USER MOD reduce.3.24.130724 H: found=0, std=0, add=572, rem=0, adj=12 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 Single : A 395 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 402 ASN : amide:sc= -6.21! C(o=-6.2!,f=-11!) USER MOD Single : A 406 TYR OH : rot 180:sc=-0.00533 USER MOD Single : A 407 HIS :FLIP no HD1:sc= -0.0732 F(o=-1.6,f=-0.073) USER MOD Single : A 410 GLN : amide:sc=-0.00809 X(o=-0.0081,f=0) USER MOD Single : A 415 GLN : amide:sc= -0.197 X(o=-0.2,f=-0.14) USER MOD Single : A 419 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 420 MET CE :methyl -149:sc= -0.0419 (180deg=-1.13) USER MOD Single : A 422 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 426 ASN : amide:sc= -0.168 X(o=-0.17,f=-0.016) USER MOD Single : A 429 SER OG : rot 67:sc= -1.15 USER MOD Single : A 431 LYS NZ :NH3+ -110:sc= 1.46 (180deg=-0.697) USER MOD Single : A 443 CYS SG : rot 180:sc= 0 USER MOD Single : A 448 SER OG : rot 96:sc= 1.09 USER MOD Single : A 449 TYR OH : rot -131:sc= -0.804 USER MOD Single : A 451 ASN : amide:sc= -0.971 K(o=-0.97,f=-10!) USER MOD Single : A 454 SER OG : rot -100:sc= 0.65 USER MOD Single : A 456 GLN : amide:sc= -0.0429 K(o=-0.043,f=-0.93) USER MOD Single : A 460 GLN : amide:sc= -0.0708 K(o=-0.071,f=-1.7!) USER MOD Single : A 461 SER OG : rot 180:sc= 0 USER MOD Single : A 462 MET CE :methyl 143:sc= -0.893 (180deg=-3.05!) USER MOD Single : A 463 ASN : amide:sc= 0.201 X(o=0.2,f=-0.012) USER MOD Single : A 466 GLN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 469 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 470 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 473 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 475 GLN : amide:sc= -0.0621 K(o=-0.062,f=-1.7!) USER MOD Single : A 477 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0532) USER MOD ----------------------------------------------------------------- ATOM 225 N LYS A 395 9.041 4.682 4.304 1.00 0.00 N ATOM 226 CA LYS A 395 8.941 6.085 3.917 1.00 0.00 C ATOM 227 C LYS A 395 7.532 6.419 3.438 1.00 0.00 C ATOM 228 O LYS A 395 6.727 5.524 3.181 1.00 0.00 O ATOM 229 CB LYS A 395 9.954 6.404 2.816 1.00 0.00 C ATOM 230 CG LYS A 395 10.020 5.349 1.725 1.00 0.00 C ATOM 231 CD LYS A 395 11.107 5.663 0.711 1.00 0.00 C ATOM 232 CE LYS A 395 10.783 6.918 -0.085 1.00 0.00 C ATOM 233 NZ LYS A 395 11.826 7.213 -1.106 1.00 0.00 N ATOM 0 HA LYS A 395 9.161 6.694 4.794 1.00 0.00 H new ATOM 0 HB2 LYS A 395 9.699 7.364 2.367 1.00 0.00 H new ATOM 0 HB3 LYS A 395 10.942 6.514 3.264 1.00 0.00 H new ATOM 0 HG2 LYS A 395 10.209 4.373 2.172 1.00 0.00 H new ATOM 0 HG3 LYS A 395 9.056 5.286 1.219 1.00 0.00 H new ATOM 0 HD2 LYS A 395 12.059 5.793 1.226 1.00 0.00 H new ATOM 0 HD3 LYS A 395 11.225 4.820 0.030 1.00 0.00 H new ATOM 0 HE2 LYS A 395 9.818 6.797 -0.577 1.00 0.00 H new ATOM 0 HE3 LYS A 395 10.690 7.765 0.595 1.00 0.00 H new ATOM 0 HZ1 LYS A 395 11.568 8.075 -1.627 1.00 0.00 H new ATOM 0 HZ2 LYS A 395 12.743 7.354 -0.635 1.00 0.00 H new ATOM 0 HZ3 LYS A 395 11.897 6.416 -1.770 1.00 0.00 H new ATOM 247 N GLU A 396 7.242 7.711 3.322 1.00 0.00 N ATOM 248 CA GLU A 396 5.929 8.160 2.873 1.00 0.00 C ATOM 249 C GLU A 396 6.057 9.338 1.911 1.00 0.00 C ATOM 250 O GLU A 396 7.152 9.849 1.680 1.00 0.00 O ATOM 251 CB GLU A 396 5.065 8.560 4.072 1.00 0.00 C ATOM 252 CG GLU A 396 5.718 9.593 4.975 1.00 0.00 C ATOM 253 CD GLU A 396 5.417 11.016 4.545 1.00 0.00 C ATOM 254 OE1 GLU A 396 4.223 11.362 4.431 1.00 0.00 O ATOM 255 OE2 GLU A 396 6.378 11.782 4.323 1.00 0.00 O ATOM 0 H GLU A 396 7.897 8.464 3.532 1.00 0.00 H new ATOM 0 HA GLU A 396 5.450 7.333 2.348 1.00 0.00 H new ATOM 0 HB2 GLU A 396 4.116 8.955 3.710 1.00 0.00 H new ATOM 0 HB3 GLU A 396 4.837 7.670 4.658 1.00 0.00 H new ATOM 0 HG2 GLU A 396 5.373 9.446 5.998 1.00 0.00 H new ATOM 0 HG3 GLU A 396 6.797 9.438 4.977 1.00 0.00 H new ATOM 262 N GLY A 397 4.928 9.762 1.350 1.00 0.00 N ATOM 263 CA GLY A 397 4.935 10.875 0.419 1.00 0.00 C ATOM 264 C GLY A 397 4.553 12.185 1.078 1.00 0.00 C ATOM 265 O GLY A 397 4.875 12.437 2.240 1.00 0.00 O ATOM 0 H GLY A 397 4.009 9.354 1.524 1.00 0.00 H new ATOM 0 HA2 GLY A 397 5.927 10.970 -0.022 1.00 0.00 H new ATOM 0 HA3 GLY A 397 4.242 10.667 -0.397 1.00 0.00 H new ATOM 269 N PRO A 398 3.853 13.048 0.327 1.00 0.00 N ATOM 270 CA PRO A 398 3.412 14.355 0.824 1.00 0.00 C ATOM 271 C PRO A 398 2.239 14.242 1.791 1.00 0.00 C ATOM 272 O PRO A 398 1.459 13.292 1.726 1.00 0.00 O ATOM 273 CB PRO A 398 2.990 15.094 -0.447 1.00 0.00 C ATOM 274 CG PRO A 398 2.581 14.018 -1.393 1.00 0.00 C ATOM 275 CD PRO A 398 3.436 12.813 -1.066 1.00 0.00 C ATOM 0 HA PRO A 398 4.195 14.862 1.387 1.00 0.00 H new ATOM 0 HB2 PRO A 398 2.168 15.782 -0.250 1.00 0.00 H new ATOM 0 HB3 PRO A 398 3.811 15.686 -0.852 1.00 0.00 H new ATOM 0 HG2 PRO A 398 1.522 13.785 -1.281 1.00 0.00 H new ATOM 0 HG3 PRO A 398 2.731 14.332 -2.426 1.00 0.00 H new ATOM 0 HD2 PRO A 398 2.874 11.884 -1.164 1.00 0.00 H new ATOM 0 HD3 PRO A 398 4.294 12.738 -1.734 1.00 0.00 H new ATOM 283 N GLU A 399 2.119 15.217 2.686 1.00 0.00 N ATOM 284 CA GLU A 399 1.040 15.226 3.666 1.00 0.00 C ATOM 285 C GLU A 399 -0.319 15.128 2.980 1.00 0.00 C ATOM 286 O GLU A 399 -0.755 16.061 2.307 1.00 0.00 O ATOM 287 CB GLU A 399 1.104 16.496 4.518 1.00 0.00 C ATOM 288 CG GLU A 399 0.206 16.453 5.743 1.00 0.00 C ATOM 289 CD GLU A 399 -1.257 16.660 5.403 1.00 0.00 C ATOM 290 OE1 GLU A 399 -1.545 17.439 4.470 1.00 0.00 O ATOM 291 OE2 GLU A 399 -2.114 16.043 6.069 1.00 0.00 O ATOM 0 H GLU A 399 2.756 16.011 2.753 1.00 0.00 H new ATOM 0 HA GLU A 399 1.164 14.357 4.313 1.00 0.00 H new ATOM 0 HB2 GLU A 399 2.133 16.657 4.838 1.00 0.00 H new ATOM 0 HB3 GLU A 399 0.824 17.351 3.902 1.00 0.00 H new ATOM 0 HG2 GLU A 399 0.326 15.492 6.243 1.00 0.00 H new ATOM 0 HG3 GLU A 399 0.523 17.221 6.448 1.00 0.00 H new ATOM 298 N GLY A 400 -0.984 13.990 3.154 1.00 0.00 N ATOM 299 CA GLY A 400 -2.286 13.790 2.546 1.00 0.00 C ATOM 300 C GLY A 400 -2.372 12.487 1.776 1.00 0.00 C ATOM 301 O GLY A 400 -3.451 11.912 1.636 1.00 0.00 O ATOM 0 H GLY A 400 -0.644 13.202 3.706 1.00 0.00 H new ATOM 0 HA2 GLY A 400 -3.052 13.801 3.322 1.00 0.00 H new ATOM 0 HA3 GLY A 400 -2.501 14.621 1.874 1.00 0.00 H new ATOM 305 N ALA A 401 -1.233 12.020 1.275 1.00 0.00 N ATOM 306 CA ALA A 401 -1.185 10.778 0.516 1.00 0.00 C ATOM 307 C ALA A 401 -0.744 9.613 1.397 1.00 0.00 C ATOM 308 O ALA A 401 0.293 9.679 2.055 1.00 0.00 O ATOM 309 CB ALA A 401 -0.250 10.922 -0.675 1.00 0.00 C ATOM 0 H ALA A 401 -0.331 12.484 1.382 1.00 0.00 H new ATOM 0 HA ALA A 401 -2.190 10.566 0.152 1.00 0.00 H new ATOM 0 HB1 ALA A 401 -0.224 9.986 -1.233 1.00 0.00 H new ATOM 0 HB2 ALA A 401 -0.608 11.721 -1.324 1.00 0.00 H new ATOM 0 HB3 ALA A 401 0.753 11.162 -0.323 1.00 0.00 H new ATOM 315 N ASN A 402 -1.540 8.549 1.405 1.00 0.00 N ATOM 316 CA ASN A 402 -1.232 7.370 2.207 1.00 0.00 C ATOM 317 C ASN A 402 -1.965 6.143 1.673 1.00 0.00 C ATOM 318 O ASN A 402 -2.954 6.263 0.949 1.00 0.00 O ATOM 319 CB ASN A 402 -1.611 7.610 3.670 1.00 0.00 C ATOM 320 CG ASN A 402 -1.535 9.074 4.055 1.00 0.00 C ATOM 321 OD1 ASN A 402 -2.538 9.788 4.026 1.00 0.00 O ATOM 322 ND2 ASN A 402 -0.341 9.530 4.416 1.00 0.00 N ATOM 0 H ASN A 402 -2.403 8.479 0.866 1.00 0.00 H new ATOM 0 HA ASN A 402 -0.160 7.186 2.143 1.00 0.00 H new ATOM 0 HB2 ASN A 402 -2.622 7.243 3.845 1.00 0.00 H new ATOM 0 HB3 ASN A 402 -0.947 7.033 4.314 1.00 0.00 H new ATOM 0 HD21 ASN A 402 -0.228 10.508 4.684 1.00 0.00 H new ATOM 0 HD22 ASN A 402 0.463 8.902 4.425 1.00 0.00 H new ATOM 329 N LEU A 403 -1.475 4.963 2.039 1.00 0.00 N ATOM 330 CA LEU A 403 -2.083 3.712 1.598 1.00 0.00 C ATOM 331 C LEU A 403 -1.683 2.560 2.514 1.00 0.00 C ATOM 332 O LEU A 403 -0.515 2.179 2.575 1.00 0.00 O ATOM 333 CB LEU A 403 -1.671 3.401 0.158 1.00 0.00 C ATOM 334 CG LEU A 403 -2.327 4.256 -0.928 1.00 0.00 C ATOM 335 CD1 LEU A 403 -1.866 3.810 -2.307 1.00 0.00 C ATOM 336 CD2 LEU A 403 -3.843 4.183 -0.820 1.00 0.00 C ATOM 0 H LEU A 403 -0.659 4.846 2.640 1.00 0.00 H new ATOM 0 HA LEU A 403 -3.166 3.828 1.642 1.00 0.00 H new ATOM 0 HB2 LEU A 403 -0.590 3.515 0.078 1.00 0.00 H new ATOM 0 HB3 LEU A 403 -1.897 2.354 -0.045 1.00 0.00 H new ATOM 0 HG LEU A 403 -2.022 5.293 -0.783 1.00 0.00 H new ATOM 0 HD11 LEU A 403 -2.342 4.429 -3.068 1.00 0.00 H new ATOM 0 HD12 LEU A 403 -0.783 3.914 -2.380 1.00 0.00 H new ATOM 0 HD13 LEU A 403 -2.141 2.767 -2.463 1.00 0.00 H new ATOM 0 HD21 LEU A 403 -4.293 4.797 -1.600 1.00 0.00 H new ATOM 0 HD22 LEU A 403 -4.167 3.149 -0.940 1.00 0.00 H new ATOM 0 HD23 LEU A 403 -4.156 4.551 0.157 1.00 0.00 H new ATOM 348 N PHE A 404 -2.663 2.008 3.224 1.00 0.00 N ATOM 349 CA PHE A 404 -2.414 0.899 4.135 1.00 0.00 C ATOM 350 C PHE A 404 -3.266 -0.311 3.765 1.00 0.00 C ATOM 351 O PHE A 404 -4.490 -0.286 3.900 1.00 0.00 O ATOM 352 CB PHE A 404 -2.705 1.320 5.577 1.00 0.00 C ATOM 353 CG PHE A 404 -1.592 2.106 6.209 1.00 0.00 C ATOM 354 CD1 PHE A 404 -1.490 3.473 6.006 1.00 0.00 C ATOM 355 CD2 PHE A 404 -0.647 1.479 7.004 1.00 0.00 C ATOM 356 CE1 PHE A 404 -0.467 4.200 6.585 1.00 0.00 C ATOM 357 CE2 PHE A 404 0.378 2.199 7.586 1.00 0.00 C ATOM 358 CZ PHE A 404 0.468 3.562 7.377 1.00 0.00 C ATOM 0 H PHE A 404 -3.636 2.312 3.185 1.00 0.00 H new ATOM 0 HA PHE A 404 -1.363 0.621 4.050 1.00 0.00 H new ATOM 0 HB2 PHE A 404 -3.617 1.917 5.596 1.00 0.00 H new ATOM 0 HB3 PHE A 404 -2.895 0.429 6.176 1.00 0.00 H new ATOM 0 HD1 PHE A 404 -2.219 3.976 5.388 1.00 0.00 H new ATOM 0 HD2 PHE A 404 -0.712 0.414 7.171 1.00 0.00 H new ATOM 0 HE1 PHE A 404 -0.399 5.265 6.419 1.00 0.00 H new ATOM 0 HE2 PHE A 404 1.108 1.697 8.204 1.00 0.00 H new ATOM 0 HZ PHE A 404 1.268 4.127 7.832 1.00 0.00 H new ATOM 368 N ILE A 405 -2.611 -1.368 3.298 1.00 0.00 N ATOM 369 CA ILE A 405 -3.309 -2.588 2.909 1.00 0.00 C ATOM 370 C ILE A 405 -3.400 -3.566 4.076 1.00 0.00 C ATOM 371 O ILE A 405 -2.421 -3.793 4.787 1.00 0.00 O ATOM 372 CB ILE A 405 -2.610 -3.283 1.726 1.00 0.00 C ATOM 373 CG1 ILE A 405 -2.447 -2.308 0.557 1.00 0.00 C ATOM 374 CG2 ILE A 405 -3.398 -4.510 1.291 1.00 0.00 C ATOM 375 CD1 ILE A 405 -1.318 -1.319 0.750 1.00 0.00 C ATOM 0 H ILE A 405 -1.599 -1.405 3.180 1.00 0.00 H new ATOM 0 HA ILE A 405 -4.314 -2.293 2.606 1.00 0.00 H new ATOM 0 HB ILE A 405 -1.620 -3.606 2.048 1.00 0.00 H new ATOM 0 HG12 ILE A 405 -2.271 -2.875 -0.357 1.00 0.00 H new ATOM 0 HG13 ILE A 405 -3.379 -1.761 0.418 1.00 0.00 H new ATOM 0 HG21 ILE A 405 -2.891 -4.990 0.454 1.00 0.00 H new ATOM 0 HG22 ILE A 405 -3.469 -5.211 2.123 1.00 0.00 H new ATOM 0 HG23 ILE A 405 -4.400 -4.209 0.984 1.00 0.00 H new ATOM 0 HD11 ILE A 405 -1.260 -0.659 -0.116 1.00 0.00 H new ATOM 0 HD12 ILE A 405 -1.503 -0.726 1.646 1.00 0.00 H new ATOM 0 HD13 ILE A 405 -0.377 -1.858 0.859 1.00 0.00 H new ATOM 387 N TYR A 406 -4.581 -4.143 4.266 1.00 0.00 N ATOM 388 CA TYR A 406 -4.801 -5.096 5.347 1.00 0.00 C ATOM 389 C TYR A 406 -5.337 -6.418 4.807 1.00 0.00 C ATOM 390 O TYR A 406 -5.717 -6.518 3.640 1.00 0.00 O ATOM 391 CB TYR A 406 -5.776 -4.518 6.374 1.00 0.00 C ATOM 392 CG TYR A 406 -5.382 -3.149 6.880 1.00 0.00 C ATOM 393 CD1 TYR A 406 -4.325 -2.993 7.768 1.00 0.00 C ATOM 394 CD2 TYR A 406 -6.068 -2.012 6.471 1.00 0.00 C ATOM 395 CE1 TYR A 406 -3.962 -1.744 8.233 1.00 0.00 C ATOM 396 CE2 TYR A 406 -5.710 -0.759 6.929 1.00 0.00 C ATOM 397 CZ TYR A 406 -4.657 -0.630 7.810 1.00 0.00 C ATOM 398 OH TYR A 406 -4.300 0.617 8.271 1.00 0.00 O ATOM 0 H TYR A 406 -5.401 -3.967 3.685 1.00 0.00 H new ATOM 0 HA TYR A 406 -3.843 -5.285 5.832 1.00 0.00 H new ATOM 0 HB2 TYR A 406 -6.768 -4.459 5.927 1.00 0.00 H new ATOM 0 HB3 TYR A 406 -5.847 -5.202 7.220 1.00 0.00 H new ATOM 0 HD1 TYR A 406 -3.778 -3.863 8.100 1.00 0.00 H new ATOM 0 HD2 TYR A 406 -6.895 -2.110 5.783 1.00 0.00 H new ATOM 0 HE1 TYR A 406 -3.139 -1.640 8.924 1.00 0.00 H new ATOM 0 HE2 TYR A 406 -6.252 0.115 6.599 1.00 0.00 H new ATOM 0 HH TYR A 406 -4.889 1.293 7.875 1.00 0.00 H new ATOM 408 N HIS A 407 -5.367 -7.432 5.666 1.00 0.00 N ATOM 409 CA HIS A 407 -5.858 -8.750 5.277 1.00 0.00 C ATOM 410 C HIS A 407 -5.068 -9.295 4.091 1.00 0.00 C ATOM 411 O HIS A 407 -5.643 -9.832 3.143 1.00 0.00 O ATOM 412 CB HIS A 407 -7.344 -8.680 4.926 1.00 0.00 C ATOM 413 CG HIS A 407 -8.202 -8.180 6.047 1.00 0.00 C ATOM 414 ND1 HIS A 407 -8.141 -7.034 6.765 1.00 0.00 N flip ATOM 415 CD2 HIS A 407 -9.271 -8.890 6.551 1.00 0.00 C flip ATOM 416 CE1 HIS A 407 -9.166 -7.072 7.680 1.00 0.00 C flip ATOM 417 NE2 HIS A 407 -9.832 -8.202 7.529 1.00 0.00 N flip ATOM 0 H HIS A 407 -5.057 -7.367 6.636 1.00 0.00 H new ATOM 0 HA HIS A 407 -5.723 -9.425 6.122 1.00 0.00 H new ATOM 0 HB2 HIS A 407 -7.474 -8.029 4.062 1.00 0.00 H new ATOM 0 HB3 HIS A 407 -7.686 -9.672 4.632 1.00 0.00 H new ATOM 0 HD2 HIS A 407 -9.599 -9.858 6.201 1.00 0.00 H new ATOM 0 HE1 HIS A 407 -9.390 -6.303 8.404 1.00 0.00 H new ATOM 0 HE2 HIS A 407 -10.642 -8.494 8.075 1.00 0.00 H new ATOM 425 N LEU A 408 -3.749 -9.155 4.150 1.00 0.00 N ATOM 426 CA LEU A 408 -2.879 -9.633 3.080 1.00 0.00 C ATOM 427 C LEU A 408 -2.428 -11.066 3.345 1.00 0.00 C ATOM 428 O LEU A 408 -2.027 -11.422 4.453 1.00 0.00 O ATOM 429 CB LEU A 408 -1.661 -8.721 2.940 1.00 0.00 C ATOM 430 CG LEU A 408 -1.888 -7.407 2.191 1.00 0.00 C ATOM 431 CD1 LEU A 408 -0.741 -6.442 2.446 1.00 0.00 C ATOM 432 CD2 LEU A 408 -2.048 -7.665 0.700 1.00 0.00 C ATOM 0 H LEU A 408 -3.257 -8.714 4.927 1.00 0.00 H new ATOM 0 HA LEU A 408 -3.446 -9.616 2.149 1.00 0.00 H new ATOM 0 HB2 LEU A 408 -1.290 -8.488 3.938 1.00 0.00 H new ATOM 0 HB3 LEU A 408 -0.874 -9.276 2.429 1.00 0.00 H new ATOM 0 HG LEU A 408 -2.807 -6.953 2.562 1.00 0.00 H new ATOM 0 HD11 LEU A 408 -0.920 -5.513 1.905 1.00 0.00 H new ATOM 0 HD12 LEU A 408 -0.672 -6.233 3.514 1.00 0.00 H new ATOM 0 HD13 LEU A 408 0.193 -6.888 2.103 1.00 0.00 H new ATOM 0 HD21 LEU A 408 -2.209 -6.719 0.182 1.00 0.00 H new ATOM 0 HD22 LEU A 408 -1.147 -8.141 0.314 1.00 0.00 H new ATOM 0 HD23 LEU A 408 -2.904 -8.320 0.534 1.00 0.00 H new ATOM 444 N PRO A 409 -2.494 -11.910 2.304 1.00 0.00 N ATOM 445 CA PRO A 409 -2.094 -13.316 2.399 1.00 0.00 C ATOM 446 C PRO A 409 -0.729 -13.488 3.056 1.00 0.00 C ATOM 447 O PRO A 409 -0.091 -12.511 3.446 1.00 0.00 O ATOM 448 CB PRO A 409 -2.046 -13.771 0.938 1.00 0.00 C ATOM 449 CG PRO A 409 -3.010 -12.880 0.233 1.00 0.00 C ATOM 450 CD PRO A 409 -2.963 -11.554 0.955 1.00 0.00 C ATOM 0 HA PRO A 409 -2.781 -13.894 3.017 1.00 0.00 H new ATOM 0 HB2 PRO A 409 -1.042 -13.673 0.526 1.00 0.00 H new ATOM 0 HB3 PRO A 409 -2.330 -14.819 0.840 1.00 0.00 H new ATOM 0 HG2 PRO A 409 -2.736 -12.762 -0.815 1.00 0.00 H new ATOM 0 HG3 PRO A 409 -4.016 -13.300 0.255 1.00 0.00 H new ATOM 0 HD2 PRO A 409 -2.284 -10.855 0.466 1.00 0.00 H new ATOM 0 HD3 PRO A 409 -3.943 -11.078 0.984 1.00 0.00 H new ATOM 458 N GLN A 410 -0.286 -14.736 3.173 1.00 0.00 N ATOM 459 CA GLN A 410 1.005 -15.033 3.783 1.00 0.00 C ATOM 460 C GLN A 410 2.129 -14.924 2.758 1.00 0.00 C ATOM 461 O GLN A 410 3.169 -14.323 3.027 1.00 0.00 O ATOM 462 CB GLN A 410 0.991 -16.435 4.395 1.00 0.00 C ATOM 463 CG GLN A 410 0.150 -16.540 5.657 1.00 0.00 C ATOM 464 CD GLN A 410 -0.192 -17.974 6.013 1.00 0.00 C ATOM 465 OE1 GLN A 410 0.278 -18.504 7.019 1.00 0.00 O ATOM 466 NE2 GLN A 410 -1.016 -18.609 5.187 1.00 0.00 N ATOM 0 H GLN A 410 -0.801 -15.556 2.854 1.00 0.00 H new ATOM 0 HA GLN A 410 1.185 -14.301 4.571 1.00 0.00 H new ATOM 0 HB2 GLN A 410 0.612 -17.141 3.656 1.00 0.00 H new ATOM 0 HB3 GLN A 410 2.014 -16.732 4.625 1.00 0.00 H new ATOM 0 HG2 GLN A 410 0.688 -16.082 6.487 1.00 0.00 H new ATOM 0 HG3 GLN A 410 -0.771 -15.973 5.523 1.00 0.00 H new ATOM 0 HE21 GLN A 410 -1.382 -18.130 4.364 1.00 0.00 H new ATOM 0 HE22 GLN A 410 -1.283 -19.575 5.376 1.00 0.00 H new ATOM 475 N GLU A 411 1.913 -15.509 1.584 1.00 0.00 N ATOM 476 CA GLU A 411 2.909 -15.477 0.521 1.00 0.00 C ATOM 477 C GLU A 411 3.244 -14.040 0.131 1.00 0.00 C ATOM 478 O GLU A 411 4.390 -13.722 -0.191 1.00 0.00 O ATOM 479 CB GLU A 411 2.407 -16.245 -0.703 1.00 0.00 C ATOM 480 CG GLU A 411 1.113 -15.693 -1.279 1.00 0.00 C ATOM 481 CD GLU A 411 0.724 -16.361 -2.584 1.00 0.00 C ATOM 482 OE1 GLU A 411 1.633 -16.780 -3.331 1.00 0.00 O ATOM 483 OE2 GLU A 411 -0.490 -16.462 -2.858 1.00 0.00 O ATOM 0 H GLU A 411 1.057 -16.010 1.346 1.00 0.00 H new ATOM 0 HA GLU A 411 3.815 -15.955 0.894 1.00 0.00 H new ATOM 0 HB2 GLU A 411 3.176 -16.225 -1.475 1.00 0.00 H new ATOM 0 HB3 GLU A 411 2.257 -17.289 -0.430 1.00 0.00 H new ATOM 0 HG2 GLU A 411 0.311 -15.826 -0.553 1.00 0.00 H new ATOM 0 HG3 GLU A 411 1.220 -14.621 -1.442 1.00 0.00 H new ATOM 490 N PHE A 412 2.235 -13.176 0.161 1.00 0.00 N ATOM 491 CA PHE A 412 2.420 -11.772 -0.191 1.00 0.00 C ATOM 492 C PHE A 412 3.520 -11.140 0.657 1.00 0.00 C ATOM 493 O PHE A 412 3.404 -11.048 1.878 1.00 0.00 O ATOM 494 CB PHE A 412 1.111 -11.000 -0.006 1.00 0.00 C ATOM 495 CG PHE A 412 0.257 -10.965 -1.240 1.00 0.00 C ATOM 496 CD1 PHE A 412 -0.363 -12.114 -1.703 1.00 0.00 C ATOM 497 CD2 PHE A 412 0.075 -9.781 -1.938 1.00 0.00 C ATOM 498 CE1 PHE A 412 -1.150 -12.084 -2.839 1.00 0.00 C ATOM 499 CE2 PHE A 412 -0.712 -9.745 -3.074 1.00 0.00 C ATOM 500 CZ PHE A 412 -1.324 -10.898 -3.525 1.00 0.00 C ATOM 0 H PHE A 412 1.281 -13.423 0.425 1.00 0.00 H new ATOM 0 HA PHE A 412 2.718 -11.722 -1.238 1.00 0.00 H new ATOM 0 HB2 PHE A 412 0.543 -11.453 0.807 1.00 0.00 H new ATOM 0 HB3 PHE A 412 1.341 -9.978 0.296 1.00 0.00 H new ATOM 0 HD1 PHE A 412 -0.230 -13.044 -1.170 1.00 0.00 H new ATOM 0 HD2 PHE A 412 0.553 -8.877 -1.591 1.00 0.00 H new ATOM 0 HE1 PHE A 412 -1.628 -12.987 -3.190 1.00 0.00 H new ATOM 0 HE2 PHE A 412 -0.848 -8.816 -3.608 1.00 0.00 H new ATOM 0 HZ PHE A 412 -1.938 -10.872 -4.413 1.00 0.00 H new ATOM 510 N GLY A 413 4.590 -10.705 -0.003 1.00 0.00 N ATOM 511 CA GLY A 413 5.697 -10.088 0.706 1.00 0.00 C ATOM 512 C GLY A 413 5.766 -8.589 0.480 1.00 0.00 C ATOM 513 O GLY A 413 4.747 -7.945 0.233 1.00 0.00 O ATOM 0 H GLY A 413 4.710 -10.769 -1.014 1.00 0.00 H new ATOM 0 HA2 GLY A 413 5.598 -10.287 1.773 1.00 0.00 H new ATOM 0 HA3 GLY A 413 6.632 -10.545 0.382 1.00 0.00 H new ATOM 517 N ASP A 414 6.970 -8.035 0.566 1.00 0.00 N ATOM 518 CA ASP A 414 7.168 -6.604 0.370 1.00 0.00 C ATOM 519 C ASP A 414 7.097 -6.243 -1.111 1.00 0.00 C ATOM 520 O ASP A 414 6.467 -5.256 -1.489 1.00 0.00 O ATOM 521 CB ASP A 414 8.514 -6.169 0.950 1.00 0.00 C ATOM 522 CG ASP A 414 8.699 -6.621 2.386 1.00 0.00 C ATOM 523 OD1 ASP A 414 8.548 -7.831 2.650 1.00 0.00 O ATOM 524 OD2 ASP A 414 8.994 -5.764 3.245 1.00 0.00 O ATOM 0 H ASP A 414 7.823 -8.555 0.770 1.00 0.00 H new ATOM 0 HA ASP A 414 6.369 -6.077 0.892 1.00 0.00 H new ATOM 0 HB2 ASP A 414 9.319 -6.576 0.338 1.00 0.00 H new ATOM 0 HB3 ASP A 414 8.594 -5.083 0.901 1.00 0.00 H new ATOM 529 N GLN A 415 7.750 -7.048 -1.942 1.00 0.00 N ATOM 530 CA GLN A 415 7.763 -6.812 -3.381 1.00 0.00 C ATOM 531 C GLN A 415 6.356 -6.911 -3.962 1.00 0.00 C ATOM 532 O GLN A 415 5.865 -5.970 -4.586 1.00 0.00 O ATOM 533 CB GLN A 415 8.686 -7.815 -4.076 1.00 0.00 C ATOM 534 CG GLN A 415 10.160 -7.472 -3.952 1.00 0.00 C ATOM 535 CD GLN A 415 10.736 -7.844 -2.599 1.00 0.00 C ATOM 536 OE1 GLN A 415 11.244 -6.992 -1.872 1.00 0.00 O ATOM 537 NE2 GLN A 415 10.657 -9.125 -2.255 1.00 0.00 N ATOM 0 H GLN A 415 8.277 -7.869 -1.644 1.00 0.00 H new ATOM 0 HA GLN A 415 8.138 -5.803 -3.554 1.00 0.00 H new ATOM 0 HB2 GLN A 415 8.515 -8.806 -3.654 1.00 0.00 H new ATOM 0 HB3 GLN A 415 8.422 -7.868 -5.132 1.00 0.00 H new ATOM 0 HG2 GLN A 415 10.716 -7.989 -4.734 1.00 0.00 H new ATOM 0 HG3 GLN A 415 10.295 -6.403 -4.119 1.00 0.00 H new ATOM 0 HE21 GLN A 415 10.227 -9.798 -2.890 1.00 0.00 H new ATOM 0 HE22 GLN A 415 11.026 -9.435 -1.356 1.00 0.00 H new ATOM 546 N ASP A 416 5.714 -8.054 -3.751 1.00 0.00 N ATOM 547 CA ASP A 416 4.362 -8.275 -4.253 1.00 0.00 C ATOM 548 C ASP A 416 3.533 -6.997 -4.164 1.00 0.00 C ATOM 549 O ASP A 416 3.125 -6.437 -5.182 1.00 0.00 O ATOM 550 CB ASP A 416 3.680 -9.395 -3.466 1.00 0.00 C ATOM 551 CG ASP A 416 4.303 -10.752 -3.732 1.00 0.00 C ATOM 552 OD1 ASP A 416 4.157 -11.260 -4.863 1.00 0.00 O ATOM 553 OD2 ASP A 416 4.937 -11.305 -2.809 1.00 0.00 O ATOM 0 H ASP A 416 6.107 -8.842 -3.236 1.00 0.00 H new ATOM 0 HA ASP A 416 4.433 -8.568 -5.300 1.00 0.00 H new ATOM 0 HB2 ASP A 416 3.739 -9.174 -2.400 1.00 0.00 H new ATOM 0 HB3 ASP A 416 2.622 -9.427 -3.727 1.00 0.00 H new ATOM 558 N LEU A 417 3.288 -6.541 -2.940 1.00 0.00 N ATOM 559 CA LEU A 417 2.507 -5.329 -2.719 1.00 0.00 C ATOM 560 C LEU A 417 2.906 -4.236 -3.704 1.00 0.00 C ATOM 561 O LEU A 417 2.050 -3.590 -4.311 1.00 0.00 O ATOM 562 CB LEU A 417 2.698 -4.832 -1.284 1.00 0.00 C ATOM 563 CG LEU A 417 1.696 -3.784 -0.799 1.00 0.00 C ATOM 564 CD1 LEU A 417 0.321 -4.406 -0.611 1.00 0.00 C ATOM 565 CD2 LEU A 417 2.176 -3.148 0.497 1.00 0.00 C ATOM 0 H LEU A 417 3.618 -6.992 -2.087 1.00 0.00 H new ATOM 0 HA LEU A 417 1.456 -5.569 -2.879 1.00 0.00 H new ATOM 0 HB2 LEU A 417 2.649 -5.690 -0.614 1.00 0.00 H new ATOM 0 HB3 LEU A 417 3.701 -4.415 -1.195 1.00 0.00 H new ATOM 0 HG LEU A 417 1.619 -3.005 -1.557 1.00 0.00 H new ATOM 0 HD11 LEU A 417 -0.379 -3.645 -0.266 1.00 0.00 H new ATOM 0 HD12 LEU A 417 -0.027 -4.814 -1.560 1.00 0.00 H new ATOM 0 HD13 LEU A 417 0.381 -5.205 0.128 1.00 0.00 H new ATOM 0 HD21 LEU A 417 1.451 -2.405 0.828 1.00 0.00 H new ATOM 0 HD22 LEU A 417 2.282 -3.917 1.262 1.00 0.00 H new ATOM 0 HD23 LEU A 417 3.139 -2.666 0.331 1.00 0.00 H new ATOM 577 N LEU A 418 4.209 -4.036 -3.863 1.00 0.00 N ATOM 578 CA LEU A 418 4.722 -3.022 -4.778 1.00 0.00 C ATOM 579 C LEU A 418 4.339 -3.345 -6.219 1.00 0.00 C ATOM 580 O LEU A 418 4.035 -2.450 -7.005 1.00 0.00 O ATOM 581 CB LEU A 418 6.243 -2.917 -4.653 1.00 0.00 C ATOM 582 CG LEU A 418 6.909 -1.814 -5.477 1.00 0.00 C ATOM 583 CD1 LEU A 418 6.756 -0.467 -4.789 1.00 0.00 C ATOM 584 CD2 LEU A 418 8.379 -2.134 -5.706 1.00 0.00 C ATOM 0 H LEU A 418 4.930 -4.563 -3.370 1.00 0.00 H new ATOM 0 HA LEU A 418 4.275 -2.065 -4.509 1.00 0.00 H new ATOM 0 HB2 LEU A 418 6.491 -2.759 -3.603 1.00 0.00 H new ATOM 0 HB3 LEU A 418 6.678 -3.873 -4.943 1.00 0.00 H new ATOM 0 HG LEU A 418 6.413 -1.762 -6.446 1.00 0.00 H new ATOM 0 HD11 LEU A 418 7.236 0.305 -5.390 1.00 0.00 H new ATOM 0 HD12 LEU A 418 5.697 -0.234 -4.677 1.00 0.00 H new ATOM 0 HD13 LEU A 418 7.225 -0.505 -3.806 1.00 0.00 H new ATOM 0 HD21 LEU A 418 8.837 -1.339 -6.294 1.00 0.00 H new ATOM 0 HD22 LEU A 418 8.888 -2.214 -4.745 1.00 0.00 H new ATOM 0 HD23 LEU A 418 8.466 -3.079 -6.243 1.00 0.00 H new ATOM 596 N GLN A 419 4.357 -4.631 -6.555 1.00 0.00 N ATOM 597 CA GLN A 419 4.011 -5.072 -7.902 1.00 0.00 C ATOM 598 C GLN A 419 2.497 -5.131 -8.083 1.00 0.00 C ATOM 599 O GLN A 419 2.000 -5.189 -9.206 1.00 0.00 O ATOM 600 CB GLN A 419 4.623 -6.446 -8.183 1.00 0.00 C ATOM 601 CG GLN A 419 6.109 -6.396 -8.497 1.00 0.00 C ATOM 602 CD GLN A 419 6.390 -5.992 -9.931 1.00 0.00 C ATOM 603 OE1 GLN A 419 6.230 -6.789 -10.856 1.00 0.00 O ATOM 604 NE2 GLN A 419 6.812 -4.748 -10.123 1.00 0.00 N ATOM 0 H GLN A 419 4.607 -5.385 -5.915 1.00 0.00 H new ATOM 0 HA GLN A 419 4.416 -4.349 -8.610 1.00 0.00 H new ATOM 0 HB2 GLN A 419 4.464 -7.089 -7.318 1.00 0.00 H new ATOM 0 HB3 GLN A 419 4.098 -6.904 -9.021 1.00 0.00 H new ATOM 0 HG2 GLN A 419 6.595 -5.691 -7.823 1.00 0.00 H new ATOM 0 HG3 GLN A 419 6.550 -7.375 -8.306 1.00 0.00 H new ATOM 0 HE21 GLN A 419 6.931 -4.121 -9.327 1.00 0.00 H new ATOM 0 HE22 GLN A 419 7.018 -4.419 -11.066 1.00 0.00 H new ATOM 613 N MET A 420 1.772 -5.113 -6.970 1.00 0.00 N ATOM 614 CA MET A 420 0.315 -5.163 -7.007 1.00 0.00 C ATOM 615 C MET A 420 -0.274 -3.762 -7.145 1.00 0.00 C ATOM 616 O MET A 420 -1.342 -3.583 -7.730 1.00 0.00 O ATOM 617 CB MET A 420 -0.226 -5.833 -5.742 1.00 0.00 C ATOM 618 CG MET A 420 -1.737 -5.740 -5.605 1.00 0.00 C ATOM 619 SD MET A 420 -2.595 -7.094 -6.429 1.00 0.00 S ATOM 620 CE MET A 420 -3.289 -7.961 -5.023 1.00 0.00 C ATOM 0 H MET A 420 2.169 -5.064 -6.032 1.00 0.00 H new ATOM 0 HA MET A 420 0.019 -5.750 -7.876 1.00 0.00 H new ATOM 0 HB2 MET A 420 0.067 -6.883 -5.743 1.00 0.00 H new ATOM 0 HB3 MET A 420 0.239 -5.373 -4.870 1.00 0.00 H new ATOM 0 HG2 MET A 420 -2.002 -5.737 -4.548 1.00 0.00 H new ATOM 0 HG3 MET A 420 -2.078 -4.792 -6.022 1.00 0.00 H new ATOM 0 HE1 MET A 420 -3.354 -9.026 -5.248 1.00 0.00 H new ATOM 0 HE2 MET A 420 -2.650 -7.813 -4.152 1.00 0.00 H new ATOM 0 HE3 MET A 420 -4.286 -7.573 -4.812 1.00 0.00 H new ATOM 630 N PHE A 421 0.431 -2.774 -6.604 1.00 0.00 N ATOM 631 CA PHE A 421 -0.023 -1.389 -6.666 1.00 0.00 C ATOM 632 C PHE A 421 0.670 -0.640 -7.800 1.00 0.00 C ATOM 633 O PHE A 421 0.141 0.338 -8.327 1.00 0.00 O ATOM 634 CB PHE A 421 0.243 -0.683 -5.336 1.00 0.00 C ATOM 635 CG PHE A 421 -0.783 -0.985 -4.280 1.00 0.00 C ATOM 636 CD1 PHE A 421 -1.140 -2.295 -3.998 1.00 0.00 C ATOM 637 CD2 PHE A 421 -1.388 0.038 -3.569 1.00 0.00 C ATOM 638 CE1 PHE A 421 -2.082 -2.577 -3.028 1.00 0.00 C ATOM 639 CE2 PHE A 421 -2.331 -0.239 -2.598 1.00 0.00 C ATOM 640 CZ PHE A 421 -2.678 -1.548 -2.327 1.00 0.00 C ATOM 0 H PHE A 421 1.318 -2.906 -6.118 1.00 0.00 H new ATOM 0 HA PHE A 421 -1.096 -1.393 -6.859 1.00 0.00 H new ATOM 0 HB2 PHE A 421 1.227 -0.975 -4.969 1.00 0.00 H new ATOM 0 HB3 PHE A 421 0.273 0.393 -5.505 1.00 0.00 H new ATOM 0 HD1 PHE A 421 -0.676 -3.104 -4.543 1.00 0.00 H new ATOM 0 HD2 PHE A 421 -1.120 1.063 -3.776 1.00 0.00 H new ATOM 0 HE1 PHE A 421 -2.352 -3.601 -2.818 1.00 0.00 H new ATOM 0 HE2 PHE A 421 -2.797 0.568 -2.051 1.00 0.00 H new ATOM 0 HZ PHE A 421 -3.414 -1.766 -1.568 1.00 0.00 H new ATOM 650 N MET A 422 1.859 -1.107 -8.170 1.00 0.00 N ATOM 651 CA MET A 422 2.624 -0.482 -9.242 1.00 0.00 C ATOM 652 C MET A 422 1.733 -0.178 -10.441 1.00 0.00 C ATOM 653 O MET A 422 1.750 0.923 -10.994 1.00 0.00 O ATOM 654 CB MET A 422 3.780 -1.390 -9.668 1.00 0.00 C ATOM 655 CG MET A 422 5.097 -1.061 -8.983 1.00 0.00 C ATOM 656 SD MET A 422 6.072 0.148 -9.899 1.00 0.00 S ATOM 657 CE MET A 422 7.731 -0.449 -9.583 1.00 0.00 C ATOM 0 H MET A 422 2.312 -1.915 -7.743 1.00 0.00 H new ATOM 0 HA MET A 422 3.028 0.458 -8.866 1.00 0.00 H new ATOM 0 HB2 MET A 422 3.516 -2.425 -9.452 1.00 0.00 H new ATOM 0 HB3 MET A 422 3.912 -1.313 -10.747 1.00 0.00 H new ATOM 0 HG2 MET A 422 4.896 -0.677 -7.983 1.00 0.00 H new ATOM 0 HG3 MET A 422 5.678 -1.975 -8.863 1.00 0.00 H new ATOM 0 HE1 MET A 422 8.452 0.197 -10.085 1.00 0.00 H new ATOM 0 HE2 MET A 422 7.922 -0.441 -8.510 1.00 0.00 H new ATOM 0 HE3 MET A 422 7.830 -1.466 -9.962 1.00 0.00 H new ATOM 667 N PRO A 423 0.936 -1.173 -10.855 1.00 0.00 N ATOM 668 CA PRO A 423 0.022 -1.035 -11.993 1.00 0.00 C ATOM 669 C PRO A 423 -0.804 0.244 -11.923 1.00 0.00 C ATOM 670 O PRO A 423 -0.934 0.967 -12.911 1.00 0.00 O ATOM 671 CB PRO A 423 -0.883 -2.264 -11.874 1.00 0.00 C ATOM 672 CG PRO A 423 -0.061 -3.270 -11.146 1.00 0.00 C ATOM 673 CD PRO A 423 0.864 -2.511 -10.244 1.00 0.00 C ATOM 0 HA PRO A 423 0.558 -0.974 -12.940 1.00 0.00 H new ATOM 0 HB2 PRO A 423 -1.798 -2.031 -11.329 1.00 0.00 H new ATOM 0 HB3 PRO A 423 -1.182 -2.632 -12.855 1.00 0.00 H new ATOM 0 HG2 PRO A 423 -0.696 -3.942 -10.569 1.00 0.00 H new ATOM 0 HG3 PRO A 423 0.503 -3.886 -11.846 1.00 0.00 H new ATOM 0 HD2 PRO A 423 0.480 -2.465 -9.225 1.00 0.00 H new ATOM 0 HD3 PRO A 423 1.846 -2.980 -10.193 1.00 0.00 H new ATOM 681 N PHE A 424 -1.359 0.520 -10.746 1.00 0.00 N ATOM 682 CA PHE A 424 -2.173 1.713 -10.546 1.00 0.00 C ATOM 683 C PHE A 424 -1.335 2.977 -10.715 1.00 0.00 C ATOM 684 O PHE A 424 -1.825 4.000 -11.192 1.00 0.00 O ATOM 685 CB PHE A 424 -2.812 1.692 -9.156 1.00 0.00 C ATOM 686 CG PHE A 424 -3.818 0.591 -8.976 1.00 0.00 C ATOM 687 CD1 PHE A 424 -3.412 -0.683 -8.615 1.00 0.00 C ATOM 688 CD2 PHE A 424 -5.170 0.831 -9.165 1.00 0.00 C ATOM 689 CE1 PHE A 424 -4.335 -1.699 -8.449 1.00 0.00 C ATOM 690 CE2 PHE A 424 -6.097 -0.179 -9.000 1.00 0.00 C ATOM 691 CZ PHE A 424 -5.679 -1.446 -8.640 1.00 0.00 C ATOM 0 H PHE A 424 -1.259 -0.066 -9.917 1.00 0.00 H new ATOM 0 HA PHE A 424 -2.960 1.717 -11.300 1.00 0.00 H new ATOM 0 HB2 PHE A 424 -2.028 1.584 -8.406 1.00 0.00 H new ATOM 0 HB3 PHE A 424 -3.298 2.651 -8.973 1.00 0.00 H new ATOM 0 HD1 PHE A 424 -2.362 -0.885 -8.461 1.00 0.00 H new ATOM 0 HD2 PHE A 424 -5.502 1.820 -9.445 1.00 0.00 H new ATOM 0 HE1 PHE A 424 -4.005 -2.689 -8.170 1.00 0.00 H new ATOM 0 HE2 PHE A 424 -7.147 0.021 -9.152 1.00 0.00 H new ATOM 0 HZ PHE A 424 -6.402 -2.237 -8.508 1.00 0.00 H new ATOM 701 N GLY A 425 -0.070 2.899 -10.317 1.00 0.00 N ATOM 702 CA GLY A 425 0.816 4.042 -10.430 1.00 0.00 C ATOM 703 C GLY A 425 2.123 3.840 -9.688 1.00 0.00 C ATOM 704 O GLY A 425 2.234 2.952 -8.844 1.00 0.00 O ATOM 0 H GLY A 425 0.358 2.064 -9.918 1.00 0.00 H new ATOM 0 HA2 GLY A 425 1.025 4.233 -11.483 1.00 0.00 H new ATOM 0 HA3 GLY A 425 0.313 4.927 -10.040 1.00 0.00 H new ATOM 708 N ASN A 426 3.115 4.666 -10.005 1.00 0.00 N ATOM 709 CA ASN A 426 4.421 4.573 -9.363 1.00 0.00 C ATOM 710 C ASN A 426 4.292 4.689 -7.847 1.00 0.00 C ATOM 711 O ASN A 426 3.835 5.708 -7.328 1.00 0.00 O ATOM 712 CB ASN A 426 5.351 5.666 -9.891 1.00 0.00 C ATOM 713 CG ASN A 426 6.811 5.258 -9.840 1.00 0.00 C ATOM 714 OD1 ASN A 426 7.634 5.931 -9.220 1.00 0.00 O ATOM 715 ND2 ASN A 426 7.139 4.149 -10.493 1.00 0.00 N ATOM 0 H ASN A 426 3.039 5.407 -10.702 1.00 0.00 H new ATOM 0 HA ASN A 426 4.846 3.598 -9.600 1.00 0.00 H new ATOM 0 HB2 ASN A 426 5.079 5.905 -10.919 1.00 0.00 H new ATOM 0 HB3 ASN A 426 5.210 6.574 -9.305 1.00 0.00 H new ATOM 0 HD21 ASN A 426 8.106 3.824 -10.493 1.00 0.00 H new ATOM 0 HD22 ASN A 426 6.424 3.622 -10.994 1.00 0.00 H new ATOM 722 N VAL A 427 4.697 3.638 -7.141 1.00 0.00 N ATOM 723 CA VAL A 427 4.629 3.622 -5.686 1.00 0.00 C ATOM 724 C VAL A 427 5.895 4.207 -5.069 1.00 0.00 C ATOM 725 O VAL A 427 7.003 3.747 -5.346 1.00 0.00 O ATOM 726 CB VAL A 427 4.423 2.193 -5.148 1.00 0.00 C ATOM 727 CG1 VAL A 427 4.672 2.144 -3.649 1.00 0.00 C ATOM 728 CG2 VAL A 427 3.024 1.696 -5.481 1.00 0.00 C ATOM 0 H VAL A 427 5.076 2.786 -7.554 1.00 0.00 H new ATOM 0 HA VAL A 427 3.773 4.236 -5.404 1.00 0.00 H new ATOM 0 HB VAL A 427 5.144 1.534 -5.632 1.00 0.00 H new ATOM 0 HG11 VAL A 427 4.521 1.127 -3.288 1.00 0.00 H new ATOM 0 HG12 VAL A 427 5.695 2.455 -3.440 1.00 0.00 H new ATOM 0 HG13 VAL A 427 3.978 2.815 -3.143 1.00 0.00 H new ATOM 0 HG21 VAL A 427 2.895 0.685 -5.094 1.00 0.00 H new ATOM 0 HG22 VAL A 427 2.285 2.356 -5.026 1.00 0.00 H new ATOM 0 HG23 VAL A 427 2.888 1.690 -6.562 1.00 0.00 H new ATOM 738 N VAL A 428 5.723 5.225 -4.231 1.00 0.00 N ATOM 739 CA VAL A 428 6.851 5.873 -3.575 1.00 0.00 C ATOM 740 C VAL A 428 7.391 5.014 -2.436 1.00 0.00 C ATOM 741 O VAL A 428 8.597 4.971 -2.194 1.00 0.00 O ATOM 742 CB VAL A 428 6.460 7.255 -3.019 1.00 0.00 C ATOM 743 CG1 VAL A 428 7.580 7.822 -2.159 1.00 0.00 C ATOM 744 CG2 VAL A 428 6.115 8.206 -4.155 1.00 0.00 C ATOM 0 H VAL A 428 4.813 5.618 -3.991 1.00 0.00 H new ATOM 0 HA VAL A 428 7.626 6.000 -4.331 1.00 0.00 H new ATOM 0 HB VAL A 428 5.577 7.139 -2.391 1.00 0.00 H new ATOM 0 HG11 VAL A 428 7.285 8.799 -1.775 1.00 0.00 H new ATOM 0 HG12 VAL A 428 7.775 7.148 -1.325 1.00 0.00 H new ATOM 0 HG13 VAL A 428 8.483 7.926 -2.760 1.00 0.00 H new ATOM 0 HG21 VAL A 428 5.841 9.178 -3.745 1.00 0.00 H new ATOM 0 HG22 VAL A 428 6.979 8.319 -4.810 1.00 0.00 H new ATOM 0 HG23 VAL A 428 5.278 7.803 -4.725 1.00 0.00 H new ATOM 754 N SER A 429 6.489 4.331 -1.739 1.00 0.00 N ATOM 755 CA SER A 429 6.874 3.475 -0.623 1.00 0.00 C ATOM 756 C SER A 429 6.021 2.210 -0.589 1.00 0.00 C ATOM 757 O SER A 429 4.829 2.244 -0.890 1.00 0.00 O ATOM 758 CB SER A 429 6.736 4.231 0.699 1.00 0.00 C ATOM 759 OG SER A 429 6.953 5.620 0.517 1.00 0.00 O ATOM 0 H SER A 429 5.487 4.354 -1.927 1.00 0.00 H new ATOM 0 HA SER A 429 7.916 3.187 -0.762 1.00 0.00 H new ATOM 0 HB2 SER A 429 5.742 4.066 1.114 1.00 0.00 H new ATOM 0 HB3 SER A 429 7.452 3.840 1.422 1.00 0.00 H new ATOM 0 HG SER A 429 6.230 5.995 -0.028 1.00 0.00 H new ATOM 765 N ALA A 430 6.643 1.094 -0.221 1.00 0.00 N ATOM 766 CA ALA A 430 5.943 -0.181 -0.145 1.00 0.00 C ATOM 767 C ALA A 430 6.705 -1.176 0.723 1.00 0.00 C ATOM 768 O ALA A 430 7.787 -1.635 0.355 1.00 0.00 O ATOM 769 CB ALA A 430 5.729 -0.749 -1.540 1.00 0.00 C ATOM 0 H ALA A 430 7.631 1.048 0.029 1.00 0.00 H new ATOM 0 HA ALA A 430 4.971 -0.007 0.317 1.00 0.00 H new ATOM 0 HB1 ALA A 430 5.205 -1.702 -1.468 1.00 0.00 H new ATOM 0 HB2 ALA A 430 5.134 -0.051 -2.130 1.00 0.00 H new ATOM 0 HB3 ALA A 430 6.694 -0.901 -2.023 1.00 0.00 H new ATOM 775 N LYS A 431 6.137 -1.506 1.876 1.00 0.00 N ATOM 776 CA LYS A 431 6.762 -2.448 2.798 1.00 0.00 C ATOM 777 C LYS A 431 5.726 -3.071 3.726 1.00 0.00 C ATOM 778 O LYS A 431 4.777 -2.409 4.148 1.00 0.00 O ATOM 779 CB LYS A 431 7.843 -1.745 3.622 1.00 0.00 C ATOM 780 CG LYS A 431 8.312 -2.549 4.822 1.00 0.00 C ATOM 781 CD LYS A 431 7.489 -2.233 6.060 1.00 0.00 C ATOM 782 CE LYS A 431 8.308 -2.402 7.331 1.00 0.00 C ATOM 783 NZ LYS A 431 7.496 -2.147 8.553 1.00 0.00 N ATOM 0 H LYS A 431 5.243 -1.135 2.196 1.00 0.00 H new ATOM 0 HA LYS A 431 7.221 -3.243 2.210 1.00 0.00 H new ATOM 0 HB2 LYS A 431 8.698 -1.534 2.980 1.00 0.00 H new ATOM 0 HB3 LYS A 431 7.459 -0.785 3.966 1.00 0.00 H new ATOM 0 HG2 LYS A 431 8.241 -3.613 4.598 1.00 0.00 H new ATOM 0 HG3 LYS A 431 9.363 -2.334 5.017 1.00 0.00 H new ATOM 0 HD2 LYS A 431 7.116 -1.211 5.999 1.00 0.00 H new ATOM 0 HD3 LYS A 431 6.619 -2.888 6.097 1.00 0.00 H new ATOM 0 HE2 LYS A 431 8.714 -3.413 7.369 1.00 0.00 H new ATOM 0 HE3 LYS A 431 9.157 -1.718 7.310 1.00 0.00 H new ATOM 0 HZ1 LYS A 431 7.807 -1.260 8.998 1.00 0.00 H new ATOM 0 HZ2 LYS A 431 6.492 -2.070 8.293 1.00 0.00 H new ATOM 0 HZ3 LYS A 431 7.621 -2.933 9.223 1.00 0.00 H new ATOM 797 N VAL A 432 5.913 -4.349 4.043 1.00 0.00 N ATOM 798 CA VAL A 432 4.996 -5.061 4.924 1.00 0.00 C ATOM 799 C VAL A 432 5.480 -5.023 6.369 1.00 0.00 C ATOM 800 O VAL A 432 6.683 -5.032 6.632 1.00 0.00 O ATOM 801 CB VAL A 432 4.825 -6.529 4.490 1.00 0.00 C ATOM 802 CG1 VAL A 432 3.882 -7.259 5.432 1.00 0.00 C ATOM 803 CG2 VAL A 432 4.323 -6.604 3.055 1.00 0.00 C ATOM 0 H VAL A 432 6.692 -4.912 3.702 1.00 0.00 H new ATOM 0 HA VAL A 432 4.033 -4.555 4.853 1.00 0.00 H new ATOM 0 HB VAL A 432 5.797 -7.019 4.538 1.00 0.00 H new ATOM 0 HG11 VAL A 432 3.774 -8.294 5.109 1.00 0.00 H new ATOM 0 HG12 VAL A 432 4.288 -7.235 6.443 1.00 0.00 H new ATOM 0 HG13 VAL A 432 2.907 -6.772 5.420 1.00 0.00 H new ATOM 0 HG21 VAL A 432 4.208 -7.648 2.764 1.00 0.00 H new ATOM 0 HG22 VAL A 432 3.361 -6.098 2.979 1.00 0.00 H new ATOM 0 HG23 VAL A 432 5.041 -6.120 2.393 1.00 0.00 H new ATOM 813 N PHE A 433 4.536 -4.982 7.303 1.00 0.00 N ATOM 814 CA PHE A 433 4.867 -4.941 8.723 1.00 0.00 C ATOM 815 C PHE A 433 5.028 -6.352 9.283 1.00 0.00 C ATOM 816 O PHE A 433 4.453 -7.307 8.763 1.00 0.00 O ATOM 817 CB PHE A 433 3.782 -4.193 9.501 1.00 0.00 C ATOM 818 CG PHE A 433 3.888 -2.699 9.391 1.00 0.00 C ATOM 819 CD1 PHE A 433 4.351 -2.108 8.227 1.00 0.00 C ATOM 820 CD2 PHE A 433 3.528 -1.886 10.453 1.00 0.00 C ATOM 821 CE1 PHE A 433 4.451 -0.732 8.123 1.00 0.00 C ATOM 822 CE2 PHE A 433 3.625 -0.511 10.355 1.00 0.00 C ATOM 823 CZ PHE A 433 4.088 0.067 9.190 1.00 0.00 C ATOM 0 H PHE A 433 3.536 -4.976 7.103 1.00 0.00 H new ATOM 0 HA PHE A 433 5.814 -4.412 8.835 1.00 0.00 H new ATOM 0 HB2 PHE A 433 2.804 -4.508 9.138 1.00 0.00 H new ATOM 0 HB3 PHE A 433 3.838 -4.477 10.552 1.00 0.00 H new ATOM 0 HD1 PHE A 433 4.637 -2.729 7.391 1.00 0.00 H new ATOM 0 HD2 PHE A 433 3.167 -2.332 11.368 1.00 0.00 H new ATOM 0 HE1 PHE A 433 4.812 -0.283 7.209 1.00 0.00 H new ATOM 0 HE2 PHE A 433 3.339 0.111 11.190 1.00 0.00 H new ATOM 0 HZ PHE A 433 4.166 1.141 9.113 1.00 0.00 H new ATOM 983 N CYS A 443 -0.235 -9.470 8.252 1.00 0.00 N ATOM 984 CA CYS A 443 -1.186 -9.513 7.146 1.00 0.00 C ATOM 985 C CYS A 443 -1.591 -8.106 6.721 1.00 0.00 C ATOM 986 O CYS A 443 -2.749 -7.856 6.387 1.00 0.00 O ATOM 987 CB CYS A 443 -2.426 -10.315 7.545 1.00 0.00 C ATOM 988 SG CYS A 443 -3.308 -9.649 8.975 1.00 0.00 S ATOM 0 HA CYS A 443 -0.701 -10.002 6.301 1.00 0.00 H new ATOM 0 HB2 CYS A 443 -3.109 -10.354 6.696 1.00 0.00 H new ATOM 0 HB3 CYS A 443 -2.128 -11.341 7.761 1.00 0.00 H new ATOM 0 HG CYS A 443 -4.342 -10.394 9.233 1.00 0.00 H new ATOM 994 N PHE A 444 -0.629 -7.189 6.737 1.00 0.00 N ATOM 995 CA PHE A 444 -0.885 -5.805 6.355 1.00 0.00 C ATOM 996 C PHE A 444 0.417 -5.079 6.034 1.00 0.00 C ATOM 997 O PHE A 444 1.447 -5.321 6.664 1.00 0.00 O ATOM 998 CB PHE A 444 -1.628 -5.074 7.476 1.00 0.00 C ATOM 999 CG PHE A 444 -0.734 -4.640 8.603 1.00 0.00 C ATOM 1000 CD1 PHE A 444 0.022 -3.485 8.499 1.00 0.00 C ATOM 1001 CD2 PHE A 444 -0.654 -5.388 9.767 1.00 0.00 C ATOM 1002 CE1 PHE A 444 0.845 -3.084 9.534 1.00 0.00 C ATOM 1003 CE2 PHE A 444 0.168 -4.992 10.806 1.00 0.00 C ATOM 1004 CZ PHE A 444 0.917 -3.838 10.690 1.00 0.00 C ATOM 0 H PHE A 444 0.335 -7.379 7.010 1.00 0.00 H new ATOM 0 HA PHE A 444 -1.506 -5.810 5.460 1.00 0.00 H new ATOM 0 HB2 PHE A 444 -2.126 -4.198 7.060 1.00 0.00 H new ATOM 0 HB3 PHE A 444 -2.407 -5.727 7.871 1.00 0.00 H new ATOM 0 HD1 PHE A 444 -0.032 -2.891 7.599 1.00 0.00 H new ATOM 0 HD2 PHE A 444 -1.240 -6.290 9.864 1.00 0.00 H new ATOM 0 HE1 PHE A 444 1.432 -2.182 9.440 1.00 0.00 H new ATOM 0 HE2 PHE A 444 0.224 -5.585 11.707 1.00 0.00 H new ATOM 0 HZ PHE A 444 1.558 -3.525 11.501 1.00 0.00 H new ATOM 1014 N GLY A 445 0.364 -4.187 5.050 1.00 0.00 N ATOM 1015 CA GLY A 445 1.546 -3.439 4.662 1.00 0.00 C ATOM 1016 C GLY A 445 1.259 -1.965 4.461 1.00 0.00 C ATOM 1017 O GLY A 445 0.101 -1.551 4.415 1.00 0.00 O ATOM 0 H GLY A 445 -0.476 -3.969 4.514 1.00 0.00 H new ATOM 0 HA2 GLY A 445 2.313 -3.555 5.427 1.00 0.00 H new ATOM 0 HA3 GLY A 445 1.950 -3.856 3.740 1.00 0.00 H new ATOM 1021 N PHE A 446 2.316 -1.168 4.342 1.00 0.00 N ATOM 1022 CA PHE A 446 2.173 0.269 4.148 1.00 0.00 C ATOM 1023 C PHE A 446 2.575 0.670 2.732 1.00 0.00 C ATOM 1024 O PHE A 446 3.406 0.016 2.101 1.00 0.00 O ATOM 1025 CB PHE A 446 3.023 1.031 5.167 1.00 0.00 C ATOM 1026 CG PHE A 446 2.994 2.520 4.978 1.00 0.00 C ATOM 1027 CD1 PHE A 446 1.789 3.196 4.879 1.00 0.00 C ATOM 1028 CD2 PHE A 446 4.172 3.246 4.901 1.00 0.00 C ATOM 1029 CE1 PHE A 446 1.759 4.567 4.704 1.00 0.00 C ATOM 1030 CE2 PHE A 446 4.149 4.617 4.727 1.00 0.00 C ATOM 1031 CZ PHE A 446 2.942 5.278 4.630 1.00 0.00 C ATOM 0 H PHE A 446 3.282 -1.494 4.377 1.00 0.00 H new ATOM 0 HA PHE A 446 1.124 0.527 4.296 1.00 0.00 H new ATOM 0 HB2 PHE A 446 2.672 0.793 6.171 1.00 0.00 H new ATOM 0 HB3 PHE A 446 4.054 0.684 5.100 1.00 0.00 H new ATOM 0 HD1 PHE A 446 0.862 2.645 4.939 1.00 0.00 H new ATOM 0 HD2 PHE A 446 5.120 2.734 4.978 1.00 0.00 H new ATOM 0 HE1 PHE A 446 0.813 5.082 4.625 1.00 0.00 H new ATOM 0 HE2 PHE A 446 5.075 5.170 4.667 1.00 0.00 H new ATOM 0 HZ PHE A 446 2.921 6.350 4.496 1.00 0.00 H new ATOM 1041 N VAL A 447 1.979 1.751 2.237 1.00 0.00 N ATOM 1042 CA VAL A 447 2.275 2.240 0.896 1.00 0.00 C ATOM 1043 C VAL A 447 1.977 3.730 0.777 1.00 0.00 C ATOM 1044 O VAL A 447 1.029 4.234 1.379 1.00 0.00 O ATOM 1045 CB VAL A 447 1.466 1.479 -0.171 1.00 0.00 C ATOM 1046 CG1 VAL A 447 1.917 1.876 -1.568 1.00 0.00 C ATOM 1047 CG2 VAL A 447 1.597 -0.024 0.034 1.00 0.00 C ATOM 0 H VAL A 447 1.289 2.304 2.745 1.00 0.00 H new ATOM 0 HA VAL A 447 3.338 2.070 0.725 1.00 0.00 H new ATOM 0 HB VAL A 447 0.415 1.748 -0.065 1.00 0.00 H new ATOM 0 HG11 VAL A 447 1.334 1.328 -2.308 1.00 0.00 H new ATOM 0 HG12 VAL A 447 1.767 2.946 -1.708 1.00 0.00 H new ATOM 0 HG13 VAL A 447 2.974 1.639 -1.690 1.00 0.00 H new ATOM 0 HG21 VAL A 447 1.019 -0.547 -0.728 1.00 0.00 H new ATOM 0 HG22 VAL A 447 2.645 -0.312 -0.044 1.00 0.00 H new ATOM 0 HG23 VAL A 447 1.220 -0.291 1.021 1.00 0.00 H new ATOM 1057 N SER A 448 2.791 4.431 -0.006 1.00 0.00 N ATOM 1058 CA SER A 448 2.617 5.865 -0.203 1.00 0.00 C ATOM 1059 C SER A 448 2.948 6.261 -1.638 1.00 0.00 C ATOM 1060 O SER A 448 3.891 5.741 -2.236 1.00 0.00 O ATOM 1061 CB SER A 448 3.501 6.646 0.770 1.00 0.00 C ATOM 1062 OG SER A 448 2.818 6.908 1.983 1.00 0.00 O ATOM 0 H SER A 448 3.578 4.028 -0.515 1.00 0.00 H new ATOM 0 HA SER A 448 1.572 6.109 -0.009 1.00 0.00 H new ATOM 0 HB2 SER A 448 4.409 6.079 0.976 1.00 0.00 H new ATOM 0 HB3 SER A 448 3.809 7.586 0.312 1.00 0.00 H new ATOM 0 HG SER A 448 3.051 6.223 2.644 1.00 0.00 H new ATOM 1068 N TYR A 449 2.166 7.184 -2.187 1.00 0.00 N ATOM 1069 CA TYR A 449 2.373 7.649 -3.553 1.00 0.00 C ATOM 1070 C TYR A 449 2.947 9.062 -3.566 1.00 0.00 C ATOM 1071 O TYR A 449 3.118 9.686 -2.517 1.00 0.00 O ATOM 1072 CB TYR A 449 1.058 7.614 -4.331 1.00 0.00 C ATOM 1073 CG TYR A 449 0.691 6.237 -4.839 1.00 0.00 C ATOM 1074 CD1 TYR A 449 0.621 5.152 -3.974 1.00 0.00 C ATOM 1075 CD2 TYR A 449 0.416 6.021 -6.184 1.00 0.00 C ATOM 1076 CE1 TYR A 449 0.288 3.892 -4.433 1.00 0.00 C ATOM 1077 CE2 TYR A 449 0.081 4.764 -6.651 1.00 0.00 C ATOM 1078 CZ TYR A 449 0.019 3.704 -5.772 1.00 0.00 C ATOM 1079 OH TYR A 449 -0.314 2.451 -6.235 1.00 0.00 O ATOM 0 H TYR A 449 1.382 7.625 -1.706 1.00 0.00 H new ATOM 0 HA TYR A 449 3.089 6.981 -4.032 1.00 0.00 H new ATOM 0 HB2 TYR A 449 0.256 7.981 -3.690 1.00 0.00 H new ATOM 0 HB3 TYR A 449 1.128 8.298 -5.177 1.00 0.00 H new ATOM 0 HD1 TYR A 449 0.831 5.296 -2.924 1.00 0.00 H new ATOM 0 HD2 TYR A 449 0.465 6.849 -6.876 1.00 0.00 H new ATOM 0 HE1 TYR A 449 0.239 3.059 -3.747 1.00 0.00 H new ATOM 0 HE2 TYR A 449 -0.131 4.613 -7.699 1.00 0.00 H new ATOM 0 HH TYR A 449 0.226 2.240 -7.025 1.00 0.00 H new ATOM 1089 N ASP A 450 3.242 9.562 -4.761 1.00 0.00 N ATOM 1090 CA ASP A 450 3.795 10.904 -4.913 1.00 0.00 C ATOM 1091 C ASP A 450 2.735 11.964 -4.631 1.00 0.00 C ATOM 1092 O ASP A 450 3.048 13.063 -4.178 1.00 0.00 O ATOM 1093 CB ASP A 450 4.357 11.089 -6.323 1.00 0.00 C ATOM 1094 CG ASP A 450 3.267 11.245 -7.365 1.00 0.00 C ATOM 1095 OD1 ASP A 450 2.812 10.215 -7.905 1.00 0.00 O ATOM 1096 OD2 ASP A 450 2.870 12.396 -7.641 1.00 0.00 O ATOM 0 H ASP A 450 3.108 9.059 -5.638 1.00 0.00 H new ATOM 0 HA ASP A 450 4.602 11.022 -4.190 1.00 0.00 H new ATOM 0 HB2 ASP A 450 5.002 11.968 -6.342 1.00 0.00 H new ATOM 0 HB3 ASP A 450 4.980 10.231 -6.578 1.00 0.00 H new ATOM 1101 N ASN A 451 1.479 11.624 -4.904 1.00 0.00 N ATOM 1102 CA ASN A 451 0.372 12.548 -4.680 1.00 0.00 C ATOM 1103 C ASN A 451 -0.847 11.813 -4.134 1.00 0.00 C ATOM 1104 O ASN A 451 -1.040 10.619 -4.365 1.00 0.00 O ATOM 1105 CB ASN A 451 0.009 13.265 -5.983 1.00 0.00 C ATOM 1106 CG ASN A 451 -0.535 12.316 -7.033 1.00 0.00 C ATOM 1107 OD1 ASN A 451 -0.622 11.108 -6.809 1.00 0.00 O ATOM 1108 ND2 ASN A 451 -0.907 12.860 -8.186 1.00 0.00 N ATOM 0 H ASN A 451 1.203 10.717 -5.280 1.00 0.00 H new ATOM 0 HA ASN A 451 0.689 13.286 -3.943 1.00 0.00 H new ATOM 0 HB2 ASN A 451 -0.732 14.037 -5.776 1.00 0.00 H new ATOM 0 HB3 ASN A 451 0.892 13.769 -6.375 1.00 0.00 H new ATOM 0 HD21 ASN A 451 -1.283 12.272 -8.930 1.00 0.00 H new ATOM 0 HD22 ASN A 451 -0.817 13.866 -8.328 1.00 0.00 H new ATOM 1115 N PRO A 452 -1.694 12.542 -3.391 1.00 0.00 N ATOM 1116 CA PRO A 452 -2.911 11.981 -2.797 1.00 0.00 C ATOM 1117 C PRO A 452 -3.999 11.727 -3.834 1.00 0.00 C ATOM 1118 O PRO A 452 -5.089 11.260 -3.504 1.00 0.00 O ATOM 1119 CB PRO A 452 -3.356 13.063 -1.809 1.00 0.00 C ATOM 1120 CG PRO A 452 -2.817 14.333 -2.371 1.00 0.00 C ATOM 1121 CD PRO A 452 -1.528 13.970 -3.075 1.00 0.00 C ATOM 0 HA PRO A 452 -2.728 11.011 -2.334 1.00 0.00 H new ATOM 0 HB2 PRO A 452 -4.442 13.098 -1.722 1.00 0.00 H new ATOM 0 HB3 PRO A 452 -2.963 12.873 -0.810 1.00 0.00 H new ATOM 0 HG2 PRO A 452 -3.526 14.783 -3.065 1.00 0.00 H new ATOM 0 HG3 PRO A 452 -2.637 15.063 -1.581 1.00 0.00 H new ATOM 0 HD2 PRO A 452 -1.382 14.565 -3.976 1.00 0.00 H new ATOM 0 HD3 PRO A 452 -0.661 14.141 -2.437 1.00 0.00 H new ATOM 1129 N VAL A 453 -3.696 12.039 -5.091 1.00 0.00 N ATOM 1130 CA VAL A 453 -4.649 11.843 -6.178 1.00 0.00 C ATOM 1131 C VAL A 453 -4.525 10.445 -6.772 1.00 0.00 C ATOM 1132 O VAL A 453 -5.523 9.824 -7.138 1.00 0.00 O ATOM 1133 CB VAL A 453 -4.446 12.884 -7.295 1.00 0.00 C ATOM 1134 CG1 VAL A 453 -5.411 12.629 -8.443 1.00 0.00 C ATOM 1135 CG2 VAL A 453 -4.616 14.293 -6.748 1.00 0.00 C ATOM 0 H VAL A 453 -2.799 12.428 -5.381 1.00 0.00 H new ATOM 0 HA VAL A 453 -5.645 11.966 -5.753 1.00 0.00 H new ATOM 0 HB VAL A 453 -3.430 12.788 -7.677 1.00 0.00 H new ATOM 0 HG11 VAL A 453 -5.253 13.374 -9.223 1.00 0.00 H new ATOM 0 HG12 VAL A 453 -5.236 11.634 -8.851 1.00 0.00 H new ATOM 0 HG13 VAL A 453 -6.436 12.697 -8.079 1.00 0.00 H new ATOM 0 HG21 VAL A 453 -4.469 15.015 -7.551 1.00 0.00 H new ATOM 0 HG22 VAL A 453 -5.620 14.405 -6.338 1.00 0.00 H new ATOM 0 HG23 VAL A 453 -3.881 14.469 -5.962 1.00 0.00 H new ATOM 1145 N SER A 454 -3.293 9.955 -6.865 1.00 0.00 N ATOM 1146 CA SER A 454 -3.037 8.630 -7.419 1.00 0.00 C ATOM 1147 C SER A 454 -3.337 7.545 -6.390 1.00 0.00 C ATOM 1148 O SER A 454 -3.914 6.508 -6.715 1.00 0.00 O ATOM 1149 CB SER A 454 -1.584 8.520 -7.885 1.00 0.00 C ATOM 1150 OG SER A 454 -1.358 7.299 -8.567 1.00 0.00 O ATOM 0 H SER A 454 -2.457 10.455 -6.564 1.00 0.00 H new ATOM 0 HA SER A 454 -3.696 8.487 -8.275 1.00 0.00 H new ATOM 0 HB2 SER A 454 -1.345 9.357 -8.542 1.00 0.00 H new ATOM 0 HB3 SER A 454 -0.917 8.589 -7.026 1.00 0.00 H new ATOM 0 HG SER A 454 -0.924 6.662 -7.962 1.00 0.00 H new ATOM 1156 N ALA A 455 -2.940 7.792 -5.146 1.00 0.00 N ATOM 1157 CA ALA A 455 -3.168 6.838 -4.068 1.00 0.00 C ATOM 1158 C ALA A 455 -4.617 6.363 -4.050 1.00 0.00 C ATOM 1159 O ALA A 455 -4.895 5.199 -3.766 1.00 0.00 O ATOM 1160 CB ALA A 455 -2.797 7.456 -2.727 1.00 0.00 C ATOM 0 H ALA A 455 -2.459 8.645 -4.860 1.00 0.00 H new ATOM 0 HA ALA A 455 -2.531 5.971 -4.245 1.00 0.00 H new ATOM 0 HB1 ALA A 455 -2.973 6.732 -1.932 1.00 0.00 H new ATOM 0 HB2 ALA A 455 -1.744 7.738 -2.735 1.00 0.00 H new ATOM 0 HB3 ALA A 455 -3.408 8.341 -2.553 1.00 0.00 H new ATOM 1166 N GLN A 456 -5.536 7.274 -4.353 1.00 0.00 N ATOM 1167 CA GLN A 456 -6.957 6.949 -4.372 1.00 0.00 C ATOM 1168 C GLN A 456 -7.260 5.887 -5.424 1.00 0.00 C ATOM 1169 O GLN A 456 -7.882 4.867 -5.130 1.00 0.00 O ATOM 1170 CB GLN A 456 -7.786 8.204 -4.644 1.00 0.00 C ATOM 1171 CG GLN A 456 -8.071 9.027 -3.398 1.00 0.00 C ATOM 1172 CD GLN A 456 -9.111 8.387 -2.499 1.00 0.00 C ATOM 1173 OE1 GLN A 456 -10.037 7.728 -2.973 1.00 0.00 O ATOM 1174 NE2 GLN A 456 -8.962 8.576 -1.194 1.00 0.00 N ATOM 0 H GLN A 456 -5.322 8.243 -4.589 1.00 0.00 H new ATOM 0 HA GLN A 456 -7.225 6.551 -3.393 1.00 0.00 H new ATOM 0 HB2 GLN A 456 -7.260 8.827 -5.368 1.00 0.00 H new ATOM 0 HB3 GLN A 456 -8.732 7.913 -5.101 1.00 0.00 H new ATOM 0 HG2 GLN A 456 -7.146 9.162 -2.838 1.00 0.00 H new ATOM 0 HG3 GLN A 456 -8.413 10.019 -3.693 1.00 0.00 H new ATOM 0 HE21 GLN A 456 -8.180 9.129 -0.845 1.00 0.00 H new ATOM 0 HE22 GLN A 456 -9.630 8.168 -0.540 1.00 0.00 H new ATOM 1183 N ALA A 457 -6.815 6.135 -6.652 1.00 0.00 N ATOM 1184 CA ALA A 457 -7.037 5.200 -7.748 1.00 0.00 C ATOM 1185 C ALA A 457 -6.917 3.756 -7.271 1.00 0.00 C ATOM 1186 O ALA A 457 -7.751 2.913 -7.599 1.00 0.00 O ATOM 1187 CB ALA A 457 -6.052 5.467 -8.877 1.00 0.00 C ATOM 0 H ALA A 457 -6.299 6.975 -6.912 1.00 0.00 H new ATOM 0 HA ALA A 457 -8.050 5.350 -8.120 1.00 0.00 H new ATOM 0 HB1 ALA A 457 -6.229 4.762 -9.689 1.00 0.00 H new ATOM 0 HB2 ALA A 457 -6.187 6.484 -9.244 1.00 0.00 H new ATOM 0 HB3 ALA A 457 -5.034 5.347 -8.507 1.00 0.00 H new ATOM 1193 N ALA A 458 -5.875 3.479 -6.493 1.00 0.00 N ATOM 1194 CA ALA A 458 -5.649 2.137 -5.970 1.00 0.00 C ATOM 1195 C ALA A 458 -6.787 1.707 -5.051 1.00 0.00 C ATOM 1196 O ALA A 458 -7.496 0.742 -5.336 1.00 0.00 O ATOM 1197 CB ALA A 458 -4.320 2.077 -5.232 1.00 0.00 C ATOM 0 H ALA A 458 -5.175 4.165 -6.211 1.00 0.00 H new ATOM 0 HA ALA A 458 -5.617 1.445 -6.812 1.00 0.00 H new ATOM 0 HB1 ALA A 458 -4.163 1.070 -4.846 1.00 0.00 H new ATOM 0 HB2 ALA A 458 -3.512 2.333 -5.917 1.00 0.00 H new ATOM 0 HB3 ALA A 458 -4.332 2.785 -4.403 1.00 0.00 H new ATOM 1203 N ILE A 459 -6.955 2.429 -3.947 1.00 0.00 N ATOM 1204 CA ILE A 459 -8.007 2.121 -2.987 1.00 0.00 C ATOM 1205 C ILE A 459 -9.344 1.901 -3.687 1.00 0.00 C ATOM 1206 O ILE A 459 -10.041 0.923 -3.422 1.00 0.00 O ATOM 1207 CB ILE A 459 -8.165 3.244 -1.946 1.00 0.00 C ATOM 1208 CG1 ILE A 459 -6.858 3.443 -1.176 1.00 0.00 C ATOM 1209 CG2 ILE A 459 -9.304 2.924 -0.990 1.00 0.00 C ATOM 1210 CD1 ILE A 459 -6.800 4.746 -0.409 1.00 0.00 C ATOM 0 H ILE A 459 -6.376 3.230 -3.696 1.00 0.00 H new ATOM 0 HA ILE A 459 -7.711 1.204 -2.478 1.00 0.00 H new ATOM 0 HB ILE A 459 -8.403 4.171 -2.467 1.00 0.00 H new ATOM 0 HG12 ILE A 459 -6.726 2.615 -0.480 1.00 0.00 H new ATOM 0 HG13 ILE A 459 -6.024 3.406 -1.877 1.00 0.00 H new ATOM 0 HG21 ILE A 459 -9.403 3.727 -0.260 1.00 0.00 H new ATOM 0 HG22 ILE A 459 -10.233 2.827 -1.551 1.00 0.00 H new ATOM 0 HG23 ILE A 459 -9.093 1.988 -0.473 1.00 0.00 H new ATOM 0 HD11 ILE A 459 -5.846 4.819 0.112 1.00 0.00 H new ATOM 0 HD12 ILE A 459 -6.900 5.581 -1.102 1.00 0.00 H new ATOM 0 HD13 ILE A 459 -7.613 4.778 0.316 1.00 0.00 H new ATOM 1222 N GLN A 460 -9.694 2.817 -4.585 1.00 0.00 N ATOM 1223 CA GLN A 460 -10.947 2.723 -5.325 1.00 0.00 C ATOM 1224 C GLN A 460 -11.301 1.267 -5.610 1.00 0.00 C ATOM 1225 O GLN A 460 -12.445 0.850 -5.427 1.00 0.00 O ATOM 1226 CB GLN A 460 -10.847 3.502 -6.638 1.00 0.00 C ATOM 1227 CG GLN A 460 -10.823 5.011 -6.449 1.00 0.00 C ATOM 1228 CD GLN A 460 -11.170 5.764 -7.718 1.00 0.00 C ATOM 1229 OE1 GLN A 460 -11.739 5.198 -8.653 1.00 0.00 O ATOM 1230 NE2 GLN A 460 -10.829 7.047 -7.758 1.00 0.00 N ATOM 0 H GLN A 460 -9.127 3.633 -4.817 1.00 0.00 H new ATOM 0 HA GLN A 460 -11.737 3.157 -4.712 1.00 0.00 H new ATOM 0 HB2 GLN A 460 -9.943 3.196 -7.165 1.00 0.00 H new ATOM 0 HB3 GLN A 460 -11.692 3.237 -7.274 1.00 0.00 H new ATOM 0 HG2 GLN A 460 -11.527 5.286 -5.664 1.00 0.00 H new ATOM 0 HG3 GLN A 460 -9.833 5.315 -6.110 1.00 0.00 H new ATOM 0 HE21 GLN A 460 -10.359 7.475 -6.960 1.00 0.00 H new ATOM 0 HE22 GLN A 460 -11.037 7.604 -8.586 1.00 0.00 H new ATOM 1239 N SER A 461 -10.314 0.500 -6.060 1.00 0.00 N ATOM 1240 CA SER A 461 -10.524 -0.909 -6.374 1.00 0.00 C ATOM 1241 C SER A 461 -9.954 -1.801 -5.277 1.00 0.00 C ATOM 1242 O SER A 461 -10.664 -2.624 -4.699 1.00 0.00 O ATOM 1243 CB SER A 461 -9.874 -1.256 -7.716 1.00 0.00 C ATOM 1244 OG SER A 461 -10.781 -1.055 -8.788 1.00 0.00 O ATOM 0 H SER A 461 -9.361 0.830 -6.215 1.00 0.00 H new ATOM 0 HA SER A 461 -11.598 -1.085 -6.440 1.00 0.00 H new ATOM 0 HB2 SER A 461 -8.987 -0.640 -7.865 1.00 0.00 H new ATOM 0 HB3 SER A 461 -9.542 -2.294 -7.706 1.00 0.00 H new ATOM 0 HG SER A 461 -10.342 -1.282 -9.635 1.00 0.00 H new ATOM 1250 N MET A 462 -8.666 -1.632 -4.993 1.00 0.00 N ATOM 1251 CA MET A 462 -8.000 -2.421 -3.963 1.00 0.00 C ATOM 1252 C MET A 462 -8.917 -2.633 -2.763 1.00 0.00 C ATOM 1253 O MET A 462 -9.032 -3.744 -2.247 1.00 0.00 O ATOM 1254 CB MET A 462 -6.709 -1.732 -3.517 1.00 0.00 C ATOM 1255 CG MET A 462 -5.636 -1.697 -4.594 1.00 0.00 C ATOM 1256 SD MET A 462 -4.553 -3.138 -4.542 1.00 0.00 S ATOM 1257 CE MET A 462 -5.576 -4.359 -5.358 1.00 0.00 C ATOM 0 H MET A 462 -8.063 -0.956 -5.462 1.00 0.00 H new ATOM 0 HA MET A 462 -7.756 -3.394 -4.388 1.00 0.00 H new ATOM 0 HB2 MET A 462 -6.938 -0.711 -3.211 1.00 0.00 H new ATOM 0 HB3 MET A 462 -6.316 -2.247 -2.640 1.00 0.00 H new ATOM 0 HG2 MET A 462 -6.111 -1.640 -5.573 1.00 0.00 H new ATOM 0 HG3 MET A 462 -5.038 -0.793 -4.476 1.00 0.00 H new ATOM 0 HE1 MET A 462 -4.950 -5.005 -5.973 1.00 0.00 H new ATOM 0 HE2 MET A 462 -6.092 -4.960 -4.609 1.00 0.00 H new ATOM 0 HE3 MET A 462 -6.309 -3.856 -5.989 1.00 0.00 H new ATOM 1267 N ASN A 463 -9.569 -1.561 -2.324 1.00 0.00 N ATOM 1268 CA ASN A 463 -10.476 -1.631 -1.184 1.00 0.00 C ATOM 1269 C ASN A 463 -11.611 -2.615 -1.451 1.00 0.00 C ATOM 1270 O ASN A 463 -12.660 -2.242 -1.971 1.00 0.00 O ATOM 1271 CB ASN A 463 -11.049 -0.246 -0.877 1.00 0.00 C ATOM 1272 CG ASN A 463 -11.967 -0.255 0.330 1.00 0.00 C ATOM 1273 OD1 ASN A 463 -13.185 -0.373 0.197 1.00 0.00 O ATOM 1274 ND2 ASN A 463 -11.385 -0.130 1.517 1.00 0.00 N ATOM 0 H ASN A 463 -9.486 -0.634 -2.740 1.00 0.00 H new ATOM 0 HA ASN A 463 -9.910 -1.983 -0.322 1.00 0.00 H new ATOM 0 HB2 ASN A 463 -10.230 0.452 -0.702 1.00 0.00 H new ATOM 0 HB3 ASN A 463 -11.598 0.118 -1.745 1.00 0.00 H new ATOM 0 HD21 ASN A 463 -11.952 -0.129 2.365 1.00 0.00 H new ATOM 0 HD22 ASN A 463 -10.371 -0.035 1.581 1.00 0.00 H new ATOM 1281 N GLY A 464 -11.390 -3.875 -1.089 1.00 0.00 N ATOM 1282 CA GLY A 464 -12.402 -4.895 -1.296 1.00 0.00 C ATOM 1283 C GLY A 464 -11.973 -5.942 -2.304 1.00 0.00 C ATOM 1284 O GLY A 464 -12.627 -6.974 -2.455 1.00 0.00 O ATOM 0 H GLY A 464 -10.528 -4.208 -0.656 1.00 0.00 H new ATOM 0 HA2 GLY A 464 -12.624 -5.380 -0.345 1.00 0.00 H new ATOM 0 HA3 GLY A 464 -13.324 -4.424 -1.637 1.00 0.00 H new ATOM 1288 N PHE A 465 -10.870 -5.677 -2.997 1.00 0.00 N ATOM 1289 CA PHE A 465 -10.354 -6.605 -3.997 1.00 0.00 C ATOM 1290 C PHE A 465 -10.403 -8.041 -3.485 1.00 0.00 C ATOM 1291 O PHE A 465 -9.656 -8.412 -2.581 1.00 0.00 O ATOM 1292 CB PHE A 465 -8.920 -6.234 -4.376 1.00 0.00 C ATOM 1293 CG PHE A 465 -8.264 -7.231 -5.288 1.00 0.00 C ATOM 1294 CD1 PHE A 465 -7.687 -8.382 -4.778 1.00 0.00 C ATOM 1295 CD2 PHE A 465 -8.224 -7.016 -6.657 1.00 0.00 C ATOM 1296 CE1 PHE A 465 -7.082 -9.302 -5.615 1.00 0.00 C ATOM 1297 CE2 PHE A 465 -7.622 -7.931 -7.498 1.00 0.00 C ATOM 1298 CZ PHE A 465 -7.050 -9.076 -6.977 1.00 0.00 C ATOM 0 H PHE A 465 -10.317 -4.828 -2.884 1.00 0.00 H new ATOM 0 HA PHE A 465 -10.986 -6.533 -4.882 1.00 0.00 H new ATOM 0 HB2 PHE A 465 -8.922 -5.257 -4.860 1.00 0.00 H new ATOM 0 HB3 PHE A 465 -8.326 -6.139 -3.467 1.00 0.00 H new ATOM 0 HD1 PHE A 465 -7.710 -8.563 -3.714 1.00 0.00 H new ATOM 0 HD2 PHE A 465 -8.669 -6.123 -7.070 1.00 0.00 H new ATOM 0 HE1 PHE A 465 -6.635 -10.195 -5.204 1.00 0.00 H new ATOM 0 HE2 PHE A 465 -7.598 -7.752 -8.563 1.00 0.00 H new ATOM 0 HZ PHE A 465 -6.579 -9.793 -7.634 1.00 0.00 H new ATOM 1308 N GLN A 466 -11.288 -8.842 -4.068 1.00 0.00 N ATOM 1309 CA GLN A 466 -11.437 -10.236 -3.670 1.00 0.00 C ATOM 1310 C GLN A 466 -10.156 -11.019 -3.943 1.00 0.00 C ATOM 1311 O GLN A 466 -9.842 -11.333 -5.091 1.00 0.00 O ATOM 1312 CB GLN A 466 -12.610 -10.880 -4.411 1.00 0.00 C ATOM 1313 CG GLN A 466 -13.134 -12.140 -3.743 1.00 0.00 C ATOM 1314 CD GLN A 466 -13.718 -13.127 -4.734 1.00 0.00 C ATOM 1315 OE1 GLN A 466 -14.357 -12.738 -5.711 1.00 0.00 O ATOM 1316 NE2 GLN A 466 -13.499 -14.413 -4.487 1.00 0.00 N ATOM 0 H GLN A 466 -11.913 -8.549 -4.819 1.00 0.00 H new ATOM 0 HA GLN A 466 -11.637 -10.262 -2.599 1.00 0.00 H new ATOM 0 HB2 GLN A 466 -13.421 -10.156 -4.489 1.00 0.00 H new ATOM 0 HB3 GLN A 466 -12.299 -11.120 -5.428 1.00 0.00 H new ATOM 0 HG2 GLN A 466 -12.324 -12.619 -3.194 1.00 0.00 H new ATOM 0 HG3 GLN A 466 -13.897 -11.869 -3.013 1.00 0.00 H new ATOM 0 HE21 GLN A 466 -12.963 -14.690 -3.664 1.00 0.00 H new ATOM 0 HE22 GLN A 466 -13.866 -15.124 -5.120 1.00 0.00 H new ATOM 1325 N ILE A 467 -9.420 -11.329 -2.881 1.00 0.00 N ATOM 1326 CA ILE A 467 -8.174 -12.075 -3.007 1.00 0.00 C ATOM 1327 C ILE A 467 -8.311 -13.476 -2.420 1.00 0.00 C ATOM 1328 O ILE A 467 -8.638 -13.639 -1.245 1.00 0.00 O ATOM 1329 CB ILE A 467 -7.010 -11.350 -2.308 1.00 0.00 C ATOM 1330 CG1 ILE A 467 -5.671 -11.944 -2.750 1.00 0.00 C ATOM 1331 CG2 ILE A 467 -7.162 -11.437 -0.797 1.00 0.00 C ATOM 1332 CD1 ILE A 467 -4.490 -11.038 -2.481 1.00 0.00 C ATOM 0 H ILE A 467 -9.665 -11.075 -1.924 1.00 0.00 H new ATOM 0 HA ILE A 467 -7.957 -12.149 -4.073 1.00 0.00 H new ATOM 0 HB ILE A 467 -7.032 -10.299 -2.595 1.00 0.00 H new ATOM 0 HG12 ILE A 467 -5.516 -12.892 -2.235 1.00 0.00 H new ATOM 0 HG13 ILE A 467 -5.715 -12.164 -3.817 1.00 0.00 H new ATOM 0 HG21 ILE A 467 -6.331 -10.920 -0.317 1.00 0.00 H new ATOM 0 HG22 ILE A 467 -8.101 -10.971 -0.498 1.00 0.00 H new ATOM 0 HG23 ILE A 467 -7.163 -12.483 -0.491 1.00 0.00 H new ATOM 0 HD11 ILE A 467 -3.575 -11.523 -2.820 1.00 0.00 H new ATOM 0 HD12 ILE A 467 -4.623 -10.098 -3.018 1.00 0.00 H new ATOM 0 HD13 ILE A 467 -4.421 -10.838 -1.412 1.00 0.00 H new ATOM 1344 N GLY A 468 -8.055 -14.487 -3.247 1.00 0.00 N ATOM 1345 CA GLY A 468 -8.154 -15.860 -2.792 1.00 0.00 C ATOM 1346 C GLY A 468 -9.557 -16.226 -2.347 1.00 0.00 C ATOM 1347 O GLY A 468 -10.423 -16.506 -3.175 1.00 0.00 O ATOM 0 H GLY A 468 -7.781 -14.378 -4.223 1.00 0.00 H new ATOM 0 HA2 GLY A 468 -7.845 -16.529 -3.596 1.00 0.00 H new ATOM 0 HA3 GLY A 468 -7.462 -16.016 -1.964 1.00 0.00 H new ATOM 1351 N MET A 469 -9.780 -16.225 -1.037 1.00 0.00 N ATOM 1352 CA MET A 469 -11.088 -16.560 -0.486 1.00 0.00 C ATOM 1353 C MET A 469 -11.650 -15.396 0.324 1.00 0.00 C ATOM 1354 O MET A 469 -12.838 -15.367 0.649 1.00 0.00 O ATOM 1355 CB MET A 469 -10.990 -17.807 0.393 1.00 0.00 C ATOM 1356 CG MET A 469 -11.068 -19.109 -0.389 1.00 0.00 C ATOM 1357 SD MET A 469 -10.553 -20.537 0.585 1.00 0.00 S ATOM 1358 CE MET A 469 -9.192 -21.149 -0.406 1.00 0.00 C ATOM 0 H MET A 469 -9.073 -15.996 -0.338 1.00 0.00 H new ATOM 0 HA MET A 469 -11.764 -16.762 -1.317 1.00 0.00 H new ATOM 0 HB2 MET A 469 -10.050 -17.780 0.945 1.00 0.00 H new ATOM 0 HB3 MET A 469 -11.793 -17.786 1.130 1.00 0.00 H new ATOM 0 HG2 MET A 469 -12.091 -19.260 -0.735 1.00 0.00 H new ATOM 0 HG3 MET A 469 -10.439 -19.034 -1.276 1.00 0.00 H new ATOM 0 HE1 MET A 469 -8.767 -22.034 0.067 1.00 0.00 H new ATOM 0 HE2 MET A 469 -9.554 -21.408 -1.401 1.00 0.00 H new ATOM 0 HE3 MET A 469 -8.426 -20.378 -0.488 1.00 0.00 H new ATOM 1368 N LYS A 470 -10.790 -14.436 0.649 1.00 0.00 N ATOM 1369 CA LYS A 470 -11.199 -13.269 1.420 1.00 0.00 C ATOM 1370 C LYS A 470 -11.022 -11.990 0.608 1.00 0.00 C ATOM 1371 O LYS A 470 -10.574 -12.029 -0.537 1.00 0.00 O ATOM 1372 CB LYS A 470 -10.392 -13.179 2.716 1.00 0.00 C ATOM 1373 CG LYS A 470 -8.906 -12.956 2.492 1.00 0.00 C ATOM 1374 CD LYS A 470 -8.151 -12.869 3.809 1.00 0.00 C ATOM 1375 CE LYS A 470 -6.716 -13.352 3.660 1.00 0.00 C ATOM 1376 NZ LYS A 470 -5.935 -13.161 4.914 1.00 0.00 N ATOM 0 H LYS A 470 -9.804 -14.444 0.389 1.00 0.00 H new ATOM 0 HA LYS A 470 -12.255 -13.379 1.665 1.00 0.00 H new ATOM 0 HB2 LYS A 470 -10.786 -12.364 3.324 1.00 0.00 H new ATOM 0 HB3 LYS A 470 -10.531 -14.098 3.286 1.00 0.00 H new ATOM 0 HG2 LYS A 470 -8.501 -13.771 1.892 1.00 0.00 H new ATOM 0 HG3 LYS A 470 -8.756 -12.038 1.924 1.00 0.00 H new ATOM 0 HD2 LYS A 470 -8.154 -11.839 4.165 1.00 0.00 H new ATOM 0 HD3 LYS A 470 -8.662 -13.468 4.563 1.00 0.00 H new ATOM 0 HE2 LYS A 470 -6.714 -14.407 3.388 1.00 0.00 H new ATOM 0 HE3 LYS A 470 -6.233 -12.812 2.845 1.00 0.00 H new ATOM 0 HZ1 LYS A 470 -4.963 -13.502 4.773 1.00 0.00 H new ATOM 0 HZ2 LYS A 470 -5.915 -12.151 5.160 1.00 0.00 H new ATOM 0 HZ3 LYS A 470 -6.381 -13.697 5.686 1.00 0.00 H new ATOM 1390 N ARG A 471 -11.375 -10.859 1.209 1.00 0.00 N ATOM 1391 CA ARG A 471 -11.254 -9.568 0.542 1.00 0.00 C ATOM 1392 C ARG A 471 -10.099 -8.761 1.126 1.00 0.00 C ATOM 1393 O ARG A 471 -9.486 -9.160 2.116 1.00 0.00 O ATOM 1394 CB ARG A 471 -12.558 -8.779 0.669 1.00 0.00 C ATOM 1395 CG ARG A 471 -13.721 -9.398 -0.088 1.00 0.00 C ATOM 1396 CD ARG A 471 -15.058 -8.987 0.509 1.00 0.00 C ATOM 1397 NE ARG A 471 -16.120 -9.932 0.175 1.00 0.00 N ATOM 1398 CZ ARG A 471 -17.344 -9.874 0.690 1.00 0.00 C ATOM 1399 NH1 ARG A 471 -17.657 -8.921 1.558 1.00 0.00 N ATOM 1400 NH2 ARG A 471 -18.256 -10.769 0.337 1.00 0.00 N ATOM 0 H ARG A 471 -11.747 -10.810 2.157 1.00 0.00 H new ATOM 0 HA ARG A 471 -11.050 -9.750 -0.513 1.00 0.00 H new ATOM 0 HB2 ARG A 471 -12.823 -8.699 1.723 1.00 0.00 H new ATOM 0 HB3 ARG A 471 -12.396 -7.765 0.303 1.00 0.00 H new ATOM 0 HG2 ARG A 471 -13.679 -9.093 -1.134 1.00 0.00 H new ATOM 0 HG3 ARG A 471 -13.632 -10.484 -0.069 1.00 0.00 H new ATOM 0 HD2 ARG A 471 -14.964 -8.915 1.593 1.00 0.00 H new ATOM 0 HD3 ARG A 471 -15.328 -7.995 0.146 1.00 0.00 H new ATOM 0 HE ARG A 471 -15.911 -10.677 -0.490 1.00 0.00 H new ATOM 0 HH11 ARG A 471 -16.958 -8.231 1.832 1.00 0.00 H new ATOM 0 HH12 ARG A 471 -18.597 -8.879 1.952 1.00 0.00 H new ATOM 0 HH21 ARG A 471 -18.019 -11.503 -0.330 1.00 0.00 H new ATOM 0 HH22 ARG A 471 -19.195 -10.724 0.733 1.00 0.00 H new ATOM 1414 N LEU A 472 -9.807 -7.622 0.506 1.00 0.00 N ATOM 1415 CA LEU A 472 -8.725 -6.757 0.964 1.00 0.00 C ATOM 1416 C LEU A 472 -9.272 -5.434 1.490 1.00 0.00 C ATOM 1417 O LEU A 472 -10.349 -4.991 1.090 1.00 0.00 O ATOM 1418 CB LEU A 472 -7.736 -6.498 -0.174 1.00 0.00 C ATOM 1419 CG LEU A 472 -6.955 -7.713 -0.674 1.00 0.00 C ATOM 1420 CD1 LEU A 472 -6.072 -7.332 -1.852 1.00 0.00 C ATOM 1421 CD2 LEU A 472 -6.121 -8.310 0.450 1.00 0.00 C ATOM 0 H LEU A 472 -10.304 -7.276 -0.315 1.00 0.00 H new ATOM 0 HA LEU A 472 -8.207 -7.264 1.778 1.00 0.00 H new ATOM 0 HB2 LEU A 472 -8.284 -6.072 -1.015 1.00 0.00 H new ATOM 0 HB3 LEU A 472 -7.022 -5.743 0.156 1.00 0.00 H new ATOM 0 HG LEU A 472 -7.668 -8.466 -1.010 1.00 0.00 H new ATOM 0 HD11 LEU A 472 -5.524 -8.210 -2.194 1.00 0.00 H new ATOM 0 HD12 LEU A 472 -6.692 -6.952 -2.664 1.00 0.00 H new ATOM 0 HD13 LEU A 472 -5.366 -6.561 -1.543 1.00 0.00 H new ATOM 0 HD21 LEU A 472 -5.572 -9.174 0.076 1.00 0.00 H new ATOM 0 HD22 LEU A 472 -5.417 -7.563 0.817 1.00 0.00 H new ATOM 0 HD23 LEU A 472 -6.776 -8.621 1.264 1.00 0.00 H new ATOM 1433 N LYS A 473 -8.521 -4.805 2.388 1.00 0.00 N ATOM 1434 CA LYS A 473 -8.927 -3.529 2.967 1.00 0.00 C ATOM 1435 C LYS A 473 -7.798 -2.506 2.876 1.00 0.00 C ATOM 1436 O LYS A 473 -6.828 -2.570 3.630 1.00 0.00 O ATOM 1437 CB LYS A 473 -9.342 -3.718 4.427 1.00 0.00 C ATOM 1438 CG LYS A 473 -10.014 -2.497 5.033 1.00 0.00 C ATOM 1439 CD LYS A 473 -10.712 -2.834 6.339 1.00 0.00 C ATOM 1440 CE LYS A 473 -9.746 -2.796 7.513 1.00 0.00 C ATOM 1441 NZ LYS A 473 -10.432 -3.069 8.805 1.00 0.00 N ATOM 0 H LYS A 473 -7.628 -5.158 2.731 1.00 0.00 H new ATOM 0 HA LYS A 473 -9.779 -3.155 2.399 1.00 0.00 H new ATOM 0 HB2 LYS A 473 -10.022 -4.567 4.495 1.00 0.00 H new ATOM 0 HB3 LYS A 473 -8.460 -3.967 5.017 1.00 0.00 H new ATOM 0 HG2 LYS A 473 -9.270 -1.720 5.207 1.00 0.00 H new ATOM 0 HG3 LYS A 473 -10.738 -2.091 4.327 1.00 0.00 H new ATOM 0 HD2 LYS A 473 -11.524 -2.128 6.512 1.00 0.00 H new ATOM 0 HD3 LYS A 473 -11.161 -3.825 6.268 1.00 0.00 H new ATOM 0 HE2 LYS A 473 -8.957 -3.532 7.358 1.00 0.00 H new ATOM 0 HE3 LYS A 473 -9.266 -1.819 7.556 1.00 0.00 H new ATOM 0 HZ1 LYS A 473 -9.739 -3.034 9.580 1.00 0.00 H new ATOM 0 HZ2 LYS A 473 -11.168 -2.352 8.966 1.00 0.00 H new ATOM 0 HZ3 LYS A 473 -10.869 -4.012 8.774 1.00 0.00 H new ATOM 1455 N VAL A 474 -7.935 -1.564 1.949 1.00 0.00 N ATOM 1456 CA VAL A 474 -6.928 -0.526 1.762 1.00 0.00 C ATOM 1457 C VAL A 474 -7.484 0.849 2.115 1.00 0.00 C ATOM 1458 O VAL A 474 -8.604 1.192 1.737 1.00 0.00 O ATOM 1459 CB VAL A 474 -6.410 -0.501 0.312 1.00 0.00 C ATOM 1460 CG1 VAL A 474 -5.242 0.464 0.178 1.00 0.00 C ATOM 1461 CG2 VAL A 474 -6.012 -1.899 -0.135 1.00 0.00 C ATOM 0 H VAL A 474 -8.732 -1.498 1.316 1.00 0.00 H new ATOM 0 HA VAL A 474 -6.101 -0.763 2.431 1.00 0.00 H new ATOM 0 HB VAL A 474 -7.214 -0.152 -0.337 1.00 0.00 H new ATOM 0 HG11 VAL A 474 -4.890 0.468 -0.853 1.00 0.00 H new ATOM 0 HG12 VAL A 474 -5.565 1.467 0.455 1.00 0.00 H new ATOM 0 HG13 VAL A 474 -4.433 0.149 0.837 1.00 0.00 H new ATOM 0 HG21 VAL A 474 -5.648 -1.863 -1.162 1.00 0.00 H new ATOM 0 HG22 VAL A 474 -5.224 -2.279 0.516 1.00 0.00 H new ATOM 0 HG23 VAL A 474 -6.878 -2.559 -0.080 1.00 0.00 H new ATOM 1471 N GLN A 475 -6.693 1.633 2.841 1.00 0.00 N ATOM 1472 CA GLN A 475 -7.107 2.971 3.246 1.00 0.00 C ATOM 1473 C GLN A 475 -5.897 3.847 3.549 1.00 0.00 C ATOM 1474 O GLN A 475 -4.893 3.374 4.084 1.00 0.00 O ATOM 1475 CB GLN A 475 -8.018 2.897 4.472 1.00 0.00 C ATOM 1476 CG GLN A 475 -8.592 4.243 4.886 1.00 0.00 C ATOM 1477 CD GLN A 475 -9.809 4.634 4.072 1.00 0.00 C ATOM 1478 OE1 GLN A 475 -10.347 3.828 3.312 1.00 0.00 O ATOM 1479 NE2 GLN A 475 -10.252 5.876 4.228 1.00 0.00 N ATOM 0 H GLN A 475 -5.762 1.365 3.161 1.00 0.00 H new ATOM 0 HA GLN A 475 -7.658 3.419 2.419 1.00 0.00 H new ATOM 0 HB2 GLN A 475 -8.838 2.210 4.264 1.00 0.00 H new ATOM 0 HB3 GLN A 475 -7.456 2.479 5.307 1.00 0.00 H new ATOM 0 HG2 GLN A 475 -8.861 4.210 5.942 1.00 0.00 H new ATOM 0 HG3 GLN A 475 -7.825 5.010 4.777 1.00 0.00 H new ATOM 0 HE21 GLN A 475 -9.776 6.511 4.869 1.00 0.00 H new ATOM 0 HE22 GLN A 475 -11.069 6.195 3.707 1.00 0.00 H new ATOM 1488 N LEU A 476 -5.996 5.125 3.204 1.00 0.00 N ATOM 1489 CA LEU A 476 -4.908 6.069 3.439 1.00 0.00 C ATOM 1490 C LEU A 476 -5.000 6.668 4.837 1.00 0.00 C ATOM 1491 O LEU A 476 -6.029 7.227 5.220 1.00 0.00 O ATOM 1492 CB LEU A 476 -4.938 7.184 2.390 1.00 0.00 C ATOM 1493 CG LEU A 476 -5.948 8.306 2.633 1.00 0.00 C ATOM 1494 CD1 LEU A 476 -5.423 9.280 3.676 1.00 0.00 C ATOM 1495 CD2 LEU A 476 -6.261 9.032 1.332 1.00 0.00 C ATOM 0 H LEU A 476 -6.819 5.533 2.760 1.00 0.00 H new ATOM 0 HA LEU A 476 -3.966 5.527 3.357 1.00 0.00 H new ATOM 0 HB2 LEU A 476 -3.943 7.625 2.329 1.00 0.00 H new ATOM 0 HB3 LEU A 476 -5.149 6.736 1.419 1.00 0.00 H new ATOM 0 HG LEU A 476 -6.870 7.864 3.010 1.00 0.00 H new ATOM 0 HD11 LEU A 476 -6.155 10.072 3.836 1.00 0.00 H new ATOM 0 HD12 LEU A 476 -5.250 8.751 4.613 1.00 0.00 H new ATOM 0 HD13 LEU A 476 -4.487 9.717 3.328 1.00 0.00 H new ATOM 0 HD21 LEU A 476 -6.981 9.827 1.523 1.00 0.00 H new ATOM 0 HD22 LEU A 476 -5.345 9.462 0.926 1.00 0.00 H new ATOM 0 HD23 LEU A 476 -6.681 8.327 0.614 1.00 0.00 H new ATOM 1507 N LYS A 477 -3.917 6.551 5.598 1.00 0.00 N ATOM 1508 CA LYS A 477 -3.873 7.085 6.955 1.00 0.00 C ATOM 1509 C LYS A 477 -4.691 8.368 7.062 1.00 0.00 C ATOM 1510 O LYS A 477 -4.377 9.371 6.422 1.00 0.00 O ATOM 1511 CB LYS A 477 -2.425 7.355 7.371 1.00 0.00 C ATOM 1512 CG LYS A 477 -2.204 7.306 8.873 1.00 0.00 C ATOM 1513 CD LYS A 477 -0.770 6.936 9.215 1.00 0.00 C ATOM 1514 CE LYS A 477 -0.503 7.061 10.706 1.00 0.00 C ATOM 1515 NZ LYS A 477 -0.425 8.484 11.140 1.00 0.00 N ATOM 0 H LYS A 477 -3.057 6.091 5.298 1.00 0.00 H new ATOM 0 HA LYS A 477 -4.306 6.342 7.625 1.00 0.00 H new ATOM 0 HB2 LYS A 477 -1.776 6.622 6.893 1.00 0.00 H new ATOM 0 HB3 LYS A 477 -2.126 8.335 7.000 1.00 0.00 H new ATOM 0 HG2 LYS A 477 -2.444 8.276 9.309 1.00 0.00 H new ATOM 0 HG3 LYS A 477 -2.884 6.580 9.318 1.00 0.00 H new ATOM 0 HD2 LYS A 477 -0.570 5.914 8.893 1.00 0.00 H new ATOM 0 HD3 LYS A 477 -0.085 7.583 8.666 1.00 0.00 H new ATOM 0 HE2 LYS A 477 -1.294 6.556 11.260 1.00 0.00 H new ATOM 0 HE3 LYS A 477 0.431 6.555 10.951 1.00 0.00 H new ATOM 0 HZ1 LYS A 477 -0.093 8.529 12.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 477 0.239 8.998 10.527 1.00 0.00 H new ATOM 0 HZ3 LYS A 477 -1.367 8.920 11.072 1.00 0.00 H new