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= -0.899 K(o=-0.9,f=-4.4!) USER MOD Set 1.2: A 454 SER OG : rot 180:sc= 0 USER MOD Single : A 395 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 402 ASN : amide:sc= -5.61! C(o=-5.6!,f=-9.8!) USER MOD Single : A 406 TYR OH : rot 180:sc= -0.0527 USER MOD Single : A 407 HIS :FLIP no HD1:sc= -0.0205 F(o=-1.4,f=-0.02) USER MOD Single : A 410 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 415 GLN : amide:sc= 0 K(o=0,f=-2.1) USER MOD Single : A 419 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 420 MET CE :methyl -149:sc= -1.12 (180deg=-4.2!) USER MOD Single : A 422 MET CE :methyl -168:sc= -0.0482 (180deg=-0.368) USER MOD Single : A 426 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 429 SER OG : rot 168:sc= -0.491 USER MOD Single : A 431 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 443 CYS SG : rot 180:sc= 0 USER MOD Single : A 448 SER OG : rot 102:sc= 0.995 USER MOD Single : A 449 TYR OH : rot -115:sc= -0.265 USER MOD Single : A 456 GLN : amide:sc= -0.144 K(o=-0.14,f=-2!) USER MOD Single : A 460 GLN : amide:sc= 0 K(o=0,f=-2.1!) USER MOD Single : A 461 SER OG : rot 180:sc= 0 USER MOD Single : A 462 MET CE :methyl -175:sc= 0 (180deg=-0.0718) USER MOD Single : A 463 ASN : amide:sc= 0 X(o=0,f=-0.002) USER MOD Single : A 466 GLN : amide:sc= 0 X(o=0,f=-0.47) USER MOD Single : A 469 MET CE :methyl 154:sc= -0.303 (180deg=-1.2) USER MOD Single : A 470 LYS NZ :NH3+ -140:sc= -2.06 (180deg=-3.9!) 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 9.018 5.131 3.937 1.00 0.00 N ATOM 226 CA LYS A 395 8.906 6.467 3.365 1.00 0.00 C ATOM 227 C LYS A 395 7.467 6.769 2.962 1.00 0.00 C ATOM 228 O LYS A 395 6.645 5.861 2.837 1.00 0.00 O ATOM 229 CB LYS A 395 9.827 6.602 2.149 1.00 0.00 C ATOM 230 CG LYS A 395 11.304 6.570 2.498 1.00 0.00 C ATOM 231 CD LYS A 395 12.170 6.871 1.286 1.00 0.00 C ATOM 232 CE LYS A 395 12.200 8.360 0.978 1.00 0.00 C ATOM 233 NZ LYS A 395 13.194 9.080 1.821 1.00 0.00 N ATOM 0 HA LYS A 395 9.209 7.187 4.125 1.00 0.00 H new ATOM 0 HB2 LYS A 395 9.610 5.796 1.448 1.00 0.00 H new ATOM 0 HB3 LYS A 395 9.604 7.538 1.637 1.00 0.00 H new ATOM 0 HG2 LYS A 395 11.509 7.298 3.283 1.00 0.00 H new ATOM 0 HG3 LYS A 395 11.563 5.589 2.897 1.00 0.00 H new ATOM 0 HD2 LYS A 395 13.185 6.515 1.465 1.00 0.00 H new ATOM 0 HD3 LYS A 395 11.789 6.327 0.421 1.00 0.00 H new ATOM 0 HE2 LYS A 395 12.441 8.508 -0.075 1.00 0.00 H new ATOM 0 HE3 LYS A 395 11.210 8.785 1.141 1.00 0.00 H new ATOM 0 HZ1 LYS A 395 13.184 10.092 1.581 1.00 0.00 H new ATOM 0 HZ2 LYS A 395 12.950 8.960 2.825 1.00 0.00 H new ATOM 0 HZ3 LYS A 395 14.143 8.692 1.647 1.00 0.00 H new ATOM 247 N GLU A 396 7.169 8.049 2.759 1.00 0.00 N ATOM 248 CA GLU A 396 5.827 8.467 2.370 1.00 0.00 C ATOM 249 C GLU A 396 5.885 9.652 1.409 1.00 0.00 C ATOM 250 O GLU A 396 6.924 10.294 1.260 1.00 0.00 O ATOM 251 CB GLU A 396 5.006 8.839 3.606 1.00 0.00 C ATOM 252 CG GLU A 396 5.685 9.861 4.503 1.00 0.00 C ATOM 253 CD GLU A 396 5.346 11.289 4.121 1.00 0.00 C ATOM 254 OE1 GLU A 396 4.145 11.593 3.964 1.00 0.00 O ATOM 255 OE2 GLU A 396 6.283 12.103 3.981 1.00 0.00 O ATOM 0 H GLU A 396 7.838 8.813 2.857 1.00 0.00 H new ATOM 0 HA GLU A 396 5.346 7.631 1.862 1.00 0.00 H new ATOM 0 HB2 GLU A 396 4.041 9.233 3.286 1.00 0.00 H new ATOM 0 HB3 GLU A 396 4.806 7.937 4.184 1.00 0.00 H new ATOM 0 HG2 GLU A 396 5.388 9.685 5.537 1.00 0.00 H new ATOM 0 HG3 GLU A 396 6.765 9.722 4.453 1.00 0.00 H new ATOM 262 N GLY A 397 4.760 9.934 0.758 1.00 0.00 N ATOM 263 CA GLY A 397 4.704 11.039 -0.181 1.00 0.00 C ATOM 264 C GLY A 397 4.332 12.348 0.487 1.00 0.00 C ATOM 265 O GLY A 397 4.687 12.605 1.638 1.00 0.00 O ATOM 0 H GLY A 397 3.887 9.417 0.864 1.00 0.00 H new ATOM 0 HA2 GLY A 397 5.672 11.146 -0.670 1.00 0.00 H new ATOM 0 HA3 GLY A 397 3.977 10.813 -0.961 1.00 0.00 H new ATOM 269 N PRO A 398 3.602 13.204 -0.245 1.00 0.00 N ATOM 270 CA PRO A 398 3.169 14.509 0.263 1.00 0.00 C ATOM 271 C PRO A 398 2.014 14.391 1.252 1.00 0.00 C ATOM 272 O PRO A 398 1.244 13.432 1.209 1.00 0.00 O ATOM 273 CB PRO A 398 2.719 15.248 -0.999 1.00 0.00 C ATOM 274 CG PRO A 398 2.292 14.173 -1.937 1.00 0.00 C ATOM 275 CD PRO A 398 3.144 12.963 -1.623 1.00 0.00 C ATOM 0 HA PRO A 398 3.962 15.017 0.811 1.00 0.00 H new ATOM 0 HB2 PRO A 398 1.900 15.934 -0.785 1.00 0.00 H new ATOM 0 HB3 PRO A 398 3.530 15.842 -1.420 1.00 0.00 H new ATOM 0 HG2 PRO A 398 1.234 13.945 -1.810 1.00 0.00 H new ATOM 0 HG3 PRO A 398 2.429 14.485 -2.972 1.00 0.00 H new ATOM 0 HD2 PRO A 398 2.570 12.039 -1.698 1.00 0.00 H new ATOM 0 HD3 PRO A 398 3.983 12.874 -2.314 1.00 0.00 H new ATOM 283 N GLU A 399 1.900 15.372 2.142 1.00 0.00 N ATOM 284 CA GLU A 399 0.838 15.377 3.141 1.00 0.00 C ATOM 285 C GLU A 399 -0.527 15.186 2.486 1.00 0.00 C ATOM 286 O GLU A 399 -0.907 15.937 1.588 1.00 0.00 O ATOM 287 CB GLU A 399 0.858 16.687 3.932 1.00 0.00 C ATOM 288 CG GLU A 399 0.074 16.623 5.232 1.00 0.00 C ATOM 289 CD GLU A 399 0.521 15.485 6.128 1.00 0.00 C ATOM 290 OE1 GLU A 399 1.542 15.647 6.828 1.00 0.00 O ATOM 291 OE2 GLU A 399 -0.150 14.432 6.129 1.00 0.00 O ATOM 0 H GLU A 399 2.530 16.173 2.191 1.00 0.00 H new ATOM 0 HA GLU A 399 1.013 14.546 3.824 1.00 0.00 H new ATOM 0 HB2 GLU A 399 1.892 16.953 4.153 1.00 0.00 H new ATOM 0 HB3 GLU A 399 0.450 17.484 3.310 1.00 0.00 H new ATOM 0 HG2 GLU A 399 0.186 17.566 5.766 1.00 0.00 H new ATOM 0 HG3 GLU A 399 -0.986 16.508 5.007 1.00 0.00 H new ATOM 298 N GLY A 400 -1.260 14.175 2.942 1.00 0.00 N ATOM 299 CA GLY A 400 -2.574 13.902 2.388 1.00 0.00 C ATOM 300 C GLY A 400 -2.627 12.584 1.644 1.00 0.00 C ATOM 301 O GLY A 400 -3.684 11.959 1.548 1.00 0.00 O ATOM 0 H GLY A 400 -0.968 13.540 3.685 1.00 0.00 H new ATOM 0 HA2 GLY A 400 -3.309 13.891 3.193 1.00 0.00 H new ATOM 0 HA3 GLY A 400 -2.854 14.709 1.711 1.00 0.00 H new ATOM 305 N ALA A 401 -1.485 12.158 1.114 1.00 0.00 N ATOM 306 CA ALA A 401 -1.406 10.904 0.375 1.00 0.00 C ATOM 307 C ALA A 401 -0.886 9.777 1.260 1.00 0.00 C ATOM 308 O ALA A 401 0.165 9.901 1.885 1.00 0.00 O ATOM 309 CB ALA A 401 -0.518 11.069 -0.850 1.00 0.00 C ATOM 0 H ALA A 401 -0.602 12.663 1.183 1.00 0.00 H new ATOM 0 HA ALA A 401 -2.412 10.639 0.048 1.00 0.00 H new ATOM 0 HB1 ALA A 401 -0.468 10.125 -1.393 1.00 0.00 H new ATOM 0 HB2 ALA A 401 -0.934 11.839 -1.500 1.00 0.00 H new ATOM 0 HB3 ALA A 401 0.484 11.361 -0.536 1.00 0.00 H new ATOM 315 N ASN A 402 -1.630 8.676 1.307 1.00 0.00 N ATOM 316 CA ASN A 402 -1.244 7.527 2.117 1.00 0.00 C ATOM 317 C ASN A 402 -1.933 6.258 1.624 1.00 0.00 C ATOM 318 O ASN A 402 -2.913 6.319 0.881 1.00 0.00 O ATOM 319 CB ASN A 402 -1.593 7.772 3.586 1.00 0.00 C ATOM 320 CG ASN A 402 -1.531 9.240 3.958 1.00 0.00 C ATOM 321 OD1 ASN A 402 -2.546 9.936 3.958 1.00 0.00 O ATOM 322 ND2 ASN A 402 -0.333 9.718 4.279 1.00 0.00 N ATOM 0 H ASN A 402 -2.503 8.556 0.794 1.00 0.00 H new ATOM 0 HA ASN A 402 -0.166 7.394 2.024 1.00 0.00 H new ATOM 0 HB2 ASN A 402 -2.594 7.391 3.787 1.00 0.00 H new ATOM 0 HB3 ASN A 402 -0.905 7.210 4.218 1.00 0.00 H new ATOM 0 HD21 ASN A 402 -0.228 10.699 4.539 1.00 0.00 H new ATOM 0 HD22 ASN A 402 0.481 9.104 4.265 1.00 0.00 H new ATOM 329 N LEU A 403 -1.413 5.109 2.041 1.00 0.00 N ATOM 330 CA LEU A 403 -1.978 3.824 1.643 1.00 0.00 C ATOM 331 C LEU A 403 -1.560 2.722 2.611 1.00 0.00 C ATOM 332 O LEU A 403 -0.370 2.479 2.815 1.00 0.00 O ATOM 333 CB LEU A 403 -1.533 3.467 0.223 1.00 0.00 C ATOM 334 CG LEU A 403 -2.241 4.210 -0.909 1.00 0.00 C ATOM 335 CD1 LEU A 403 -1.783 3.686 -2.260 1.00 0.00 C ATOM 336 CD2 LEU A 403 -3.751 4.080 -0.769 1.00 0.00 C ATOM 0 H LEU A 403 -0.601 5.041 2.655 1.00 0.00 H new ATOM 0 HA LEU A 403 -3.064 3.910 1.666 1.00 0.00 H new ATOM 0 HB2 LEU A 403 -0.463 3.656 0.141 1.00 0.00 H new ATOM 0 HB3 LEU A 403 -1.680 2.397 0.076 1.00 0.00 H new ATOM 0 HG LEU A 403 -1.979 5.266 -0.844 1.00 0.00 H new ATOM 0 HD11 LEU A 403 -2.298 4.227 -3.054 1.00 0.00 H new ATOM 0 HD12 LEU A 403 -0.707 3.831 -2.361 1.00 0.00 H new ATOM 0 HD13 LEU A 403 -2.015 2.624 -2.336 1.00 0.00 H new ATOM 0 HD21 LEU A 403 -4.239 4.615 -1.583 1.00 0.00 H new ATOM 0 HD22 LEU A 403 -4.031 3.027 -0.807 1.00 0.00 H new ATOM 0 HD23 LEU A 403 -4.066 4.505 0.184 1.00 0.00 H new ATOM 348 N PHE A 404 -2.546 2.057 3.204 1.00 0.00 N ATOM 349 CA PHE A 404 -2.282 0.979 4.150 1.00 0.00 C ATOM 350 C PHE A 404 -3.087 -0.267 3.794 1.00 0.00 C ATOM 351 O PHE A 404 -4.317 -0.261 3.851 1.00 0.00 O ATOM 352 CB PHE A 404 -2.616 1.428 5.573 1.00 0.00 C ATOM 353 CG PHE A 404 -1.546 2.273 6.203 1.00 0.00 C ATOM 354 CD1 PHE A 404 -1.455 3.626 5.916 1.00 0.00 C ATOM 355 CD2 PHE A 404 -0.632 1.715 7.082 1.00 0.00 C ATOM 356 CE1 PHE A 404 -0.471 4.405 6.494 1.00 0.00 C ATOM 357 CE2 PHE A 404 0.354 2.489 7.663 1.00 0.00 C ATOM 358 CZ PHE A 404 0.434 3.837 7.369 1.00 0.00 C ATOM 0 H PHE A 404 -3.536 2.246 3.046 1.00 0.00 H new ATOM 0 HA PHE A 404 -1.222 0.732 4.094 1.00 0.00 H new ATOM 0 HB2 PHE A 404 -3.550 1.990 5.558 1.00 0.00 H new ATOM 0 HB3 PHE A 404 -2.784 0.547 6.193 1.00 0.00 H new ATOM 0 HD1 PHE A 404 -2.161 4.076 5.233 1.00 0.00 H new ATOM 0 HD2 PHE A 404 -0.691 0.662 7.316 1.00 0.00 H new ATOM 0 HE1 PHE A 404 -0.410 5.458 6.262 1.00 0.00 H new ATOM 0 HE2 PHE A 404 1.061 2.041 8.346 1.00 0.00 H new ATOM 0 HZ PHE A 404 1.203 4.445 7.823 1.00 0.00 H new ATOM 368 N ILE A 405 -2.385 -1.333 3.426 1.00 0.00 N ATOM 369 CA ILE A 405 -3.034 -2.587 3.062 1.00 0.00 C ATOM 370 C ILE A 405 -3.195 -3.494 4.276 1.00 0.00 C ATOM 371 O ILE A 405 -2.262 -3.675 5.057 1.00 0.00 O ATOM 372 CB ILE A 405 -2.241 -3.336 1.975 1.00 0.00 C ATOM 373 CG1 ILE A 405 -2.124 -2.477 0.715 1.00 0.00 C ATOM 374 CG2 ILE A 405 -2.906 -4.667 1.658 1.00 0.00 C ATOM 375 CD1 ILE A 405 -1.097 -1.373 0.828 1.00 0.00 C ATOM 0 H ILE A 405 -1.367 -1.354 3.372 1.00 0.00 H new ATOM 0 HA ILE A 405 -4.018 -2.332 2.670 1.00 0.00 H new ATOM 0 HB ILE A 405 -1.237 -3.535 2.349 1.00 0.00 H new ATOM 0 HG12 ILE A 405 -1.865 -3.117 -0.128 1.00 0.00 H new ATOM 0 HG13 ILE A 405 -3.096 -2.036 0.494 1.00 0.00 H new ATOM 0 HG21 ILE A 405 -2.334 -5.185 0.888 1.00 0.00 H new ATOM 0 HG22 ILE A 405 -2.941 -5.280 2.559 1.00 0.00 H new ATOM 0 HG23 ILE A 405 -3.920 -4.491 1.300 1.00 0.00 H new ATOM 0 HD11 ILE A 405 -1.069 -0.805 -0.102 1.00 0.00 H new ATOM 0 HD12 ILE A 405 -1.365 -0.709 1.650 1.00 0.00 H new ATOM 0 HD13 ILE A 405 -0.115 -1.807 1.018 1.00 0.00 H new ATOM 387 N TYR A 406 -4.386 -4.066 4.426 1.00 0.00 N ATOM 388 CA TYR A 406 -4.670 -4.957 5.546 1.00 0.00 C ATOM 389 C TYR A 406 -5.281 -6.267 5.058 1.00 0.00 C ATOM 390 O TYR A 406 -5.704 -6.377 3.907 1.00 0.00 O ATOM 391 CB TYR A 406 -5.617 -4.277 6.536 1.00 0.00 C ATOM 392 CG TYR A 406 -5.109 -2.948 7.047 1.00 0.00 C ATOM 393 CD1 TYR A 406 -4.082 -2.887 7.981 1.00 0.00 C ATOM 394 CD2 TYR A 406 -5.656 -1.753 6.596 1.00 0.00 C ATOM 395 CE1 TYR A 406 -3.615 -1.674 8.449 1.00 0.00 C ATOM 396 CE2 TYR A 406 -5.194 -0.536 7.058 1.00 0.00 C ATOM 397 CZ TYR A 406 -4.173 -0.502 7.986 1.00 0.00 C ATOM 398 OH TYR A 406 -3.711 0.708 8.450 1.00 0.00 O ATOM 0 H TYR A 406 -5.169 -3.929 3.787 1.00 0.00 H new ATOM 0 HA TYR A 406 -3.729 -5.181 6.048 1.00 0.00 H new ATOM 0 HB2 TYR A 406 -6.584 -4.126 6.056 1.00 0.00 H new ATOM 0 HB3 TYR A 406 -5.782 -4.943 7.383 1.00 0.00 H new ATOM 0 HD1 TYR A 406 -3.642 -3.803 8.347 1.00 0.00 H new ATOM 0 HD2 TYR A 406 -6.457 -1.776 5.871 1.00 0.00 H new ATOM 0 HE1 TYR A 406 -2.816 -1.644 9.175 1.00 0.00 H new ATOM 0 HE2 TYR A 406 -5.629 0.383 6.695 1.00 0.00 H new ATOM 0 HH TYR A 406 -4.210 1.435 8.022 1.00 0.00 H new ATOM 408 N HIS A 407 -5.322 -7.258 5.942 1.00 0.00 N ATOM 409 CA HIS A 407 -5.881 -8.562 5.604 1.00 0.00 C ATOM 410 C HIS A 407 -5.133 -9.185 4.428 1.00 0.00 C ATOM 411 O HIS A 407 -5.745 -9.624 3.454 1.00 0.00 O ATOM 412 CB HIS A 407 -7.366 -8.431 5.267 1.00 0.00 C ATOM 413 CG HIS A 407 -8.179 -7.825 6.370 1.00 0.00 C ATOM 414 ND1 HIS A 407 -8.142 -6.589 6.921 1.00 0.00 N flip ATOM 415 CD2 HIS A 407 -9.171 -8.512 7.039 1.00 0.00 C flip ATOM 416 CE1 HIS A 407 -9.102 -6.552 7.902 1.00 0.00 C flip ATOM 417 NE2 HIS A 407 -9.710 -7.724 7.952 1.00 0.00 N flip ATOM 0 H HIS A 407 -4.975 -7.183 6.898 1.00 0.00 H new ATOM 0 HA HIS A 407 -5.769 -9.214 6.470 1.00 0.00 H new ATOM 0 HB2 HIS A 407 -7.474 -7.821 4.370 1.00 0.00 H new ATOM 0 HB3 HIS A 407 -7.765 -9.418 5.032 1.00 0.00 H new ATOM 0 HD2 HIS A 407 -9.461 -9.534 6.846 1.00 0.00 H new ATOM 0 HE1 HIS A 407 -9.324 -5.703 8.531 1.00 0.00 H new ATOM 0 HE2 HIS A 407 -10.467 -7.977 8.587 1.00 0.00 H new ATOM 425 N LEU A 408 -3.809 -9.219 4.527 1.00 0.00 N ATOM 426 CA LEU A 408 -2.978 -9.788 3.472 1.00 0.00 C ATOM 427 C LEU A 408 -2.722 -11.270 3.720 1.00 0.00 C ATOM 428 O LEU A 408 -2.664 -11.734 4.859 1.00 0.00 O ATOM 429 CB LEU A 408 -1.648 -9.036 3.383 1.00 0.00 C ATOM 430 CG LEU A 408 -1.682 -7.697 2.647 1.00 0.00 C ATOM 431 CD1 LEU A 408 -0.407 -6.911 2.910 1.00 0.00 C ATOM 432 CD2 LEU A 408 -1.878 -7.913 1.154 1.00 0.00 C ATOM 0 H LEU A 408 -3.288 -8.859 5.327 1.00 0.00 H new ATOM 0 HA LEU A 408 -3.511 -9.684 2.527 1.00 0.00 H new ATOM 0 HB2 LEU A 408 -1.284 -8.862 4.395 1.00 0.00 H new ATOM 0 HB3 LEU A 408 -0.921 -9.681 2.889 1.00 0.00 H new ATOM 0 HG LEU A 408 -2.526 -7.119 3.024 1.00 0.00 H new ATOM 0 HD11 LEU A 408 -0.449 -5.961 2.378 1.00 0.00 H new ATOM 0 HD12 LEU A 408 -0.309 -6.724 3.979 1.00 0.00 H new ATOM 0 HD13 LEU A 408 0.452 -7.484 2.561 1.00 0.00 H new ATOM 0 HD21 LEU A 408 -1.900 -6.949 0.647 1.00 0.00 H new ATOM 0 HD22 LEU A 408 -1.055 -8.511 0.762 1.00 0.00 H new ATOM 0 HD23 LEU A 408 -2.820 -8.434 0.982 1.00 0.00 H new ATOM 444 N PRO A 409 -2.564 -12.034 2.628 1.00 0.00 N ATOM 445 CA PRO A 409 -2.309 -13.476 2.702 1.00 0.00 C ATOM 446 C PRO A 409 -0.857 -13.791 3.044 1.00 0.00 C ATOM 447 O PRO A 409 -0.003 -12.905 3.042 1.00 0.00 O ATOM 448 CB PRO A 409 -2.645 -13.967 1.291 1.00 0.00 C ATOM 449 CG PRO A 409 -2.389 -12.794 0.411 1.00 0.00 C ATOM 450 CD PRO A 409 -2.621 -11.549 1.239 1.00 0.00 C ATOM 0 HA PRO A 409 -2.895 -13.955 3.486 1.00 0.00 H new ATOM 0 HB2 PRO A 409 -2.023 -14.817 1.009 1.00 0.00 H new ATOM 0 HB3 PRO A 409 -3.682 -14.294 1.222 1.00 0.00 H new ATOM 0 HG2 PRO A 409 -1.368 -12.816 0.029 1.00 0.00 H new ATOM 0 HG3 PRO A 409 -3.053 -12.810 -0.453 1.00 0.00 H new ATOM 0 HD2 PRO A 409 -1.859 -10.794 1.048 1.00 0.00 H new ATOM 0 HD3 PRO A 409 -3.585 -11.093 1.014 1.00 0.00 H new ATOM 458 N GLN A 410 -0.584 -15.059 3.336 1.00 0.00 N ATOM 459 CA GLN A 410 0.765 -15.489 3.681 1.00 0.00 C ATOM 460 C GLN A 410 1.659 -15.520 2.445 1.00 0.00 C ATOM 461 O GLN A 410 2.865 -15.292 2.535 1.00 0.00 O ATOM 462 CB GLN A 410 0.732 -16.872 4.334 1.00 0.00 C ATOM 463 CG GLN A 410 2.056 -17.285 4.954 1.00 0.00 C ATOM 464 CD GLN A 410 2.067 -18.735 5.396 1.00 0.00 C ATOM 465 OE1 GLN A 410 2.418 -19.629 4.626 1.00 0.00 O ATOM 466 NE2 GLN A 410 1.681 -18.976 6.644 1.00 0.00 N ATOM 0 H GLN A 410 -1.279 -15.805 3.340 1.00 0.00 H new ATOM 0 HA GLN A 410 1.178 -14.770 4.389 1.00 0.00 H new ATOM 0 HB2 GLN A 410 -0.039 -16.882 5.104 1.00 0.00 H new ATOM 0 HB3 GLN A 410 0.445 -17.611 3.586 1.00 0.00 H new ATOM 0 HG2 GLN A 410 2.857 -17.123 4.232 1.00 0.00 H new ATOM 0 HG3 GLN A 410 2.266 -16.646 5.812 1.00 0.00 H new ATOM 0 HE21 GLN A 410 1.398 -18.205 7.248 1.00 0.00 H new ATOM 0 HE22 GLN A 410 1.668 -19.933 6.998 1.00 0.00 H new ATOM 475 N GLU A 411 1.059 -15.804 1.294 1.00 0.00 N ATOM 476 CA GLU A 411 1.802 -15.865 0.040 1.00 0.00 C ATOM 477 C GLU A 411 2.396 -14.502 -0.307 1.00 0.00 C ATOM 478 O GLU A 411 3.517 -14.411 -0.808 1.00 0.00 O ATOM 479 CB GLU A 411 0.893 -16.341 -1.095 1.00 0.00 C ATOM 480 CG GLU A 411 -0.547 -15.877 -0.957 1.00 0.00 C ATOM 481 CD GLU A 411 -1.273 -15.827 -2.287 1.00 0.00 C ATOM 482 OE1 GLU A 411 -0.694 -15.301 -3.260 1.00 0.00 O ATOM 483 OE2 GLU A 411 -2.422 -16.313 -2.354 1.00 0.00 O ATOM 0 H GLU A 411 0.061 -15.995 1.203 1.00 0.00 H new ATOM 0 HA GLU A 411 2.618 -16.577 0.165 1.00 0.00 H new ATOM 0 HB2 GLU A 411 1.292 -15.982 -2.044 1.00 0.00 H new ATOM 0 HB3 GLU A 411 0.913 -17.430 -1.133 1.00 0.00 H new ATOM 0 HG2 GLU A 411 -1.078 -16.548 -0.282 1.00 0.00 H new ATOM 0 HG3 GLU A 411 -0.564 -14.887 -0.501 1.00 0.00 H new ATOM 490 N PHE A 412 1.637 -13.447 -0.038 1.00 0.00 N ATOM 491 CA PHE A 412 2.085 -12.088 -0.323 1.00 0.00 C ATOM 492 C PHE A 412 3.210 -11.678 0.623 1.00 0.00 C ATOM 493 O PHE A 412 3.256 -12.109 1.774 1.00 0.00 O ATOM 494 CB PHE A 412 0.918 -11.107 -0.201 1.00 0.00 C ATOM 495 CG PHE A 412 0.162 -10.912 -1.485 1.00 0.00 C ATOM 496 CD1 PHE A 412 -0.304 -12.003 -2.202 1.00 0.00 C ATOM 497 CD2 PHE A 412 -0.081 -9.640 -1.975 1.00 0.00 C ATOM 498 CE1 PHE A 412 -1.000 -11.828 -3.382 1.00 0.00 C ATOM 499 CE2 PHE A 412 -0.777 -9.458 -3.155 1.00 0.00 C ATOM 500 CZ PHE A 412 -1.236 -10.553 -3.860 1.00 0.00 C ATOM 0 H PHE A 412 0.707 -13.506 0.378 1.00 0.00 H new ATOM 0 HA PHE A 412 2.465 -12.064 -1.344 1.00 0.00 H new ATOM 0 HB2 PHE A 412 0.231 -11.466 0.565 1.00 0.00 H new ATOM 0 HB3 PHE A 412 1.298 -10.143 0.138 1.00 0.00 H new ATOM 0 HD1 PHE A 412 -0.121 -13.002 -1.834 1.00 0.00 H new ATOM 0 HD2 PHE A 412 0.278 -8.780 -1.429 1.00 0.00 H new ATOM 0 HE1 PHE A 412 -1.359 -12.686 -3.930 1.00 0.00 H new ATOM 0 HE2 PHE A 412 -0.962 -8.460 -3.525 1.00 0.00 H new ATOM 0 HZ PHE A 412 -1.778 -10.413 -4.783 1.00 0.00 H new ATOM 510 N GLY A 413 4.116 -10.842 0.127 1.00 0.00 N ATOM 511 CA GLY A 413 5.230 -10.387 0.940 1.00 0.00 C ATOM 512 C GLY A 413 5.472 -8.896 0.810 1.00 0.00 C ATOM 513 O GLY A 413 4.535 -8.101 0.874 1.00 0.00 O ATOM 0 H GLY A 413 4.099 -10.471 -0.823 1.00 0.00 H new ATOM 0 HA2 GLY A 413 5.037 -10.631 1.985 1.00 0.00 H new ATOM 0 HA3 GLY A 413 6.132 -10.925 0.649 1.00 0.00 H new ATOM 517 N ASP A 414 6.731 -8.516 0.628 1.00 0.00 N ATOM 518 CA ASP A 414 7.094 -7.111 0.490 1.00 0.00 C ATOM 519 C ASP A 414 7.000 -6.666 -0.966 1.00 0.00 C ATOM 520 O ASP A 414 6.215 -5.780 -1.304 1.00 0.00 O ATOM 521 CB ASP A 414 8.510 -6.873 1.019 1.00 0.00 C ATOM 522 CG ASP A 414 8.773 -7.606 2.320 1.00 0.00 C ATOM 523 OD1 ASP A 414 7.794 -7.963 3.008 1.00 0.00 O ATOM 524 OD2 ASP A 414 9.958 -7.823 2.647 1.00 0.00 O ATOM 0 H ASP A 414 7.518 -9.162 0.573 1.00 0.00 H new ATOM 0 HA ASP A 414 6.391 -6.520 1.078 1.00 0.00 H new ATOM 0 HB2 ASP A 414 9.233 -7.196 0.271 1.00 0.00 H new ATOM 0 HB3 ASP A 414 8.664 -5.804 1.170 1.00 0.00 H new ATOM 529 N GLN A 415 7.806 -7.286 -1.823 1.00 0.00 N ATOM 530 CA GLN A 415 7.814 -6.952 -3.241 1.00 0.00 C ATOM 531 C GLN A 415 6.412 -7.052 -3.832 1.00 0.00 C ATOM 532 O GLN A 415 5.912 -6.102 -4.435 1.00 0.00 O ATOM 533 CB GLN A 415 8.767 -7.877 -4.000 1.00 0.00 C ATOM 534 CG GLN A 415 10.208 -7.393 -4.006 1.00 0.00 C ATOM 535 CD GLN A 415 10.463 -6.334 -5.061 1.00 0.00 C ATOM 536 OE1 GLN A 415 9.543 -5.641 -5.496 1.00 0.00 O ATOM 537 NE2 GLN A 415 11.717 -6.204 -5.479 1.00 0.00 N ATOM 0 H GLN A 415 8.461 -8.022 -1.559 1.00 0.00 H new ATOM 0 HA GLN A 415 8.159 -5.923 -3.343 1.00 0.00 H new ATOM 0 HB2 GLN A 415 8.728 -8.871 -3.554 1.00 0.00 H new ATOM 0 HB3 GLN A 415 8.421 -7.976 -5.029 1.00 0.00 H new ATOM 0 HG2 GLN A 415 10.456 -6.990 -3.024 1.00 0.00 H new ATOM 0 HG3 GLN A 415 10.871 -8.240 -4.179 1.00 0.00 H new ATOM 0 HE21 GLN A 415 12.448 -6.800 -5.091 1.00 0.00 H new ATOM 0 HE22 GLN A 415 11.949 -5.508 -6.188 1.00 0.00 H new ATOM 546 N ASP A 416 5.782 -8.208 -3.656 1.00 0.00 N ATOM 547 CA ASP A 416 4.437 -8.434 -4.172 1.00 0.00 C ATOM 548 C ASP A 416 3.593 -7.168 -4.056 1.00 0.00 C ATOM 549 O ASP A 416 3.122 -6.630 -5.058 1.00 0.00 O ATOM 550 CB ASP A 416 3.764 -9.581 -3.417 1.00 0.00 C ATOM 551 CG ASP A 416 4.543 -10.878 -3.520 1.00 0.00 C ATOM 552 OD1 ASP A 416 4.933 -11.246 -4.647 1.00 0.00 O ATOM 553 OD2 ASP A 416 4.762 -11.524 -2.474 1.00 0.00 O ATOM 0 H ASP A 416 6.182 -9.004 -3.159 1.00 0.00 H new ATOM 0 HA ASP A 416 4.518 -8.702 -5.226 1.00 0.00 H new ATOM 0 HB2 ASP A 416 3.657 -9.308 -2.367 1.00 0.00 H new ATOM 0 HB3 ASP A 416 2.759 -9.732 -3.812 1.00 0.00 H new ATOM 558 N LEU A 417 3.404 -6.699 -2.828 1.00 0.00 N ATOM 559 CA LEU A 417 2.614 -5.497 -2.580 1.00 0.00 C ATOM 560 C LEU A 417 3.009 -4.380 -3.540 1.00 0.00 C ATOM 561 O LEU A 417 2.151 -3.707 -4.114 1.00 0.00 O ATOM 562 CB LEU A 417 2.797 -5.032 -1.135 1.00 0.00 C ATOM 563 CG LEU A 417 1.830 -3.952 -0.650 1.00 0.00 C ATOM 564 CD1 LEU A 417 0.413 -4.497 -0.577 1.00 0.00 C ATOM 565 CD2 LEU A 417 2.267 -3.413 0.705 1.00 0.00 C ATOM 0 H LEU A 417 3.787 -7.132 -1.988 1.00 0.00 H new ATOM 0 HA LEU A 417 1.565 -5.740 -2.746 1.00 0.00 H new ATOM 0 HB2 LEU A 417 2.700 -5.898 -0.481 1.00 0.00 H new ATOM 0 HB3 LEU A 417 3.815 -4.658 -1.021 1.00 0.00 H new ATOM 0 HG LEU A 417 1.845 -3.131 -1.367 1.00 0.00 H new ATOM 0 HD11 LEU A 417 -0.261 -3.714 -0.230 1.00 0.00 H new ATOM 0 HD12 LEU A 417 0.101 -4.832 -1.566 1.00 0.00 H new ATOM 0 HD13 LEU A 417 0.381 -5.337 0.117 1.00 0.00 H new ATOM 0 HD21 LEU A 417 1.567 -2.645 1.034 1.00 0.00 H new ATOM 0 HD22 LEU A 417 2.283 -4.225 1.432 1.00 0.00 H new ATOM 0 HD23 LEU A 417 3.265 -2.982 0.621 1.00 0.00 H new ATOM 577 N LEU A 418 4.313 -4.187 -3.711 1.00 0.00 N ATOM 578 CA LEU A 418 4.823 -3.153 -4.604 1.00 0.00 C ATOM 579 C LEU A 418 4.335 -3.377 -6.033 1.00 0.00 C ATOM 580 O LEU A 418 3.734 -2.490 -6.638 1.00 0.00 O ATOM 581 CB LEU A 418 6.352 -3.132 -4.573 1.00 0.00 C ATOM 582 CG LEU A 418 7.026 -2.045 -5.412 1.00 0.00 C ATOM 583 CD1 LEU A 418 6.853 -0.683 -4.758 1.00 0.00 C ATOM 584 CD2 LEU A 418 8.501 -2.362 -5.608 1.00 0.00 C ATOM 0 H LEU A 418 5.036 -4.733 -3.243 1.00 0.00 H new ATOM 0 HA LEU A 418 4.446 -2.191 -4.257 1.00 0.00 H new ATOM 0 HB2 LEU A 418 6.673 -3.015 -3.538 1.00 0.00 H new ATOM 0 HB3 LEU A 418 6.716 -4.102 -4.912 1.00 0.00 H new ATOM 0 HG LEU A 418 6.548 -2.018 -6.391 1.00 0.00 H new ATOM 0 HD11 LEU A 418 7.339 0.078 -5.369 1.00 0.00 H new ATOM 0 HD12 LEU A 418 5.791 -0.454 -4.670 1.00 0.00 H new ATOM 0 HD13 LEU A 418 7.305 -0.696 -3.766 1.00 0.00 H new ATOM 0 HD21 LEU A 418 8.965 -1.578 -6.207 1.00 0.00 H new ATOM 0 HD22 LEU A 418 8.994 -2.416 -4.637 1.00 0.00 H new ATOM 0 HD23 LEU A 418 8.603 -3.319 -6.120 1.00 0.00 H new ATOM 596 N GLN A 419 4.596 -4.568 -6.561 1.00 0.00 N ATOM 597 CA GLN A 419 4.183 -4.908 -7.918 1.00 0.00 C ATOM 598 C GLN A 419 2.664 -5.017 -8.012 1.00 0.00 C ATOM 599 O GLN A 419 2.106 -5.116 -9.105 1.00 0.00 O ATOM 600 CB GLN A 419 4.828 -6.223 -8.355 1.00 0.00 C ATOM 601 CG GLN A 419 6.340 -6.142 -8.494 1.00 0.00 C ATOM 602 CD GLN A 419 6.931 -7.370 -9.159 1.00 0.00 C ATOM 603 OE1 GLN A 419 6.994 -8.446 -8.560 1.00 0.00 O ATOM 604 NE2 GLN A 419 7.369 -7.217 -10.403 1.00 0.00 N ATOM 0 H GLN A 419 5.091 -5.313 -6.071 1.00 0.00 H new ATOM 0 HA GLN A 419 4.514 -4.111 -8.583 1.00 0.00 H new ATOM 0 HB2 GLN A 419 4.579 -6.999 -7.631 1.00 0.00 H new ATOM 0 HB3 GLN A 419 4.399 -6.529 -9.309 1.00 0.00 H new ATOM 0 HG2 GLN A 419 6.601 -5.258 -9.075 1.00 0.00 H new ATOM 0 HG3 GLN A 419 6.786 -6.018 -7.507 1.00 0.00 H new ATOM 0 HE21 GLN A 419 7.297 -6.308 -10.861 1.00 0.00 H new ATOM 0 HE22 GLN A 419 7.777 -8.008 -10.901 1.00 0.00 H new ATOM 613 N MET A 420 2.001 -4.998 -6.861 1.00 0.00 N ATOM 614 CA MET A 420 0.547 -5.094 -6.814 1.00 0.00 C ATOM 615 C MET A 420 -0.094 -3.720 -6.985 1.00 0.00 C ATOM 616 O MET A 420 -1.197 -3.600 -7.518 1.00 0.00 O ATOM 617 CB MET A 420 0.098 -5.718 -5.492 1.00 0.00 C ATOM 618 CG MET A 420 -1.411 -5.719 -5.303 1.00 0.00 C ATOM 619 SD MET A 420 -2.212 -7.116 -6.114 1.00 0.00 S ATOM 620 CE MET A 420 -3.157 -7.802 -4.756 1.00 0.00 C ATOM 0 H MET A 420 2.448 -4.917 -5.948 1.00 0.00 H new ATOM 0 HA MET A 420 0.223 -5.732 -7.637 1.00 0.00 H new ATOM 0 HB2 MET A 420 0.463 -6.744 -5.441 1.00 0.00 H new ATOM 0 HB3 MET A 420 0.559 -5.174 -4.668 1.00 0.00 H new ATOM 0 HG2 MET A 420 -1.640 -5.743 -4.238 1.00 0.00 H new ATOM 0 HG3 MET A 420 -1.823 -4.790 -5.697 1.00 0.00 H new ATOM 0 HE1 MET A 420 -3.248 -8.881 -4.884 1.00 0.00 H new ATOM 0 HE2 MET A 420 -2.649 -7.590 -3.815 1.00 0.00 H new ATOM 0 HE3 MET A 420 -4.150 -7.353 -4.741 1.00 0.00 H new ATOM 630 N PHE A 421 0.605 -2.685 -6.529 1.00 0.00 N ATOM 631 CA PHE A 421 0.103 -1.320 -6.630 1.00 0.00 C ATOM 632 C PHE A 421 0.746 -0.590 -7.806 1.00 0.00 C ATOM 633 O PHE A 421 0.213 0.403 -8.299 1.00 0.00 O ATOM 634 CB PHE A 421 0.373 -0.557 -5.331 1.00 0.00 C ATOM 635 CG PHE A 421 -0.619 -0.856 -4.243 1.00 0.00 C ATOM 636 CD1 PHE A 421 -0.957 -2.164 -3.937 1.00 0.00 C ATOM 637 CD2 PHE A 421 -1.211 0.172 -3.527 1.00 0.00 C ATOM 638 CE1 PHE A 421 -1.868 -2.443 -2.935 1.00 0.00 C ATOM 639 CE2 PHE A 421 -2.123 -0.101 -2.524 1.00 0.00 C ATOM 640 CZ PHE A 421 -2.453 -1.409 -2.229 1.00 0.00 C ATOM 0 H PHE A 421 1.520 -2.766 -6.086 1.00 0.00 H new ATOM 0 HA PHE A 421 -0.973 -1.366 -6.798 1.00 0.00 H new ATOM 0 HB2 PHE A 421 1.374 -0.802 -4.976 1.00 0.00 H new ATOM 0 HB3 PHE A 421 0.361 0.513 -5.538 1.00 0.00 H new ATOM 0 HD1 PHE A 421 -0.504 -2.975 -4.487 1.00 0.00 H new ATOM 0 HD2 PHE A 421 -0.958 1.197 -3.755 1.00 0.00 H new ATOM 0 HE1 PHE A 421 -2.122 -3.467 -2.705 1.00 0.00 H new ATOM 0 HE2 PHE A 421 -2.577 0.708 -1.972 1.00 0.00 H new ATOM 0 HZ PHE A 421 -3.167 -1.624 -1.448 1.00 0.00 H new ATOM 650 N MET A 422 1.895 -1.089 -8.247 1.00 0.00 N ATOM 651 CA MET A 422 2.612 -0.485 -9.365 1.00 0.00 C ATOM 652 C MET A 422 1.672 -0.238 -10.541 1.00 0.00 C ATOM 653 O MET A 422 1.666 0.834 -11.146 1.00 0.00 O ATOM 654 CB MET A 422 3.769 -1.384 -9.801 1.00 0.00 C ATOM 655 CG MET A 422 5.095 -1.030 -9.145 1.00 0.00 C ATOM 656 SD MET A 422 6.515 -1.470 -10.166 1.00 0.00 S ATOM 657 CE MET A 422 7.753 -1.778 -8.907 1.00 0.00 C ATOM 0 H MET A 422 2.350 -1.910 -7.848 1.00 0.00 H new ATOM 0 HA MET A 422 3.012 0.473 -9.034 1.00 0.00 H new ATOM 0 HB2 MET A 422 3.522 -2.419 -9.567 1.00 0.00 H new ATOM 0 HB3 MET A 422 3.880 -1.320 -10.883 1.00 0.00 H new ATOM 0 HG2 MET A 422 5.119 0.040 -8.938 1.00 0.00 H new ATOM 0 HG3 MET A 422 5.170 -1.542 -8.186 1.00 0.00 H new ATOM 0 HE1 MET A 422 8.736 -1.852 -9.373 1.00 0.00 H new ATOM 0 HE2 MET A 422 7.753 -0.958 -8.188 1.00 0.00 H new ATOM 0 HE3 MET A 422 7.525 -2.712 -8.393 1.00 0.00 H new ATOM 667 N PRO A 423 0.861 -1.252 -10.876 1.00 0.00 N ATOM 668 CA PRO A 423 -0.096 -1.167 -11.983 1.00 0.00 C ATOM 669 C PRO A 423 -0.920 0.115 -11.940 1.00 0.00 C ATOM 670 O PRO A 423 -1.207 0.715 -12.976 1.00 0.00 O ATOM 671 CB PRO A 423 -0.995 -2.387 -11.768 1.00 0.00 C ATOM 672 CG PRO A 423 -0.145 -3.359 -11.024 1.00 0.00 C ATOM 673 CD PRO A 423 0.815 -2.558 -10.198 1.00 0.00 C ATOM 0 HA PRO A 423 0.402 -1.152 -12.952 1.00 0.00 H new ATOM 0 HB2 PRO A 423 -1.887 -2.126 -11.199 1.00 0.00 H new ATOM 0 HB3 PRO A 423 -1.332 -2.802 -12.718 1.00 0.00 H new ATOM 0 HG2 PRO A 423 -0.757 -4.001 -10.390 1.00 0.00 H new ATOM 0 HG3 PRO A 423 0.391 -4.011 -11.714 1.00 0.00 H new ATOM 0 HD2 PRO A 423 0.472 -2.462 -9.168 1.00 0.00 H new ATOM 0 HD3 PRO A 423 1.799 -3.025 -10.164 1.00 0.00 H new ATOM 681 N PHE A 424 -1.297 0.531 -10.735 1.00 0.00 N ATOM 682 CA PHE A 424 -2.088 1.744 -10.558 1.00 0.00 C ATOM 683 C PHE A 424 -1.233 2.988 -10.776 1.00 0.00 C ATOM 684 O PHE A 424 -1.721 4.017 -11.242 1.00 0.00 O ATOM 685 CB PHE A 424 -2.707 1.774 -9.160 1.00 0.00 C ATOM 686 CG PHE A 424 -3.792 0.755 -8.961 1.00 0.00 C ATOM 687 CD1 PHE A 424 -3.481 -0.546 -8.601 1.00 0.00 C ATOM 688 CD2 PHE A 424 -5.123 1.098 -9.134 1.00 0.00 C ATOM 689 CE1 PHE A 424 -4.478 -1.486 -8.419 1.00 0.00 C ATOM 690 CE2 PHE A 424 -6.125 0.163 -8.953 1.00 0.00 C ATOM 691 CZ PHE A 424 -5.801 -1.131 -8.594 1.00 0.00 C ATOM 0 H PHE A 424 -1.068 0.046 -9.867 1.00 0.00 H new ATOM 0 HA PHE A 424 -2.886 1.740 -11.301 1.00 0.00 H new ATOM 0 HB2 PHE A 424 -1.923 1.607 -8.421 1.00 0.00 H new ATOM 0 HB3 PHE A 424 -3.115 2.768 -8.973 1.00 0.00 H new ATOM 0 HD1 PHE A 424 -2.448 -0.829 -8.461 1.00 0.00 H new ATOM 0 HD2 PHE A 424 -5.381 2.109 -9.414 1.00 0.00 H new ATOM 0 HE1 PHE A 424 -4.222 -2.498 -8.140 1.00 0.00 H new ATOM 0 HE2 PHE A 424 -7.159 0.444 -9.092 1.00 0.00 H new ATOM 0 HZ PHE A 424 -6.581 -1.864 -8.450 1.00 0.00 H new ATOM 701 N GLY A 425 0.048 2.886 -10.433 1.00 0.00 N ATOM 702 CA GLY A 425 0.952 4.010 -10.597 1.00 0.00 C ATOM 703 C GLY A 425 2.306 3.761 -9.965 1.00 0.00 C ATOM 704 O GLY A 425 2.564 2.681 -9.437 1.00 0.00 O ATOM 0 H GLY A 425 0.476 2.045 -10.045 1.00 0.00 H new ATOM 0 HA2 GLY A 425 1.083 4.215 -11.659 1.00 0.00 H new ATOM 0 HA3 GLY A 425 0.505 4.900 -10.153 1.00 0.00 H new ATOM 708 N ASN A 426 3.176 4.765 -10.021 1.00 0.00 N ATOM 709 CA ASN A 426 4.514 4.649 -9.451 1.00 0.00 C ATOM 710 C ASN A 426 4.474 4.797 -7.933 1.00 0.00 C ATOM 711 O ASN A 426 4.499 5.909 -7.405 1.00 0.00 O ATOM 712 CB ASN A 426 5.441 5.707 -10.052 1.00 0.00 C ATOM 713 CG ASN A 426 6.885 5.248 -10.105 1.00 0.00 C ATOM 714 OD1 ASN A 426 7.592 5.268 -9.098 1.00 0.00 O ATOM 715 ND2 ASN A 426 7.330 4.831 -11.287 1.00 0.00 N ATOM 0 H ASN A 426 2.979 5.667 -10.455 1.00 0.00 H new ATOM 0 HA ASN A 426 4.899 3.658 -9.692 1.00 0.00 H new ATOM 0 HB2 ASN A 426 5.103 5.952 -11.059 1.00 0.00 H new ATOM 0 HB3 ASN A 426 5.375 6.621 -9.462 1.00 0.00 H new ATOM 0 HD21 ASN A 426 8.293 4.510 -11.385 1.00 0.00 H new ATOM 0 HD22 ASN A 426 6.708 4.832 -12.095 1.00 0.00 H new ATOM 722 N VAL A 427 4.411 3.667 -7.235 1.00 0.00 N ATOM 723 CA VAL A 427 4.368 3.670 -5.778 1.00 0.00 C ATOM 724 C VAL A 427 5.657 4.233 -5.191 1.00 0.00 C ATOM 725 O VAL A 427 6.753 3.793 -5.537 1.00 0.00 O ATOM 726 CB VAL A 427 4.140 2.252 -5.221 1.00 0.00 C ATOM 727 CG1 VAL A 427 4.220 2.256 -3.701 1.00 0.00 C ATOM 728 CG2 VAL A 427 2.801 1.704 -5.690 1.00 0.00 C ATOM 0 H VAL A 427 4.389 2.738 -7.656 1.00 0.00 H new ATOM 0 HA VAL A 427 3.532 4.306 -5.487 1.00 0.00 H new ATOM 0 HB VAL A 427 4.927 1.601 -5.601 1.00 0.00 H new ATOM 0 HG11 VAL A 427 4.056 1.246 -3.325 1.00 0.00 H new ATOM 0 HG12 VAL A 427 5.205 2.604 -3.389 1.00 0.00 H new ATOM 0 HG13 VAL A 427 3.456 2.921 -3.298 1.00 0.00 H new ATOM 0 HG21 VAL A 427 2.657 0.702 -5.287 1.00 0.00 H new ATOM 0 HG22 VAL A 427 1.999 2.354 -5.341 1.00 0.00 H new ATOM 0 HG23 VAL A 427 2.786 1.663 -6.779 1.00 0.00 H new ATOM 738 N VAL A 428 5.518 5.210 -4.301 1.00 0.00 N ATOM 739 CA VAL A 428 6.671 5.834 -3.664 1.00 0.00 C ATOM 740 C VAL A 428 7.218 4.961 -2.539 1.00 0.00 C ATOM 741 O VAL A 428 8.427 4.759 -2.426 1.00 0.00 O ATOM 742 CB VAL A 428 6.318 7.221 -3.097 1.00 0.00 C ATOM 743 CG1 VAL A 428 7.475 7.775 -2.280 1.00 0.00 C ATOM 744 CG2 VAL A 428 5.942 8.176 -4.219 1.00 0.00 C ATOM 0 H VAL A 428 4.618 5.587 -4.005 1.00 0.00 H new ATOM 0 HA VAL A 428 7.433 5.949 -4.435 1.00 0.00 H new ATOM 0 HB VAL A 428 5.457 7.115 -2.437 1.00 0.00 H new ATOM 0 HG11 VAL A 428 7.207 8.756 -1.888 1.00 0.00 H new ATOM 0 HG12 VAL A 428 7.692 7.100 -1.452 1.00 0.00 H new ATOM 0 HG13 VAL A 428 8.357 7.867 -2.914 1.00 0.00 H new ATOM 0 HG21 VAL A 428 5.696 9.151 -3.799 1.00 0.00 H new ATOM 0 HG22 VAL A 428 6.782 8.278 -4.906 1.00 0.00 H new ATOM 0 HG23 VAL A 428 5.079 7.784 -4.757 1.00 0.00 H new ATOM 754 N SER A 429 6.317 4.444 -1.708 1.00 0.00 N ATOM 755 CA SER A 429 6.708 3.595 -0.590 1.00 0.00 C ATOM 756 C SER A 429 5.907 2.296 -0.587 1.00 0.00 C ATOM 757 O SER A 429 4.730 2.280 -0.946 1.00 0.00 O ATOM 758 CB SER A 429 6.506 4.334 0.734 1.00 0.00 C ATOM 759 OG SER A 429 5.170 4.208 1.190 1.00 0.00 O ATOM 0 H SER A 429 5.312 4.599 -1.789 1.00 0.00 H new ATOM 0 HA SER A 429 7.764 3.350 -0.704 1.00 0.00 H new ATOM 0 HB2 SER A 429 7.189 3.935 1.484 1.00 0.00 H new ATOM 0 HB3 SER A 429 6.752 5.388 0.607 1.00 0.00 H new ATOM 0 HG SER A 429 5.110 4.518 2.118 1.00 0.00 H new ATOM 765 N ALA A 430 6.556 1.209 -0.181 1.00 0.00 N ATOM 766 CA ALA A 430 5.905 -0.093 -0.130 1.00 0.00 C ATOM 767 C ALA A 430 6.663 -1.051 0.784 1.00 0.00 C ATOM 768 O ALA A 430 7.746 -1.526 0.441 1.00 0.00 O ATOM 769 CB ALA A 430 5.786 -0.680 -1.529 1.00 0.00 C ATOM 0 H ALA A 430 7.531 1.205 0.117 1.00 0.00 H new ATOM 0 HA ALA A 430 4.905 0.045 0.280 1.00 0.00 H new ATOM 0 HB1 ALA A 430 5.298 -1.653 -1.475 1.00 0.00 H new ATOM 0 HB2 ALA A 430 5.195 -0.012 -2.155 1.00 0.00 H new ATOM 0 HB3 ALA A 430 6.780 -0.797 -1.960 1.00 0.00 H new ATOM 775 N LYS A 431 6.088 -1.329 1.949 1.00 0.00 N ATOM 776 CA LYS A 431 6.709 -2.230 2.913 1.00 0.00 C ATOM 777 C LYS A 431 5.653 -3.039 3.660 1.00 0.00 C ATOM 778 O LYS A 431 4.473 -2.686 3.663 1.00 0.00 O ATOM 779 CB LYS A 431 7.559 -1.437 3.909 1.00 0.00 C ATOM 780 CG LYS A 431 7.786 -2.161 5.225 1.00 0.00 C ATOM 781 CD LYS A 431 8.633 -1.333 6.177 1.00 0.00 C ATOM 782 CE LYS A 431 8.845 -2.051 7.501 1.00 0.00 C ATOM 783 NZ LYS A 431 9.403 -1.141 8.541 1.00 0.00 N ATOM 0 H LYS A 431 5.193 -0.943 2.249 1.00 0.00 H new ATOM 0 HA LYS A 431 7.351 -2.921 2.366 1.00 0.00 H new ATOM 0 HB2 LYS A 431 8.525 -1.215 3.454 1.00 0.00 H new ATOM 0 HB3 LYS A 431 7.074 -0.482 4.108 1.00 0.00 H new ATOM 0 HG2 LYS A 431 6.825 -2.383 5.690 1.00 0.00 H new ATOM 0 HG3 LYS A 431 8.277 -3.116 5.036 1.00 0.00 H new ATOM 0 HD2 LYS A 431 9.599 -1.122 5.717 1.00 0.00 H new ATOM 0 HD3 LYS A 431 8.149 -0.373 6.356 1.00 0.00 H new ATOM 0 HE2 LYS A 431 7.897 -2.461 7.848 1.00 0.00 H new ATOM 0 HE3 LYS A 431 9.522 -2.893 7.354 1.00 0.00 H new ATOM 0 HZ1 LYS A 431 9.533 -1.667 9.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 431 10.320 -0.769 8.221 1.00 0.00 H new ATOM 0 HZ3 LYS A 431 8.746 -0.351 8.700 1.00 0.00 H new ATOM 797 N VAL A 432 6.084 -4.125 4.293 1.00 0.00 N ATOM 798 CA VAL A 432 5.176 -4.982 5.047 1.00 0.00 C ATOM 799 C VAL A 432 5.646 -5.148 6.488 1.00 0.00 C ATOM 800 O VAL A 432 6.845 -5.139 6.765 1.00 0.00 O ATOM 801 CB VAL A 432 5.048 -6.372 4.396 1.00 0.00 C ATOM 802 CG1 VAL A 432 4.471 -7.373 5.385 1.00 0.00 C ATOM 803 CG2 VAL A 432 4.192 -6.295 3.140 1.00 0.00 C ATOM 0 H VAL A 432 7.056 -4.433 4.299 1.00 0.00 H new ATOM 0 HA VAL A 432 4.201 -4.495 5.041 1.00 0.00 H new ATOM 0 HB VAL A 432 6.043 -6.714 4.109 1.00 0.00 H new ATOM 0 HG11 VAL A 432 4.388 -8.349 4.908 1.00 0.00 H new ATOM 0 HG12 VAL A 432 5.127 -7.448 6.252 1.00 0.00 H new ATOM 0 HG13 VAL A 432 3.484 -7.040 5.705 1.00 0.00 H new ATOM 0 HG21 VAL A 432 4.112 -7.286 2.693 1.00 0.00 H new ATOM 0 HG22 VAL A 432 3.197 -5.933 3.399 1.00 0.00 H new ATOM 0 HG23 VAL A 432 4.653 -5.611 2.427 1.00 0.00 H new ATOM 813 N PHE A 433 4.693 -5.302 7.400 1.00 0.00 N ATOM 814 CA PHE A 433 5.009 -5.470 8.814 1.00 0.00 C ATOM 815 C PHE A 433 5.119 -6.949 9.174 1.00 0.00 C ATOM 816 O PHE A 433 4.513 -7.803 8.526 1.00 0.00 O ATOM 817 CB PHE A 433 3.940 -4.800 9.680 1.00 0.00 C ATOM 818 CG PHE A 433 4.078 -3.307 9.753 1.00 0.00 C ATOM 819 CD1 PHE A 433 4.203 -2.552 8.598 1.00 0.00 C ATOM 820 CD2 PHE A 433 4.083 -2.657 10.977 1.00 0.00 C ATOM 821 CE1 PHE A 433 4.329 -1.177 8.661 1.00 0.00 C ATOM 822 CE2 PHE A 433 4.208 -1.282 11.047 1.00 0.00 C ATOM 823 CZ PHE A 433 4.333 -0.542 9.887 1.00 0.00 C ATOM 0 H PHE A 433 3.696 -5.314 7.186 1.00 0.00 H new ATOM 0 HA PHE A 433 5.971 -4.995 9.005 1.00 0.00 H new ATOM 0 HB2 PHE A 433 2.955 -5.047 9.283 1.00 0.00 H new ATOM 0 HB3 PHE A 433 3.990 -5.211 10.688 1.00 0.00 H new ATOM 0 HD1 PHE A 433 4.202 -3.044 7.637 1.00 0.00 H new ATOM 0 HD2 PHE A 433 3.988 -3.231 11.887 1.00 0.00 H new ATOM 0 HE1 PHE A 433 4.424 -0.600 7.753 1.00 0.00 H new ATOM 0 HE2 PHE A 433 4.208 -0.787 12.007 1.00 0.00 H new ATOM 0 HZ PHE A 433 4.434 0.532 9.939 1.00 0.00 H new ATOM 983 N CYS A 443 0.069 -9.449 8.092 1.00 0.00 N ATOM 984 CA CYS A 443 -1.097 -9.445 7.217 1.00 0.00 C ATOM 985 C CYS A 443 -1.493 -8.020 6.844 1.00 0.00 C ATOM 986 O CYS A 443 -2.658 -7.743 6.554 1.00 0.00 O ATOM 987 CB CYS A 443 -2.271 -10.153 7.894 1.00 0.00 C ATOM 988 SG CYS A 443 -1.852 -11.760 8.609 1.00 0.00 S ATOM 0 HA CYS A 443 -0.837 -9.981 6.304 1.00 0.00 H new ATOM 0 HB2 CYS A 443 -2.665 -9.509 8.680 1.00 0.00 H new ATOM 0 HB3 CYS A 443 -3.069 -10.289 7.164 1.00 0.00 H new ATOM 0 HG CYS A 443 -2.909 -12.279 9.160 1.00 0.00 H new ATOM 994 N PHE A 444 -0.518 -7.118 6.856 1.00 0.00 N ATOM 995 CA PHE A 444 -0.764 -5.720 6.523 1.00 0.00 C ATOM 996 C PHE A 444 0.539 -5.005 6.175 1.00 0.00 C ATOM 997 O PHE A 444 1.576 -5.248 6.792 1.00 0.00 O ATOM 998 CB PHE A 444 -1.453 -5.009 7.689 1.00 0.00 C ATOM 999 CG PHE A 444 -0.509 -4.598 8.782 1.00 0.00 C ATOM 1000 CD1 PHE A 444 0.360 -3.534 8.602 1.00 0.00 C ATOM 1001 CD2 PHE A 444 -0.490 -5.276 9.991 1.00 0.00 C ATOM 1002 CE1 PHE A 444 1.230 -3.155 9.607 1.00 0.00 C ATOM 1003 CE2 PHE A 444 0.378 -4.901 10.999 1.00 0.00 C ATOM 1004 CZ PHE A 444 1.238 -3.838 10.807 1.00 0.00 C ATOM 0 H PHE A 444 0.451 -7.330 7.093 1.00 0.00 H new ATOM 0 HA PHE A 444 -1.418 -5.691 5.651 1.00 0.00 H new ATOM 0 HB2 PHE A 444 -1.967 -4.125 7.312 1.00 0.00 H new ATOM 0 HB3 PHE A 444 -2.215 -5.667 8.106 1.00 0.00 H new ATOM 0 HD1 PHE A 444 0.358 -2.995 7.666 1.00 0.00 H new ATOM 0 HD2 PHE A 444 -1.162 -6.107 10.147 1.00 0.00 H new ATOM 0 HE1 PHE A 444 1.903 -2.325 9.454 1.00 0.00 H new ATOM 0 HE2 PHE A 444 0.384 -5.439 11.936 1.00 0.00 H new ATOM 0 HZ PHE A 444 1.916 -3.541 11.594 1.00 0.00 H new ATOM 1014 N GLY A 445 0.477 -4.124 5.183 1.00 0.00 N ATOM 1015 CA GLY A 445 1.658 -3.388 4.769 1.00 0.00 C ATOM 1016 C GLY A 445 1.373 -1.917 4.537 1.00 0.00 C ATOM 1017 O GLY A 445 0.215 -1.511 4.431 1.00 0.00 O ATOM 0 H GLY A 445 -0.370 -3.906 4.658 1.00 0.00 H new ATOM 0 HA2 GLY A 445 2.431 -3.489 5.531 1.00 0.00 H new ATOM 0 HA3 GLY A 445 2.053 -3.827 3.853 1.00 0.00 H new ATOM 1021 N PHE A 446 2.430 -1.116 4.461 1.00 0.00 N ATOM 1022 CA PHE A 446 2.288 0.319 4.243 1.00 0.00 C ATOM 1023 C PHE A 446 2.627 0.687 2.802 1.00 0.00 C ATOM 1024 O PHE A 446 3.399 -0.004 2.139 1.00 0.00 O ATOM 1025 CB PHE A 446 3.191 1.094 5.206 1.00 0.00 C ATOM 1026 CG PHE A 446 3.166 2.580 4.987 1.00 0.00 C ATOM 1027 CD1 PHE A 446 1.968 3.275 5.002 1.00 0.00 C ATOM 1028 CD2 PHE A 446 4.340 3.281 4.767 1.00 0.00 C ATOM 1029 CE1 PHE A 446 1.941 4.642 4.800 1.00 0.00 C ATOM 1030 CE2 PHE A 446 4.320 4.647 4.564 1.00 0.00 C ATOM 1031 CZ PHE A 446 3.119 5.329 4.582 1.00 0.00 C ATOM 0 H PHE A 446 3.395 -1.436 4.547 1.00 0.00 H new ATOM 0 HA PHE A 446 1.249 0.589 4.433 1.00 0.00 H new ATOM 0 HB2 PHE A 446 2.884 0.881 6.230 1.00 0.00 H new ATOM 0 HB3 PHE A 446 4.215 0.736 5.099 1.00 0.00 H new ATOM 0 HD1 PHE A 446 1.044 2.743 5.174 1.00 0.00 H new ATOM 0 HD2 PHE A 446 5.282 2.753 4.754 1.00 0.00 H new ATOM 0 HE1 PHE A 446 1.000 5.172 4.813 1.00 0.00 H new ATOM 0 HE2 PHE A 446 5.243 5.181 4.391 1.00 0.00 H new ATOM 0 HZ PHE A 446 3.101 6.398 4.426 1.00 0.00 H new ATOM 1041 N VAL A 447 2.043 1.782 2.325 1.00 0.00 N ATOM 1042 CA VAL A 447 2.283 2.244 0.962 1.00 0.00 C ATOM 1043 C VAL A 447 1.950 3.724 0.817 1.00 0.00 C ATOM 1044 O VAL A 447 1.113 4.257 1.545 1.00 0.00 O ATOM 1045 CB VAL A 447 1.454 1.440 -0.056 1.00 0.00 C ATOM 1046 CG1 VAL A 447 1.545 2.072 -1.437 1.00 0.00 C ATOM 1047 CG2 VAL A 447 1.914 -0.010 -0.094 1.00 0.00 C ATOM 0 H VAL A 447 1.401 2.365 2.861 1.00 0.00 H new ATOM 0 HA VAL A 447 3.343 2.092 0.758 1.00 0.00 H new ATOM 0 HB VAL A 447 0.410 1.458 0.258 1.00 0.00 H new ATOM 0 HG11 VAL A 447 0.953 1.490 -2.143 1.00 0.00 H new ATOM 0 HG12 VAL A 447 1.162 3.092 -1.396 1.00 0.00 H new ATOM 0 HG13 VAL A 447 2.585 2.088 -1.762 1.00 0.00 H new ATOM 0 HG21 VAL A 447 1.316 -0.562 -0.819 1.00 0.00 H new ATOM 0 HG22 VAL A 447 2.964 -0.051 -0.383 1.00 0.00 H new ATOM 0 HG23 VAL A 447 1.791 -0.457 0.893 1.00 0.00 H new ATOM 1057 N SER A 448 2.612 4.384 -0.128 1.00 0.00 N ATOM 1058 CA SER A 448 2.389 5.805 -0.367 1.00 0.00 C ATOM 1059 C SER A 448 2.724 6.172 -1.809 1.00 0.00 C ATOM 1060 O SER A 448 3.577 5.547 -2.439 1.00 0.00 O ATOM 1061 CB SER A 448 3.234 6.644 0.594 1.00 0.00 C ATOM 1062 OG SER A 448 2.644 6.693 1.882 1.00 0.00 O ATOM 0 H SER A 448 3.307 3.957 -0.741 1.00 0.00 H new ATOM 0 HA SER A 448 1.334 6.017 -0.192 1.00 0.00 H new ATOM 0 HB2 SER A 448 4.236 6.222 0.665 1.00 0.00 H new ATOM 0 HB3 SER A 448 3.341 7.655 0.201 1.00 0.00 H new ATOM 0 HG SER A 448 3.114 6.076 2.481 1.00 0.00 H new ATOM 1068 N TYR A 449 2.045 7.190 -2.327 1.00 0.00 N ATOM 1069 CA TYR A 449 2.267 7.640 -3.696 1.00 0.00 C ATOM 1070 C TYR A 449 2.885 9.035 -3.716 1.00 0.00 C ATOM 1071 O TYR A 449 3.213 9.597 -2.671 1.00 0.00 O ATOM 1072 CB TYR A 449 0.950 7.641 -4.474 1.00 0.00 C ATOM 1073 CG TYR A 449 0.545 6.275 -4.980 1.00 0.00 C ATOM 1074 CD1 TYR A 449 0.575 5.166 -4.144 1.00 0.00 C ATOM 1075 CD2 TYR A 449 0.132 6.094 -6.295 1.00 0.00 C ATOM 1076 CE1 TYR A 449 0.207 3.915 -4.603 1.00 0.00 C ATOM 1077 CE2 TYR A 449 -0.238 4.848 -6.761 1.00 0.00 C ATOM 1078 CZ TYR A 449 -0.200 3.762 -5.911 1.00 0.00 C ATOM 1079 OH TYR A 449 -0.568 2.519 -6.373 1.00 0.00 O ATOM 0 H TYR A 449 1.336 7.719 -1.819 1.00 0.00 H new ATOM 0 HA TYR A 449 2.961 6.948 -4.172 1.00 0.00 H new ATOM 0 HB2 TYR A 449 0.159 8.031 -3.833 1.00 0.00 H new ATOM 0 HB3 TYR A 449 1.038 8.321 -5.321 1.00 0.00 H new ATOM 0 HD1 TYR A 449 0.891 5.283 -3.118 1.00 0.00 H new ATOM 0 HD2 TYR A 449 0.100 6.942 -6.963 1.00 0.00 H new ATOM 0 HE1 TYR A 449 0.238 3.063 -3.941 1.00 0.00 H new ATOM 0 HE2 TYR A 449 -0.556 4.724 -7.786 1.00 0.00 H new ATOM 0 HH TYR A 449 0.063 2.227 -7.064 1.00 0.00 H new ATOM 1089 N ASP A 450 3.039 9.588 -4.915 1.00 0.00 N ATOM 1090 CA ASP A 450 3.615 10.919 -5.074 1.00 0.00 C ATOM 1091 C ASP A 450 2.571 11.998 -4.806 1.00 0.00 C ATOM 1092 O ASP A 450 2.905 13.173 -4.655 1.00 0.00 O ATOM 1093 CB ASP A 450 4.188 11.084 -6.483 1.00 0.00 C ATOM 1094 CG ASP A 450 4.468 12.533 -6.827 1.00 0.00 C ATOM 1095 OD1 ASP A 450 5.459 13.086 -6.305 1.00 0.00 O ATOM 1096 OD2 ASP A 450 3.699 13.113 -7.620 1.00 0.00 O ATOM 0 H ASP A 450 2.773 9.136 -5.790 1.00 0.00 H new ATOM 0 HA ASP A 450 4.420 11.030 -4.347 1.00 0.00 H new ATOM 0 HB2 ASP A 450 5.110 10.509 -6.567 1.00 0.00 H new ATOM 0 HB3 ASP A 450 3.487 10.670 -7.208 1.00 0.00 H new ATOM 1101 N ASN A 451 1.307 11.591 -4.750 1.00 0.00 N ATOM 1102 CA ASN A 451 0.215 12.526 -4.503 1.00 0.00 C ATOM 1103 C ASN A 451 -1.037 11.787 -4.036 1.00 0.00 C ATOM 1104 O ASN A 451 -1.196 10.586 -4.254 1.00 0.00 O ATOM 1105 CB ASN A 451 -0.096 13.328 -5.768 1.00 0.00 C ATOM 1106 CG ASN A 451 0.066 12.501 -7.030 1.00 0.00 C ATOM 1107 OD1 ASN A 451 -0.601 11.481 -7.207 1.00 0.00 O ATOM 1108 ND2 ASN A 451 0.953 12.940 -7.915 1.00 0.00 N ATOM 0 H ASN A 451 1.014 10.622 -4.872 1.00 0.00 H new ATOM 0 HA ASN A 451 0.528 13.211 -3.715 1.00 0.00 H new ATOM 0 HB2 ASN A 451 -1.117 13.707 -5.713 1.00 0.00 H new ATOM 0 HB3 ASN A 451 0.563 14.194 -5.817 1.00 0.00 H new ATOM 0 HD21 ASN A 451 1.104 12.427 -8.783 1.00 0.00 H new ATOM 0 HD22 ASN A 451 1.484 13.791 -7.726 1.00 0.00 H new ATOM 1115 N PRO A 452 -1.947 12.521 -3.379 1.00 0.00 N ATOM 1116 CA PRO A 452 -3.199 11.957 -2.869 1.00 0.00 C ATOM 1117 C PRO A 452 -4.222 11.721 -3.975 1.00 0.00 C ATOM 1118 O PRO A 452 -5.277 11.130 -3.744 1.00 0.00 O ATOM 1119 CB PRO A 452 -3.701 13.029 -1.898 1.00 0.00 C ATOM 1120 CG PRO A 452 -3.133 14.305 -2.416 1.00 0.00 C ATOM 1121 CD PRO A 452 -1.821 13.958 -3.083 1.00 0.00 C ATOM 0 HA PRO A 452 -3.048 10.981 -2.408 1.00 0.00 H new ATOM 0 HB2 PRO A 452 -4.790 13.062 -1.873 1.00 0.00 H new ATOM 0 HB3 PRO A 452 -3.365 12.830 -0.880 1.00 0.00 H new ATOM 0 HG2 PRO A 452 -3.816 14.773 -3.125 1.00 0.00 H new ATOM 0 HG3 PRO A 452 -2.979 15.017 -1.605 1.00 0.00 H new ATOM 0 HD2 PRO A 452 -1.667 14.541 -3.991 1.00 0.00 H new ATOM 0 HD3 PRO A 452 -0.974 14.159 -2.428 1.00 0.00 H new ATOM 1129 N VAL A 453 -3.901 12.184 -5.179 1.00 0.00 N ATOM 1130 CA VAL A 453 -4.792 12.021 -6.322 1.00 0.00 C ATOM 1131 C VAL A 453 -4.652 10.632 -6.934 1.00 0.00 C ATOM 1132 O VAL A 453 -5.640 10.018 -7.338 1.00 0.00 O ATOM 1133 CB VAL A 453 -4.510 13.078 -7.407 1.00 0.00 C ATOM 1134 CG1 VAL A 453 -5.454 12.897 -8.586 1.00 0.00 C ATOM 1135 CG2 VAL A 453 -4.630 14.480 -6.829 1.00 0.00 C ATOM 0 H VAL A 453 -3.031 12.674 -5.388 1.00 0.00 H new ATOM 0 HA VAL A 453 -5.809 12.151 -5.952 1.00 0.00 H new ATOM 0 HB VAL A 453 -3.489 12.943 -7.765 1.00 0.00 H new ATOM 0 HG11 VAL A 453 -5.240 13.652 -9.342 1.00 0.00 H new ATOM 0 HG12 VAL A 453 -5.315 11.904 -9.015 1.00 0.00 H new ATOM 0 HG13 VAL A 453 -6.484 13.005 -8.247 1.00 0.00 H new ATOM 0 HG21 VAL A 453 -4.428 15.214 -7.609 1.00 0.00 H new ATOM 0 HG22 VAL A 453 -5.638 14.629 -6.443 1.00 0.00 H new ATOM 0 HG23 VAL A 453 -3.910 14.603 -6.020 1.00 0.00 H new ATOM 1145 N SER A 454 -3.418 10.141 -6.998 1.00 0.00 N ATOM 1146 CA SER A 454 -3.148 8.824 -7.563 1.00 0.00 C ATOM 1147 C SER A 454 -3.383 7.729 -6.527 1.00 0.00 C ATOM 1148 O SER A 454 -3.932 6.672 -6.838 1.00 0.00 O ATOM 1149 CB SER A 454 -1.711 8.753 -8.080 1.00 0.00 C ATOM 1150 OG SER A 454 -1.593 9.376 -9.348 1.00 0.00 O ATOM 0 H SER A 454 -2.590 10.635 -6.666 1.00 0.00 H new ATOM 0 HA SER A 454 -3.834 8.665 -8.395 1.00 0.00 H new ATOM 0 HB2 SER A 454 -1.041 9.238 -7.370 1.00 0.00 H new ATOM 0 HB3 SER A 454 -1.399 7.711 -8.153 1.00 0.00 H new ATOM 0 HG SER A 454 -0.664 9.318 -9.656 1.00 0.00 H new ATOM 1156 N ALA A 455 -2.963 7.991 -5.293 1.00 0.00 N ATOM 1157 CA ALA A 455 -3.129 7.030 -4.211 1.00 0.00 C ATOM 1158 C ALA A 455 -4.581 6.578 -4.095 1.00 0.00 C ATOM 1159 O ALA A 455 -4.857 5.441 -3.714 1.00 0.00 O ATOM 1160 CB ALA A 455 -2.656 7.631 -2.894 1.00 0.00 C ATOM 0 H ALA A 455 -2.506 8.861 -5.019 1.00 0.00 H new ATOM 0 HA ALA A 455 -2.520 6.155 -4.440 1.00 0.00 H new ATOM 0 HB1 ALA A 455 -2.786 6.902 -2.094 1.00 0.00 H new ATOM 0 HB2 ALA A 455 -1.602 7.899 -2.974 1.00 0.00 H new ATOM 0 HB3 ALA A 455 -3.241 8.523 -2.670 1.00 0.00 H new ATOM 1166 N GLN A 456 -5.504 7.475 -4.425 1.00 0.00 N ATOM 1167 CA GLN A 456 -6.927 7.167 -4.357 1.00 0.00 C ATOM 1168 C GLN A 456 -7.319 6.159 -5.433 1.00 0.00 C ATOM 1169 O GLN A 456 -8.063 5.215 -5.171 1.00 0.00 O ATOM 1170 CB GLN A 456 -7.755 8.444 -4.513 1.00 0.00 C ATOM 1171 CG GLN A 456 -7.935 9.214 -3.215 1.00 0.00 C ATOM 1172 CD GLN A 456 -9.114 8.719 -2.401 1.00 0.00 C ATOM 1173 OE1 GLN A 456 -9.971 7.994 -2.906 1.00 0.00 O ATOM 1174 NE2 GLN A 456 -9.165 9.110 -1.133 1.00 0.00 N ATOM 0 H GLN A 456 -5.292 8.421 -4.742 1.00 0.00 H new ATOM 0 HA GLN A 456 -7.131 6.727 -3.381 1.00 0.00 H new ATOM 0 HB2 GLN A 456 -7.274 9.092 -5.246 1.00 0.00 H new ATOM 0 HB3 GLN A 456 -8.736 8.185 -4.911 1.00 0.00 H new ATOM 0 HG2 GLN A 456 -7.026 9.131 -2.619 1.00 0.00 H new ATOM 0 HG3 GLN A 456 -8.073 10.272 -3.441 1.00 0.00 H new ATOM 0 HE21 GLN A 456 -8.433 9.711 -0.755 1.00 0.00 H new ATOM 0 HE22 GLN A 456 -9.936 8.809 -0.537 1.00 0.00 H new ATOM 1183 N ALA A 457 -6.812 6.367 -6.644 1.00 0.00 N ATOM 1184 CA ALA A 457 -7.107 5.475 -7.759 1.00 0.00 C ATOM 1185 C ALA A 457 -7.022 4.014 -7.330 1.00 0.00 C ATOM 1186 O ALA A 457 -7.852 3.194 -7.721 1.00 0.00 O ATOM 1187 CB ALA A 457 -6.156 5.745 -8.915 1.00 0.00 C ATOM 0 H ALA A 457 -6.195 7.145 -6.878 1.00 0.00 H new ATOM 0 HA ALA A 457 -8.127 5.670 -8.089 1.00 0.00 H new ATOM 0 HB1 ALA A 457 -6.387 5.072 -9.741 1.00 0.00 H new ATOM 0 HB2 ALA A 457 -6.269 6.778 -9.245 1.00 0.00 H new ATOM 0 HB3 ALA A 457 -5.130 5.579 -8.588 1.00 0.00 H new ATOM 1193 N ALA A 458 -6.014 3.697 -6.526 1.00 0.00 N ATOM 1194 CA ALA A 458 -5.822 2.334 -6.045 1.00 0.00 C ATOM 1195 C ALA A 458 -6.982 1.897 -5.158 1.00 0.00 C ATOM 1196 O ALA A 458 -7.759 1.017 -5.527 1.00 0.00 O ATOM 1197 CB ALA A 458 -4.506 2.223 -5.288 1.00 0.00 C ATOM 0 H ALA A 458 -5.318 4.364 -6.194 1.00 0.00 H new ATOM 0 HA ALA A 458 -5.789 1.671 -6.909 1.00 0.00 H new ATOM 0 HB1 ALA A 458 -4.375 1.200 -4.934 1.00 0.00 H new ATOM 0 HB2 ALA A 458 -3.682 2.486 -5.951 1.00 0.00 H new ATOM 0 HB3 ALA A 458 -4.518 2.903 -4.436 1.00 0.00 H new ATOM 1203 N ILE A 459 -7.092 2.516 -3.987 1.00 0.00 N ATOM 1204 CA ILE A 459 -8.159 2.190 -3.048 1.00 0.00 C ATOM 1205 C ILE A 459 -9.496 2.045 -3.765 1.00 0.00 C ATOM 1206 O ILE A 459 -10.241 1.095 -3.524 1.00 0.00 O ATOM 1207 CB ILE A 459 -8.290 3.262 -1.951 1.00 0.00 C ATOM 1208 CG1 ILE A 459 -7.017 3.313 -1.103 1.00 0.00 C ATOM 1209 CG2 ILE A 459 -9.503 2.980 -1.077 1.00 0.00 C ATOM 1210 CD1 ILE A 459 -6.920 4.548 -0.234 1.00 0.00 C ATOM 0 H ILE A 459 -6.456 3.246 -3.666 1.00 0.00 H new ATOM 0 HA ILE A 459 -7.893 1.240 -2.585 1.00 0.00 H new ATOM 0 HB ILE A 459 -8.427 4.233 -2.427 1.00 0.00 H new ATOM 0 HG12 ILE A 459 -6.977 2.428 -0.468 1.00 0.00 H new ATOM 0 HG13 ILE A 459 -6.149 3.273 -1.762 1.00 0.00 H new ATOM 0 HG21 ILE A 459 -9.582 3.747 -0.306 1.00 0.00 H new ATOM 0 HG22 ILE A 459 -10.404 2.988 -1.691 1.00 0.00 H new ATOM 0 HG23 ILE A 459 -9.393 2.003 -0.607 1.00 0.00 H new ATOM 0 HD11 ILE A 459 -5.993 4.518 0.339 1.00 0.00 H new ATOM 0 HD12 ILE A 459 -6.928 5.438 -0.864 1.00 0.00 H new ATOM 0 HD13 ILE A 459 -7.769 4.580 0.449 1.00 0.00 H new ATOM 1222 N GLN A 460 -9.794 2.993 -4.648 1.00 0.00 N ATOM 1223 CA GLN A 460 -11.043 2.971 -5.401 1.00 0.00 C ATOM 1224 C GLN A 460 -11.423 1.543 -5.782 1.00 0.00 C ATOM 1225 O GLN A 460 -12.567 1.127 -5.601 1.00 0.00 O ATOM 1226 CB GLN A 460 -10.918 3.831 -6.660 1.00 0.00 C ATOM 1227 CG GLN A 460 -11.181 5.308 -6.415 1.00 0.00 C ATOM 1228 CD GLN A 460 -11.490 6.066 -7.692 1.00 0.00 C ATOM 1229 OE1 GLN A 460 -10.644 6.180 -8.579 1.00 0.00 O ATOM 1230 NE2 GLN A 460 -12.707 6.588 -7.791 1.00 0.00 N ATOM 0 H GLN A 460 -9.188 3.786 -4.860 1.00 0.00 H new ATOM 0 HA GLN A 460 -11.829 3.380 -4.766 1.00 0.00 H new ATOM 0 HB2 GLN A 460 -9.916 3.712 -7.073 1.00 0.00 H new ATOM 0 HB3 GLN A 460 -11.618 3.465 -7.411 1.00 0.00 H new ATOM 0 HG2 GLN A 460 -12.016 5.414 -5.723 1.00 0.00 H new ATOM 0 HG3 GLN A 460 -10.310 5.753 -5.934 1.00 0.00 H new ATOM 0 HE21 GLN A 460 -13.376 6.469 -7.031 1.00 0.00 H new ATOM 0 HE22 GLN A 460 -12.972 7.108 -8.627 1.00 0.00 H new ATOM 1239 N SER A 461 -10.456 0.799 -6.309 1.00 0.00 N ATOM 1240 CA SER A 461 -10.691 -0.580 -6.719 1.00 0.00 C ATOM 1241 C SER A 461 -10.149 -1.556 -5.679 1.00 0.00 C ATOM 1242 O SER A 461 -10.870 -2.430 -5.198 1.00 0.00 O ATOM 1243 CB SER A 461 -10.038 -0.849 -8.076 1.00 0.00 C ATOM 1244 OG SER A 461 -10.910 -0.507 -9.139 1.00 0.00 O ATOM 0 H SER A 461 -9.503 1.128 -6.462 1.00 0.00 H new ATOM 0 HA SER A 461 -11.767 -0.729 -6.806 1.00 0.00 H new ATOM 0 HB2 SER A 461 -9.115 -0.274 -8.159 1.00 0.00 H new ATOM 0 HB3 SER A 461 -9.766 -1.902 -8.150 1.00 0.00 H new ATOM 0 HG SER A 461 -10.468 -0.687 -9.995 1.00 0.00 H new ATOM 1250 N MET A 462 -8.875 -1.398 -5.336 1.00 0.00 N ATOM 1251 CA MET A 462 -8.237 -2.264 -4.352 1.00 0.00 C ATOM 1252 C MET A 462 -9.139 -2.467 -3.139 1.00 0.00 C ATOM 1253 O MET A 462 -9.339 -3.591 -2.683 1.00 0.00 O ATOM 1254 CB MET A 462 -6.896 -1.672 -3.912 1.00 0.00 C ATOM 1255 CG MET A 462 -5.896 -1.523 -5.047 1.00 0.00 C ATOM 1256 SD MET A 462 -5.778 -3.004 -6.068 1.00 0.00 S ATOM 1257 CE MET A 462 -5.133 -4.181 -4.883 1.00 0.00 C ATOM 0 H MET A 462 -8.265 -0.679 -5.725 1.00 0.00 H new ATOM 0 HA MET A 462 -8.062 -3.234 -4.818 1.00 0.00 H new ATOM 0 HB2 MET A 462 -7.070 -0.695 -3.461 1.00 0.00 H new ATOM 0 HB3 MET A 462 -6.464 -2.307 -3.139 1.00 0.00 H new ATOM 0 HG2 MET A 462 -6.185 -0.678 -5.672 1.00 0.00 H new ATOM 0 HG3 MET A 462 -4.914 -1.293 -4.633 1.00 0.00 H new ATOM 0 HE1 MET A 462 -4.921 -5.125 -5.386 1.00 0.00 H new ATOM 0 HE2 MET A 462 -4.215 -3.790 -4.444 1.00 0.00 H new ATOM 0 HE3 MET A 462 -5.870 -4.346 -4.097 1.00 0.00 H new ATOM 1267 N ASN A 463 -9.681 -1.369 -2.621 1.00 0.00 N ATOM 1268 CA ASN A 463 -10.561 -1.426 -1.460 1.00 0.00 C ATOM 1269 C ASN A 463 -11.582 -2.551 -1.606 1.00 0.00 C ATOM 1270 O ASN A 463 -12.550 -2.431 -2.357 1.00 0.00 O ATOM 1271 CB ASN A 463 -11.282 -0.090 -1.273 1.00 0.00 C ATOM 1272 CG ASN A 463 -12.299 -0.132 -0.150 1.00 0.00 C ATOM 1273 OD1 ASN A 463 -13.491 -0.332 -0.384 1.00 0.00 O ATOM 1274 ND2 ASN A 463 -11.832 0.054 1.080 1.00 0.00 N ATOM 0 H ASN A 463 -9.526 -0.430 -2.987 1.00 0.00 H new ATOM 0 HA ASN A 463 -9.948 -1.626 -0.581 1.00 0.00 H new ATOM 0 HB2 ASN A 463 -10.549 0.689 -1.066 1.00 0.00 H new ATOM 0 HB3 ASN A 463 -11.782 0.182 -2.202 1.00 0.00 H new ATOM 0 HD21 ASN A 463 -12.470 0.034 1.876 1.00 0.00 H new ATOM 0 HD22 ASN A 463 -10.836 0.217 1.228 1.00 0.00 H new ATOM 1281 N GLY A 464 -11.360 -3.643 -0.882 1.00 0.00 N ATOM 1282 CA GLY A 464 -12.269 -4.772 -0.945 1.00 0.00 C ATOM 1283 C GLY A 464 -11.937 -5.721 -2.080 1.00 0.00 C ATOM 1284 O GLY A 464 -12.808 -6.436 -2.575 1.00 0.00 O ATOM 0 H GLY A 464 -10.567 -3.766 -0.253 1.00 0.00 H new ATOM 0 HA2 GLY A 464 -12.236 -5.315 -0.000 1.00 0.00 H new ATOM 0 HA3 GLY A 464 -13.289 -4.407 -1.067 1.00 0.00 H new ATOM 1288 N PHE A 465 -10.675 -5.727 -2.494 1.00 0.00 N ATOM 1289 CA PHE A 465 -10.230 -6.593 -3.579 1.00 0.00 C ATOM 1290 C PHE A 465 -10.233 -8.056 -3.145 1.00 0.00 C ATOM 1291 O PHE A 465 -9.400 -8.477 -2.342 1.00 0.00 O ATOM 1292 CB PHE A 465 -8.829 -6.189 -4.041 1.00 0.00 C ATOM 1293 CG PHE A 465 -8.299 -7.037 -5.162 1.00 0.00 C ATOM 1294 CD1 PHE A 465 -7.807 -8.309 -4.913 1.00 0.00 C ATOM 1295 CD2 PHE A 465 -8.292 -6.564 -6.464 1.00 0.00 C ATOM 1296 CE1 PHE A 465 -7.320 -9.092 -5.942 1.00 0.00 C ATOM 1297 CE2 PHE A 465 -7.806 -7.343 -7.497 1.00 0.00 C ATOM 1298 CZ PHE A 465 -7.318 -8.608 -7.235 1.00 0.00 C ATOM 0 H PHE A 465 -9.942 -5.141 -2.094 1.00 0.00 H new ATOM 0 HA PHE A 465 -10.926 -6.478 -4.410 1.00 0.00 H new ATOM 0 HB2 PHE A 465 -8.847 -5.147 -4.362 1.00 0.00 H new ATOM 0 HB3 PHE A 465 -8.144 -6.250 -3.195 1.00 0.00 H new ATOM 0 HD1 PHE A 465 -7.804 -8.692 -3.903 1.00 0.00 H new ATOM 0 HD2 PHE A 465 -8.671 -5.575 -6.674 1.00 0.00 H new ATOM 0 HE1 PHE A 465 -6.941 -10.082 -5.735 1.00 0.00 H new ATOM 0 HE2 PHE A 465 -7.808 -6.963 -8.508 1.00 0.00 H new ATOM 0 HZ PHE A 465 -6.935 -9.218 -8.040 1.00 0.00 H new ATOM 1308 N GLN A 466 -11.177 -8.825 -3.680 1.00 0.00 N ATOM 1309 CA GLN A 466 -11.289 -10.239 -3.345 1.00 0.00 C ATOM 1310 C GLN A 466 -10.073 -11.014 -3.845 1.00 0.00 C ATOM 1311 O GLN A 466 -9.949 -11.290 -5.039 1.00 0.00 O ATOM 1312 CB GLN A 466 -12.566 -10.827 -3.947 1.00 0.00 C ATOM 1313 CG GLN A 466 -12.596 -12.347 -3.946 1.00 0.00 C ATOM 1314 CD GLN A 466 -14.001 -12.903 -3.833 1.00 0.00 C ATOM 1315 OE1 GLN A 466 -14.974 -12.244 -4.204 1.00 0.00 O ATOM 1316 NE2 GLN A 466 -14.116 -14.122 -3.319 1.00 0.00 N ATOM 0 H GLN A 466 -11.874 -8.492 -4.346 1.00 0.00 H new ATOM 0 HA GLN A 466 -11.333 -10.328 -2.260 1.00 0.00 H new ATOM 0 HB2 GLN A 466 -13.425 -10.455 -3.389 1.00 0.00 H new ATOM 0 HB3 GLN A 466 -12.672 -10.471 -4.972 1.00 0.00 H new ATOM 0 HG2 GLN A 466 -12.136 -12.716 -4.863 1.00 0.00 H new ATOM 0 HG3 GLN A 466 -11.995 -12.718 -3.116 1.00 0.00 H new ATOM 0 HE21 GLN A 466 -13.283 -14.632 -3.025 1.00 0.00 H new ATOM 0 HE22 GLN A 466 -15.037 -14.548 -3.219 1.00 0.00 H new ATOM 1325 N ILE A 467 -9.181 -11.363 -2.925 1.00 0.00 N ATOM 1326 CA ILE A 467 -7.977 -12.107 -3.273 1.00 0.00 C ATOM 1327 C ILE A 467 -8.022 -13.522 -2.706 1.00 0.00 C ATOM 1328 O ILE A 467 -8.385 -13.726 -1.548 1.00 0.00 O ATOM 1329 CB ILE A 467 -6.710 -11.400 -2.757 1.00 0.00 C ATOM 1330 CG1 ILE A 467 -5.457 -12.068 -3.329 1.00 0.00 C ATOM 1331 CG2 ILE A 467 -6.677 -11.413 -1.236 1.00 0.00 C ATOM 1332 CD1 ILE A 467 -4.181 -11.308 -3.040 1.00 0.00 C ATOM 0 H ILE A 467 -9.269 -11.143 -1.933 1.00 0.00 H new ATOM 0 HA ILE A 467 -7.939 -12.155 -4.361 1.00 0.00 H new ATOM 0 HB ILE A 467 -6.730 -10.363 -3.091 1.00 0.00 H new ATOM 0 HG12 ILE A 467 -5.372 -13.074 -2.918 1.00 0.00 H new ATOM 0 HG13 ILE A 467 -5.571 -12.173 -4.408 1.00 0.00 H new ATOM 0 HG21 ILE A 467 -5.775 -10.910 -0.887 1.00 0.00 H new ATOM 0 HG22 ILE A 467 -7.555 -10.895 -0.849 1.00 0.00 H new ATOM 0 HG23 ILE A 467 -6.677 -12.444 -0.881 1.00 0.00 H new ATOM 0 HD11 ILE A 467 -3.335 -11.839 -3.475 1.00 0.00 H new ATOM 0 HD12 ILE A 467 -4.245 -10.310 -3.475 1.00 0.00 H new ATOM 0 HD13 ILE A 467 -4.043 -11.226 -1.962 1.00 0.00 H new ATOM 1344 N GLY A 468 -7.648 -14.496 -3.530 1.00 0.00 N ATOM 1345 CA GLY A 468 -7.651 -15.880 -3.092 1.00 0.00 C ATOM 1346 C GLY A 468 -9.019 -16.337 -2.626 1.00 0.00 C ATOM 1347 O GLY A 468 -9.836 -16.787 -3.429 1.00 0.00 O ATOM 0 H GLY A 468 -7.343 -14.352 -4.493 1.00 0.00 H new ATOM 0 HA2 GLY A 468 -7.318 -16.518 -3.911 1.00 0.00 H new ATOM 0 HA3 GLY A 468 -6.934 -16.003 -2.280 1.00 0.00 H new ATOM 1351 N MET A 469 -9.268 -16.222 -1.326 1.00 0.00 N ATOM 1352 CA MET A 469 -10.546 -16.629 -0.754 1.00 0.00 C ATOM 1353 C MET A 469 -11.081 -15.562 0.195 1.00 0.00 C ATOM 1354 O MET A 469 -12.157 -15.715 0.774 1.00 0.00 O ATOM 1355 CB MET A 469 -10.399 -17.959 -0.015 1.00 0.00 C ATOM 1356 CG MET A 469 -10.393 -19.170 -0.936 1.00 0.00 C ATOM 1357 SD MET A 469 -10.495 -20.728 -0.034 1.00 0.00 S ATOM 1358 CE MET A 469 -12.066 -20.533 0.804 1.00 0.00 C ATOM 0 H MET A 469 -8.602 -15.850 -0.649 1.00 0.00 H new ATOM 0 HA MET A 469 -11.257 -16.753 -1.570 1.00 0.00 H new ATOM 0 HB2 MET A 469 -9.473 -17.945 0.560 1.00 0.00 H new ATOM 0 HB3 MET A 469 -11.216 -18.060 0.699 1.00 0.00 H new ATOM 0 HG2 MET A 469 -11.232 -19.100 -1.628 1.00 0.00 H new ATOM 0 HG3 MET A 469 -9.483 -19.161 -1.536 1.00 0.00 H new ATOM 0 HE1 MET A 469 -12.492 -21.515 1.011 1.00 0.00 H new ATOM 0 HE2 MET A 469 -11.914 -19.998 1.742 1.00 0.00 H new ATOM 0 HE3 MET A 469 -12.749 -19.967 0.170 1.00 0.00 H new ATOM 1368 N LYS A 470 -10.323 -14.483 0.352 1.00 0.00 N ATOM 1369 CA LYS A 470 -10.720 -13.388 1.231 1.00 0.00 C ATOM 1370 C LYS A 470 -10.664 -12.054 0.498 1.00 0.00 C ATOM 1371 O LYS A 470 -10.348 -12.000 -0.692 1.00 0.00 O ATOM 1372 CB LYS A 470 -9.814 -13.344 2.464 1.00 0.00 C ATOM 1373 CG LYS A 470 -8.332 -13.344 2.131 1.00 0.00 C ATOM 1374 CD LYS A 470 -7.483 -13.092 3.365 1.00 0.00 C ATOM 1375 CE LYS A 470 -6.003 -13.288 3.073 1.00 0.00 C ATOM 1376 NZ LYS A 470 -5.495 -12.289 2.092 1.00 0.00 N ATOM 0 H LYS A 470 -9.429 -14.342 -0.118 1.00 0.00 H new ATOM 0 HA LYS A 470 -11.748 -13.564 1.548 1.00 0.00 H new ATOM 0 HB2 LYS A 470 -10.047 -12.451 3.044 1.00 0.00 H new ATOM 0 HB3 LYS A 470 -10.035 -14.203 3.098 1.00 0.00 H new ATOM 0 HG2 LYS A 470 -8.058 -14.302 1.689 1.00 0.00 H new ATOM 0 HG3 LYS A 470 -8.126 -12.577 1.384 1.00 0.00 H new ATOM 0 HD2 LYS A 470 -7.653 -12.077 3.724 1.00 0.00 H new ATOM 0 HD3 LYS A 470 -7.790 -13.768 4.163 1.00 0.00 H new ATOM 0 HE2 LYS A 470 -5.436 -13.207 4.000 1.00 0.00 H new ATOM 0 HE3 LYS A 470 -5.839 -14.294 2.686 1.00 0.00 H new ATOM 0 HZ1 LYS A 470 -4.837 -12.753 1.433 1.00 0.00 H new ATOM 0 HZ2 LYS A 470 -6.293 -11.888 1.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 470 -4.999 -11.527 2.597 1.00 0.00 H new ATOM 1390 N ARG A 471 -10.970 -10.976 1.213 1.00 0.00 N ATOM 1391 CA ARG A 471 -10.954 -9.641 0.630 1.00 0.00 C ATOM 1392 C ARG A 471 -9.838 -8.796 1.236 1.00 0.00 C ATOM 1393 O ARG A 471 -9.337 -9.094 2.321 1.00 0.00 O ATOM 1394 CB ARG A 471 -12.304 -8.951 0.844 1.00 0.00 C ATOM 1395 CG ARG A 471 -13.454 -9.621 0.109 1.00 0.00 C ATOM 1396 CD ARG A 471 -14.795 -9.036 0.523 1.00 0.00 C ATOM 1397 NE ARG A 471 -15.902 -9.934 0.211 1.00 0.00 N ATOM 1398 CZ ARG A 471 -16.295 -10.924 1.006 1.00 0.00 C ATOM 1399 NH1 ARG A 471 -15.671 -11.139 2.157 1.00 0.00 N ATOM 1400 NH2 ARG A 471 -17.311 -11.698 0.653 1.00 0.00 N ATOM 0 H ARG A 471 -11.232 -11.002 2.198 1.00 0.00 H new ATOM 0 HA ARG A 471 -10.770 -9.742 -0.440 1.00 0.00 H new ATOM 0 HB2 ARG A 471 -12.528 -8.932 1.911 1.00 0.00 H new ATOM 0 HB3 ARG A 471 -12.229 -7.914 0.516 1.00 0.00 H new ATOM 0 HG2 ARG A 471 -13.320 -9.501 -0.966 1.00 0.00 H new ATOM 0 HG3 ARG A 471 -13.444 -10.692 0.314 1.00 0.00 H new ATOM 0 HD2 ARG A 471 -14.786 -8.830 1.593 1.00 0.00 H new ATOM 0 HD3 ARG A 471 -14.947 -8.083 0.016 1.00 0.00 H new ATOM 0 HE ARG A 471 -16.402 -9.794 -0.667 1.00 0.00 H new ATOM 0 HH11 ARG A 471 -14.889 -10.544 2.432 1.00 0.00 H new ATOM 0 HH12 ARG A 471 -15.973 -11.899 2.767 1.00 0.00 H new ATOM 0 HH21 ARG A 471 -17.793 -11.535 -0.231 1.00 0.00 H new ATOM 0 HH22 ARG A 471 -17.611 -12.457 1.265 1.00 0.00 H new ATOM 1414 N LEU A 472 -9.452 -7.740 0.528 1.00 0.00 N ATOM 1415 CA LEU A 472 -8.393 -6.851 0.995 1.00 0.00 C ATOM 1416 C LEU A 472 -8.976 -5.559 1.557 1.00 0.00 C ATOM 1417 O LEU A 472 -10.097 -5.173 1.223 1.00 0.00 O ATOM 1418 CB LEU A 472 -7.425 -6.535 -0.147 1.00 0.00 C ATOM 1419 CG LEU A 472 -6.640 -7.720 -0.710 1.00 0.00 C ATOM 1420 CD1 LEU A 472 -5.722 -7.267 -1.834 1.00 0.00 C ATOM 1421 CD2 LEU A 472 -5.841 -8.402 0.391 1.00 0.00 C ATOM 0 H LEU A 472 -9.856 -7.478 -0.371 1.00 0.00 H new ATOM 0 HA LEU A 472 -7.850 -7.359 1.792 1.00 0.00 H new ATOM 0 HB2 LEU A 472 -7.991 -6.080 -0.960 1.00 0.00 H new ATOM 0 HB3 LEU A 472 -6.713 -5.787 0.203 1.00 0.00 H new ATOM 0 HG LEU A 472 -7.350 -8.441 -1.116 1.00 0.00 H new ATOM 0 HD11 LEU A 472 -5.172 -8.124 -2.222 1.00 0.00 H new ATOM 0 HD12 LEU A 472 -6.317 -6.825 -2.634 1.00 0.00 H new ATOM 0 HD13 LEU A 472 -5.019 -6.526 -1.453 1.00 0.00 H new ATOM 0 HD21 LEU A 472 -5.289 -9.243 -0.028 1.00 0.00 H new ATOM 0 HD22 LEU A 472 -5.141 -7.689 0.827 1.00 0.00 H new ATOM 0 HD23 LEU A 472 -6.520 -8.763 1.163 1.00 0.00 H new ATOM 1433 N LYS A 473 -8.206 -4.890 2.409 1.00 0.00 N ATOM 1434 CA LYS A 473 -8.643 -3.638 3.014 1.00 0.00 C ATOM 1435 C LYS A 473 -7.554 -2.575 2.913 1.00 0.00 C ATOM 1436 O LYS A 473 -6.566 -2.613 3.646 1.00 0.00 O ATOM 1437 CB LYS A 473 -9.018 -3.861 4.482 1.00 0.00 C ATOM 1438 CG LYS A 473 -9.254 -2.574 5.252 1.00 0.00 C ATOM 1439 CD LYS A 473 -9.001 -2.758 6.738 1.00 0.00 C ATOM 1440 CE LYS A 473 -9.884 -1.842 7.572 1.00 0.00 C ATOM 1441 NZ LYS A 473 -9.229 -1.455 8.852 1.00 0.00 N ATOM 0 H LYS A 473 -7.276 -5.195 2.696 1.00 0.00 H new ATOM 0 HA LYS A 473 -9.520 -3.287 2.470 1.00 0.00 H new ATOM 0 HB2 LYS A 473 -9.919 -4.473 4.529 1.00 0.00 H new ATOM 0 HB3 LYS A 473 -8.223 -4.426 4.969 1.00 0.00 H new ATOM 0 HG2 LYS A 473 -8.600 -1.793 4.865 1.00 0.00 H new ATOM 0 HG3 LYS A 473 -10.279 -2.238 5.096 1.00 0.00 H new ATOM 0 HD2 LYS A 473 -9.188 -3.796 7.014 1.00 0.00 H new ATOM 0 HD3 LYS A 473 -7.953 -2.554 6.958 1.00 0.00 H new ATOM 0 HE2 LYS A 473 -10.120 -0.945 6.999 1.00 0.00 H new ATOM 0 HE3 LYS A 473 -10.829 -2.343 7.784 1.00 0.00 H new ATOM 0 HZ1 LYS A 473 -9.862 -0.831 9.391 1.00 0.00 H new ATOM 0 HZ2 LYS A 473 -9.026 -2.309 9.410 1.00 0.00 H new ATOM 0 HZ3 LYS A 473 -8.340 -0.955 8.650 1.00 0.00 H new ATOM 1455 N VAL A 474 -7.742 -1.628 2.001 1.00 0.00 N ATOM 1456 CA VAL A 474 -6.777 -0.552 1.804 1.00 0.00 C ATOM 1457 C VAL A 474 -7.368 0.796 2.201 1.00 0.00 C ATOM 1458 O VAL A 474 -8.509 1.107 1.862 1.00 0.00 O ATOM 1459 CB VAL A 474 -6.304 -0.483 0.340 1.00 0.00 C ATOM 1460 CG1 VAL A 474 -4.999 0.294 0.238 1.00 0.00 C ATOM 1461 CG2 VAL A 474 -6.148 -1.882 -0.236 1.00 0.00 C ATOM 0 H VAL A 474 -8.554 -1.583 1.386 1.00 0.00 H new ATOM 0 HA VAL A 474 -5.922 -0.772 2.443 1.00 0.00 H new ATOM 0 HB VAL A 474 -7.059 0.043 -0.244 1.00 0.00 H new ATOM 0 HG11 VAL A 474 -4.679 0.333 -0.803 1.00 0.00 H new ATOM 0 HG12 VAL A 474 -5.149 1.308 0.610 1.00 0.00 H new ATOM 0 HG13 VAL A 474 -4.233 -0.201 0.834 1.00 0.00 H new ATOM 0 HG21 VAL A 474 -5.813 -1.814 -1.271 1.00 0.00 H new ATOM 0 HG22 VAL A 474 -5.413 -2.436 0.348 1.00 0.00 H new ATOM 0 HG23 VAL A 474 -7.106 -2.400 -0.198 1.00 0.00 H new ATOM 1471 N GLN A 475 -6.583 1.592 2.920 1.00 0.00 N ATOM 1472 CA GLN A 475 -7.031 2.908 3.363 1.00 0.00 C ATOM 1473 C GLN A 475 -5.841 3.818 3.650 1.00 0.00 C ATOM 1474 O GLN A 475 -4.849 3.392 4.242 1.00 0.00 O ATOM 1475 CB GLN A 475 -7.903 2.780 4.611 1.00 0.00 C ATOM 1476 CG GLN A 475 -8.585 4.078 5.013 1.00 0.00 C ATOM 1477 CD GLN A 475 -9.734 3.860 5.978 1.00 0.00 C ATOM 1478 OE1 GLN A 475 -10.875 3.649 5.567 1.00 0.00 O ATOM 1479 NE2 GLN A 475 -9.437 3.908 7.272 1.00 0.00 N ATOM 0 H GLN A 475 -5.635 1.350 3.208 1.00 0.00 H new ATOM 0 HA GLN A 475 -7.621 3.353 2.562 1.00 0.00 H new ATOM 0 HB2 GLN A 475 -8.663 2.019 4.436 1.00 0.00 H new ATOM 0 HB3 GLN A 475 -7.287 2.431 5.440 1.00 0.00 H new ATOM 0 HG2 GLN A 475 -7.852 4.742 5.471 1.00 0.00 H new ATOM 0 HG3 GLN A 475 -8.956 4.581 4.120 1.00 0.00 H new ATOM 0 HE21 GLN A 475 -8.477 4.086 7.569 1.00 0.00 H new ATOM 0 HE22 GLN A 475 -10.169 3.767 7.969 1.00 0.00 H new ATOM 1488 N LEU A 476 -5.947 5.073 3.226 1.00 0.00 N ATOM 1489 CA LEU A 476 -4.880 6.045 3.438 1.00 0.00 C ATOM 1490 C LEU A 476 -4.978 6.667 4.828 1.00 0.00 C ATOM 1491 O LEU A 476 -6.034 7.161 5.226 1.00 0.00 O ATOM 1492 CB LEU A 476 -4.940 7.139 2.372 1.00 0.00 C ATOM 1493 CG LEU A 476 -5.975 8.242 2.598 1.00 0.00 C ATOM 1494 CD1 LEU A 476 -5.462 9.254 3.611 1.00 0.00 C ATOM 1495 CD2 LEU A 476 -6.321 8.927 1.285 1.00 0.00 C ATOM 0 H LEU A 476 -6.761 5.441 2.734 1.00 0.00 H new ATOM 0 HA LEU A 476 -3.926 5.523 3.360 1.00 0.00 H new ATOM 0 HB2 LEU A 476 -3.956 7.602 2.299 1.00 0.00 H new ATOM 0 HB3 LEU A 476 -5.143 6.670 1.410 1.00 0.00 H new ATOM 0 HG LEU A 476 -6.882 7.787 2.996 1.00 0.00 H new ATOM 0 HD11 LEU A 476 -6.211 10.032 3.760 1.00 0.00 H new ATOM 0 HD12 LEU A 476 -5.266 8.753 4.559 1.00 0.00 H new ATOM 0 HD13 LEU A 476 -4.541 9.704 3.241 1.00 0.00 H new ATOM 0 HD21 LEU A 476 -7.059 9.709 1.466 1.00 0.00 H new ATOM 0 HD22 LEU A 476 -5.421 9.369 0.857 1.00 0.00 H new ATOM 0 HD23 LEU A 476 -6.731 8.195 0.590 1.00 0.00 H new ATOM 1507 N LYS A 477 -3.870 6.643 5.561 1.00 0.00 N ATOM 1508 CA LYS A 477 -3.829 7.208 6.905 1.00 0.00 C ATOM 1509 C LYS A 477 -4.728 8.436 7.006 1.00 0.00 C ATOM 1510 O LYS A 477 -4.454 9.469 6.395 1.00 0.00 O ATOM 1511 CB LYS A 477 -2.393 7.581 7.280 1.00 0.00 C ATOM 1512 CG LYS A 477 -2.144 7.611 8.777 1.00 0.00 C ATOM 1513 CD LYS A 477 -1.862 6.222 9.325 1.00 0.00 C ATOM 1514 CE LYS A 477 -1.335 6.282 10.750 1.00 0.00 C ATOM 1515 NZ LYS A 477 0.129 6.556 10.789 1.00 0.00 N ATOM 0 H LYS A 477 -2.988 6.238 5.247 1.00 0.00 H new ATOM 0 HA LYS A 477 -4.195 6.453 7.601 1.00 0.00 H new ATOM 0 HB2 LYS A 477 -1.709 6.867 6.821 1.00 0.00 H new ATOM 0 HB3 LYS A 477 -2.160 8.560 6.862 1.00 0.00 H new ATOM 0 HG2 LYS A 477 -1.300 8.266 8.993 1.00 0.00 H new ATOM 0 HG3 LYS A 477 -3.013 8.033 9.283 1.00 0.00 H new ATOM 0 HD2 LYS A 477 -2.775 5.627 9.298 1.00 0.00 H new ATOM 0 HD3 LYS A 477 -1.135 5.719 8.688 1.00 0.00 H new ATOM 0 HE2 LYS A 477 -1.865 7.059 11.301 1.00 0.00 H new ATOM 0 HE3 LYS A 477 -1.541 5.338 11.254 1.00 0.00 H new ATOM 0 HZ1 LYS A 477 0.450 6.589 11.778 1.00 0.00 H new ATOM 0 HZ2 LYS A 477 0.637 5.801 10.285 1.00 0.00 H new ATOM 0 HZ3 LYS A 477 0.324 7.469 10.331 1.00 0.00 H new