN A 402 -2.177 9.505 4.139 1.00 0.00 O ATOM 322 ND2 ASN A 402 0.067 9.449 4.095 1.00 0.00 N ATOM 0 H ASN A 402 -2.383 8.456 0.922 1.00 0.00 H new ATOM 0 HA ASN A 402 0.050 7.131 1.740 1.00 0.00 H new ATOM 0 HB2 ASN A 402 -2.078 6.979 3.820 1.00 0.00 H new ATOM 0 HB3 ASN A 402 -0.336 6.905 3.994 1.00 0.00 H new ATOM 0 HD21 ASN A 402 0.141 10.423 4.390 1.00 0.00 H new ATOM 0 HD22 ASN A 402 0.911 8.903 3.919 1.00 0.00 H new ATOM 329 N LEU A 403 -1.343 4.892 1.881 1.00 0.00 N ATOM 330 CA LEU A 403 -2.015 3.658 1.490 1.00 0.00 C ATOM 331 C LEU A 403 -1.624 2.509 2.414 1.00 0.00 C ATOM 332 O LEU A 403 -0.464 2.102 2.458 1.00 0.00 O ATOM 333 CB LEU A 403 -1.671 3.304 0.042 1.00 0.00 C ATOM 334 CG LEU A 403 -2.435 4.071 -1.037 1.00 0.00 C ATOM 335 CD1 LEU A 403 -2.122 3.507 -2.415 1.00 0.00 C ATOM 336 CD2 LEU A 403 -3.932 4.023 -0.766 1.00 0.00 C ATOM 0 H LEU A 403 -0.512 4.756 2.457 1.00 0.00 H new ATOM 0 HA LEU A 403 -3.090 3.816 1.573 1.00 0.00 H new ATOM 0 HB2 LEU A 403 -0.604 3.471 -0.108 1.00 0.00 H new ATOM 0 HB3 LEU A 403 -1.850 2.239 -0.103 1.00 0.00 H new ATOM 0 HG LEU A 403 -2.115 5.113 -1.012 1.00 0.00 H new ATOM 0 HD11 LEU A 403 -2.675 4.065 -3.171 1.00 0.00 H new ATOM 0 HD12 LEU A 403 -1.053 3.594 -2.609 1.00 0.00 H new ATOM 0 HD13 LEU A 403 -2.414 2.458 -2.453 1.00 0.00 H new ATOM 0 HD21 LEU A 403 -4.460 4.574 -1.544 1.00 0.00 H new ATOM 0 HD22 LEU A 403 -4.268 2.986 -0.764 1.00 0.00 H new ATOM 0 HD23 LEU A 403 -4.141 4.474 0.204 1.00 0.00 H new ATOM 348 N PHE A 404 -2.602 1.989 3.148 1.00 0.00 N ATOM 349 CA PHE A 404 -2.360 0.885 4.071 1.00 0.00 C ATOM 350 C PHE A 404 -3.206 -0.330 3.698 1.00 0.00 C ATOM 351 O PHE A 404 -4.430 -0.309 3.827 1.00 0.00 O ATOM 352 CB PHE A 404 -2.669 1.315 5.506 1.00 0.00 C ATOM 353 CG PHE A 404 -1.588 2.154 6.127 1.00 0.00 C ATOM 354 CD1 PHE A 404 -1.358 3.447 5.687 1.00 0.00 C ATOM 355 CD2 PHE A 404 -0.802 1.648 7.150 1.00 0.00 C ATOM 356 CE1 PHE A 404 -0.363 4.220 6.256 1.00 0.00 C ATOM 357 CE2 PHE A 404 0.193 2.416 7.723 1.00 0.00 C ATOM 358 CZ PHE A 404 0.413 3.704 7.276 1.00 0.00 C ATOM 0 H PHE A 404 -3.569 2.313 3.122 1.00 0.00 H new ATOM 0 HA PHE A 404 -1.308 0.609 4.001 1.00 0.00 H new ATOM 0 HB2 PHE A 404 -3.604 1.876 5.515 1.00 0.00 H new ATOM 0 HB3 PHE A 404 -2.824 0.426 6.118 1.00 0.00 H new ATOM 0 HD1 PHE A 404 -1.962 3.856 4.891 1.00 0.00 H new ATOM 0 HD2 PHE A 404 -0.969 0.641 7.503 1.00 0.00 H new ATOM 0 HE1 PHE A 404 -0.192 5.226 5.903 1.00 0.00 H new ATOM 0 HE2 PHE A 404 0.798 2.010 8.520 1.00 0.00 H new ATOM 0 HZ PHE A 404 1.190 4.307 7.723 1.00 0.00 H new ATOM 368 N ILE A 405 -2.543 -1.385 3.237 1.00 0.00 N ATOM 369 CA ILE A 405 -3.232 -2.608 2.847 1.00 0.00 C ATOM 370 C ILE A 405 -3.339 -3.577 4.019 1.00 0.00 C ATOM 371 O ILE A 405 -2.374 -3.784 4.757 1.00 0.00 O ATOM 372 CB ILE A 405 -2.515 -3.310 1.678 1.00 0.00 C ATOM 373 CG1 ILE A 405 -2.388 -2.361 0.485 1.00 0.00 C ATOM 374 CG2 ILE A 405 -3.263 -4.573 1.280 1.00 0.00 C ATOM 375 CD1 ILE A 405 -1.377 -1.256 0.696 1.00 0.00 C ATOM 0 H ILE A 405 -1.530 -1.417 3.125 1.00 0.00 H new ATOM 0 HA ILE A 405 -4.233 -2.318 2.527 1.00 0.00 H new ATOM 0 HB ILE A 405 -1.513 -3.591 2.002 1.00 0.00 H new ATOM 0 HG12 ILE A 405 -2.107 -2.936 -0.398 1.00 0.00 H new ATOM 0 HG13 ILE A 405 -3.362 -1.917 0.279 1.00 0.00 H new ATOM 0 HG21 ILE A 405 -2.744 -5.058 0.453 1.00 0.00 H new ATOM 0 HG22 ILE A 405 -3.306 -5.254 2.130 1.00 0.00 H new ATOM 0 HG23 ILE A 405 -4.276 -4.314 0.971 1.00 0.00 H new ATOM 0 HD11 ILE A 405 -1.340 -0.622 -0.190 1.00 0.00 H new ATOM 0 HD12 ILE A 405 -1.668 -0.657 1.559 1.00 0.00 H new ATOM 0 HD13 ILE A 405 -0.393 -1.691 0.871 1.00 0.00 H new ATOM 387 N TYR A 406 -4.515 -4.171 4.183 1.00 0.00 N ATOM 388 CA TYR A 406 -4.749 -5.118 5.268 1.00 0.00 C ATOM 389 C TYR A 406 -5.246 -6.455 4.724 1.00 0.00 C ATOM 390 O TYR A 406 -5.439 -6.616 3.519 1.00 0.00 O ATOM 391 CB TYR A 406 -5.764 -4.549 6.260 1.00 0.00 C ATOM 392 CG TYR A 406 -5.585 -3.073 6.530 1.00 0.00 C ATOM 393 CD1 TYR A 406 -4.545 -2.614 7.330 1.00 0.00 C ATOM 394 CD2 TYR A 406 -6.456 -2.136 5.987 1.00 0.00 C ATOM 395 CE1 TYR A 406 -4.379 -1.265 7.580 1.00 0.00 C ATOM 396 CE2 TYR A 406 -6.296 -0.786 6.230 1.00 0.00 C ATOM 397 CZ TYR A 406 -5.256 -0.355 7.027 1.00 0.00 C ATOM 398 OH TYR A 406 -5.093 0.989 7.273 1.00 0.00 O ATOM 0 H TYR A 406 -5.322 -4.014 3.579 1.00 0.00 H new ATOM 0 HA TYR A 406 -3.803 -5.284 5.783 1.00 0.00 H new ATOM 0 HB2 TYR A 406 -6.770 -4.720 5.876 1.00 0.00 H new ATOM 0 HB3 TYR A 406 -5.685 -5.094 7.201 1.00 0.00 H new ATOM 0 HD1 TYR A 406 -3.855 -3.323 7.763 1.00 0.00 H new ATOM 0 HD2 TYR A 406 -7.273 -2.470 5.364 1.00 0.00 H new ATOM 0 HE1 TYR A 406 -3.567 -0.925 8.205 1.00 0.00 H new ATOM 0 HE2 TYR A 406 -6.981 -0.072 5.798 1.00 0.00 H new ATOM 0 HH TYR A 406 -5.793 1.494 6.809 1.00 0.00 H new ATOM 408 N HIS A 407 -5.450 -7.412 5.624 1.00 0.00 N ATOM 409 CA HIS A 407 -5.926 -8.735 5.237 1.00 0.00 C ATOM 410 C HIS A 407 -5.126 -9.277 4.056 1.00 0.00 C ATOM 411 O HIS A 407 -5.691 -9.656 3.030 1.00 0.00 O ATOM 412 CB HIS A 407 -7.411 -8.683 4.879 1.00 0.00 C ATOM 413 CG HIS A 407 -8.261 -8.056 5.942 1.00 0.00 C ATOM 414 ND1 HIS A 407 -7.987 -7.072 6.830 1.00 0.00 N flip ATOM 415 CD2 HIS A 407 -9.565 -8.435 6.183 1.00 0.00 C flip ATOM 416 CE1 HIS A 407 -9.117 -6.876 7.584 1.00 0.00 C flip ATOM 417 NE2 HIS A 407 -10.055 -7.711 7.174 1.00 0.00 N flip ATOM 0 H HIS A 407 -5.293 -7.296 6.625 1.00 0.00 H new ATOM 0 HA HIS A 407 -5.788 -9.405 6.086 1.00 0.00 H new ATOM 0 HB2 HIS A 407 -7.533 -8.125 3.951 1.00 0.00 H new ATOM 0 HB3 HIS A 407 -7.767 -9.696 4.691 1.00 0.00 H new ATOM 0 HD2 HIS A 407 -10.102 -9.203 5.646 1.00 0.00 H new ATOM 0 HE1 HIS A 407 -9.222 -6.156 8.382 1.00 0.00 H new ATOM 0 HE2 HIS A 407 -10.997 -7.784 7.557 1.00 0.00 H new ATOM 425 N LEU A 408 -3.806 -9.308 4.207 1.00 0.00 N ATOM 426 CA LEU A 408 -2.927 -9.802 3.153 1.00 0.00 C ATOM 427 C LEU A 408 -2.560 -11.263 3.390 1.00 0.00 C ATOM 428 O LEU A 408 -2.325 -11.694 4.520 1.00 0.00 O ATOM 429 CB LEU A 408 -1.658 -8.951 3.079 1.00 0.00 C ATOM 430 CG LEU A 408 -1.783 -7.622 2.334 1.00 0.00 C ATOM 431 CD1 LEU A 408 -0.551 -6.763 2.565 1.00 0.00 C ATOM 432 CD2 LEU A 408 -1.997 -7.864 0.846 1.00 0.00 C ATOM 0 H LEU A 408 -3.321 -8.997 5.049 1.00 0.00 H new ATOM 0 HA LEU A 408 -3.461 -9.730 2.206 1.00 0.00 H new ATOM 0 HB2 LEU A 408 -1.323 -8.744 4.096 1.00 0.00 H new ATOM 0 HB3 LEU A 408 -0.877 -9.541 2.600 1.00 0.00 H new ATOM 0 HG LEU A 408 -2.650 -7.088 2.723 1.00 0.00 H new ATOM 0 HD11 LEU A 408 -0.658 -5.821 2.027 1.00 0.00 H new ATOM 0 HD12 LEU A 408 -0.442 -6.562 3.631 1.00 0.00 H new ATOM 0 HD13 LEU A 408 0.332 -7.289 2.203 1.00 0.00 H new ATOM 0 HD21 LEU A 408 -2.084 -6.907 0.331 1.00 0.00 H new ATOM 0 HD22 LEU A 408 -1.150 -8.418 0.442 1.00 0.00 H new ATOM 0 HD23 LEU A 408 -2.911 -8.440 0.699 1.00 0.00 H new ATOM 444 N PRO A 409 -2.507 -12.045 2.301 1.00 0.00 N ATOM 445 CA PRO A 409 -2.167 -13.470 2.365 1.00 0.00 C ATOM 446 C PRO A 409 -0.897 -13.727 3.170 1.00 0.00 C ATOM 447 O PRO A 409 -0.343 -12.812 3.778 1.00 0.00 O ATOM 448 CB PRO A 409 -1.956 -13.850 0.898 1.00 0.00 C ATOM 449 CG PRO A 409 -2.796 -12.886 0.132 1.00 0.00 C ATOM 450 CD PRO A 409 -2.777 -11.599 0.924 1.00 0.00 C ATOM 0 HA PRO A 409 -2.942 -14.052 2.863 1.00 0.00 H new ATOM 0 HB2 PRO A 409 -0.906 -13.771 0.616 1.00 0.00 H new ATOM 0 HB3 PRO A 409 -2.261 -14.879 0.708 1.00 0.00 H new ATOM 0 HG2 PRO A 409 -2.398 -12.733 -0.871 1.00 0.00 H new ATOM 0 HG3 PRO A 409 -3.814 -13.259 0.018 1.00 0.00 H new ATOM 0 HD2 PRO A 409 -2.006 -10.918 0.564 1.00 0.00 H new ATOM 0 HD3 PRO A 409 -3.727 -11.070 0.853 1.00 0.00 H new ATOM 458 N GLN A 410 -0.443 -14.976 3.167 1.00 0.00 N ATOM 459 CA GLN A 410 0.762 -15.351 3.897 1.00 0.00 C ATOM 460 C GLN A 410 1.982 -15.333 2.981 1.00 0.00 C ATOM 461 O GLN A 410 3.100 -15.082 3.428 1.00 0.00 O ATOM 462 CB GLN A 410 0.596 -16.740 4.517 1.00 0.00 C ATOM 463 CG GLN A 410 1.733 -17.132 5.446 1.00 0.00 C ATOM 464 CD GLN A 410 1.415 -18.361 6.274 1.00 0.00 C ATOM 465 OE1 GLN A 410 0.352 -18.450 6.889 1.00 0.00 O ATOM 466 NE2 GLN A 410 2.336 -19.318 6.291 1.00 0.00 N ATOM 0 H GLN A 410 -0.891 -15.745 2.668 1.00 0.00 H new ATOM 0 HA GLN A 410 0.917 -14.621 4.692 1.00 0.00 H new ATOM 0 HB2 GLN A 410 -0.342 -16.771 5.071 1.00 0.00 H new ATOM 0 HB3 GLN A 410 0.519 -17.478 3.719 1.00 0.00 H new ATOM 0 HG2 GLN A 410 2.631 -17.319 4.856 1.00 0.00 H new ATOM 0 HG3 GLN A 410 1.957 -16.298 6.112 1.00 0.00 H new ATOM 0 HE21 GLN A 410 3.203 -19.201 5.766 1.00 0.00 H new ATOM 0 HE22 GLN A 410 2.177 -20.170 6.829 1.00 0.00 H new ATOM 475 N GLU A 411 1.756 -15.601 1.699 1.00 0.00 N ATOM 476 CA GLU A 411 2.838 -15.616 0.722 1.00 0.00 C ATOM 477 C GLU A 411 3.221 -14.197 0.310 1.00 0.00 C ATOM 478 O GLU A 411 4.316 -13.959 -0.197 1.00 0.00 O ATOM 479 CB GLU A 411 2.430 -16.423 -0.513 1.00 0.00 C ATOM 480 CG GLU A 411 1.177 -15.901 -1.194 1.00 0.00 C ATOM 481 CD GLU A 411 0.990 -16.469 -2.588 1.00 0.00 C ATOM 482 OE1 GLU A 411 0.971 -17.710 -2.724 1.00 0.00 O ATOM 483 OE2 GLU A 411 0.864 -15.674 -3.542 1.00 0.00 O ATOM 0 H GLU A 411 0.835 -15.810 1.313 1.00 0.00 H new ATOM 0 HA GLU A 411 3.704 -16.088 1.187 1.00 0.00 H new ATOM 0 HB2 GLU A 411 3.252 -16.416 -1.229 1.00 0.00 H new ATOM 0 HB3 GLU A 411 2.269 -17.461 -0.222 1.00 0.00 H new ATOM 0 HG2 GLU A 411 0.307 -16.149 -0.585 1.00 0.00 H new ATOM 0 HG3 GLU A 411 1.226 -14.814 -1.252 1.00 0.00 H new ATOM 490 N PHE A 412 2.308 -13.257 0.533 1.00 0.00 N ATOM 491 CA PHE A 412 2.546 -11.861 0.184 1.00 0.00 C ATOM 492 C PHE A 412 3.684 -11.280 1.019 1.00 0.00 C ATOM 493 O PHE A 412 3.683 -11.380 2.246 1.00 0.00 O ATOM 494 CB PHE A 412 1.275 -11.037 0.390 1.00 0.00 C ATOM 495 CG PHE A 412 0.401 -10.968 -0.829 1.00 0.00 C ATOM 496 CD1 PHE A 412 -0.078 -12.125 -1.422 1.00 0.00 C ATOM 497 CD2 PHE A 412 0.060 -9.745 -1.385 1.00 0.00 C ATOM 498 CE1 PHE A 412 -0.882 -12.065 -2.544 1.00 0.00 C ATOM 499 CE2 PHE A 412 -0.745 -9.678 -2.506 1.00 0.00 C ATOM 500 CZ PHE A 412 -1.215 -10.840 -3.088 1.00 0.00 C ATOM 0 H PHE A 412 1.396 -13.437 0.954 1.00 0.00 H new ATOM 0 HA PHE A 412 2.830 -11.818 -0.867 1.00 0.00 H new ATOM 0 HB2 PHE A 412 0.703 -11.465 1.213 1.00 0.00 H new ATOM 0 HB3 PHE A 412 1.552 -10.025 0.687 1.00 0.00 H new ATOM 0 HD1 PHE A 412 0.180 -13.086 -1.002 1.00 0.00 H new ATOM 0 HD2 PHE A 412 0.428 -8.834 -0.937 1.00 0.00 H new ATOM 0 HE1 PHE A 412 -1.250 -12.975 -2.995 1.00 0.00 H new ATOM 0 HE2 PHE A 412 -1.007 -8.718 -2.927 1.00 0.00 H new ATOM 0 HZ PHE A 412 -1.841 -10.790 -3.966 1.00 0.00 H new ATOM 510 N GLY A 413 4.655 -10.671 0.345 1.00 0.00 N ATOM 511 CA GLY A 413 5.785 -10.083 1.039 1.00 0.00 C ATOM 512 C GLY A 413 5.875 -8.584 0.835 1.00 0.00 C ATOM 513 O GLY A 413 4.858 -7.888 0.839 1.00 0.00 O ATOM 0 H GLY A 413 4.679 -10.575 -0.670 1.00 0.00 H new ATOM 0 HA2 GLY A 413 5.704 -10.297 2.105 1.00 0.00 H new ATOM 0 HA3 GLY A 413 6.705 -10.550 0.689 1.00 0.00 H new ATOM 517 N ASP A 414 7.092 -8.084 0.659 1.00 0.00 N ATOM 518 CA ASP A 414 7.311 -6.657 0.453 1.00 0.00 C ATOM 519 C ASP A 414 7.216 -6.300 -1.027 1.00 0.00 C ATOM 520 O ASP A 414 6.714 -5.237 -1.388 1.00 0.00 O ATOM 521 CB ASP A 414 8.677 -6.244 1.004 1.00 0.00 C ATOM 522 CG ASP A 414 8.730 -6.297 2.518 1.00 0.00 C ATOM 523 OD1 ASP A 414 7.922 -7.038 3.114 1.00 0.00 O ATOM 524 OD2 ASP A 414 9.578 -5.594 3.107 1.00 0.00 O ATOM 0 H ASP A 414 7.943 -8.646 0.655 1.00 0.00 H new ATOM 0 HA ASP A 414 6.533 -6.114 0.989 1.00 0.00 H new ATOM 0 HB2 ASP A 414 9.445 -6.900 0.593 1.00 0.00 H new ATOM 0 HB3 ASP A 414 8.910 -5.233 0.670 1.00 0.00 H new ATOM 529 N GLN A 415 7.705 -7.197 -1.879 1.00 0.00 N ATOM 530 CA GLN A 415 7.678 -6.976 -3.319 1.00 0.00 C ATOM 531 C GLN A 415 6.256 -7.085 -3.860 1.00 0.00 C ATOM 532 O GLN A 415 5.735 -6.145 -4.461 1.00 0.00 O ATOM 533 CB GLN A 415 8.585 -7.982 -4.029 1.00 0.00 C ATOM 534 CG GLN A 415 10.063 -7.777 -3.741 1.00 0.00 C ATOM 535 CD GLN A 415 10.694 -6.729 -4.637 1.00 0.00 C ATOM 536 OE1 GLN A 415 10.059 -5.735 -4.991 1.00 0.00 O ATOM 537 NE2 GLN A 415 11.949 -6.947 -5.010 1.00 0.00 N ATOM 0 H GLN A 415 8.124 -8.083 -1.596 1.00 0.00 H new ATOM 0 HA GLN A 415 8.045 -5.968 -3.513 1.00 0.00 H new ATOM 0 HB2 GLN A 415 8.301 -8.990 -3.728 1.00 0.00 H new ATOM 0 HB3 GLN A 415 8.420 -7.912 -5.104 1.00 0.00 H new ATOM 0 HG2 GLN A 415 10.188 -7.482 -2.699 1.00 0.00 H new ATOM 0 HG3 GLN A 415 10.589 -8.723 -3.870 1.00 0.00 H new ATOM 0 HE21 GLN A 415 12.437 -7.785 -4.693 1.00 0.00 H new ATOM 0 HE22 GLN A 415 12.425 -6.277 -5.614 1.00 0.00 H new ATOM 546 N ASP A 416 5.634 -8.239 -3.644 1.00 0.00 N ATOM 547 CA ASP A 416 4.271 -8.472 -4.108 1.00 0.00 C ATOM 548 C ASP A 416 3.423 -7.214 -3.957 1.00 0.00 C ATOM 549 O ASP A 416 2.740 -6.795 -4.893 1.00 0.00 O ATOM 550 CB ASP A 416 3.636 -9.627 -3.332 1.00 0.00 C ATOM 551 CG ASP A 416 4.410 -10.922 -3.485 1.00 0.00 C ATOM 552 OD1 ASP A 416 4.640 -11.342 -4.638 1.00 0.00 O ATOM 553 OD2 ASP A 416 4.784 -11.514 -2.451 1.00 0.00 O ATOM 0 H ASP A 416 6.052 -9.028 -3.151 1.00 0.00 H new ATOM 0 HA ASP A 416 4.313 -8.735 -5.165 1.00 0.00 H new ATOM 0 HB2 ASP A 416 3.579 -9.364 -2.276 1.00 0.00 H new ATOM 0 HB3 ASP A 416 2.613 -9.775 -3.679 1.00 0.00 H new ATOM 558 N LEU A 417 3.469 -6.613 -2.772 1.00 0.00 N ATOM 559 CA LEU A 417 2.704 -5.403 -2.497 1.00 0.00 C ATOM 560 C LEU A 417 3.083 -4.287 -3.466 1.00 0.00 C ATOM 561 O LEU A 417 2.221 -3.553 -3.952 1.00 0.00 O ATOM 562 CB LEU A 417 2.939 -4.944 -1.057 1.00 0.00 C ATOM 563 CG LEU A 417 2.127 -3.731 -0.598 1.00 0.00 C ATOM 564 CD1 LEU A 417 0.638 -4.044 -0.625 1.00 0.00 C ATOM 565 CD2 LEU A 417 2.558 -3.298 0.796 1.00 0.00 C ATOM 0 H LEU A 417 4.029 -6.945 -1.987 1.00 0.00 H new ATOM 0 HA LEU A 417 1.647 -5.633 -2.631 1.00 0.00 H new ATOM 0 HB2 LEU A 417 2.718 -5.778 -0.390 1.00 0.00 H new ATOM 0 HB3 LEU A 417 3.998 -4.713 -0.938 1.00 0.00 H new ATOM 0 HG LEU A 417 2.317 -2.908 -1.287 1.00 0.00 H new ATOM 0 HD11 LEU A 417 0.076 -3.170 -0.295 1.00 0.00 H new ATOM 0 HD12 LEU A 417 0.340 -4.306 -1.640 1.00 0.00 H new ATOM 0 HD13 LEU A 417 0.430 -4.881 0.041 1.00 0.00 H new ATOM 0 HD21 LEU A 417 1.970 -2.434 1.107 1.00 0.00 H new ATOM 0 HD22 LEU A 417 2.398 -4.117 1.497 1.00 0.00 H new ATOM 0 HD23 LEU A 417 3.615 -3.032 0.784 1.00 0.00 H new ATOM 577 N LEU A 418 4.376 -4.167 -3.745 1.00 0.00 N ATOM 578 CA LEU A 418 4.870 -3.142 -4.659 1.00 0.00 C ATOM 579 C LEU A 418 4.352 -3.379 -6.073 1.00 0.00 C ATOM 580 O LEU A 418 3.691 -2.518 -6.654 1.00 0.00 O ATOM 581 CB LEU A 418 6.399 -3.125 -4.659 1.00 0.00 C ATOM 582 CG LEU A 418 7.062 -2.380 -5.818 1.00 0.00 C ATOM 583 CD1 LEU A 418 6.782 -0.888 -5.722 1.00 0.00 C ATOM 584 CD2 LEU A 418 8.560 -2.643 -5.835 1.00 0.00 C ATOM 0 H LEU A 418 5.102 -4.766 -3.352 1.00 0.00 H new ATOM 0 HA LEU A 418 4.503 -2.175 -4.315 1.00 0.00 H new ATOM 0 HB2 LEU A 418 6.737 -2.677 -3.725 1.00 0.00 H new ATOM 0 HB3 LEU A 418 6.754 -4.156 -4.665 1.00 0.00 H new ATOM 0 HG LEU A 418 6.639 -2.750 -6.752 1.00 0.00 H new ATOM 0 HD11 LEU A 418 7.261 -0.374 -6.555 1.00 0.00 H new ATOM 0 HD12 LEU A 418 5.706 -0.716 -5.760 1.00 0.00 H new ATOM 0 HD13 LEU A 418 7.177 -0.503 -4.782 1.00 0.00 H new ATOM 0 HD21 LEU A 418 9.015 -2.105 -6.667 1.00 0.00 H new ATOM 0 HD22 LEU A 418 9.000 -2.302 -4.898 1.00 0.00 H new ATOM 0 HD23 LEU A 418 8.741 -3.711 -5.953 1.00 0.00 H new ATOM 596 N GLN A 419 4.655 -4.552 -6.620 1.00 0.00 N ATOM 597 CA GLN A 419 4.218 -4.901 -7.966 1.00 0.00 C ATOM 598 C GLN A 419 2.700 -5.045 -8.026 1.00 0.00 C ATOM 599 O GLN A 419 2.122 -5.175 -9.106 1.00 0.00 O ATOM 600 CB GLN A 419 4.883 -6.202 -8.420 1.00 0.00 C ATOM 601 CG GLN A 419 6.370 -6.058 -8.702 1.00 0.00 C ATOM 602 CD GLN A 419 6.989 -7.335 -9.237 1.00 0.00 C ATOM 603 OE1 GLN A 419 6.480 -8.431 -9.000 1.00 0.00 O ATOM 604 NE2 GLN A 419 8.092 -7.200 -9.963 1.00 0.00 N ATOM 0 H GLN A 419 5.201 -5.276 -6.152 1.00 0.00 H new ATOM 0 HA GLN A 419 4.515 -4.095 -8.637 1.00 0.00 H new ATOM 0 HB2 GLN A 419 4.739 -6.961 -7.651 1.00 0.00 H new ATOM 0 HB3 GLN A 419 4.384 -6.561 -9.320 1.00 0.00 H new ATOM 0 HG2 GLN A 419 6.523 -5.255 -9.423 1.00 0.00 H new ATOM 0 HG3 GLN A 419 6.883 -5.766 -7.786 1.00 0.00 H new ATOM 0 HE21 GLN A 419 8.479 -6.272 -10.134 1.00 0.00 H new ATOM 0 HE22 GLN A 419 8.552 -8.024 -10.349 1.00 0.00 H new ATOM 613 N MET A 420 2.062 -5.021 -6.861 1.00 0.00 N ATOM 614 CA MET A 420 0.612 -5.148 -6.782 1.00 0.00 C ATOM 615 C MET A 420 -0.060 -3.784 -6.910 1.00 0.00 C ATOM 616 O MET A 420 -1.203 -3.684 -7.359 1.00 0.00 O ATOM 617 CB MET A 420 0.207 -5.808 -5.463 1.00 0.00 C ATOM 618 CG MET A 420 -1.297 -5.856 -5.243 1.00 0.00 C ATOM 619 SD MET A 420 -2.072 -7.265 -6.059 1.00 0.00 S ATOM 620 CE MET A 420 -2.909 -8.037 -4.677 1.00 0.00 C ATOM 0 H MET A 420 2.526 -4.915 -5.959 1.00 0.00 H new ATOM 0 HA MET A 420 0.281 -5.776 -7.609 1.00 0.00 H new ATOM 0 HB2 MET A 420 0.602 -6.824 -5.438 1.00 0.00 H new ATOM 0 HB3 MET A 420 0.669 -5.266 -4.638 1.00 0.00 H new ATOM 0 HG2 MET A 420 -1.503 -5.902 -4.174 1.00 0.00 H new ATOM 0 HG3 MET A 420 -1.745 -4.934 -5.615 1.00 0.00 H new ATOM 0 HE1 MET A 420 -2.756 -9.116 -4.715 1.00 0.00 H new ATOM 0 HE2 MET A 420 -2.505 -7.646 -3.743 1.00 0.00 H new ATOM 0 HE3 MET A 420 -3.976 -7.820 -4.730 1.00 0.00 H new ATOM 630 N PHE A 421 0.654 -2.737 -6.511 1.00 0.00 N ATOM 631 CA PHE A 421 0.125 -1.380 -6.579 1.00 0.00 C ATOM 632 C PHE A 421 0.848 -0.569 -7.650 1.00 0.00 C ATOM 633 O PHE A 421 0.631 0.636 -7.782 1.00 0.00 O ATOM 634 CB PHE A 421 0.260 -0.689 -5.221 1.00 0.00 C ATOM 635 CG PHE A 421 -0.807 -1.080 -4.240 1.00 0.00 C ATOM 636 CD1 PHE A 421 -1.177 -2.407 -4.091 1.00 0.00 C ATOM 637 CD2 PHE A 421 -1.443 -0.121 -3.467 1.00 0.00 C ATOM 638 CE1 PHE A 421 -2.159 -2.770 -3.188 1.00 0.00 C ATOM 639 CE2 PHE A 421 -2.425 -0.479 -2.564 1.00 0.00 C ATOM 640 CZ PHE A 421 -2.785 -1.805 -2.425 1.00 0.00 C ATOM 0 H PHE A 421 1.601 -2.802 -6.137 1.00 0.00 H new ATOM 0 HA PHE A 421 -0.931 -1.440 -6.844 1.00 0.00 H new ATOM 0 HB2 PHE A 421 1.236 -0.926 -4.797 1.00 0.00 H new ATOM 0 HB3 PHE A 421 0.230 0.391 -5.367 1.00 0.00 H new ATOM 0 HD1 PHE A 421 -0.693 -3.166 -4.687 1.00 0.00 H new ATOM 0 HD2 PHE A 421 -1.168 0.918 -3.572 1.00 0.00 H new ATOM 0 HE1 PHE A 421 -2.436 -3.808 -3.080 1.00 0.00 H new ATOM 0 HE2 PHE A 421 -2.911 0.278 -1.967 1.00 0.00 H new ATOM 0 HZ PHE A 421 -3.554 -2.086 -1.721 1.00 0.00 H new ATOM 650 N MET A 422 1.707 -1.238 -8.412 1.00 0.00 N ATOM 651 CA MET A 422 2.462 -0.579 -9.472 1.00 0.00 C ATOM 652 C MET A 422 1.562 -0.257 -10.661 1.00 0.00 C ATOM 653 O MET A 422 1.592 0.843 -11.212 1.00 0.00 O ATOM 654 CB MET A 422 3.626 -1.463 -9.923 1.00 0.00 C ATOM 655 CG MET A 422 4.928 -1.171 -9.194 1.00 0.00 C ATOM 656 SD MET A 422 6.221 -2.368 -9.576 1.00 0.00 S ATOM 657 CE MET A 422 7.686 -1.439 -9.130 1.00 0.00 C ATOM 0 H MET A 422 1.898 -2.235 -8.316 1.00 0.00 H new ATOM 0 HA MET A 422 2.858 0.356 -9.075 1.00 0.00 H new ATOM 0 HB2 MET A 422 3.359 -2.508 -9.768 1.00 0.00 H new ATOM 0 HB3 MET A 422 3.780 -1.328 -10.994 1.00 0.00 H new ATOM 0 HG2 MET A 422 5.273 -0.172 -9.460 1.00 0.00 H new ATOM 0 HG3 MET A 422 4.746 -1.169 -8.119 1.00 0.00 H new ATOM 0 HE1 MET A 422 8.211 -1.131 -10.034 1.00 0.00 H new ATOM 0 HE2 MET A 422 7.397 -0.556 -8.560 1.00 0.00 H new ATOM 0 HE3 MET A 422 8.342 -2.064 -8.524 1.00 0.00 H new ATOM 667 N PRO A 423 0.742 -1.238 -11.066 1.00 0.00 N ATOM 668 CA PRO A 423 -0.182 -1.082 -12.192 1.00 0.00 C ATOM 669 C PRO A 423 -0.984 0.212 -12.111 1.00 0.00 C ATOM 670 O PRO A 423 -1.383 0.772 -13.132 1.00 0.00 O ATOM 671 CB PRO A 423 -1.108 -2.294 -12.062 1.00 0.00 C ATOM 672 CG PRO A 423 -0.296 -3.316 -11.344 1.00 0.00 C ATOM 673 CD PRO A 423 0.653 -2.575 -10.454 1.00 0.00 C ATOM 0 HA PRO A 423 0.344 -1.030 -13.145 1.00 0.00 H new ATOM 0 HB2 PRO A 423 -2.011 -2.044 -11.506 1.00 0.00 H new ATOM 0 HB3 PRO A 423 -1.426 -2.656 -13.040 1.00 0.00 H new ATOM 0 HG2 PRO A 423 -0.937 -3.977 -10.760 1.00 0.00 H new ATOM 0 HG3 PRO A 423 0.248 -3.943 -12.051 1.00 0.00 H new ATOM 0 HD2 PRO A 423 0.282 -2.522 -9.430 1.00 0.00 H new ATOM 0 HD3 PRO A 423 1.627 -3.062 -10.415 1.00 0.00 H new ATOM 681 N PHE A 424 -1.215 0.683 -10.890 1.00 0.00 N ATOM 682 CA PHE A 424 -1.970 1.912 -10.676 1.00 0.00 C ATOM 683 C PHE A 424 -1.114 3.137 -10.980 1.00 0.00 C ATOM 684 O PHE A 424 -1.611 4.152 -11.467 1.00 0.00 O ATOM 685 CB PHE A 424 -2.478 1.978 -9.233 1.00 0.00 C ATOM 686 CG PHE A 424 -3.572 0.992 -8.938 1.00 0.00 C ATOM 687 CD1 PHE A 424 -3.268 -0.307 -8.561 1.00 0.00 C ATOM 688 CD2 PHE A 424 -4.903 1.363 -9.037 1.00 0.00 C ATOM 689 CE1 PHE A 424 -4.273 -1.216 -8.289 1.00 0.00 C ATOM 690 CE2 PHE A 424 -5.912 0.458 -8.765 1.00 0.00 C ATOM 691 CZ PHE A 424 -5.597 -0.833 -8.390 1.00 0.00 C ATOM 0 H PHE A 424 -0.890 0.233 -10.034 1.00 0.00 H new ATOM 0 HA PHE A 424 -2.822 1.908 -11.356 1.00 0.00 H new ATOM 0 HB2 PHE A 424 -1.645 1.798 -8.554 1.00 0.00 H new ATOM 0 HB3 PHE A 424 -2.843 2.985 -9.030 1.00 0.00 H new ATOM 0 HD1 PHE A 424 -2.235 -0.612 -8.479 1.00 0.00 H new ATOM 0 HD2 PHE A 424 -5.155 2.371 -9.330 1.00 0.00 H new ATOM 0 HE1 PHE A 424 -4.024 -2.226 -7.998 1.00 0.00 H new ATOM 0 HE2 PHE A 424 -6.946 0.760 -8.846 1.00 0.00 H new ATOM 0 HZ PHE A 424 -6.383 -1.542 -8.176 1.00 0.00 H new ATOM 701 N GLY A 425 0.181 3.034 -10.691 1.00 0.00 N ATOM 702 CA GLY A 425 1.087 4.140 -10.940 1.00 0.00 C ATOM 703 C GLY A 425 2.408 3.982 -10.214 1.00 0.00 C ATOM 704 O GLY A 425 2.747 2.890 -9.761 1.00 0.00 O ATOM 0 H GLY A 425 0.618 2.204 -10.289 1.00 0.00 H new ATOM 0 HA2 GLY A 425 1.272 4.220 -12.011 1.00 0.00 H new ATOM 0 HA3 GLY A 425 0.613 5.071 -10.628 1.00 0.00 H new ATOM 708 N ASN A 426 3.156 5.075 -10.105 1.00 0.00 N ATOM 709 CA ASN A 426 4.449 5.052 -9.431 1.00 0.00 C ATOM 710 C ASN A 426 4.272 4.929 -7.920 1.00 0.00 C ATOM 711 O ASN A 426 3.444 5.616 -7.323 1.00 0.00 O ATOM 712 CB ASN A 426 5.241 6.318 -9.761 1.00 0.00 C ATOM 713 CG ASN A 426 5.153 6.690 -11.229 1.00 0.00 C ATOM 714 OD1 ASN A 426 5.639 5.963 -12.095 1.00 0.00 O ATOM 715 ND2 ASN A 426 4.530 7.827 -11.514 1.00 0.00 N ATOM 0 H ASN A 426 2.889 5.987 -10.475 1.00 0.00 H new ATOM 0 HA ASN A 426 5.002 4.182 -9.787 1.00 0.00 H new ATOM 0 HB2 ASN A 426 4.867 7.145 -9.157 1.00 0.00 H new ATOM 0 HB3 ASN A 426 6.286 6.171 -9.488 1.00 0.00 H new ATOM 0 HD21 ASN A 426 4.439 8.129 -12.484 1.00 0.00 H new ATOM 0 HD22 ASN A 426 4.142 8.398 -10.763 1.00 0.00 H new ATOM 722 N VAL A 427 5.058 4.049 -7.307 1.00 0.00 N ATOM 723 CA VAL A 427 4.990 3.837 -5.867 1.00 0.00 C ATOM 724 C VAL A 427 6.213 4.417 -5.167 1.00 0.00 C ATOM 725 O VAL A 427 7.341 3.979 -5.399 1.00 0.00 O ATOM 726 CB VAL A 427 4.879 2.338 -5.525 1.00 0.00 C ATOM 727 CG1 VAL A 427 5.239 2.095 -4.067 1.00 0.00 C ATOM 728 CG2 VAL A 427 3.481 1.824 -5.831 1.00 0.00 C ATOM 0 H VAL A 427 5.749 3.472 -7.786 1.00 0.00 H new ATOM 0 HA VAL A 427 4.096 4.350 -5.514 1.00 0.00 H new ATOM 0 HB VAL A 427 5.587 1.788 -6.145 1.00 0.00 H new ATOM 0 HG11 VAL A 427 5.155 1.031 -3.844 1.00 0.00 H new ATOM 0 HG12 VAL A 427 6.262 2.424 -3.885 1.00 0.00 H new ATOM 0 HG13 VAL A 427 4.558 2.655 -3.426 1.00 0.00 H new ATOM 0 HG21 VAL A 427 3.421 0.764 -5.584 1.00 0.00 H new ATOM 0 HG22 VAL A 427 2.752 2.377 -5.238 1.00 0.00 H new ATOM 0 HG23 VAL A 427 3.267 1.962 -6.891 1.00 0.00 H new ATOM 738 N VAL A 428 5.985 5.406 -4.310 1.00 0.00 N ATOM 739 CA VAL A 428 7.068 6.046 -3.574 1.00 0.00 C ATOM 740 C VAL A 428 7.682 5.091 -2.556 1.00 0.00 C ATOM 741 O VAL A 428 8.889 4.851 -2.563 1.00 0.00 O ATOM 742 CB VAL A 428 6.581 7.312 -2.845 1.00 0.00 C ATOM 743 CG1 VAL A 428 7.598 7.755 -1.804 1.00 0.00 C ATOM 744 CG2 VAL A 428 6.306 8.428 -3.842 1.00 0.00 C ATOM 0 H VAL A 428 5.059 5.782 -4.108 1.00 0.00 H new ATOM 0 HA VAL A 428 7.825 6.326 -4.307 1.00 0.00 H new ATOM 0 HB VAL A 428 5.649 7.077 -2.330 1.00 0.00 H new ATOM 0 HG11 VAL A 428 7.236 8.651 -1.300 1.00 0.00 H new ATOM 0 HG12 VAL A 428 7.740 6.959 -1.073 1.00 0.00 H new ATOM 0 HG13 VAL A 428 8.548 7.973 -2.293 1.00 0.00 H new ATOM 0 HG21 VAL A 428 5.963 9.315 -3.310 1.00 0.00 H new ATOM 0 HG22 VAL A 428 7.221 8.663 -4.387 1.00 0.00 H new ATOM 0 HG23 VAL A 428 5.537 8.107 -4.545 1.00 0.00 H new ATOM 754 N SER A 429 6.842 4.548 -1.681 1.00 0.00 N ATOM 755 CA SER A 429 7.301 3.621 -0.654 1.00 0.00 C ATOM 756 C SER A 429 6.349 2.435 -0.528 1.00 0.00 C ATOM 757 O SER A 429 5.146 2.564 -0.750 1.00 0.00 O ATOM 758 CB SER A 429 7.422 4.337 0.692 1.00 0.00 C ATOM 759 OG SER A 429 7.786 5.695 0.517 1.00 0.00 O ATOM 0 H SER A 429 5.839 4.734 -1.663 1.00 0.00 H new ATOM 0 HA SER A 429 8.282 3.248 -0.949 1.00 0.00 H new ATOM 0 HB2 SER A 429 6.473 4.278 1.226 1.00 0.00 H new ATOM 0 HB3 SER A 429 8.167 3.834 1.309 1.00 0.00 H new ATOM 0 HG SER A 429 6.977 6.243 0.437 1.00 0.00 H new ATOM 765 N ALA A 430 6.899 1.278 -0.170 1.00 0.00 N ATOM 766 CA ALA A 430 6.101 0.069 -0.012 1.00 0.00 C ATOM 767 C ALA A 430 6.837 -0.969 0.827 1.00 0.00 C ATOM 768 O ALA A 430 7.928 -1.413 0.467 1.00 0.00 O ATOM 769 CB ALA A 430 5.742 -0.507 -1.373 1.00 0.00 C ATOM 0 H ALA A 430 7.894 1.154 0.016 1.00 0.00 H new ATOM 0 HA ALA A 430 5.183 0.335 0.511 1.00 0.00 H new ATOM 0 HB1 ALA A 430 5.146 -1.410 -1.240 1.00 0.00 H new ATOM 0 HB2 ALA A 430 5.168 0.227 -1.939 1.00 0.00 H new ATOM 0 HB3 ALA A 430 6.654 -0.751 -1.917 1.00 0.00 H new ATOM 775 N LYS A 431 6.236 -1.353 1.948 1.00 0.00 N ATOM 776 CA LYS A 431 6.833 -2.340 2.839 1.00 0.00 C ATOM 777 C LYS A 431 5.783 -2.940 3.769 1.00 0.00 C ATOM 778 O LYS A 431 4.887 -2.241 4.242 1.00 0.00 O ATOM 779 CB LYS A 431 7.954 -1.701 3.663 1.00 0.00 C ATOM 780 CG LYS A 431 8.293 -2.470 4.928 1.00 0.00 C ATOM 781 CD LYS A 431 7.454 -2.002 6.106 1.00 0.00 C ATOM 782 CE LYS A 431 8.105 -2.366 7.432 1.00 0.00 C ATOM 783 NZ LYS A 431 9.202 -1.423 7.789 1.00 0.00 N ATOM 0 H LYS A 431 5.334 -0.995 2.261 1.00 0.00 H new ATOM 0 HA LYS A 431 7.250 -3.140 2.227 1.00 0.00 H new ATOM 0 HB2 LYS A 431 8.848 -1.622 3.045 1.00 0.00 H new ATOM 0 HB3 LYS A 431 7.662 -0.686 3.932 1.00 0.00 H new ATOM 0 HG2 LYS A 431 8.128 -3.535 4.763 1.00 0.00 H new ATOM 0 HG3 LYS A 431 9.350 -2.343 5.160 1.00 0.00 H new ATOM 0 HD2 LYS A 431 7.317 -0.922 6.051 1.00 0.00 H new ATOM 0 HD3 LYS A 431 6.463 -2.452 6.050 1.00 0.00 H new ATOM 0 HE2 LYS A 431 7.352 -2.362 8.220 1.00 0.00 H new ATOM 0 HE3 LYS A 431 8.501 -3.380 7.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 431 9.620 -1.705 8.699 1.00 0.00 H new ATOM 0 HZ2 LYS A 431 9.933 -1.446 7.050 1.00 0.00 H new ATOM 0 HZ3 LYS A 431 8.819 -0.459 7.868 1.00 0.00 H new ATOM 797 N VAL A 432 5.901 -4.238 4.028 1.00 0.00 N ATOM 798 CA VAL A 432 4.964 -4.931 4.903 1.00 0.00 C ATOM 799 C VAL A 432 5.396 -4.831 6.361 1.00 0.00 C ATOM 800 O VAL A 432 6.581 -4.674 6.659 1.00 0.00 O ATOM 801 CB VAL A 432 4.832 -6.417 4.519 1.00 0.00 C ATOM 802 CG1 VAL A 432 3.898 -7.137 5.480 1.00 0.00 C ATOM 803 CG2 VAL A 432 4.345 -6.555 3.084 1.00 0.00 C ATOM 0 H VAL A 432 6.637 -4.831 3.644 1.00 0.00 H new ATOM 0 HA VAL A 432 3.997 -4.444 4.780 1.00 0.00 H new ATOM 0 HB VAL A 432 5.815 -6.881 4.591 1.00 0.00 H new ATOM 0 HG11 VAL A 432 3.818 -8.185 5.192 1.00 0.00 H new ATOM 0 HG12 VAL A 432 4.294 -7.068 6.493 1.00 0.00 H new ATOM 0 HG13 VAL A 432 2.912 -6.674 5.444 1.00 0.00 H new ATOM 0 HG21 VAL A 432 4.257 -7.611 2.829 1.00 0.00 H new ATOM 0 HG22 VAL A 432 3.371 -6.075 2.982 1.00 0.00 H new ATOM 0 HG23 VAL A 432 5.057 -6.077 2.411 1.00 0.00 H new ATOM 813 N PHE A 433 4.429 -4.924 7.267 1.00 0.00 N ATOM 814 CA PHE A 433 4.710 -4.844 8.696 1.00 0.00 C ATOM 815 C PHE A 433 4.809 -6.237 9.311 1.00 0.00 C ATOM 816 O PHE A 433 4.176 -7.181 8.837 1.00 0.00 O ATOM 817 CB PHE A 433 3.621 -4.037 9.406 1.00 0.00 C ATOM 818 CG PHE A 433 3.790 -2.550 9.269 1.00 0.00 C ATOM 819 CD1 PHE A 433 4.303 -2.003 8.104 1.00 0.00 C ATOM 820 CD2 PHE A 433 3.437 -1.701 10.306 1.00 0.00 C ATOM 821 CE1 PHE A 433 4.459 -0.636 7.975 1.00 0.00 C ATOM 822 CE2 PHE A 433 3.591 -0.333 10.182 1.00 0.00 C ATOM 823 CZ PHE A 433 4.103 0.200 9.015 1.00 0.00 C ATOM 0 H PHE A 433 3.444 -5.055 7.038 1.00 0.00 H new ATOM 0 HA PHE A 433 5.669 -4.341 8.825 1.00 0.00 H new ATOM 0 HB2 PHE A 433 2.649 -4.322 9.005 1.00 0.00 H new ATOM 0 HB3 PHE A 433 3.618 -4.298 10.464 1.00 0.00 H new ATOM 0 HD1 PHE A 433 4.584 -2.652 7.288 1.00 0.00 H new ATOM 0 HD2 PHE A 433 3.037 -2.113 11.221 1.00 0.00 H new ATOM 0 HE1 PHE A 433 4.859 -0.222 7.061 1.00 0.00 H new ATOM 0 HE2 PHE A 433 3.311 0.319 10.997 1.00 0.00 H new ATOM 0 HZ PHE A 433 4.225 1.269 8.916 1.00 0.00 H new ATOM 983 N CYS A 443 -0.439 -9.364 8.260 1.00 0.00 N ATOM 984 CA CYS A 443 -1.363 -9.428 7.133 1.00 0.00 C ATOM 985 C CYS A 443 -1.739 -8.027 6.658 1.00 0.00 C ATOM 986 O CYS A 443 -2.879 -7.780 6.264 1.00 0.00 O ATOM 987 CB CYS A 443 -2.622 -10.204 7.521 1.00 0.00 C ATOM 988 SG CYS A 443 -3.599 -9.419 8.824 1.00 0.00 S ATOM 0 HA CYS A 443 -0.864 -9.948 6.315 1.00 0.00 H new ATOM 0 HB2 CYS A 443 -3.247 -10.327 6.637 1.00 0.00 H new ATOM 0 HB3 CYS A 443 -2.334 -11.203 7.849 1.00 0.00 H new ATOM 0 HG CYS A 443 -4.644 -10.148 9.082 1.00 0.00 H new ATOM 994 N PHE A 444 -0.774 -7.115 6.702 1.00 0.00 N ATOM 995 CA PHE A 444 -1.005 -5.738 6.279 1.00 0.00 C ATOM 996 C PHE A 444 0.313 -5.039 5.959 1.00 0.00 C ATOM 997 O PHE A 444 1.325 -5.264 6.623 1.00 0.00 O ATOM 998 CB PHE A 444 -1.754 -4.967 7.367 1.00 0.00 C ATOM 999 CG PHE A 444 -0.869 -4.498 8.487 1.00 0.00 C ATOM 1000 CD1 PHE A 444 -0.052 -3.391 8.325 1.00 0.00 C ATOM 1001 CD2 PHE A 444 -0.853 -5.165 9.701 1.00 0.00 C ATOM 1002 CE1 PHE A 444 0.764 -2.958 9.353 1.00 0.00 C ATOM 1003 CE2 PHE A 444 -0.040 -4.737 10.733 1.00 0.00 C ATOM 1004 CZ PHE A 444 0.770 -3.631 10.559 1.00 0.00 C ATOM 0 H PHE A 444 0.175 -7.304 7.026 1.00 0.00 H new ATOM 0 HA PHE A 444 -1.613 -5.759 5.375 1.00 0.00 H new ATOM 0 HB2 PHE A 444 -2.245 -4.104 6.917 1.00 0.00 H new ATOM 0 HB3 PHE A 444 -2.539 -5.603 7.777 1.00 0.00 H new ATOM 0 HD1 PHE A 444 -0.053 -2.860 7.384 1.00 0.00 H new ATOM 0 HD2 PHE A 444 -1.484 -6.030 9.843 1.00 0.00 H new ATOM 0 HE1 PHE A 444 1.397 -2.094 9.213 1.00 0.00 H new ATOM 0 HE2 PHE A 444 -0.038 -5.266 11.674 1.00 0.00 H new ATOM 0 HZ PHE A 444 1.406 -3.294 11.364 1.00 0.00 H new ATOM 1014 N GLY A 445 0.294 -4.190 4.937 1.00 0.00 N ATOM 1015 CA GLY A 445 1.492 -3.471 4.545 1.00 0.00 C ATOM 1016 C GLY A 445 1.253 -1.982 4.399 1.00 0.00 C ATOM 1017 O GLY A 445 0.128 -1.508 4.559 1.00 0.00 O ATOM 0 H GLY A 445 -0.531 -3.987 4.372 1.00 0.00 H new ATOM 0 HA2 GLY A 445 2.272 -3.639 5.287 1.00 0.00 H new ATOM 0 HA3 GLY A 445 1.859 -3.871 3.600 1.00 0.00 H new ATOM 1021 N PHE A 446 2.313 -1.241 4.094 1.00 0.00 N ATOM 1022 CA PHE A 446 2.214 0.205 3.927 1.00 0.00 C ATOM 1023 C PHE A 446 2.622 0.619 2.517 1.00 0.00 C ATOM 1024 O PHE A 446 3.415 -0.059 1.862 1.00 0.00 O ATOM 1025 CB PHE A 446 3.094 0.918 4.956 1.00 0.00 C ATOM 1026 CG PHE A 446 3.125 2.410 4.785 1.00 0.00 C ATOM 1027 CD1 PHE A 446 1.949 3.127 4.628 1.00 0.00 C ATOM 1028 CD2 PHE A 446 4.328 3.097 4.782 1.00 0.00 C ATOM 1029 CE1 PHE A 446 1.974 4.499 4.471 1.00 0.00 C ATOM 1030 CE2 PHE A 446 4.359 4.469 4.626 1.00 0.00 C ATOM 1031 CZ PHE A 446 3.181 5.172 4.471 1.00 0.00 C ATOM 0 H PHE A 446 3.251 -1.618 3.957 1.00 0.00 H new ATOM 0 HA PHE A 446 1.175 0.495 4.084 1.00 0.00 H new ATOM 0 HB2 PHE A 446 2.733 0.682 5.957 1.00 0.00 H new ATOM 0 HB3 PHE A 446 4.110 0.531 4.884 1.00 0.00 H new ATOM 0 HD1 PHE A 446 1.003 2.607 4.628 1.00 0.00 H new ATOM 0 HD2 PHE A 446 5.253 2.553 4.903 1.00 0.00 H new ATOM 0 HE1 PHE A 446 1.051 5.046 4.348 1.00 0.00 H new ATOM 0 HE2 PHE A 446 5.304 4.992 4.625 1.00 0.00 H new ATOM 0 HZ PHE A 446 3.203 6.245 4.350 1.00 0.00 H new ATOM 1041 N VAL A 447 2.074 1.738 2.054 1.00 0.00 N ATOM 1042 CA VAL A 447 2.380 2.244 0.721 1.00 0.00 C ATOM 1043 C VAL A 447 2.068 3.733 0.615 1.00 0.00 C ATOM 1044 O VAL A 447 1.215 4.252 1.333 1.00 0.00 O ATOM 1045 CB VAL A 447 1.589 1.487 -0.363 1.00 0.00 C ATOM 1046 CG1 VAL A 447 1.782 2.143 -1.721 1.00 0.00 C ATOM 1047 CG2 VAL A 447 2.009 0.025 -0.403 1.00 0.00 C ATOM 0 H VAL A 447 1.416 2.311 2.582 1.00 0.00 H new ATOM 0 HA VAL A 447 3.446 2.085 0.559 1.00 0.00 H new ATOM 0 HB VAL A 447 0.529 1.531 -0.113 1.00 0.00 H new ATOM 0 HG11 VAL A 447 1.216 1.594 -2.474 1.00 0.00 H new ATOM 0 HG12 VAL A 447 1.429 3.173 -1.681 1.00 0.00 H new ATOM 0 HG13 VAL A 447 2.840 2.132 -1.983 1.00 0.00 H new ATOM 0 HG21 VAL A 447 1.441 -0.496 -1.174 1.00 0.00 H new ATOM 0 HG22 VAL A 447 3.073 -0.042 -0.629 1.00 0.00 H new ATOM 0 HG23 VAL A 447 1.814 -0.436 0.565 1.00 0.00 H new ATOM 1057 N SER A 448 2.765 4.414 -0.290 1.00 0.00 N ATOM 1058 CA SER A 448 2.566 5.845 -0.489 1.00 0.00 C ATOM 1059 C SER A 448 2.891 6.244 -1.925 1.00 0.00 C ATOM 1060 O SER A 448 3.805 5.697 -2.541 1.00 0.00 O ATOM 1061 CB SER A 448 3.436 6.643 0.484 1.00 0.00 C ATOM 1062 OG SER A 448 4.810 6.347 0.299 1.00 0.00 O ATOM 0 H SER A 448 3.472 3.998 -0.896 1.00 0.00 H new ATOM 0 HA SER A 448 1.517 6.071 -0.296 1.00 0.00 H new ATOM 0 HB2 SER A 448 3.267 7.710 0.337 1.00 0.00 H new ATOM 0 HB3 SER A 448 3.146 6.413 1.509 1.00 0.00 H new ATOM 0 HG SER A 448 5.262 7.123 -0.095 1.00 0.00 H new ATOM 1068 N TYR A 449 2.135 7.201 -2.452 1.00 0.00 N ATOM 1069 CA TYR A 449 2.340 7.672 -3.816 1.00 0.00 C ATOM 1070 C TYR A 449 2.957 9.068 -3.824 1.00 0.00 C ATOM 1071 O TYR A 449 3.282 9.620 -2.773 1.00 0.00 O ATOM 1072 CB TYR A 449 1.014 7.685 -4.578 1.00 0.00 C ATOM 1073 CG TYR A 449 0.601 6.326 -5.099 1.00 0.00 C ATOM 1074 CD1 TYR A 449 0.281 5.294 -4.225 1.00 0.00 C ATOM 1075 CD2 TYR A 449 0.534 6.074 -6.463 1.00 0.00 C ATOM 1076 CE1 TYR A 449 -0.095 4.051 -4.696 1.00 0.00 C ATOM 1077 CE2 TYR A 449 0.157 4.835 -6.942 1.00 0.00 C ATOM 1078 CZ TYR A 449 -0.156 3.826 -6.055 1.00 0.00 C ATOM 1079 OH TYR A 449 -0.531 2.589 -6.529 1.00 0.00 O ATOM 0 H TYR A 449 1.375 7.665 -1.955 1.00 0.00 H new ATOM 0 HA TYR A 449 3.029 6.987 -4.310 1.00 0.00 H new ATOM 0 HB2 TYR A 449 0.231 8.066 -3.922 1.00 0.00 H new ATOM 0 HB3 TYR A 449 1.093 8.377 -5.416 1.00 0.00 H new ATOM 0 HD1 TYR A 449 0.327 5.467 -3.160 1.00 0.00 H new ATOM 0 HD2 TYR A 449 0.781 6.860 -7.161 1.00 0.00 H new ATOM 0 HE1 TYR A 449 -0.340 3.259 -4.003 1.00 0.00 H new ATOM 0 HE2 TYR A 449 0.107 4.657 -8.006 1.00 0.00 H new ATOM 0 HH TYR A 449 0.229 2.168 -6.983 1.00 0.00 H new ATOM 1089 N ASP A 450 3.113 9.632 -5.016 1.00 0.00 N ATOM 1090 CA ASP A 450 3.688 10.964 -5.162 1.00 0.00 C ATOM 1091 C ASP A 450 2.650 12.041 -4.866 1.00 0.00 C ATOM 1092 O ASP A 450 2.991 13.199 -4.636 1.00 0.00 O ATOM 1093 CB ASP A 450 4.246 11.149 -6.574 1.00 0.00 C ATOM 1094 CG ASP A 450 4.473 12.608 -6.921 1.00 0.00 C ATOM 1095 OD1 ASP A 450 3.481 13.363 -6.984 1.00 0.00 O ATOM 1096 OD2 ASP A 450 5.642 12.993 -7.129 1.00 0.00 O ATOM 0 H ASP A 450 2.849 9.188 -5.895 1.00 0.00 H new ATOM 0 HA ASP A 450 4.501 11.063 -4.442 1.00 0.00 H new ATOM 0 HB2 ASP A 450 5.187 10.607 -6.663 1.00 0.00 H new ATOM 0 HB3 ASP A 450 3.556 10.710 -7.295 1.00 0.00 H new ATOM 1101 N ASN A 451 1.380 11.648 -4.876 1.00 0.00 N ATOM 1102 CA ASN A 451 0.290 12.581 -4.611 1.00 0.00 C ATOM 1103 C ASN A 451 -0.902 11.861 -3.986 1.00 0.00 C ATOM 1104 O ASN A 451 -1.093 10.658 -4.161 1.00 0.00 O ATOM 1105 CB ASN A 451 -0.140 13.276 -5.904 1.00 0.00 C ATOM 1106 CG ASN A 451 -0.397 12.295 -7.031 1.00 0.00 C ATOM 1107 OD1 ASN A 451 -1.538 11.909 -7.285 1.00 0.00 O ATOM 1108 ND2 ASN A 451 0.667 11.885 -7.712 1.00 0.00 N ATOM 0 H ASN A 451 1.081 10.691 -5.064 1.00 0.00 H new ATOM 0 HA ASN A 451 0.650 13.331 -3.906 1.00 0.00 H new ATOM 0 HB2 ASN A 451 -1.044 13.856 -5.718 1.00 0.00 H new ATOM 0 HB3 ASN A 451 0.634 13.981 -6.209 1.00 0.00 H new ATOM 0 HD21 ASN A 451 0.557 11.224 -8.481 1.00 0.00 H new ATOM 0 HD22 ASN A 451 1.594 12.232 -7.466 1.00 0.00 H new ATOM 1115 N PRO A 452 -1.724 12.614 -3.241 1.00 0.00 N ATOM 1116 CA PRO A 452 -2.912 12.071 -2.577 1.00 0.00 C ATOM 1117 C PRO A 452 -4.043 11.781 -3.557 1.00 0.00 C ATOM 1118 O PRO A 452 -5.007 11.094 -3.222 1.00 0.00 O ATOM 1119 CB PRO A 452 -3.317 13.184 -1.608 1.00 0.00 C ATOM 1120 CG PRO A 452 -2.811 14.436 -2.236 1.00 0.00 C ATOM 1121 CD PRO A 452 -1.557 14.056 -2.991 1.00 0.00 C ATOM 0 HA PRO A 452 -2.706 11.117 -2.091 1.00 0.00 H new ATOM 0 HB2 PRO A 452 -4.398 13.218 -1.473 1.00 0.00 H new ATOM 0 HB3 PRO A 452 -2.878 13.030 -0.622 1.00 0.00 H new ATOM 0 HG2 PRO A 452 -3.556 14.862 -2.909 1.00 0.00 H new ATOM 0 HG3 PRO A 452 -2.596 15.191 -1.480 1.00 0.00 H new ATOM 0 HD2 PRO A 452 -1.465 14.616 -3.922 1.00 0.00 H new ATOM 0 HD3 PRO A 452 -0.660 14.260 -2.406 1.00 0.00 H new ATOM 1129 N VAL A 453 -3.917 12.308 -4.771 1.00 0.00 N ATOM 1130 CA VAL A 453 -4.929 12.105 -5.801 1.00 0.00 C ATOM 1131 C VAL A 453 -4.790 10.729 -6.443 1.00 0.00 C ATOM 1132 O VAL A 453 -5.785 10.080 -6.766 1.00 0.00 O ATOM 1133 CB VAL A 453 -4.837 13.182 -6.899 1.00 0.00 C ATOM 1134 CG1 VAL A 453 -5.984 13.034 -7.888 1.00 0.00 C ATOM 1135 CG2 VAL A 453 -4.832 14.572 -6.280 1.00 0.00 C ATOM 0 H VAL A 453 -3.124 12.879 -5.065 1.00 0.00 H new ATOM 0 HA VAL A 453 -5.899 12.179 -5.310 1.00 0.00 H new ATOM 0 HB VAL A 453 -3.901 13.047 -7.441 1.00 0.00 H new ATOM 0 HG11 VAL A 453 -5.903 13.803 -8.657 1.00 0.00 H new ATOM 0 HG12 VAL A 453 -5.938 12.049 -8.353 1.00 0.00 H new ATOM 0 HG13 VAL A 453 -6.933 13.144 -7.363 1.00 0.00 H new ATOM 0 HG21 VAL A 453 -4.767 15.321 -7.069 1.00 0.00 H new ATOM 0 HG22 VAL A 453 -5.751 14.721 -5.713 1.00 0.00 H new ATOM 0 HG23 VAL A 453 -3.975 14.671 -5.614 1.00 0.00 H new ATOM 1145 N SER A 454 -3.549 10.289 -6.625 1.00 0.00 N ATOM 1146 CA SER A 454 -3.280 8.990 -7.231 1.00 0.00 C ATOM 1147 C SER A 454 -3.570 7.861 -6.248 1.00 0.00 C ATOM 1148 O SER A 454 -4.285 6.913 -6.569 1.00 0.00 O ATOM 1149 CB SER A 454 -1.825 8.915 -7.698 1.00 0.00 C ATOM 1150 OG SER A 454 -0.942 9.382 -6.693 1.00 0.00 O ATOM 0 H SER A 454 -2.714 10.813 -6.362 1.00 0.00 H new ATOM 0 HA SER A 454 -3.938 8.874 -8.092 1.00 0.00 H new ATOM 0 HB2 SER A 454 -1.575 7.886 -7.956 1.00 0.00 H new ATOM 0 HB3 SER A 454 -1.699 9.510 -8.602 1.00 0.00 H new ATOM 0 HG SER A 454 -0.019 9.323 -7.016 1.00 0.00 H new ATOM 1156 N ALA A 455 -3.010 7.971 -5.048 1.00 0.00 N ATOM 1157 CA ALA A 455 -3.209 6.960 -4.016 1.00 0.00 C ATOM 1158 C ALA A 455 -4.654 6.477 -3.994 1.00 0.00 C ATOM 1159 O ALA A 455 -4.917 5.287 -3.818 1.00 0.00 O ATOM 1160 CB ALA A 455 -2.814 7.512 -2.655 1.00 0.00 C ATOM 0 H ALA A 455 -2.415 8.750 -4.766 1.00 0.00 H new ATOM 0 HA ALA A 455 -2.572 6.107 -4.249 1.00 0.00 H new ATOM 0 HB1 ALA A 455 -2.967 6.747 -1.894 1.00 0.00 H new ATOM 0 HB2 ALA A 455 -1.764 7.802 -2.671 1.00 0.00 H new ATOM 0 HB3 ALA A 455 -3.428 8.383 -2.423 1.00 0.00 H new ATOM 1166 N GLN A 456 -5.587 7.406 -4.174 1.00 0.00 N ATOM 1167 CA GLN A 456 -7.008 7.072 -4.173 1.00 0.00 C ATOM 1168 C GLN A 456 -7.318 6.010 -5.223 1.00 0.00 C ATOM 1169 O GLN A 456 -7.953 4.999 -4.928 1.00 0.00 O ATOM 1170 CB GLN A 456 -7.846 8.324 -4.432 1.00 0.00 C ATOM 1171 CG GLN A 456 -8.054 9.184 -3.196 1.00 0.00 C ATOM 1172 CD GLN A 456 -9.021 8.563 -2.208 1.00 0.00 C ATOM 1173 OE1 GLN A 456 -10.220 8.468 -2.470 1.00 0.00 O ATOM 1174 NE2 GLN A 456 -8.503 8.134 -1.063 1.00 0.00 N ATOM 0 H GLN A 456 -5.386 8.395 -4.322 1.00 0.00 H new ATOM 0 HA GLN A 456 -7.262 6.670 -3.192 1.00 0.00 H new ATOM 0 HB2 GLN A 456 -7.361 8.922 -5.203 1.00 0.00 H new ATOM 0 HB3 GLN A 456 -8.818 8.026 -4.824 1.00 0.00 H new ATOM 0 HG2 GLN A 456 -7.094 9.347 -2.706 1.00 0.00 H new ATOM 0 HG3 GLN A 456 -8.428 10.163 -3.498 1.00 0.00 H new ATOM 0 HE21 GLN A 456 -7.503 8.233 -0.887 1.00 0.00 H new ATOM 0 HE22 GLN A 456 -9.105 7.706 -0.360 1.00 0.00 H new ATOM 1183 N ALA A 457 -6.865 6.249 -6.450 1.00 0.00 N ATOM 1184 CA ALA A 457 -7.094 5.312 -7.543 1.00 0.00 C ATOM 1185 C ALA A 457 -7.015 3.869 -7.056 1.00 0.00 C ATOM 1186 O ALA A 457 -7.843 3.035 -7.421 1.00 0.00 O ATOM 1187 CB ALA A 457 -6.088 5.550 -8.660 1.00 0.00 C ATOM 0 H ALA A 457 -6.338 7.082 -6.711 1.00 0.00 H new ATOM 0 HA ALA A 457 -8.099 5.482 -7.930 1.00 0.00 H new ATOM 0 HB1 ALA A 457 -6.270 4.844 -9.470 1.00 0.00 H new ATOM 0 HB2 ALA A 457 -6.195 6.568 -9.035 1.00 0.00 H new ATOM 0 HB3 ALA A 457 -5.078 5.409 -8.276 1.00 0.00 H new ATOM 1193 N ALA A 458 -6.015 3.583 -6.230 1.00 0.00 N ATOM 1194 CA ALA A 458 -5.830 2.241 -5.692 1.00 0.00 C ATOM 1195 C ALA A 458 -7.015 1.827 -4.828 1.00 0.00 C ATOM 1196 O ALA A 458 -7.756 0.906 -5.174 1.00 0.00 O ATOM 1197 CB ALA A 458 -4.538 2.166 -4.890 1.00 0.00 C ATOM 0 H ALA A 458 -5.321 4.262 -5.919 1.00 0.00 H new ATOM 0 HA ALA A 458 -5.765 1.547 -6.530 1.00 0.00 H new ATOM 0 HB1 ALA A 458 -4.413 1.158 -4.494 1.00 0.00 H new ATOM 0 HB2 ALA A 458 -3.694 2.409 -5.536 1.00 0.00 H new ATOM 0 HB3 ALA A 458 -4.580 2.877 -4.065 1.00 0.00 H new ATOM 1203 N ILE A 459 -7.190 2.513 -3.703 1.00 0.00 N ATOM 1204 CA ILE A 459 -8.286 2.216 -2.790 1.00 0.00 C ATOM 1205 C ILE A 459 -9.604 2.070 -3.544 1.00 0.00 C ATOM 1206 O ILE A 459 -10.399 1.176 -3.255 1.00 0.00 O ATOM 1207 CB ILE A 459 -8.439 3.311 -1.718 1.00 0.00 C ATOM 1208 CG1 ILE A 459 -7.158 3.425 -0.889 1.00 0.00 C ATOM 1209 CG2 ILE A 459 -9.631 3.013 -0.822 1.00 0.00 C ATOM 1210 CD1 ILE A 459 -7.081 4.694 -0.068 1.00 0.00 C ATOM 0 H ILE A 459 -6.586 3.278 -3.402 1.00 0.00 H new ATOM 0 HA ILE A 459 -8.043 1.273 -2.301 1.00 0.00 H new ATOM 0 HB ILE A 459 -8.614 4.265 -2.216 1.00 0.00 H new ATOM 0 HG12 ILE A 459 -7.089 2.566 -0.222 1.00 0.00 H new ATOM 0 HG13 ILE A 459 -6.298 3.381 -1.557 1.00 0.00 H new ATOM 0 HG21 ILE A 459 -9.725 3.796 -0.070 1.00 0.00 H new ATOM 0 HG22 ILE A 459 -10.539 2.977 -1.424 1.00 0.00 H new ATOM 0 HG23 ILE A 459 -9.484 2.052 -0.329 1.00 0.00 H new ATOM 0 HD11 ILE A 459 -6.147 4.708 0.494 1.00 0.00 H new ATOM 0 HD12 ILE A 459 -7.119 5.559 -0.730 1.00 0.00 H new ATOM 0 HD13 ILE A 459 -7.922 4.731 0.625 1.00 0.00 H new ATOM 1222 N GLN A 460 -9.828 2.955 -4.510 1.00 0.00 N ATOM 1223 CA GLN A 460 -11.049 2.925 -5.306 1.00 0.00 C ATOM 1224 C GLN A 460 -11.388 1.499 -5.729 1.00 0.00 C ATOM 1225 O GLN A 460 -12.520 1.045 -5.571 1.00 0.00 O ATOM 1226 CB GLN A 460 -10.902 3.815 -6.541 1.00 0.00 C ATOM 1227 CG GLN A 460 -10.953 5.301 -6.228 1.00 0.00 C ATOM 1228 CD GLN A 460 -12.370 5.839 -6.179 1.00 0.00 C ATOM 1229 OE1 GLN A 460 -13.168 5.602 -7.086 1.00 0.00 O ATOM 1230 NE2 GLN A 460 -12.690 6.567 -5.117 1.00 0.00 N ATOM 0 H GLN A 460 -9.180 3.702 -4.760 1.00 0.00 H new ATOM 0 HA GLN A 460 -11.863 3.305 -4.689 1.00 0.00 H new ATOM 0 HB2 GLN A 460 -9.956 3.588 -7.032 1.00 0.00 H new ATOM 0 HB3 GLN A 460 -11.695 3.574 -7.249 1.00 0.00 H new ATOM 0 HG2 GLN A 460 -10.466 5.484 -5.270 1.00 0.00 H new ATOM 0 HG3 GLN A 460 -10.387 5.847 -6.983 1.00 0.00 H new ATOM 0 HE21 GLN A 460 -11.997 6.739 -4.389 1.00 0.00 H new ATOM 0 HE22 GLN A 460 -13.629 6.955 -5.029 1.00 0.00 H new ATOM 1239 N SER A 461 -10.396 0.797 -6.270 1.00 0.00 N ATOM 1240 CA SER A 461 -10.589 -0.577 -6.722 1.00 0.00 C ATOM 1241 C SER A 461 -10.104 -1.568 -5.668 1.00 0.00 C ATOM 1242 O SER A 461 -10.861 -2.422 -5.209 1.00 0.00 O ATOM 1243 CB SER A 461 -9.849 -0.812 -8.039 1.00 0.00 C ATOM 1244 OG SER A 461 -10.039 -2.138 -8.501 1.00 0.00 O ATOM 0 H SER A 461 -9.451 1.157 -6.406 1.00 0.00 H new ATOM 0 HA SER A 461 -11.656 -0.735 -6.881 1.00 0.00 H new ATOM 0 HB2 SER A 461 -10.205 -0.107 -8.790 1.00 0.00 H new ATOM 0 HB3 SER A 461 -8.785 -0.621 -7.901 1.00 0.00 H new ATOM 0 HG SER A 461 -9.557 -2.262 -9.345 1.00 0.00 H new ATOM 1250 N MET A 462 -8.836 -1.446 -5.291 1.00 0.00 N ATOM 1251 CA MET A 462 -8.248 -2.330 -4.290 1.00 0.00 C ATOM 1252 C MET A 462 -9.227 -2.585 -3.147 1.00 0.00 C ATOM 1253 O MET A 462 -9.432 -3.726 -2.738 1.00 0.00 O ATOM 1254 CB MET A 462 -6.952 -1.728 -3.744 1.00 0.00 C ATOM 1255 CG MET A 462 -5.891 -1.501 -4.808 1.00 0.00 C ATOM 1256 SD MET A 462 -5.613 -2.959 -5.833 1.00 0.00 S ATOM 1257 CE MET A 462 -4.886 -4.078 -4.639 1.00 0.00 C ATOM 0 H MET A 462 -8.196 -0.744 -5.663 1.00 0.00 H new ATOM 0 HA MET A 462 -8.022 -3.282 -4.770 1.00 0.00 H new ATOM 0 HB2 MET A 462 -7.178 -0.778 -3.260 1.00 0.00 H new ATOM 0 HB3 MET A 462 -6.549 -2.389 -2.976 1.00 0.00 H new ATOM 0 HG2 MET A 462 -6.191 -0.667 -5.443 1.00 0.00 H new ATOM 0 HG3 MET A 462 -4.955 -1.215 -4.328 1.00 0.00 H new ATOM 0 HE1 MET A 462 -3.881 -4.350 -4.961 1.00 0.00 H new ATOM 0 HE2 MET A 462 -4.836 -3.589 -3.666 1.00 0.00 H new ATOM 0 HE3 MET A 462 -5.498 -4.977 -4.563 1.00 0.00 H new ATOM 1267 N ASN A 463 -9.827 -1.514 -2.639 1.00 0.00 N ATOM 1268 CA ASN A 463 -10.783 -1.622 -1.544 1.00 0.00 C ATOM 1269 C ASN A 463 -11.758 -2.769 -1.784 1.00 0.00 C ATOM 1270 O ASN A 463 -12.654 -2.672 -2.622 1.00 0.00 O ATOM 1271 CB ASN A 463 -11.552 -0.309 -1.378 1.00 0.00 C ATOM 1272 CG ASN A 463 -12.604 -0.388 -0.290 1.00 0.00 C ATOM 1273 OD1 ASN A 463 -13.749 -0.764 -0.543 1.00 0.00 O ATOM 1274 ND2 ASN A 463 -12.219 -0.033 0.931 1.00 0.00 N ATOM 0 H ASN A 463 -9.668 -0.562 -2.968 1.00 0.00 H new ATOM 0 HA ASN A 463 -10.227 -1.827 -0.629 1.00 0.00 H new ATOM 0 HB2 ASN A 463 -10.851 0.492 -1.144 1.00 0.00 H new ATOM 0 HB3 ASN A 463 -12.029 -0.049 -2.323 1.00 0.00 H new ATOM 0 HD21 ASN A 463 -12.883 -0.066 1.705 1.00 0.00 H new ATOM 0 HD22 ASN A 463 -11.260 0.272 1.095 1.00 0.00 H new ATOM 1281 N GLY A 464 -11.578 -3.858 -1.042 1.00 0.00 N ATOM 1282 CA GLY A 464 -12.450 -5.009 -1.189 1.00 0.00 C ATOM 1283 C GLY A 464 -12.040 -5.903 -2.342 1.00 0.00 C ATOM 1284 O GLY A 464 -12.873 -6.599 -2.924 1.00 0.00 O ATOM 0 H GLY A 464 -10.844 -3.963 -0.342 1.00 0.00 H new ATOM 0 HA2 GLY A 464 -12.443 -5.587 -0.265 1.00 0.00 H new ATOM 0 HA3 GLY A 464 -13.474 -4.668 -1.344 1.00 0.00 H new ATOM 1288 N PHE A 465 -10.754 -5.884 -2.675 1.00 0.00 N ATOM 1289 CA PHE A 465 -10.236 -6.697 -3.769 1.00 0.00 C ATOM 1290 C PHE A 465 -10.332 -8.183 -3.434 1.00 0.00 C ATOM 1291 O PHE A 465 -9.714 -8.655 -2.482 1.00 0.00 O ATOM 1292 CB PHE A 465 -8.783 -6.323 -4.067 1.00 0.00 C ATOM 1293 CG PHE A 465 -8.155 -7.163 -5.142 1.00 0.00 C ATOM 1294 CD1 PHE A 465 -7.789 -8.475 -4.890 1.00 0.00 C ATOM 1295 CD2 PHE A 465 -7.931 -6.640 -6.405 1.00 0.00 C ATOM 1296 CE1 PHE A 465 -7.212 -9.252 -5.877 1.00 0.00 C ATOM 1297 CE2 PHE A 465 -7.354 -7.412 -7.397 1.00 0.00 C ATOM 1298 CZ PHE A 465 -6.994 -8.718 -7.132 1.00 0.00 C ATOM 0 H PHE A 465 -10.051 -5.315 -2.203 1.00 0.00 H new ATOM 0 HA PHE A 465 -10.843 -6.501 -4.653 1.00 0.00 H new ATOM 0 HB2 PHE A 465 -8.740 -5.275 -4.364 1.00 0.00 H new ATOM 0 HB3 PHE A 465 -8.197 -6.419 -3.153 1.00 0.00 H new ATOM 0 HD1 PHE A 465 -7.957 -8.896 -3.910 1.00 0.00 H new ATOM 0 HD2 PHE A 465 -8.210 -5.618 -6.617 1.00 0.00 H new ATOM 0 HE1 PHE A 465 -6.932 -10.274 -5.667 1.00 0.00 H new ATOM 0 HE2 PHE A 465 -7.185 -6.993 -8.378 1.00 0.00 H new ATOM 0 HZ PHE A 465 -6.542 -9.322 -7.905 1.00 0.00 H new ATOM 1308 N GLN A 466 -11.111 -8.913 -4.227 1.00 0.00 N ATOM 1309 CA GLN A 466 -11.289 -10.344 -4.014 1.00 0.00 C ATOM 1310 C GLN A 466 -9.977 -11.093 -4.224 1.00 0.00 C ATOM 1311 O GLN A 466 -9.414 -11.081 -5.319 1.00 0.00 O ATOM 1312 CB GLN A 466 -12.360 -10.892 -4.958 1.00 0.00 C ATOM 1313 CG GLN A 466 -12.925 -12.236 -4.525 1.00 0.00 C ATOM 1314 CD GLN A 466 -12.096 -13.404 -5.022 1.00 0.00 C ATOM 1315 OE1 GLN A 466 -11.758 -13.482 -6.204 1.00 0.00 O ATOM 1316 NE2 GLN A 466 -11.765 -14.322 -4.121 1.00 0.00 N ATOM 0 H GLN A 466 -11.628 -8.537 -5.022 1.00 0.00 H new ATOM 0 HA GLN A 466 -11.611 -10.495 -2.984 1.00 0.00 H new ATOM 0 HB2 GLN A 466 -13.174 -10.171 -5.028 1.00 0.00 H new ATOM 0 HB3 GLN A 466 -11.935 -10.991 -5.957 1.00 0.00 H new ATOM 0 HG2 GLN A 466 -12.978 -12.270 -3.437 1.00 0.00 H new ATOM 0 HG3 GLN A 466 -13.945 -12.334 -4.897 1.00 0.00 H new ATOM 0 HE21 GLN A 466 -12.066 -14.218 -3.152 1.00 0.00 H new ATOM 0 HE22 GLN A 466 -11.209 -15.131 -4.398 1.00 0.00 H new ATOM 1325 N ILE A 467 -9.497 -11.743 -3.170 1.00 0.00 N ATOM 1326 CA ILE A 467 -8.251 -12.498 -3.240 1.00 0.00 C ATOM 1327 C ILE A 467 -8.354 -13.801 -2.455 1.00 0.00 C ATOM 1328 O ILE A 467 -8.602 -13.794 -1.250 1.00 0.00 O ATOM 1329 CB ILE A 467 -7.065 -11.678 -2.700 1.00 0.00 C ATOM 1330 CG1 ILE A 467 -5.743 -12.263 -3.200 1.00 0.00 C ATOM 1331 CG2 ILE A 467 -7.094 -11.642 -1.179 1.00 0.00 C ATOM 1332 CD1 ILE A 467 -4.560 -11.343 -3.000 1.00 0.00 C ATOM 0 H ILE A 467 -9.951 -11.763 -2.257 1.00 0.00 H new ATOM 0 HA ILE A 467 -8.077 -12.723 -4.292 1.00 0.00 H new ATOM 0 HB ILE A 467 -7.151 -10.656 -3.069 1.00 0.00 H new ATOM 0 HG12 ILE A 467 -5.553 -13.203 -2.683 1.00 0.00 H new ATOM 0 HG13 ILE A 467 -5.836 -12.496 -4.261 1.00 0.00 H new ATOM 0 HG21 ILE A 467 -6.249 -11.059 -0.813 1.00 0.00 H new ATOM 0 HG22 ILE A 467 -8.024 -11.184 -0.844 1.00 0.00 H new ATOM 0 HG23 ILE A 467 -7.029 -12.658 -0.790 1.00 0.00 H new ATOM 0 HD11 ILE A 467 -3.657 -11.823 -3.378 1.00 0.00 H new ATOM 0 HD12 ILE A 467 -4.728 -10.411 -3.540 1.00 0.00 H new ATOM 0 HD13 ILE A 467 -4.440 -11.130 -1.938 1.00 0.00 H new ATOM 1344 N GLY A 468 -8.158 -14.919 -3.146 1.00 0.00 N ATOM 1345 CA GLY A 468 -8.230 -16.215 -2.497 1.00 0.00 C ATOM 1346 C GLY A 468 -9.639 -16.570 -2.066 1.00 0.00 C ATOM 1347 O GLY A 468 -10.475 -16.937 -2.892 1.00 0.00 O ATOM 0 H GLY A 468 -7.951 -14.951 -4.144 1.00 0.00 H new ATOM 0 HA2 GLY A 468 -7.858 -16.980 -3.178 1.00 0.00 H new ATOM 0 HA3 GLY A 468 -7.575 -16.218 -1.626 1.00 0.00 H new ATOM 1351 N MET A 469 -9.905 -16.462 -0.769 1.00 0.00 N ATOM 1352 CA MET A 469 -11.223 -16.775 -0.229 1.00 0.00 C ATOM 1353 C MET A 469 -11.713 -15.660 0.689 1.00 0.00 C ATOM 1354 O MET A 469 -12.689 -15.828 1.421 1.00 0.00 O ATOM 1355 CB MET A 469 -11.184 -18.100 0.533 1.00 0.00 C ATOM 1356 CG MET A 469 -12.549 -18.749 0.695 1.00 0.00 C ATOM 1357 SD MET A 469 -12.535 -20.115 1.872 1.00 0.00 S ATOM 1358 CE MET A 469 -12.766 -19.235 3.414 1.00 0.00 C ATOM 0 H MET A 469 -9.225 -16.160 -0.072 1.00 0.00 H new ATOM 0 HA MET A 469 -11.918 -16.865 -1.064 1.00 0.00 H new ATOM 0 HB2 MET A 469 -10.522 -18.791 0.010 1.00 0.00 H new ATOM 0 HB3 MET A 469 -10.752 -17.930 1.519 1.00 0.00 H new ATOM 0 HG2 MET A 469 -13.267 -17.998 1.025 1.00 0.00 H new ATOM 0 HG3 MET A 469 -12.891 -19.113 -0.274 1.00 0.00 H new ATOM 0 HE1 MET A 469 -12.779 -19.946 4.240 1.00 0.00 H new ATOM 0 HE2 MET A 469 -11.948 -18.529 3.556 1.00 0.00 H new ATOM 0 HE3 MET A 469 -13.712 -18.694 3.386 1.00 0.00 H new ATOM 1368 N LYS A 470 -11.030 -14.521 0.647 1.00 0.00 N ATOM 1369 CA LYS A 470 -11.396 -13.377 1.474 1.00 0.00 C ATOM 1370 C LYS A 470 -11.282 -12.077 0.685 1.00 0.00 C ATOM 1371 O LYS A 470 -10.934 -12.084 -0.496 1.00 0.00 O ATOM 1372 CB LYS A 470 -10.503 -13.313 2.715 1.00 0.00 C ATOM 1373 CG LYS A 470 -9.024 -13.472 2.410 1.00 0.00 C ATOM 1374 CD LYS A 470 -8.378 -12.138 2.074 1.00 0.00 C ATOM 1375 CE LYS A 470 -6.865 -12.198 2.227 1.00 0.00 C ATOM 1376 NZ LYS A 470 -6.291 -13.415 1.588 1.00 0.00 N ATOM 0 H LYS A 470 -10.219 -14.365 0.048 1.00 0.00 H new ATOM 0 HA LYS A 470 -12.433 -13.502 1.786 1.00 0.00 H new ATOM 0 HB2 LYS A 470 -10.661 -12.358 3.217 1.00 0.00 H new ATOM 0 HB3 LYS A 470 -10.807 -14.094 3.412 1.00 0.00 H new ATOM 0 HG2 LYS A 470 -8.520 -13.915 3.269 1.00 0.00 H new ATOM 0 HG3 LYS A 470 -8.896 -14.160 1.575 1.00 0.00 H new ATOM 0 HD2 LYS A 470 -8.631 -11.857 1.052 1.00 0.00 H new ATOM 0 HD3 LYS A 470 -8.780 -11.363 2.726 1.00 0.00 H new ATOM 0 HE2 LYS A 470 -6.419 -11.309 1.781 1.00 0.00 H new ATOM 0 HE3 LYS A 470 -6.606 -12.187 3.286 1.00 0.00 H new ATOM 0 HZ1 LYS A 470 -5.410 -13.165 1.094 1.00 0.00 H new ATOM 0 HZ2 LYS A 470 -6.089 -14.128 2.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 470 -6.973 -13.803 0.905 1.00 0.00 H new ATOM 1390 N ARG A 471 -11.576 -10.961 1.347 1.00 0.00 N ATOM 1391 CA ARG A 471 -11.505 -9.654 0.707 1.00 0.00 C ATOM 1392 C ARG A 471 -10.316 -8.854 1.233 1.00 0.00 C ATOM 1393 O ARG A 471 -9.753 -9.175 2.279 1.00 0.00 O ATOM 1394 CB ARG A 471 -12.801 -8.876 0.945 1.00 0.00 C ATOM 1395 CG ARG A 471 -13.989 -9.420 0.168 1.00 0.00 C ATOM 1396 CD ARG A 471 -15.304 -8.880 0.709 1.00 0.00 C ATOM 1397 NE ARG A 471 -15.778 -9.646 1.859 1.00 0.00 N ATOM 1398 CZ ARG A 471 -17.010 -9.553 2.346 1.00 0.00 C ATOM 1399 NH1 ARG A 471 -17.888 -8.731 1.785 1.00 0.00 N ATOM 1400 NH2 ARG A 471 -17.367 -10.283 3.395 1.00 0.00 N ATOM 0 H ARG A 471 -11.865 -10.937 2.325 1.00 0.00 H new ATOM 0 HA ARG A 471 -11.372 -9.808 -0.364 1.00 0.00 H new ATOM 0 HB2 ARG A 471 -13.035 -8.893 2.009 1.00 0.00 H new ATOM 0 HB3 ARG A 471 -12.644 -7.833 0.670 1.00 0.00 H new ATOM 0 HG2 ARG A 471 -13.890 -9.153 -0.884 1.00 0.00 H new ATOM 0 HG3 ARG A 471 -13.992 -10.509 0.221 1.00 0.00 H new ATOM 0 HD2 ARG A 471 -15.177 -7.836 0.996 1.00 0.00 H new ATOM 0 HD3 ARG A 471 -16.057 -8.904 -0.078 1.00 0.00 H new ATOM 0 HE ARG A 471 -15.127 -10.287 2.313 1.00 0.00 H new ATOM 0 HH11 ARG A 471 -17.617 -8.169 0.978 1.00 0.00 H new ATOM 0 HH12 ARG A 471 -18.834 -8.661 2.161 1.00 0.00 H new ATOM 0 HH21 ARG A 471 -16.695 -10.916 3.828 1.00 0.00 H new ATOM 0 HH22 ARG A 471 -18.314 -10.211 3.768 1.00 0.00 H new ATOM 1414 N LEU A 472 -9.940 -7.813 0.499 1.00 0.00 N ATOM 1415 CA LEU A 472 -8.817 -6.967 0.890 1.00 0.00 C ATOM 1416 C LEU A 472 -9.302 -5.590 1.333 1.00 0.00 C ATOM 1417 O LEU A 472 -10.314 -5.088 0.843 1.00 0.00 O ATOM 1418 CB LEU A 472 -7.832 -6.825 -0.272 1.00 0.00 C ATOM 1419 CG LEU A 472 -6.965 -8.048 -0.571 1.00 0.00 C ATOM 1420 CD1 LEU A 472 -6.071 -7.789 -1.772 1.00 0.00 C ATOM 1421 CD2 LEU A 472 -6.131 -8.421 0.647 1.00 0.00 C ATOM 0 H LEU A 472 -10.396 -7.534 -0.370 1.00 0.00 H new ATOM 0 HA LEU A 472 -8.311 -7.441 1.731 1.00 0.00 H new ATOM 0 HB2 LEU A 472 -8.396 -6.576 -1.171 1.00 0.00 H new ATOM 0 HB3 LEU A 472 -7.175 -5.981 -0.064 1.00 0.00 H new ATOM 0 HG LEU A 472 -7.622 -8.885 -0.808 1.00 0.00 H new ATOM 0 HD11 LEU A 472 -5.462 -8.671 -1.969 1.00 0.00 H new ATOM 0 HD12 LEU A 472 -6.687 -7.572 -2.644 1.00 0.00 H new ATOM 0 HD13 LEU A 472 -5.422 -6.938 -1.566 1.00 0.00 H new ATOM 0 HD21 LEU A 472 -5.520 -9.294 0.416 1.00 0.00 H new ATOM 0 HD22 LEU A 472 -5.484 -7.586 0.915 1.00 0.00 H new ATOM 0 HD23 LEU A 472 -6.791 -8.651 1.483 1.00 0.00 H new ATOM 1433 N LYS A 473 -8.570 -4.983 2.261 1.00 0.00 N ATOM 1434 CA LYS A 473 -8.922 -3.662 2.769 1.00 0.00 C ATOM 1435 C LYS A 473 -7.758 -2.689 2.606 1.00 0.00 C ATOM 1436 O LYS A 473 -6.635 -2.975 3.020 1.00 0.00 O ATOM 1437 CB LYS A 473 -9.325 -3.749 4.243 1.00 0.00 C ATOM 1438 CG LYS A 473 -9.754 -2.419 4.836 1.00 0.00 C ATOM 1439 CD LYS A 473 -11.248 -2.195 4.683 1.00 0.00 C ATOM 1440 CE LYS A 473 -12.019 -2.743 5.875 1.00 0.00 C ATOM 1441 NZ LYS A 473 -12.186 -1.721 6.945 1.00 0.00 N ATOM 0 H LYS A 473 -7.730 -5.385 2.677 1.00 0.00 H new ATOM 0 HA LYS A 473 -9.767 -3.291 2.189 1.00 0.00 H new ATOM 0 HB2 LYS A 473 -10.142 -4.463 4.346 1.00 0.00 H new ATOM 0 HB3 LYS A 473 -8.485 -4.140 4.818 1.00 0.00 H new ATOM 0 HG2 LYS A 473 -9.487 -2.388 5.892 1.00 0.00 H new ATOM 0 HG3 LYS A 473 -9.212 -1.610 4.346 1.00 0.00 H new ATOM 0 HD2 LYS A 473 -11.448 -1.129 4.578 1.00 0.00 H new ATOM 0 HD3 LYS A 473 -11.598 -2.676 3.770 1.00 0.00 H new ATOM 0 HE2 LYS A 473 -12.999 -3.088 5.546 1.00 0.00 H new ATOM 0 HE3 LYS A 473 -11.495 -3.609 6.279 1.00 0.00 H new ATOM 0 HZ1 LYS A 473 -12.716 -2.133 7.739 1.00 0.00 H new ATOM 0 HZ2 LYS A 473 -11.251 -1.410 7.277 1.00 0.00 H new ATOM 0 HZ3 LYS A 473 -12.708 -0.905 6.567 1.00 0.00 H new ATOM 1455 N VAL A 474 -8.035 -1.537 2.002 1.00 0.00 N ATOM 1456 CA VAL A 474 -7.011 -0.521 1.788 1.00 0.00 C ATOM 1457 C VAL A 474 -7.521 0.862 2.176 1.00 0.00 C ATOM 1458 O VAL A 474 -8.630 1.250 1.811 1.00 0.00 O ATOM 1459 CB VAL A 474 -6.548 -0.493 0.320 1.00 0.00 C ATOM 1460 CG1 VAL A 474 -5.380 0.467 0.147 1.00 0.00 C ATOM 1461 CG2 VAL A 474 -6.172 -1.892 -0.148 1.00 0.00 C ATOM 0 H VAL A 474 -8.959 -1.284 1.653 1.00 0.00 H new ATOM 0 HA VAL A 474 -6.165 -0.784 2.423 1.00 0.00 H new ATOM 0 HB VAL A 474 -7.374 -0.138 -0.296 1.00 0.00 H new ATOM 0 HG11 VAL A 474 -5.066 0.474 -0.897 1.00 0.00 H new ATOM 0 HG12 VAL A 474 -5.688 1.471 0.440 1.00 0.00 H new ATOM 0 HG13 VAL A 474 -4.548 0.145 0.774 1.00 0.00 H new ATOM 0 HG21 VAL A 474 -5.847 -1.853 -1.188 1.00 0.00 H new ATOM 0 HG22 VAL A 474 -5.362 -2.277 0.471 1.00 0.00 H new ATOM 0 HG23 VAL A 474 -7.038 -2.549 -0.063 1.00 0.00 H new ATOM 1471 N GLN A 475 -6.702 1.601 2.917 1.00 0.00 N ATOM 1472 CA GLN A 475 -7.071 2.943 3.354 1.00 0.00 C ATOM 1473 C GLN A 475 -5.831 3.771 3.675 1.00 0.00 C ATOM 1474 O GLN A 475 -4.896 3.287 4.316 1.00 0.00 O ATOM 1475 CB GLN A 475 -7.982 2.870 4.581 1.00 0.00 C ATOM 1476 CG GLN A 475 -8.757 4.152 4.841 1.00 0.00 C ATOM 1477 CD GLN A 475 -9.859 3.970 5.865 1.00 0.00 C ATOM 1478 OE1 GLN A 475 -9.593 3.740 7.045 1.00 0.00 O ATOM 1479 NE2 GLN A 475 -11.105 4.071 5.418 1.00 0.00 N ATOM 0 H GLN A 475 -5.780 1.294 3.227 1.00 0.00 H new ATOM 0 HA GLN A 475 -7.609 3.428 2.539 1.00 0.00 H new ATOM 0 HB2 GLN A 475 -8.687 2.049 4.451 1.00 0.00 H new ATOM 0 HB3 GLN A 475 -7.378 2.636 5.458 1.00 0.00 H new ATOM 0 HG2 GLN A 475 -8.069 4.924 5.186 1.00 0.00 H new ATOM 0 HG3 GLN A 475 -9.190 4.506 3.906 1.00 0.00 H new ATOM 0 HE21 GLN A 475 -11.279 4.263 4.431 1.00 0.00 H new ATOM 0 HE22 GLN A 475 -11.888 3.957 6.061 1.00 0.00 H new ATOM 1488 N LEU A 476 -5.828 5.021 3.226 1.00 0.00 N ATOM 1489 CA LEU A 476 -4.702 5.918 3.465 1.00 0.00 C ATOM 1490 C LEU A 476 -4.750 6.488 4.878 1.00 0.00 C ATOM 1491 O LEU A 476 -5.772 7.022 5.310 1.00 0.00 O ATOM 1492 CB LEU A 476 -4.705 7.056 2.443 1.00 0.00 C ATOM 1493 CG LEU A 476 -5.671 8.208 2.726 1.00 0.00 C ATOM 1494 CD1 LEU A 476 -5.098 9.137 3.784 1.00 0.00 C ATOM 1495 CD2 LEU A 476 -5.973 8.976 1.446 1.00 0.00 C ATOM 0 H LEU A 476 -6.593 5.437 2.694 1.00 0.00 H new ATOM 0 HA LEU A 476 -3.782 5.343 3.356 1.00 0.00 H new ATOM 0 HB2 LEU A 476 -3.696 7.462 2.378 1.00 0.00 H new ATOM 0 HB3 LEU A 476 -4.945 6.639 1.465 1.00 0.00 H new ATOM 0 HG LEU A 476 -6.604 7.791 3.105 1.00 0.00 H new ATOM 0 HD11 LEU A 476 -5.799 9.950 3.972 1.00 0.00 H new ATOM 0 HD12 LEU A 476 -4.932 8.580 4.706 1.00 0.00 H new ATOM 0 HD13 LEU A 476 -4.151 9.548 3.433 1.00 0.00 H new ATOM 0 HD21 LEU A 476 -6.662 9.792 1.665 1.00 0.00 H new ATOM 0 HD22 LEU A 476 -5.047 9.382 1.038 1.00 0.00 H new ATOM 0 HD23 LEU A 476 -6.427 8.304 0.717 1.00 0.00 H new ATOM 1507 N LYS A 477 -3.637 6.372 5.596 1.00 0.00 N ATOM 1508 CA LYS A 477 -3.550 6.878 6.960 1.00 0.00 C ATOM 1509 C LYS A 477 -4.371 8.154 7.121 1.00 0.00 C ATOM 1510 O LYS A 477 -4.006 9.208 6.600 1.00 0.00 O ATOM 1511 CB LYS A 477 -2.091 7.147 7.334 1.00 0.00 C ATOM 1512 CG LYS A 477 -1.858 7.266 8.831 1.00 0.00 C ATOM 1513 CD LYS A 477 -0.376 7.327 9.161 1.00 0.00 C ATOM 1514 CE LYS A 477 -0.142 7.394 10.662 1.00 0.00 C ATOM 1515 NZ LYS A 477 -0.316 8.777 11.189 1.00 0.00 N ATOM 0 H LYS A 477 -2.783 5.932 5.255 1.00 0.00 H new ATOM 0 HA LYS A 477 -3.956 6.119 7.629 1.00 0.00 H new ATOM 0 HB2 LYS A 477 -1.470 6.342 6.941 1.00 0.00 H new ATOM 0 HB3 LYS A 477 -1.764 8.067 6.850 1.00 0.00 H new ATOM 0 HG2 LYS A 477 -2.353 8.161 9.207 1.00 0.00 H new ATOM 0 HG3 LYS A 477 -2.310 6.415 9.339 1.00 0.00 H new ATOM 0 HD2 LYS A 477 0.125 6.450 8.752 1.00 0.00 H new ATOM 0 HD3 LYS A 477 0.069 8.200 8.683 1.00 0.00 H new ATOM 0 HE2 LYS A 477 -0.836 6.722 11.168 1.00 0.00 H new ATOM 0 HE3 LYS A 477 0.865 7.043 10.889 1.00 0.00 H new ATOM 0 HZ1 LYS A 477 -0.148 8.781 12.215 1.00 0.00 H new ATOM 0 HZ2 LYS A 477 0.363 9.413 10.725 1.00 0.00 H new ATOM 0 HZ3 LYS A 477 -1.284 9.103 10.995 1.00 0.00 H new