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 419 GLN : amide:sc= -0.273 X(o=-0.27,f=-0.02) USER MOD Set 1.2: A 422 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 395 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 402 ASN :FLIP amide:sc= -3.06 F(o=-4.4!,f=-3.1) USER MOD Single : A 406 TYR OH : rot 180:sc= -1.26 USER MOD Single : A 407 HIS :FLIP no HD1:sc= -0.0402 F(o=-0.57,f=-0.04) USER MOD Single : A 410 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 415 GLN : amide:sc= 0.91 K(o=0.91,f=-6.7!) USER MOD Single : A 420 MET CE :methyl 165:sc= -1.3 (180deg=-2.14) USER MOD Single : A 426 ASN : amide:sc= 0 X(o=0,f=-0.046) USER MOD Single : A 429 SER OG : rot -60:sc= -0.952 USER MOD Single : A 431 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 443 CYS SG : rot 17:sc= 0.114 USER MOD Single : A 448 SER OG : rot 110:sc= -0.21 USER MOD Single : A 449 TYR OH : rot -119:sc= -0.375 USER MOD Single : A 451 ASN : amide:sc= -1.78! C(o=-1.8!,f=-7.5!) USER MOD Single : A 454 SER OG : rot 180:sc= 0 USER MOD Single : A 456 GLN :FLIP amide:sc= -0.761 F(o=-2,f=-0.76) USER MOD Single : A 460 GLN : amide:sc= 0 K(o=0,f=-0.78) USER MOD Single : A 461 SER OG : rot 180:sc= 0 USER MOD Single : A 462 MET CE :methyl -176:sc= 0 (180deg=-0.0325) USER MOD Single : A 463 ASN : amide:sc= -0.481 X(o=-0.48,f=-0.0056) USER MOD Single : A 466 GLN : amide:sc= -0.0756 K(o=-0.076,f=-1.3) USER MOD Single : A 469 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 470 LYS NZ :NH3+ -162:sc= -0.0104 (180deg=-0.174) 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 9.128 4.974 4.295 1.00 0.00 N ATOM 226 CA LYS A 395 8.845 6.381 4.039 1.00 0.00 C ATOM 227 C LYS A 395 7.427 6.561 3.503 1.00 0.00 C ATOM 228 O LYS A 395 6.742 5.586 3.196 1.00 0.00 O ATOM 229 CB LYS A 395 9.854 6.954 3.042 1.00 0.00 C ATOM 230 CG LYS A 395 11.302 6.706 3.434 1.00 0.00 C ATOM 231 CD LYS A 395 12.250 7.030 2.292 1.00 0.00 C ATOM 232 CE LYS A 395 12.474 5.824 1.394 1.00 0.00 C ATOM 233 NZ LYS A 395 13.360 6.147 0.241 1.00 0.00 N ATOM 0 HA LYS A 395 8.931 6.920 4.982 1.00 0.00 H new ATOM 0 HB2 LYS A 395 9.672 6.516 2.061 1.00 0.00 H new ATOM 0 HB3 LYS A 395 9.690 8.027 2.948 1.00 0.00 H new ATOM 0 HG2 LYS A 395 11.555 7.315 4.302 1.00 0.00 H new ATOM 0 HG3 LYS A 395 11.427 5.664 3.728 1.00 0.00 H new ATOM 0 HD2 LYS A 395 11.844 7.853 1.703 1.00 0.00 H new ATOM 0 HD3 LYS A 395 13.205 7.367 2.695 1.00 0.00 H new ATOM 0 HE2 LYS A 395 12.916 5.015 1.976 1.00 0.00 H new ATOM 0 HE3 LYS A 395 11.514 5.463 1.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 395 13.488 5.299 -0.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 395 12.927 6.901 -0.329 1.00 0.00 H new ATOM 0 HZ3 LYS A 395 14.285 6.467 0.593 1.00 0.00 H new ATOM 247 N GLU A 396 6.997 7.814 3.391 1.00 0.00 N ATOM 248 CA GLU A 396 5.661 8.120 2.891 1.00 0.00 C ATOM 249 C GLU A 396 5.718 9.198 1.812 1.00 0.00 C ATOM 250 O GLU A 396 6.794 9.669 1.447 1.00 0.00 O ATOM 251 CB GLU A 396 4.755 8.575 4.036 1.00 0.00 C ATOM 252 CG GLU A 396 5.288 9.782 4.790 1.00 0.00 C ATOM 253 CD GLU A 396 4.620 9.970 6.138 1.00 0.00 C ATOM 254 OE1 GLU A 396 4.653 9.024 6.954 1.00 0.00 O ATOM 255 OE2 GLU A 396 4.063 11.062 6.378 1.00 0.00 O ATOM 0 H GLU A 396 7.553 8.632 3.639 1.00 0.00 H new ATOM 0 HA GLU A 396 5.249 7.212 2.451 1.00 0.00 H new ATOM 0 HB2 GLU A 396 3.769 8.813 3.636 1.00 0.00 H new ATOM 0 HB3 GLU A 396 4.624 7.749 4.735 1.00 0.00 H new ATOM 0 HG2 GLU A 396 6.363 9.670 4.934 1.00 0.00 H new ATOM 0 HG3 GLU A 396 5.139 10.677 4.187 1.00 0.00 H new ATOM 262 N GLY A 397 4.551 9.584 1.306 1.00 0.00 N ATOM 263 CA GLY A 397 4.489 10.603 0.276 1.00 0.00 C ATOM 264 C GLY A 397 4.168 11.975 0.834 1.00 0.00 C ATOM 265 O GLY A 397 4.574 12.328 1.943 1.00 0.00 O ATOM 0 H GLY A 397 3.647 9.208 1.592 1.00 0.00 H new ATOM 0 HA2 GLY A 397 5.443 10.642 -0.249 1.00 0.00 H new ATOM 0 HA3 GLY A 397 3.732 10.327 -0.458 1.00 0.00 H new ATOM 269 N PRO A 398 3.426 12.776 0.057 1.00 0.00 N ATOM 270 CA PRO A 398 3.036 14.131 0.460 1.00 0.00 C ATOM 271 C PRO A 398 1.969 14.127 1.550 1.00 0.00 C ATOM 272 O PRO A 398 1.163 13.201 1.638 1.00 0.00 O ATOM 273 CB PRO A 398 2.480 14.738 -0.830 1.00 0.00 C ATOM 274 CG PRO A 398 1.991 13.572 -1.618 1.00 0.00 C ATOM 275 CD PRO A 398 2.908 12.422 -1.274 1.00 0.00 C ATOM 0 HA PRO A 398 3.872 14.687 0.883 1.00 0.00 H new ATOM 0 HB2 PRO A 398 1.673 15.441 -0.621 1.00 0.00 H new ATOM 0 HB3 PRO A 398 3.249 15.288 -1.372 1.00 0.00 H new ATOM 0 HG2 PRO A 398 0.957 13.336 -1.365 1.00 0.00 H new ATOM 0 HG3 PRO A 398 2.017 13.785 -2.687 1.00 0.00 H new ATOM 0 HD2 PRO A 398 2.371 11.473 -1.256 1.00 0.00 H new ATOM 0 HD3 PRO A 398 3.712 12.319 -2.003 1.00 0.00 H new ATOM 283 N GLU A 399 1.970 15.168 2.377 1.00 0.00 N ATOM 284 CA GLU A 399 1.001 15.283 3.460 1.00 0.00 C ATOM 285 C GLU A 399 -0.425 15.161 2.931 1.00 0.00 C ATOM 286 O GLU A 399 -1.001 16.130 2.439 1.00 0.00 O ATOM 287 CB GLU A 399 1.174 16.617 4.189 1.00 0.00 C ATOM 288 CG GLU A 399 0.241 16.787 5.376 1.00 0.00 C ATOM 289 CD GLU A 399 0.458 18.099 6.106 1.00 0.00 C ATOM 290 OE1 GLU A 399 1.556 18.290 6.670 1.00 0.00 O ATOM 291 OE2 GLU A 399 -0.470 18.935 6.111 1.00 0.00 O ATOM 0 H GLU A 399 2.631 15.943 2.317 1.00 0.00 H new ATOM 0 HA GLU A 399 1.180 14.468 4.161 1.00 0.00 H new ATOM 0 HB2 GLU A 399 2.205 16.703 4.533 1.00 0.00 H new ATOM 0 HB3 GLU A 399 1.004 17.431 3.484 1.00 0.00 H new ATOM 0 HG2 GLU A 399 -0.792 16.734 5.032 1.00 0.00 H new ATOM 0 HG3 GLU A 399 0.389 15.960 6.071 1.00 0.00 H new ATOM 298 N GLY A 400 -0.988 13.961 3.035 1.00 0.00 N ATOM 299 CA GLY A 400 -2.341 13.733 2.563 1.00 0.00 C ATOM 300 C GLY A 400 -2.468 12.449 1.766 1.00 0.00 C ATOM 301 O GLY A 400 -3.558 11.888 1.651 1.00 0.00 O ATOM 0 H GLY A 400 -0.531 13.143 3.438 1.00 0.00 H new ATOM 0 HA2 GLY A 400 -3.019 13.696 3.416 1.00 0.00 H new ATOM 0 HA3 GLY A 400 -2.653 14.574 1.944 1.00 0.00 H new ATOM 305 N ALA A 401 -1.353 11.985 1.214 1.00 0.00 N ATOM 306 CA ALA A 401 -1.344 10.760 0.425 1.00 0.00 C ATOM 307 C ALA A 401 -0.835 9.580 1.246 1.00 0.00 C ATOM 308 O ALA A 401 0.238 9.647 1.844 1.00 0.00 O ATOM 309 CB ALA A 401 -0.495 10.942 -0.825 1.00 0.00 C ATOM 0 H ALA A 401 -0.444 12.439 1.299 1.00 0.00 H new ATOM 0 HA ALA A 401 -2.370 10.544 0.126 1.00 0.00 H new ATOM 0 HB1 ALA A 401 -0.498 10.019 -1.404 1.00 0.00 H new ATOM 0 HB2 ALA A 401 -0.906 11.751 -1.429 1.00 0.00 H new ATOM 0 HB3 ALA A 401 0.528 11.187 -0.538 1.00 0.00 H new ATOM 315 N ASN A 402 -1.612 8.502 1.271 1.00 0.00 N ATOM 316 CA ASN A 402 -1.239 7.309 2.021 1.00 0.00 C ATOM 317 C ASN A 402 -1.972 6.081 1.489 1.00 0.00 C ATOM 318 O ASN A 402 -2.942 6.199 0.740 1.00 0.00 O ATOM 319 CB ASN A 402 -1.548 7.498 3.508 1.00 0.00 C ATOM 320 CG ASN A 402 -0.530 8.380 4.203 1.00 0.00 C ATOM 321 OD1 ASN A 402 -0.714 9.691 4.099 1.00 0.00 O flip ATOM 322 ND2 ASN A 402 0.411 7.888 4.826 1.00 0.00 N flip ATOM 0 H ASN A 402 -2.503 8.430 0.781 1.00 0.00 H new ATOM 0 HA ASN A 402 -0.167 7.152 1.897 1.00 0.00 H new ATOM 0 HB2 ASN A 402 -2.540 7.937 3.617 1.00 0.00 H new ATOM 0 HB3 ASN A 402 -1.575 6.524 3.997 1.00 0.00 H new ATOM 0 HD21 ASN A 402 0.513 6.875 4.879 1.00 0.00 H new ATOM 0 HD22 ASN A 402 1.089 8.494 5.289 1.00 0.00 H new ATOM 329 N LEU A 403 -1.503 4.902 1.882 1.00 0.00 N ATOM 330 CA LEU A 403 -2.114 3.651 1.447 1.00 0.00 C ATOM 331 C LEU A 403 -1.735 2.506 2.381 1.00 0.00 C ATOM 332 O LEU A 403 -0.584 2.069 2.408 1.00 0.00 O ATOM 333 CB LEU A 403 -1.684 3.322 0.016 1.00 0.00 C ATOM 334 CG LEU A 403 -2.375 4.117 -1.092 1.00 0.00 C ATOM 335 CD1 LEU A 403 -1.942 3.613 -2.460 1.00 0.00 C ATOM 336 CD2 LEU A 403 -3.887 4.031 -0.945 1.00 0.00 C ATOM 0 H LEU A 403 -0.701 4.786 2.502 1.00 0.00 H new ATOM 0 HA LEU A 403 -3.197 3.774 1.475 1.00 0.00 H new ATOM 0 HB2 LEU A 403 -0.609 3.483 -0.065 1.00 0.00 H new ATOM 0 HB3 LEU A 403 -1.862 2.261 -0.161 1.00 0.00 H new ATOM 0 HG LEU A 403 -2.079 5.162 -1.002 1.00 0.00 H new ATOM 0 HD11 LEU A 403 -2.444 4.191 -3.236 1.00 0.00 H new ATOM 0 HD12 LEU A 403 -0.863 3.726 -2.564 1.00 0.00 H new ATOM 0 HD13 LEU A 403 -2.208 2.561 -2.561 1.00 0.00 H new ATOM 0 HD21 LEU A 403 -4.363 4.602 -1.742 1.00 0.00 H new ATOM 0 HD22 LEU A 403 -4.200 2.989 -1.009 1.00 0.00 H new ATOM 0 HD23 LEU A 403 -4.182 4.440 0.021 1.00 0.00 H new ATOM 348 N PHE A 404 -2.710 2.021 3.142 1.00 0.00 N ATOM 349 CA PHE A 404 -2.479 0.925 4.075 1.00 0.00 C ATOM 350 C PHE A 404 -3.277 -0.311 3.671 1.00 0.00 C ATOM 351 O PHE A 404 -4.508 -0.297 3.675 1.00 0.00 O ATOM 352 CB PHE A 404 -2.859 1.350 5.496 1.00 0.00 C ATOM 353 CG PHE A 404 -1.822 2.206 6.164 1.00 0.00 C ATOM 354 CD1 PHE A 404 -1.605 3.508 5.745 1.00 0.00 C ATOM 355 CD2 PHE A 404 -1.063 1.708 7.210 1.00 0.00 C ATOM 356 CE1 PHE A 404 -0.650 4.298 6.357 1.00 0.00 C ATOM 357 CE2 PHE A 404 -0.106 2.493 7.828 1.00 0.00 C ATOM 358 CZ PHE A 404 0.099 3.790 7.401 1.00 0.00 C ATOM 0 H PHE A 404 -3.668 2.370 3.131 1.00 0.00 H new ATOM 0 HA PHE A 404 -1.418 0.675 4.048 1.00 0.00 H new ATOM 0 HB2 PHE A 404 -3.802 1.895 5.463 1.00 0.00 H new ATOM 0 HB3 PHE A 404 -3.027 0.459 6.100 1.00 0.00 H new ATOM 0 HD1 PHE A 404 -2.189 3.911 4.931 1.00 0.00 H new ATOM 0 HD2 PHE A 404 -1.220 0.694 7.547 1.00 0.00 H new ATOM 0 HE1 PHE A 404 -0.489 5.311 6.019 1.00 0.00 H new ATOM 0 HE2 PHE A 404 0.479 2.092 8.642 1.00 0.00 H new ATOM 0 HZ PHE A 404 0.844 4.406 7.882 1.00 0.00 H new ATOM 368 N ILE A 405 -2.566 -1.378 3.321 1.00 0.00 N ATOM 369 CA ILE A 405 -3.207 -2.622 2.915 1.00 0.00 C ATOM 370 C ILE A 405 -3.429 -3.542 4.111 1.00 0.00 C ATOM 371 O ILE A 405 -2.546 -3.706 4.953 1.00 0.00 O ATOM 372 CB ILE A 405 -2.371 -3.366 1.856 1.00 0.00 C ATOM 373 CG1 ILE A 405 -2.217 -2.506 0.600 1.00 0.00 C ATOM 374 CG2 ILE A 405 -3.016 -4.701 1.515 1.00 0.00 C ATOM 375 CD1 ILE A 405 -1.175 -1.417 0.738 1.00 0.00 C ATOM 0 H ILE A 405 -1.546 -1.405 3.311 1.00 0.00 H new ATOM 0 HA ILE A 405 -4.171 -2.354 2.482 1.00 0.00 H new ATOM 0 HB ILE A 405 -1.379 -3.558 2.266 1.00 0.00 H new ATOM 0 HG12 ILE A 405 -1.951 -3.148 -0.240 1.00 0.00 H new ATOM 0 HG13 ILE A 405 -3.178 -2.050 0.361 1.00 0.00 H new ATOM 0 HG21 ILE A 405 -2.414 -5.215 0.766 1.00 0.00 H new ATOM 0 HG22 ILE A 405 -3.079 -5.315 2.414 1.00 0.00 H new ATOM 0 HG23 ILE A 405 -4.018 -4.531 1.121 1.00 0.00 H new ATOM 0 HD11 ILE A 405 -1.119 -0.847 -0.189 1.00 0.00 H new ATOM 0 HD12 ILE A 405 -1.450 -0.752 1.557 1.00 0.00 H new ATOM 0 HD13 ILE A 405 -0.204 -1.867 0.946 1.00 0.00 H new ATOM 387 N TYR A 406 -4.613 -4.141 4.177 1.00 0.00 N ATOM 388 CA TYR A 406 -4.951 -5.046 5.269 1.00 0.00 C ATOM 389 C TYR A 406 -5.523 -6.355 4.735 1.00 0.00 C ATOM 390 O TYR A 406 -5.863 -6.463 3.557 1.00 0.00 O ATOM 391 CB TYR A 406 -5.957 -4.385 6.213 1.00 0.00 C ATOM 392 CG TYR A 406 -5.592 -2.966 6.589 1.00 0.00 C ATOM 393 CD1 TYR A 406 -4.454 -2.695 7.339 1.00 0.00 C ATOM 394 CD2 TYR A 406 -6.386 -1.896 6.193 1.00 0.00 C ATOM 395 CE1 TYR A 406 -4.118 -1.400 7.684 1.00 0.00 C ATOM 396 CE2 TYR A 406 -6.057 -0.599 6.533 1.00 0.00 C ATOM 397 CZ TYR A 406 -4.922 -0.356 7.279 1.00 0.00 C ATOM 398 OH TYR A 406 -4.591 0.936 7.621 1.00 0.00 O ATOM 0 H TYR A 406 -5.354 -4.016 3.488 1.00 0.00 H new ATOM 0 HA TYR A 406 -4.037 -5.268 5.819 1.00 0.00 H new ATOM 0 HB2 TYR A 406 -6.940 -4.386 5.742 1.00 0.00 H new ATOM 0 HB3 TYR A 406 -6.038 -4.983 7.121 1.00 0.00 H new ATOM 0 HD1 TYR A 406 -3.822 -3.510 7.658 1.00 0.00 H new ATOM 0 HD2 TYR A 406 -7.275 -2.082 5.609 1.00 0.00 H new ATOM 0 HE1 TYR A 406 -3.230 -1.207 8.268 1.00 0.00 H new ATOM 0 HE2 TYR A 406 -6.685 0.221 6.217 1.00 0.00 H new ATOM 0 HH TYR A 406 -5.260 1.552 7.257 1.00 0.00 H new ATOM 408 N HIS A 407 -5.627 -7.349 5.612 1.00 0.00 N ATOM 409 CA HIS A 407 -6.159 -8.653 5.231 1.00 0.00 C ATOM 410 C HIS A 407 -5.317 -9.281 4.125 1.00 0.00 C ATOM 411 O HIS A 407 -5.845 -9.727 3.105 1.00 0.00 O ATOM 412 CB HIS A 407 -7.610 -8.520 4.769 1.00 0.00 C ATOM 413 CG HIS A 407 -8.539 -8.044 5.843 1.00 0.00 C ATOM 414 ND1 HIS A 407 -8.461 -6.978 6.674 1.00 0.00 N flip ATOM 415 CD2 HIS A 407 -9.714 -8.692 6.163 1.00 0.00 C flip ATOM 416 CE1 HIS A 407 -9.579 -7.001 7.471 1.00 0.00 C flip ATOM 417 NE2 HIS A 407 -10.318 -8.044 7.143 1.00 0.00 N flip ATOM 0 H HIS A 407 -5.350 -7.276 6.591 1.00 0.00 H new ATOM 0 HA HIS A 407 -6.122 -9.303 6.106 1.00 0.00 H new ATOM 0 HB2 HIS A 407 -7.653 -7.827 3.929 1.00 0.00 H new ATOM 0 HB3 HIS A 407 -7.956 -9.486 4.403 1.00 0.00 H new ATOM 0 HD2 HIS A 407 -10.082 -9.589 5.687 1.00 0.00 H new ATOM 0 HE1 HIS A 407 -9.815 -6.282 8.241 1.00 0.00 H new ATOM 0 HE2 HIS A 407 -11.205 -8.305 7.573 1.00 0.00 H new ATOM 425 N LEU A 408 -4.004 -9.312 4.332 1.00 0.00 N ATOM 426 CA LEU A 408 -3.088 -9.885 3.353 1.00 0.00 C ATOM 427 C LEU A 408 -2.734 -11.324 3.714 1.00 0.00 C ATOM 428 O LEU A 408 -2.634 -11.689 4.886 1.00 0.00 O ATOM 429 CB LEU A 408 -1.815 -9.042 3.262 1.00 0.00 C ATOM 430 CG LEU A 408 -1.949 -7.698 2.547 1.00 0.00 C ATOM 431 CD1 LEU A 408 -0.794 -6.779 2.915 1.00 0.00 C ATOM 432 CD2 LEU A 408 -2.014 -7.899 1.040 1.00 0.00 C ATOM 0 H LEU A 408 -3.551 -8.947 5.170 1.00 0.00 H new ATOM 0 HA LEU A 408 -3.586 -9.886 2.384 1.00 0.00 H new ATOM 0 HB2 LEU A 408 -1.452 -8.858 4.273 1.00 0.00 H new ATOM 0 HB3 LEU A 408 -1.051 -9.628 2.751 1.00 0.00 H new ATOM 0 HG LEU A 408 -2.877 -7.228 2.871 1.00 0.00 H new ATOM 0 HD11 LEU A 408 -0.907 -5.827 2.396 1.00 0.00 H new ATOM 0 HD12 LEU A 408 -0.794 -6.608 3.991 1.00 0.00 H new ATOM 0 HD13 LEU A 408 0.148 -7.243 2.621 1.00 0.00 H new ATOM 0 HD21 LEU A 408 -2.109 -6.931 0.548 1.00 0.00 H new ATOM 0 HD22 LEU A 408 -1.103 -8.391 0.699 1.00 0.00 H new ATOM 0 HD23 LEU A 408 -2.876 -8.518 0.792 1.00 0.00 H new ATOM 444 N PRO A 409 -2.539 -12.162 2.686 1.00 0.00 N ATOM 445 CA PRO A 409 -2.191 -13.574 2.870 1.00 0.00 C ATOM 446 C PRO A 409 -0.728 -13.764 3.258 1.00 0.00 C ATOM 447 O PRO A 409 0.008 -12.794 3.429 1.00 0.00 O ATOM 448 CB PRO A 409 -2.464 -14.189 1.495 1.00 0.00 C ATOM 449 CG PRO A 409 -2.272 -13.067 0.533 1.00 0.00 C ATOM 450 CD PRO A 409 -2.643 -11.795 1.263 1.00 0.00 C ATOM 0 HA PRO A 409 -2.761 -14.033 3.678 1.00 0.00 H new ATOM 0 HB2 PRO A 409 -1.779 -15.011 1.286 1.00 0.00 H new ATOM 0 HB3 PRO A 409 -3.475 -14.593 1.436 1.00 0.00 H new ATOM 0 HG2 PRO A 409 -1.239 -13.027 0.188 1.00 0.00 H new ATOM 0 HG3 PRO A 409 -2.898 -13.203 -0.349 1.00 0.00 H new ATOM 0 HD2 PRO A 409 -1.968 -10.978 1.011 1.00 0.00 H new ATOM 0 HD3 PRO A 409 -3.650 -11.467 1.007 1.00 0.00 H new ATOM 458 N GLN A 410 -0.317 -15.020 3.394 1.00 0.00 N ATOM 459 CA GLN A 410 1.059 -15.337 3.761 1.00 0.00 C ATOM 460 C GLN A 410 1.961 -15.352 2.532 1.00 0.00 C ATOM 461 O GLN A 410 3.125 -14.957 2.601 1.00 0.00 O ATOM 462 CB GLN A 410 1.121 -16.690 4.471 1.00 0.00 C ATOM 463 CG GLN A 410 0.530 -16.670 5.873 1.00 0.00 C ATOM 464 CD GLN A 410 0.755 -17.970 6.619 1.00 0.00 C ATOM 465 OE1 GLN A 410 1.452 -18.004 7.633 1.00 0.00 O ATOM 466 NE2 GLN A 410 0.164 -19.050 6.121 1.00 0.00 N ATOM 0 H GLN A 410 -0.916 -15.834 3.256 1.00 0.00 H new ATOM 0 HA GLN A 410 1.415 -14.562 4.440 1.00 0.00 H new ATOM 0 HB2 GLN A 410 0.590 -17.430 3.872 1.00 0.00 H new ATOM 0 HB3 GLN A 410 2.160 -17.013 4.528 1.00 0.00 H new ATOM 0 HG2 GLN A 410 0.973 -15.850 6.438 1.00 0.00 H new ATOM 0 HG3 GLN A 410 -0.540 -16.472 5.809 1.00 0.00 H new ATOM 0 HE21 GLN A 410 -0.405 -18.977 5.278 1.00 0.00 H new ATOM 0 HE22 GLN A 410 0.279 -19.953 6.582 1.00 0.00 H new ATOM 475 N GLU A 411 1.417 -15.811 1.410 1.00 0.00 N ATOM 476 CA GLU A 411 2.175 -15.878 0.166 1.00 0.00 C ATOM 477 C GLU A 411 2.686 -14.498 -0.236 1.00 0.00 C ATOM 478 O GLU A 411 3.763 -14.367 -0.817 1.00 0.00 O ATOM 479 CB GLU A 411 1.309 -16.459 -0.953 1.00 0.00 C ATOM 480 CG GLU A 411 0.290 -15.478 -1.506 1.00 0.00 C ATOM 481 CD GLU A 411 -0.827 -16.163 -2.271 1.00 0.00 C ATOM 482 OE1 GLU A 411 -0.527 -16.850 -3.270 1.00 0.00 O ATOM 483 OE2 GLU A 411 -1.999 -16.013 -1.869 1.00 0.00 O ATOM 0 H GLU A 411 0.455 -16.142 1.336 1.00 0.00 H new ATOM 0 HA GLU A 411 3.033 -16.530 0.328 1.00 0.00 H new ATOM 0 HB2 GLU A 411 1.955 -16.794 -1.764 1.00 0.00 H new ATOM 0 HB3 GLU A 411 0.787 -17.339 -0.577 1.00 0.00 H new ATOM 0 HG2 GLU A 411 -0.137 -14.903 -0.685 1.00 0.00 H new ATOM 0 HG3 GLU A 411 0.794 -14.769 -2.163 1.00 0.00 H new ATOM 490 N PHE A 412 1.904 -13.470 0.078 1.00 0.00 N ATOM 491 CA PHE A 412 2.276 -12.099 -0.249 1.00 0.00 C ATOM 492 C PHE A 412 3.526 -11.675 0.516 1.00 0.00 C ATOM 493 O PHE A 412 3.829 -12.215 1.579 1.00 0.00 O ATOM 494 CB PHE A 412 1.123 -11.145 0.068 1.00 0.00 C ATOM 495 CG PHE A 412 0.179 -10.940 -1.082 1.00 0.00 C ATOM 496 CD1 PHE A 412 -0.291 -12.020 -1.811 1.00 0.00 C ATOM 497 CD2 PHE A 412 -0.235 -9.666 -1.436 1.00 0.00 C ATOM 498 CE1 PHE A 412 -1.159 -11.836 -2.870 1.00 0.00 C ATOM 499 CE2 PHE A 412 -1.105 -9.476 -2.495 1.00 0.00 C ATOM 500 CZ PHE A 412 -1.566 -10.560 -3.213 1.00 0.00 C ATOM 0 H PHE A 412 1.009 -13.561 0.558 1.00 0.00 H new ATOM 0 HA PHE A 412 2.493 -12.054 -1.316 1.00 0.00 H new ATOM 0 HB2 PHE A 412 0.565 -11.533 0.920 1.00 0.00 H new ATOM 0 HB3 PHE A 412 1.533 -10.180 0.368 1.00 0.00 H new ATOM 0 HD1 PHE A 412 0.025 -13.019 -1.548 1.00 0.00 H new ATOM 0 HD2 PHE A 412 0.125 -8.813 -0.880 1.00 0.00 H new ATOM 0 HE1 PHE A 412 -1.519 -12.687 -3.429 1.00 0.00 H new ATOM 0 HE2 PHE A 412 -1.423 -8.478 -2.760 1.00 0.00 H new ATOM 0 HZ PHE A 412 -2.243 -10.412 -4.041 1.00 0.00 H new ATOM 510 N GLY A 413 4.251 -10.705 -0.035 1.00 0.00 N ATOM 511 CA GLY A 413 5.460 -10.226 0.608 1.00 0.00 C ATOM 512 C GLY A 413 5.676 -8.740 0.403 1.00 0.00 C ATOM 513 O GLY A 413 4.717 -7.975 0.305 1.00 0.00 O ATOM 0 H GLY A 413 4.022 -10.243 -0.915 1.00 0.00 H new ATOM 0 HA2 GLY A 413 5.409 -10.439 1.676 1.00 0.00 H new ATOM 0 HA3 GLY A 413 6.318 -10.772 0.215 1.00 0.00 H new ATOM 517 N ASP A 414 6.938 -8.331 0.340 1.00 0.00 N ATOM 518 CA ASP A 414 7.278 -6.925 0.147 1.00 0.00 C ATOM 519 C ASP A 414 7.116 -6.524 -1.317 1.00 0.00 C ATOM 520 O ASP A 414 6.327 -5.638 -1.642 1.00 0.00 O ATOM 521 CB ASP A 414 8.711 -6.656 0.606 1.00 0.00 C ATOM 522 CG ASP A 414 8.891 -6.870 2.096 1.00 0.00 C ATOM 523 OD1 ASP A 414 8.421 -7.908 2.607 1.00 0.00 O ATOM 524 OD2 ASP A 414 9.501 -5.999 2.751 1.00 0.00 O ATOM 0 H ASP A 414 7.743 -8.952 0.420 1.00 0.00 H new ATOM 0 HA ASP A 414 6.595 -6.326 0.748 1.00 0.00 H new ATOM 0 HB2 ASP A 414 9.392 -7.311 0.063 1.00 0.00 H new ATOM 0 HB3 ASP A 414 8.984 -5.631 0.353 1.00 0.00 H new ATOM 529 N GLN A 415 7.869 -7.183 -2.193 1.00 0.00 N ATOM 530 CA GLN A 415 7.809 -6.893 -3.619 1.00 0.00 C ATOM 531 C GLN A 415 6.377 -6.988 -4.136 1.00 0.00 C ATOM 532 O GLN A 415 5.830 -6.019 -4.661 1.00 0.00 O ATOM 533 CB GLN A 415 8.709 -7.856 -4.395 1.00 0.00 C ATOM 534 CG GLN A 415 10.191 -7.537 -4.273 1.00 0.00 C ATOM 535 CD GLN A 415 10.839 -8.222 -3.086 1.00 0.00 C ATOM 536 OE1 GLN A 415 10.168 -8.582 -2.119 1.00 0.00 O ATOM 537 NE2 GLN A 415 12.152 -8.408 -3.155 1.00 0.00 N ATOM 0 H GLN A 415 8.527 -7.920 -1.939 1.00 0.00 H new ATOM 0 HA GLN A 415 8.163 -5.873 -3.771 1.00 0.00 H new ATOM 0 HB2 GLN A 415 8.534 -8.871 -4.038 1.00 0.00 H new ATOM 0 HB3 GLN A 415 8.427 -7.835 -5.448 1.00 0.00 H new ATOM 0 HG2 GLN A 415 10.701 -7.842 -5.187 1.00 0.00 H new ATOM 0 HG3 GLN A 415 10.320 -6.459 -4.181 1.00 0.00 H new ATOM 0 HE21 GLN A 415 12.669 -8.094 -3.976 1.00 0.00 H new ATOM 0 HE22 GLN A 415 12.643 -8.865 -2.387 1.00 0.00 H new ATOM 546 N ASP A 416 5.776 -8.163 -3.983 1.00 0.00 N ATOM 547 CA ASP A 416 4.407 -8.387 -4.433 1.00 0.00 C ATOM 548 C ASP A 416 3.566 -7.127 -4.259 1.00 0.00 C ATOM 549 O ASP A 416 3.047 -6.574 -5.229 1.00 0.00 O ATOM 550 CB ASP A 416 3.777 -9.547 -3.662 1.00 0.00 C ATOM 551 CG ASP A 416 4.646 -10.789 -3.671 1.00 0.00 C ATOM 552 OD1 ASP A 416 5.050 -11.221 -4.770 1.00 0.00 O ATOM 553 OD2 ASP A 416 4.921 -11.330 -2.580 1.00 0.00 O ATOM 0 H ASP A 416 6.216 -8.975 -3.551 1.00 0.00 H new ATOM 0 HA ASP A 416 4.435 -8.640 -5.493 1.00 0.00 H new ATOM 0 HB2 ASP A 416 3.598 -9.240 -2.632 1.00 0.00 H new ATOM 0 HB3 ASP A 416 2.806 -9.784 -4.097 1.00 0.00 H new ATOM 558 N LEU A 417 3.434 -6.678 -3.016 1.00 0.00 N ATOM 559 CA LEU A 417 2.653 -5.483 -2.712 1.00 0.00 C ATOM 560 C LEU A 417 3.022 -4.338 -3.652 1.00 0.00 C ATOM 561 O LEU A 417 2.149 -3.680 -4.219 1.00 0.00 O ATOM 562 CB LEU A 417 2.879 -5.057 -1.260 1.00 0.00 C ATOM 563 CG LEU A 417 2.067 -3.853 -0.781 1.00 0.00 C ATOM 564 CD1 LEU A 417 0.625 -4.256 -0.510 1.00 0.00 C ATOM 565 CD2 LEU A 417 2.697 -3.248 0.466 1.00 0.00 C ATOM 0 H LEU A 417 3.858 -7.123 -2.202 1.00 0.00 H new ATOM 0 HA LEU A 417 1.599 -5.722 -2.855 1.00 0.00 H new ATOM 0 HB2 LEU A 417 2.651 -5.905 -0.614 1.00 0.00 H new ATOM 0 HB3 LEU A 417 3.937 -4.832 -1.129 1.00 0.00 H new ATOM 0 HG LEU A 417 2.070 -3.099 -1.568 1.00 0.00 H new ATOM 0 HD11 LEU A 417 0.062 -3.387 -0.170 1.00 0.00 H new ATOM 0 HD12 LEU A 417 0.177 -4.643 -1.425 1.00 0.00 H new ATOM 0 HD13 LEU A 417 0.601 -5.027 0.260 1.00 0.00 H new ATOM 0 HD21 LEU A 417 2.106 -2.392 0.793 1.00 0.00 H new ATOM 0 HD22 LEU A 417 2.724 -3.995 1.259 1.00 0.00 H new ATOM 0 HD23 LEU A 417 3.712 -2.923 0.239 1.00 0.00 H new ATOM 577 N LEU A 418 4.320 -4.109 -3.815 1.00 0.00 N ATOM 578 CA LEU A 418 4.806 -3.046 -4.688 1.00 0.00 C ATOM 579 C LEU A 418 4.385 -3.293 -6.133 1.00 0.00 C ATOM 580 O LEU A 418 3.938 -2.379 -6.824 1.00 0.00 O ATOM 581 CB LEU A 418 6.329 -2.943 -4.600 1.00 0.00 C ATOM 582 CG LEU A 418 6.999 -2.015 -5.615 1.00 0.00 C ATOM 583 CD1 LEU A 418 6.799 -0.560 -5.221 1.00 0.00 C ATOM 584 CD2 LEU A 418 8.481 -2.339 -5.737 1.00 0.00 C ATOM 0 H LEU A 418 5.055 -4.645 -3.354 1.00 0.00 H new ATOM 0 HA LEU A 418 4.364 -2.107 -4.355 1.00 0.00 H new ATOM 0 HB2 LEU A 418 6.593 -2.604 -3.598 1.00 0.00 H new ATOM 0 HB3 LEU A 418 6.748 -3.942 -4.719 1.00 0.00 H new ATOM 0 HG LEU A 418 6.532 -2.174 -6.587 1.00 0.00 H new ATOM 0 HD11 LEU A 418 7.282 0.085 -5.954 1.00 0.00 H new ATOM 0 HD12 LEU A 418 5.733 -0.336 -5.187 1.00 0.00 H new ATOM 0 HD13 LEU A 418 7.238 -0.385 -4.239 1.00 0.00 H new ATOM 0 HD21 LEU A 418 8.941 -1.669 -6.463 1.00 0.00 H new ATOM 0 HD22 LEU A 418 8.963 -2.210 -4.768 1.00 0.00 H new ATOM 0 HD23 LEU A 418 8.602 -3.371 -6.067 1.00 0.00 H new ATOM 596 N GLN A 419 4.527 -4.537 -6.580 1.00 0.00 N ATOM 597 CA GLN A 419 4.160 -4.905 -7.943 1.00 0.00 C ATOM 598 C GLN A 419 2.644 -4.974 -8.098 1.00 0.00 C ATOM 599 O GLN A 419 2.124 -4.952 -9.213 1.00 0.00 O ATOM 600 CB GLN A 419 4.785 -6.249 -8.317 1.00 0.00 C ATOM 601 CG GLN A 419 6.284 -6.313 -8.071 1.00 0.00 C ATOM 602 CD GLN A 419 7.057 -5.322 -8.919 1.00 0.00 C ATOM 603 OE1 GLN A 419 7.437 -5.620 -10.052 1.00 0.00 O ATOM 604 NE2 GLN A 419 7.294 -4.136 -8.373 1.00 0.00 N ATOM 0 H GLN A 419 4.893 -5.306 -6.019 1.00 0.00 H new ATOM 0 HA GLN A 419 4.541 -4.136 -8.615 1.00 0.00 H new ATOM 0 HB2 GLN A 419 4.297 -7.039 -7.745 1.00 0.00 H new ATOM 0 HB3 GLN A 419 4.589 -6.451 -9.370 1.00 0.00 H new ATOM 0 HG2 GLN A 419 6.484 -6.118 -7.017 1.00 0.00 H new ATOM 0 HG3 GLN A 419 6.640 -7.321 -8.282 1.00 0.00 H new ATOM 0 HE21 GLN A 419 6.960 -3.932 -7.431 1.00 0.00 H new ATOM 0 HE22 GLN A 419 7.810 -3.428 -8.895 1.00 0.00 H new ATOM 613 N MET A 420 1.943 -5.058 -6.973 1.00 0.00 N ATOM 614 CA MET A 420 0.486 -5.130 -6.985 1.00 0.00 C ATOM 615 C MET A 420 -0.126 -3.736 -7.078 1.00 0.00 C ATOM 616 O MET A 420 -1.223 -3.563 -7.611 1.00 0.00 O ATOM 617 CB MET A 420 -0.020 -5.840 -5.728 1.00 0.00 C ATOM 618 CG MET A 420 -1.533 -5.802 -5.575 1.00 0.00 C ATOM 619 SD MET A 420 -2.072 -6.154 -3.892 1.00 0.00 S ATOM 620 CE MET A 420 -3.147 -7.560 -4.167 1.00 0.00 C ATOM 0 H MET A 420 2.359 -5.078 -6.042 1.00 0.00 H new ATOM 0 HA MET A 420 0.181 -5.700 -7.863 1.00 0.00 H new ATOM 0 HB2 MET A 420 0.309 -6.879 -5.750 1.00 0.00 H new ATOM 0 HB3 MET A 420 0.437 -5.380 -4.852 1.00 0.00 H new ATOM 0 HG2 MET A 420 -1.899 -4.819 -5.871 1.00 0.00 H new ATOM 0 HG3 MET A 420 -1.981 -6.527 -6.255 1.00 0.00 H new ATOM 0 HE1 MET A 420 -3.346 -8.057 -3.218 1.00 0.00 H new ATOM 0 HE2 MET A 420 -4.087 -7.220 -4.603 1.00 0.00 H new ATOM 0 HE3 MET A 420 -2.663 -8.260 -4.848 1.00 0.00 H new ATOM 630 N PHE A 421 0.588 -2.745 -6.555 1.00 0.00 N ATOM 631 CA PHE A 421 0.114 -1.366 -6.578 1.00 0.00 C ATOM 632 C PHE A 421 0.829 -0.563 -7.661 1.00 0.00 C ATOM 633 O PHE A 421 0.347 0.483 -8.092 1.00 0.00 O ATOM 634 CB PHE A 421 0.328 -0.708 -5.214 1.00 0.00 C ATOM 635 CG PHE A 421 -0.722 -1.068 -4.203 1.00 0.00 C ATOM 636 CD1 PHE A 421 -1.030 -2.394 -3.947 1.00 0.00 C ATOM 637 CD2 PHE A 421 -1.402 -0.081 -3.508 1.00 0.00 C ATOM 638 CE1 PHE A 421 -1.995 -2.730 -3.016 1.00 0.00 C ATOM 639 CE2 PHE A 421 -2.368 -0.410 -2.577 1.00 0.00 C ATOM 640 CZ PHE A 421 -2.666 -1.736 -2.332 1.00 0.00 C ATOM 0 H PHE A 421 1.497 -2.871 -6.110 1.00 0.00 H new ATOM 0 HA PHE A 421 -0.952 -1.378 -6.804 1.00 0.00 H new ATOM 0 HB2 PHE A 421 1.306 -0.998 -4.829 1.00 0.00 H new ATOM 0 HB3 PHE A 421 0.343 0.375 -5.340 1.00 0.00 H new ATOM 0 HD1 PHE A 421 -0.510 -3.175 -4.481 1.00 0.00 H new ATOM 0 HD2 PHE A 421 -1.174 0.958 -3.696 1.00 0.00 H new ATOM 0 HE1 PHE A 421 -2.224 -3.768 -2.824 1.00 0.00 H new ATOM 0 HE2 PHE A 421 -2.890 0.369 -2.041 1.00 0.00 H new ATOM 0 HZ PHE A 421 -3.423 -1.995 -1.606 1.00 0.00 H new ATOM 650 N MET A 422 1.982 -1.062 -8.096 1.00 0.00 N ATOM 651 CA MET A 422 2.764 -0.392 -9.128 1.00 0.00 C ATOM 652 C MET A 422 1.890 -0.041 -10.329 1.00 0.00 C ATOM 653 O MET A 422 1.937 1.070 -10.856 1.00 0.00 O ATOM 654 CB MET A 422 3.928 -1.279 -9.571 1.00 0.00 C ATOM 655 CG MET A 422 5.221 -1.006 -8.818 1.00 0.00 C ATOM 656 SD MET A 422 6.238 0.250 -9.616 1.00 0.00 S ATOM 657 CE MET A 422 7.863 -0.489 -9.470 1.00 0.00 C ATOM 0 H MET A 422 2.395 -1.928 -7.750 1.00 0.00 H new ATOM 0 HA MET A 422 3.161 0.532 -8.707 1.00 0.00 H new ATOM 0 HB2 MET A 422 3.651 -2.324 -9.433 1.00 0.00 H new ATOM 0 HB3 MET A 422 4.100 -1.133 -10.637 1.00 0.00 H new ATOM 0 HG2 MET A 422 4.985 -0.686 -7.803 1.00 0.00 H new ATOM 0 HG3 MET A 422 5.791 -1.931 -8.736 1.00 0.00 H new ATOM 0 HE1 MET A 422 8.605 0.171 -9.920 1.00 0.00 H new ATOM 0 HE2 MET A 422 8.101 -0.639 -8.417 1.00 0.00 H new ATOM 0 HE3 MET A 422 7.873 -1.450 -9.984 1.00 0.00 H new ATOM 667 N PRO A 423 1.074 -1.009 -10.771 1.00 0.00 N ATOM 668 CA PRO A 423 0.175 -0.826 -11.915 1.00 0.00 C ATOM 669 C PRO A 423 -0.622 0.471 -11.823 1.00 0.00 C ATOM 670 O PRO A 423 -0.684 1.243 -12.780 1.00 0.00 O ATOM 671 CB PRO A 423 -0.759 -2.035 -11.828 1.00 0.00 C ATOM 672 CG PRO A 423 0.032 -3.076 -11.115 1.00 0.00 C ATOM 673 CD PRO A 423 0.966 -2.358 -10.189 1.00 0.00 C ATOM 0 HA PRO A 423 0.720 -0.758 -12.856 1.00 0.00 H new ATOM 0 HB2 PRO A 423 -1.672 -1.791 -11.285 1.00 0.00 H new ATOM 0 HB3 PRO A 423 -1.059 -2.376 -12.819 1.00 0.00 H new ATOM 0 HG2 PRO A 423 -0.624 -3.745 -10.558 1.00 0.00 H new ATOM 0 HG3 PRO A 423 0.588 -3.691 -11.823 1.00 0.00 H new ATOM 0 HD2 PRO A 423 0.574 -2.324 -9.173 1.00 0.00 H new ATOM 0 HD3 PRO A 423 1.937 -2.851 -10.140 1.00 0.00 H new ATOM 681 N PHE A 424 -1.231 0.706 -10.664 1.00 0.00 N ATOM 682 CA PHE A 424 -2.024 1.910 -10.448 1.00 0.00 C ATOM 683 C PHE A 424 -1.158 3.160 -10.570 1.00 0.00 C ATOM 684 O PHE A 424 -1.630 4.215 -10.994 1.00 0.00 O ATOM 685 CB PHE A 424 -2.688 1.867 -9.070 1.00 0.00 C ATOM 686 CG PHE A 424 -3.721 0.785 -8.936 1.00 0.00 C ATOM 687 CD1 PHE A 424 -3.346 -0.519 -8.661 1.00 0.00 C ATOM 688 CD2 PHE A 424 -5.068 1.073 -9.083 1.00 0.00 C ATOM 689 CE1 PHE A 424 -4.295 -1.517 -8.538 1.00 0.00 C ATOM 690 CE2 PHE A 424 -6.022 0.081 -8.961 1.00 0.00 C ATOM 691 CZ PHE A 424 -5.634 -1.217 -8.686 1.00 0.00 C ATOM 0 H PHE A 424 -1.190 0.078 -9.861 1.00 0.00 H new ATOM 0 HA PHE A 424 -2.797 1.950 -11.215 1.00 0.00 H new ATOM 0 HB2 PHE A 424 -1.920 1.722 -8.310 1.00 0.00 H new ATOM 0 HB3 PHE A 424 -3.155 2.831 -8.870 1.00 0.00 H new ATOM 0 HD1 PHE A 424 -2.300 -0.760 -8.541 1.00 0.00 H new ATOM 0 HD2 PHE A 424 -5.376 2.086 -9.296 1.00 0.00 H new ATOM 0 HE1 PHE A 424 -3.989 -2.531 -8.326 1.00 0.00 H new ATOM 0 HE2 PHE A 424 -7.069 0.319 -9.080 1.00 0.00 H new ATOM 0 HZ PHE A 424 -6.377 -1.995 -8.587 1.00 0.00 H new ATOM 701 N GLY A 425 0.110 3.035 -10.194 1.00 0.00 N ATOM 702 CA GLY A 425 1.021 4.162 -10.267 1.00 0.00 C ATOM 703 C GLY A 425 2.385 3.844 -9.689 1.00 0.00 C ATOM 704 O GLY A 425 2.591 2.772 -9.121 1.00 0.00 O ATOM 0 H GLY A 425 0.523 2.173 -9.840 1.00 0.00 H new ATOM 0 HA2 GLY A 425 1.133 4.468 -11.307 1.00 0.00 H new ATOM 0 HA3 GLY A 425 0.591 5.008 -9.731 1.00 0.00 H new ATOM 708 N ASN A 426 3.321 4.777 -9.835 1.00 0.00 N ATOM 709 CA ASN A 426 4.674 4.588 -9.324 1.00 0.00 C ATOM 710 C ASN A 426 4.715 4.776 -7.811 1.00 0.00 C ATOM 711 O ASN A 426 4.894 5.889 -7.316 1.00 0.00 O ATOM 712 CB ASN A 426 5.636 5.570 -9.997 1.00 0.00 C ATOM 713 CG ASN A 426 6.208 5.023 -11.291 1.00 0.00 C ATOM 714 OD1 ASN A 426 6.872 3.986 -11.300 1.00 0.00 O ATOM 715 ND2 ASN A 426 5.952 5.720 -12.392 1.00 0.00 N ATOM 0 H ASN A 426 3.167 5.670 -10.302 1.00 0.00 H new ATOM 0 HA ASN A 426 4.984 3.569 -9.554 1.00 0.00 H new ATOM 0 HB2 ASN A 426 5.114 6.505 -10.200 1.00 0.00 H new ATOM 0 HB3 ASN A 426 6.451 5.803 -9.312 1.00 0.00 H new ATOM 0 HD21 ASN A 426 6.310 5.401 -13.292 1.00 0.00 H new ATOM 0 HD22 ASN A 426 5.397 6.574 -12.337 1.00 0.00 H new ATOM 722 N VAL A 427 4.548 3.679 -7.079 1.00 0.00 N ATOM 723 CA VAL A 427 4.568 3.720 -5.622 1.00 0.00 C ATOM 724 C VAL A 427 5.868 4.329 -5.107 1.00 0.00 C ATOM 725 O VAL A 427 6.958 3.912 -5.499 1.00 0.00 O ATOM 726 CB VAL A 427 4.396 2.315 -5.017 1.00 0.00 C ATOM 727 CG1 VAL A 427 4.587 2.355 -3.509 1.00 0.00 C ATOM 728 CG2 VAL A 427 3.033 1.744 -5.376 1.00 0.00 C ATOM 0 H VAL A 427 4.397 2.750 -7.472 1.00 0.00 H new ATOM 0 HA VAL A 427 3.730 4.344 -5.312 1.00 0.00 H new ATOM 0 HB VAL A 427 5.160 1.661 -5.438 1.00 0.00 H new ATOM 0 HG11 VAL A 427 4.462 1.353 -3.100 1.00 0.00 H new ATOM 0 HG12 VAL A 427 5.589 2.718 -3.279 1.00 0.00 H new ATOM 0 HG13 VAL A 427 3.848 3.023 -3.066 1.00 0.00 H new ATOM 0 HG21 VAL A 427 2.928 0.750 -4.940 1.00 0.00 H new ATOM 0 HG22 VAL A 427 2.251 2.396 -4.986 1.00 0.00 H new ATOM 0 HG23 VAL A 427 2.941 1.676 -6.460 1.00 0.00 H new ATOM 738 N VAL A 428 5.745 5.317 -4.227 1.00 0.00 N ATOM 739 CA VAL A 428 6.910 5.982 -3.656 1.00 0.00 C ATOM 740 C VAL A 428 7.615 5.085 -2.644 1.00 0.00 C ATOM 741 O VAL A 428 8.827 4.881 -2.717 1.00 0.00 O ATOM 742 CB VAL A 428 6.522 7.304 -2.970 1.00 0.00 C ATOM 743 CG1 VAL A 428 7.651 7.794 -2.076 1.00 0.00 C ATOM 744 CG2 VAL A 428 6.158 8.356 -4.007 1.00 0.00 C ATOM 0 H VAL A 428 4.850 5.675 -3.894 1.00 0.00 H new ATOM 0 HA VAL A 428 7.588 6.195 -4.482 1.00 0.00 H new ATOM 0 HB VAL A 428 5.647 7.125 -2.345 1.00 0.00 H new ATOM 0 HG11 VAL A 428 7.358 8.730 -1.600 1.00 0.00 H new ATOM 0 HG12 VAL A 428 7.859 7.047 -1.310 1.00 0.00 H new ATOM 0 HG13 VAL A 428 8.546 7.957 -2.677 1.00 0.00 H new ATOM 0 HG21 VAL A 428 5.886 9.284 -3.504 1.00 0.00 H new ATOM 0 HG22 VAL A 428 7.012 8.534 -4.660 1.00 0.00 H new ATOM 0 HG23 VAL A 428 5.314 8.005 -4.601 1.00 0.00 H new ATOM 754 N SER A 429 6.847 4.549 -1.701 1.00 0.00 N ATOM 755 CA SER A 429 7.397 3.676 -0.671 1.00 0.00 C ATOM 756 C SER A 429 6.409 2.571 -0.311 1.00 0.00 C ATOM 757 O SER A 429 5.228 2.830 -0.079 1.00 0.00 O ATOM 758 CB SER A 429 7.751 4.486 0.578 1.00 0.00 C ATOM 759 OG SER A 429 8.894 5.294 0.355 1.00 0.00 O ATOM 0 H SER A 429 5.841 4.704 -1.629 1.00 0.00 H new ATOM 0 HA SER A 429 8.303 3.215 -1.066 1.00 0.00 H new ATOM 0 HB2 SER A 429 6.906 5.115 0.859 1.00 0.00 H new ATOM 0 HB3 SER A 429 7.937 3.810 1.413 1.00 0.00 H new ATOM 0 HG SER A 429 9.658 4.724 0.126 1.00 0.00 H new ATOM 765 N ALA A 430 6.901 1.337 -0.265 1.00 0.00 N ATOM 766 CA ALA A 430 6.063 0.192 0.068 1.00 0.00 C ATOM 767 C ALA A 430 6.812 -0.797 0.954 1.00 0.00 C ATOM 768 O ALA A 430 7.937 -1.193 0.648 1.00 0.00 O ATOM 769 CB ALA A 430 5.579 -0.494 -1.201 1.00 0.00 C ATOM 0 H ALA A 430 7.876 1.105 -0.454 1.00 0.00 H new ATOM 0 HA ALA A 430 5.199 0.555 0.624 1.00 0.00 H new ATOM 0 HB1 ALA A 430 4.954 -1.347 -0.938 1.00 0.00 H new ATOM 0 HB2 ALA A 430 4.999 0.211 -1.797 1.00 0.00 H new ATOM 0 HB3 ALA A 430 6.437 -0.837 -1.779 1.00 0.00 H new ATOM 775 N LYS A 431 6.183 -1.193 2.056 1.00 0.00 N ATOM 776 CA LYS A 431 6.790 -2.136 2.987 1.00 0.00 C ATOM 777 C LYS A 431 5.728 -2.796 3.862 1.00 0.00 C ATOM 778 O LYS A 431 4.805 -2.136 4.339 1.00 0.00 O ATOM 779 CB LYS A 431 7.820 -1.424 3.866 1.00 0.00 C ATOM 780 CG LYS A 431 8.092 -2.135 5.181 1.00 0.00 C ATOM 781 CD LYS A 431 7.125 -1.689 6.266 1.00 0.00 C ATOM 782 CE LYS A 431 7.597 -2.123 7.646 1.00 0.00 C ATOM 783 NZ LYS A 431 8.554 -1.147 8.236 1.00 0.00 N ATOM 0 H LYS A 431 5.252 -0.875 2.326 1.00 0.00 H new ATOM 0 HA LYS A 431 7.291 -2.911 2.407 1.00 0.00 H new ATOM 0 HB2 LYS A 431 8.755 -1.330 3.313 1.00 0.00 H new ATOM 0 HB3 LYS A 431 7.470 -0.413 4.075 1.00 0.00 H new ATOM 0 HG2 LYS A 431 8.008 -3.212 5.038 1.00 0.00 H new ATOM 0 HG3 LYS A 431 9.115 -1.935 5.499 1.00 0.00 H new ATOM 0 HD2 LYS A 431 7.022 -0.604 6.240 1.00 0.00 H new ATOM 0 HD3 LYS A 431 6.138 -2.107 6.070 1.00 0.00 H new ATOM 0 HE2 LYS A 431 6.737 -2.233 8.306 1.00 0.00 H new ATOM 0 HE3 LYS A 431 8.072 -3.101 7.576 1.00 0.00 H new ATOM 0 HZ1 LYS A 431 8.852 -1.478 9.176 1.00 0.00 H new ATOM 0 HZ2 LYS A 431 9.387 -1.061 7.619 1.00 0.00 H new ATOM 0 HZ3 LYS A 431 8.092 -0.219 8.326 1.00 0.00 H new ATOM 797 N VAL A 432 5.866 -4.102 4.068 1.00 0.00 N ATOM 798 CA VAL A 432 4.920 -4.850 4.888 1.00 0.00 C ATOM 799 C VAL A 432 5.399 -4.944 6.332 1.00 0.00 C ATOM 800 O VAL A 432 6.599 -4.924 6.602 1.00 0.00 O ATOM 801 CB VAL A 432 4.703 -6.272 4.337 1.00 0.00 C ATOM 802 CG1 VAL A 432 3.836 -7.085 5.285 1.00 0.00 C ATOM 803 CG2 VAL A 432 4.083 -6.216 2.949 1.00 0.00 C ATOM 0 H VAL A 432 6.623 -4.664 3.679 1.00 0.00 H new ATOM 0 HA VAL A 432 3.975 -4.308 4.857 1.00 0.00 H new ATOM 0 HB VAL A 432 5.672 -6.764 4.257 1.00 0.00 H new ATOM 0 HG11 VAL A 432 3.694 -8.087 4.879 1.00 0.00 H new ATOM 0 HG12 VAL A 432 4.325 -7.153 6.257 1.00 0.00 H new ATOM 0 HG13 VAL A 432 2.867 -6.599 5.399 1.00 0.00 H new ATOM 0 HG21 VAL A 432 3.937 -7.229 2.575 1.00 0.00 H new ATOM 0 HG22 VAL A 432 3.121 -5.706 3.000 1.00 0.00 H new ATOM 0 HG23 VAL A 432 4.746 -5.673 2.276 1.00 0.00 H new ATOM 813 N PHE A 433 4.451 -5.046 7.258 1.00 0.00 N ATOM 814 CA PHE A 433 4.775 -5.143 8.676 1.00 0.00 C ATOM 815 C PHE A 433 5.123 -6.578 9.058 1.00 0.00 C ATOM 816 O PHE A 433 4.670 -7.529 8.419 1.00 0.00 O ATOM 817 CB PHE A 433 3.601 -4.647 9.524 1.00 0.00 C ATOM 818 CG PHE A 433 3.525 -3.152 9.627 1.00 0.00 C ATOM 819 CD1 PHE A 433 4.023 -2.348 8.614 1.00 0.00 C ATOM 820 CD2 PHE A 433 2.956 -2.548 10.738 1.00 0.00 C ATOM 821 CE1 PHE A 433 3.955 -0.970 8.706 1.00 0.00 C ATOM 822 CE2 PHE A 433 2.884 -1.171 10.834 1.00 0.00 C ATOM 823 CZ PHE A 433 3.385 -0.381 9.818 1.00 0.00 C ATOM 0 H PHE A 433 3.452 -5.064 7.051 1.00 0.00 H new ATOM 0 HA PHE A 433 5.644 -4.514 8.868 1.00 0.00 H new ATOM 0 HB2 PHE A 433 2.671 -5.021 9.096 1.00 0.00 H new ATOM 0 HB3 PHE A 433 3.684 -5.068 10.526 1.00 0.00 H new ATOM 0 HD1 PHE A 433 4.470 -2.803 7.742 1.00 0.00 H new ATOM 0 HD2 PHE A 433 2.565 -3.160 11.537 1.00 0.00 H new ATOM 0 HE1 PHE A 433 4.347 -0.355 7.909 1.00 0.00 H new ATOM 0 HE2 PHE A 433 2.436 -0.713 11.703 1.00 0.00 H new ATOM 0 HZ PHE A 433 3.331 0.695 9.893 1.00 0.00 H new ATOM 983 N CYS A 443 -0.397 -9.544 7.892 1.00 0.00 N ATOM 984 CA CYS A 443 -1.462 -9.470 6.897 1.00 0.00 C ATOM 985 C CYS A 443 -1.825 -8.019 6.598 1.00 0.00 C ATOM 986 O CYS A 443 -2.973 -7.709 6.283 1.00 0.00 O ATOM 987 CB CYS A 443 -2.697 -10.227 7.385 1.00 0.00 C ATOM 988 SG CYS A 443 -3.295 -9.698 9.008 1.00 0.00 S ATOM 0 HA CYS A 443 -1.101 -9.933 5.978 1.00 0.00 H new ATOM 0 HB2 CYS A 443 -3.498 -10.102 6.656 1.00 0.00 H new ATOM 0 HB3 CYS A 443 -2.465 -11.291 7.424 1.00 0.00 H new ATOM 0 HG CYS A 443 -2.786 -8.538 9.301 1.00 0.00 H new ATOM 994 N PHE A 444 -0.839 -7.134 6.701 1.00 0.00 N ATOM 995 CA PHE A 444 -1.054 -5.715 6.444 1.00 0.00 C ATOM 996 C PHE A 444 0.270 -5.000 6.197 1.00 0.00 C ATOM 997 O PHE A 444 1.278 -5.297 6.838 1.00 0.00 O ATOM 998 CB PHE A 444 -1.786 -5.067 7.622 1.00 0.00 C ATOM 999 CG PHE A 444 -1.175 -5.388 8.957 1.00 0.00 C ATOM 1000 CD1 PHE A 444 0.057 -4.863 9.313 1.00 0.00 C ATOM 1001 CD2 PHE A 444 -1.832 -6.214 9.853 1.00 0.00 C ATOM 1002 CE1 PHE A 444 0.621 -5.157 10.540 1.00 0.00 C ATOM 1003 CE2 PHE A 444 -1.273 -6.511 11.082 1.00 0.00 C ATOM 1004 CZ PHE A 444 -0.045 -5.981 11.426 1.00 0.00 C ATOM 0 H PHE A 444 0.117 -7.375 6.961 1.00 0.00 H new ATOM 0 HA PHE A 444 -1.668 -5.622 5.548 1.00 0.00 H new ATOM 0 HB2 PHE A 444 -1.793 -3.986 7.485 1.00 0.00 H new ATOM 0 HB3 PHE A 444 -2.825 -5.395 7.619 1.00 0.00 H new ATOM 0 HD1 PHE A 444 0.582 -4.217 8.624 1.00 0.00 H new ATOM 0 HD2 PHE A 444 -2.792 -6.631 9.589 1.00 0.00 H new ATOM 0 HE1 PHE A 444 1.582 -4.743 10.806 1.00 0.00 H new ATOM 0 HE2 PHE A 444 -1.796 -7.157 11.772 1.00 0.00 H new ATOM 0 HZ PHE A 444 0.394 -6.210 12.386 1.00 0.00 H new ATOM 1014 N GLY A 445 0.260 -4.054 5.262 1.00 0.00 N ATOM 1015 CA GLY A 445 1.466 -3.311 4.945 1.00 0.00 C ATOM 1016 C GLY A 445 1.196 -1.836 4.721 1.00 0.00 C ATOM 1017 O GLY A 445 0.053 -1.388 4.801 1.00 0.00 O ATOM 0 H GLY A 445 -0.562 -3.789 4.719 1.00 0.00 H new ATOM 0 HA2 GLY A 445 2.184 -3.427 5.757 1.00 0.00 H new ATOM 0 HA3 GLY A 445 1.925 -3.733 4.051 1.00 0.00 H new ATOM 1021 N PHE A 446 2.252 -1.079 4.444 1.00 0.00 N ATOM 1022 CA PHE A 446 2.124 0.354 4.210 1.00 0.00 C ATOM 1023 C PHE A 446 2.555 0.716 2.792 1.00 0.00 C ATOM 1024 O PHE A 446 3.409 0.052 2.203 1.00 0.00 O ATOM 1025 CB PHE A 446 2.963 1.135 5.225 1.00 0.00 C ATOM 1026 CG PHE A 446 2.966 2.618 4.986 1.00 0.00 C ATOM 1027 CD1 PHE A 446 1.775 3.314 4.851 1.00 0.00 C ATOM 1028 CD2 PHE A 446 4.159 3.317 4.898 1.00 0.00 C ATOM 1029 CE1 PHE A 446 1.775 4.678 4.630 1.00 0.00 C ATOM 1030 CE2 PHE A 446 4.166 4.681 4.677 1.00 0.00 C ATOM 1031 CZ PHE A 446 2.971 5.362 4.545 1.00 0.00 C ATOM 0 H PHE A 446 3.206 -1.434 4.376 1.00 0.00 H new ATOM 0 HA PHE A 446 1.075 0.623 4.331 1.00 0.00 H new ATOM 0 HB2 PHE A 446 2.583 0.937 6.227 1.00 0.00 H new ATOM 0 HB3 PHE A 446 3.989 0.768 5.195 1.00 0.00 H new ATOM 0 HD1 PHE A 446 0.836 2.784 4.919 1.00 0.00 H new ATOM 0 HD2 PHE A 446 5.095 2.789 5.003 1.00 0.00 H new ATOM 0 HE1 PHE A 446 0.840 5.208 4.524 1.00 0.00 H new ATOM 0 HE2 PHE A 446 5.103 5.213 4.608 1.00 0.00 H new ATOM 0 HZ PHE A 446 2.973 6.429 4.375 1.00 0.00 H new ATOM 1041 N VAL A 447 1.957 1.772 2.248 1.00 0.00 N ATOM 1042 CA VAL A 447 2.279 2.223 0.900 1.00 0.00 C ATOM 1043 C VAL A 447 1.966 3.704 0.727 1.00 0.00 C ATOM 1044 O VAL A 447 0.996 4.214 1.287 1.00 0.00 O ATOM 1045 CB VAL A 447 1.504 1.417 -0.160 1.00 0.00 C ATOM 1046 CG1 VAL A 447 1.779 1.964 -1.552 1.00 0.00 C ATOM 1047 CG2 VAL A 447 1.864 -0.058 -0.077 1.00 0.00 C ATOM 0 H VAL A 447 1.247 2.331 2.721 1.00 0.00 H new ATOM 0 HA VAL A 447 3.348 2.063 0.758 1.00 0.00 H new ATOM 0 HB VAL A 447 0.437 1.518 0.040 1.00 0.00 H new ATOM 0 HG11 VAL A 447 1.223 1.383 -2.288 1.00 0.00 H new ATOM 0 HG12 VAL A 447 1.465 3.007 -1.602 1.00 0.00 H new ATOM 0 HG13 VAL A 447 2.846 1.895 -1.766 1.00 0.00 H new ATOM 0 HG21 VAL A 447 1.307 -0.612 -0.833 1.00 0.00 H new ATOM 0 HG22 VAL A 447 2.933 -0.182 -0.250 1.00 0.00 H new ATOM 0 HG23 VAL A 447 1.610 -0.439 0.912 1.00 0.00 H new ATOM 1057 N SER A 448 2.793 4.390 -0.055 1.00 0.00 N ATOM 1058 CA SER A 448 2.606 5.816 -0.301 1.00 0.00 C ATOM 1059 C SER A 448 2.891 6.157 -1.761 1.00 0.00 C ATOM 1060 O SER A 448 3.755 5.551 -2.394 1.00 0.00 O ATOM 1061 CB SER A 448 3.517 6.637 0.614 1.00 0.00 C ATOM 1062 OG SER A 448 4.861 6.596 0.165 1.00 0.00 O ATOM 0 H SER A 448 3.599 3.982 -0.529 1.00 0.00 H new ATOM 0 HA SER A 448 1.567 6.064 -0.084 1.00 0.00 H new ATOM 0 HB2 SER A 448 3.172 7.670 0.644 1.00 0.00 H new ATOM 0 HB3 SER A 448 3.458 6.252 1.632 1.00 0.00 H new ATOM 0 HG SER A 448 5.115 7.474 -0.188 1.00 0.00 H new ATOM 1068 N TYR A 449 2.158 7.133 -2.287 1.00 0.00 N ATOM 1069 CA TYR A 449 2.330 7.554 -3.673 1.00 0.00 C ATOM 1070 C TYR A 449 2.918 8.960 -3.745 1.00 0.00 C ATOM 1071 O TYR A 449 3.092 9.626 -2.724 1.00 0.00 O ATOM 1072 CB TYR A 449 0.991 7.510 -4.411 1.00 0.00 C ATOM 1073 CG TYR A 449 0.597 6.124 -4.868 1.00 0.00 C ATOM 1074 CD1 TYR A 449 0.689 5.035 -4.009 1.00 0.00 C ATOM 1075 CD2 TYR A 449 0.134 5.902 -6.159 1.00 0.00 C ATOM 1076 CE1 TYR A 449 0.330 3.767 -4.422 1.00 0.00 C ATOM 1077 CE2 TYR A 449 -0.228 4.638 -6.581 1.00 0.00 C ATOM 1078 CZ TYR A 449 -0.127 3.573 -5.708 1.00 0.00 C ATOM 1079 OH TYR A 449 -0.485 2.311 -6.125 1.00 0.00 O ATOM 0 H TYR A 449 1.440 7.647 -1.776 1.00 0.00 H new ATOM 0 HA TYR A 449 3.024 6.864 -4.153 1.00 0.00 H new ATOM 0 HB2 TYR A 449 0.212 7.903 -3.757 1.00 0.00 H new ATOM 0 HB3 TYR A 449 1.042 8.169 -5.278 1.00 0.00 H new ATOM 0 HD1 TYR A 449 1.047 5.183 -3.001 1.00 0.00 H new ATOM 0 HD2 TYR A 449 0.056 6.733 -6.845 1.00 0.00 H new ATOM 0 HE1 TYR A 449 0.407 2.932 -3.741 1.00 0.00 H new ATOM 0 HE2 TYR A 449 -0.588 4.483 -7.587 1.00 0.00 H new ATOM 0 HH TYR A 449 0.077 2.045 -6.882 1.00 0.00 H new ATOM 1089 N ASP A 450 3.221 9.406 -4.959 1.00 0.00 N ATOM 1090 CA ASP A 450 3.787 10.733 -5.168 1.00 0.00 C ATOM 1091 C ASP A 450 2.739 11.815 -4.926 1.00 0.00 C ATOM 1092 O ASP A 450 3.073 12.980 -4.717 1.00 0.00 O ATOM 1093 CB ASP A 450 4.347 10.855 -6.586 1.00 0.00 C ATOM 1094 CG ASP A 450 4.369 12.289 -7.078 1.00 0.00 C ATOM 1095 OD1 ASP A 450 5.377 12.984 -6.836 1.00 0.00 O ATOM 1096 OD2 ASP A 450 3.377 12.714 -7.707 1.00 0.00 O ATOM 0 H ASP A 450 3.084 8.867 -5.814 1.00 0.00 H new ATOM 0 HA ASP A 450 4.598 10.872 -4.453 1.00 0.00 H new ATOM 0 HB2 ASP A 450 5.359 10.450 -6.610 1.00 0.00 H new ATOM 0 HB3 ASP A 450 3.745 10.250 -7.264 1.00 0.00 H new ATOM 1101 N ASN A 451 1.470 11.420 -4.959 1.00 0.00 N ATOM 1102 CA ASN A 451 0.373 12.357 -4.746 1.00 0.00 C ATOM 1103 C ASN A 451 -0.843 11.646 -4.159 1.00 0.00 C ATOM 1104 O ASN A 451 -1.030 10.440 -4.327 1.00 0.00 O ATOM 1105 CB ASN A 451 -0.007 13.038 -6.061 1.00 0.00 C ATOM 1106 CG ASN A 451 -0.093 12.059 -7.216 1.00 0.00 C ATOM 1107 OD1 ASN A 451 0.551 11.010 -7.203 1.00 0.00 O ATOM 1108 ND2 ASN A 451 -0.889 12.400 -8.222 1.00 0.00 N ATOM 0 H ASN A 451 1.176 10.458 -5.131 1.00 0.00 H new ATOM 0 HA ASN A 451 0.708 13.114 -4.037 1.00 0.00 H new ATOM 0 HB2 ASN A 451 -0.967 13.541 -5.942 1.00 0.00 H new ATOM 0 HB3 ASN A 451 0.729 13.807 -6.294 1.00 0.00 H new ATOM 0 HD21 ASN A 451 -0.986 11.782 -9.028 1.00 0.00 H new ATOM 0 HD22 ASN A 451 -1.404 13.280 -8.189 1.00 0.00 H new ATOM 1115 N PRO A 452 -1.691 12.409 -3.453 1.00 0.00 N ATOM 1116 CA PRO A 452 -2.904 11.873 -2.828 1.00 0.00 C ATOM 1117 C PRO A 452 -4.010 11.607 -3.843 1.00 0.00 C ATOM 1118 O PRO A 452 -4.982 10.910 -3.550 1.00 0.00 O ATOM 1119 CB PRO A 452 -3.323 12.982 -1.859 1.00 0.00 C ATOM 1120 CG PRO A 452 -2.788 14.235 -2.463 1.00 0.00 C ATOM 1121 CD PRO A 452 -1.532 13.852 -3.212 1.00 0.00 C ATOM 0 HA PRO A 452 -2.724 10.912 -2.346 1.00 0.00 H new ATOM 0 HB2 PRO A 452 -4.407 13.026 -1.752 1.00 0.00 H new ATOM 0 HB3 PRO A 452 -2.911 12.815 -0.864 1.00 0.00 H new ATOM 0 HG2 PRO A 452 -3.519 14.683 -3.136 1.00 0.00 H new ATOM 0 HG3 PRO A 452 -2.569 14.974 -1.692 1.00 0.00 H new ATOM 0 HD2 PRO A 452 -1.439 14.405 -4.146 1.00 0.00 H new ATOM 0 HD3 PRO A 452 -0.637 14.063 -2.626 1.00 0.00 H new ATOM 1129 N VAL A 453 -3.856 12.166 -5.039 1.00 0.00 N ATOM 1130 CA VAL A 453 -4.842 11.989 -6.100 1.00 0.00 C ATOM 1131 C VAL A 453 -4.701 10.619 -6.755 1.00 0.00 C ATOM 1132 O VAL A 453 -5.695 9.982 -7.106 1.00 0.00 O ATOM 1133 CB VAL A 453 -4.709 13.079 -7.179 1.00 0.00 C ATOM 1134 CG1 VAL A 453 -5.702 12.839 -8.306 1.00 0.00 C ATOM 1135 CG2 VAL A 453 -4.905 14.458 -6.568 1.00 0.00 C ATOM 0 H VAL A 453 -3.058 12.746 -5.298 1.00 0.00 H new ATOM 0 HA VAL A 453 -5.825 12.068 -5.636 1.00 0.00 H new ATOM 0 HB VAL A 453 -3.704 13.032 -7.598 1.00 0.00 H new ATOM 0 HG11 VAL A 453 -5.593 13.619 -9.059 1.00 0.00 H new ATOM 0 HG12 VAL A 453 -5.509 11.867 -8.760 1.00 0.00 H new ATOM 0 HG13 VAL A 453 -6.716 12.858 -7.907 1.00 0.00 H new ATOM 0 HG21 VAL A 453 -4.808 15.217 -7.344 1.00 0.00 H new ATOM 0 HG22 VAL A 453 -5.897 14.520 -6.122 1.00 0.00 H new ATOM 0 HG23 VAL A 453 -4.150 14.626 -5.800 1.00 0.00 H new ATOM 1145 N SER A 454 -3.460 10.172 -6.918 1.00 0.00 N ATOM 1146 CA SER A 454 -3.189 8.880 -7.537 1.00 0.00 C ATOM 1147 C SER A 454 -3.383 7.747 -6.532 1.00 0.00 C ATOM 1148 O SER A 454 -3.845 6.662 -6.886 1.00 0.00 O ATOM 1149 CB SER A 454 -1.764 8.845 -8.093 1.00 0.00 C ATOM 1150 OG SER A 454 -1.665 7.947 -9.185 1.00 0.00 O ATOM 0 H SER A 454 -2.627 10.685 -6.630 1.00 0.00 H new ATOM 0 HA SER A 454 -3.894 8.742 -8.357 1.00 0.00 H new ATOM 0 HB2 SER A 454 -1.470 9.845 -8.412 1.00 0.00 H new ATOM 0 HB3 SER A 454 -1.071 8.545 -7.307 1.00 0.00 H new ATOM 0 HG SER A 454 -0.745 7.944 -9.524 1.00 0.00 H new ATOM 1156 N ALA A 455 -3.025 8.007 -5.279 1.00 0.00 N ATOM 1157 CA ALA A 455 -3.160 7.012 -4.224 1.00 0.00 C ATOM 1158 C ALA A 455 -4.599 6.518 -4.115 1.00 0.00 C ATOM 1159 O ALA A 455 -4.843 5.331 -3.904 1.00 0.00 O ATOM 1160 CB ALA A 455 -2.696 7.587 -2.893 1.00 0.00 C ATOM 0 H ALA A 455 -2.639 8.899 -4.970 1.00 0.00 H new ATOM 0 HA ALA A 455 -2.529 6.161 -4.480 1.00 0.00 H new ATOM 0 HB1 ALA A 455 -2.803 6.832 -2.114 1.00 0.00 H new ATOM 0 HB2 ALA A 455 -1.650 7.884 -2.970 1.00 0.00 H new ATOM 0 HB3 ALA A 455 -3.303 8.457 -2.641 1.00 0.00 H new ATOM 1166 N GLN A 456 -5.548 7.438 -4.262 1.00 0.00 N ATOM 1167 CA GLN A 456 -6.962 7.095 -4.178 1.00 0.00 C ATOM 1168 C GLN A 456 -7.349 6.107 -5.275 1.00 0.00 C ATOM 1169 O GLN A 456 -8.084 5.152 -5.032 1.00 0.00 O ATOM 1170 CB GLN A 456 -7.822 8.356 -4.286 1.00 0.00 C ATOM 1171 CG GLN A 456 -8.027 9.067 -2.958 1.00 0.00 C ATOM 1172 CD GLN A 456 -8.842 8.248 -1.977 1.00 0.00 C ATOM 1173 OE1 GLN A 456 -8.159 7.488 -1.128 1.00 0.00 O flip ATOM 1174 NE2 GLN A 456 -10.072 8.296 -1.982 1.00 0.00 N flip ATOM 0 H GLN A 456 -5.363 8.425 -4.440 1.00 0.00 H new ATOM 0 HA GLN A 456 -7.139 6.624 -3.211 1.00 0.00 H new ATOM 0 HB2 GLN A 456 -7.355 9.045 -4.990 1.00 0.00 H new ATOM 0 HB3 GLN A 456 -8.794 8.088 -4.700 1.00 0.00 H new ATOM 0 HG2 GLN A 456 -7.056 9.293 -2.518 1.00 0.00 H new ATOM 0 HG3 GLN A 456 -8.527 10.019 -3.134 1.00 0.00 H new ATOM 0 HE21 GLN A 456 -10.556 8.894 -2.652 1.00 0.00 H new ATOM 0 HE22 GLN A 456 -10.607 7.738 -1.316 1.00 0.00 H new ATOM 1183 N ALA A 457 -6.849 6.347 -6.483 1.00 0.00 N ATOM 1184 CA ALA A 457 -7.139 5.478 -7.616 1.00 0.00 C ATOM 1185 C ALA A 457 -7.067 4.009 -7.215 1.00 0.00 C ATOM 1186 O ALA A 457 -7.923 3.209 -7.591 1.00 0.00 O ATOM 1187 CB ALA A 457 -6.178 5.763 -8.761 1.00 0.00 C ATOM 0 H ALA A 457 -6.241 7.136 -6.702 1.00 0.00 H new ATOM 0 HA ALA A 457 -8.155 5.686 -7.950 1.00 0.00 H new ATOM 0 HB1 ALA A 457 -6.407 5.106 -9.600 1.00 0.00 H new ATOM 0 HB2 ALA A 457 -6.283 6.802 -9.074 1.00 0.00 H new ATOM 0 HB3 ALA A 457 -5.155 5.585 -8.430 1.00 0.00 H new ATOM 1193 N ALA A 458 -6.038 3.659 -6.449 1.00 0.00 N ATOM 1194 CA ALA A 458 -5.855 2.287 -5.995 1.00 0.00 C ATOM 1195 C ALA A 458 -6.996 1.853 -5.080 1.00 0.00 C ATOM 1196 O ALA A 458 -7.827 1.027 -5.459 1.00 0.00 O ATOM 1197 CB ALA A 458 -4.519 2.141 -5.281 1.00 0.00 C ATOM 0 H ALA A 458 -5.319 4.308 -6.130 1.00 0.00 H new ATOM 0 HA ALA A 458 -5.860 1.638 -6.871 1.00 0.00 H new ATOM 0 HB1 ALA A 458 -4.396 1.111 -4.947 1.00 0.00 H new ATOM 0 HB2 ALA A 458 -3.711 2.400 -5.965 1.00 0.00 H new ATOM 0 HB3 ALA A 458 -4.492 2.807 -4.419 1.00 0.00 H new ATOM 1203 N ILE A 459 -7.028 2.416 -3.878 1.00 0.00 N ATOM 1204 CA ILE A 459 -8.069 2.087 -2.910 1.00 0.00 C ATOM 1205 C ILE A 459 -9.434 1.992 -3.581 1.00 0.00 C ATOM 1206 O ILE A 459 -10.199 1.063 -3.323 1.00 0.00 O ATOM 1207 CB ILE A 459 -8.135 3.131 -1.779 1.00 0.00 C ATOM 1208 CG1 ILE A 459 -6.831 3.135 -0.980 1.00 0.00 C ATOM 1209 CG2 ILE A 459 -9.321 2.849 -0.869 1.00 0.00 C ATOM 1210 CD1 ILE A 459 -6.670 4.348 -0.092 1.00 0.00 C ATOM 0 H ILE A 459 -6.347 3.101 -3.550 1.00 0.00 H new ATOM 0 HA ILE A 459 -7.810 1.118 -2.484 1.00 0.00 H new ATOM 0 HB ILE A 459 -8.268 4.118 -2.222 1.00 0.00 H new ATOM 0 HG12 ILE A 459 -6.789 2.236 -0.365 1.00 0.00 H new ATOM 0 HG13 ILE A 459 -5.990 3.087 -1.672 1.00 0.00 H new ATOM 0 HG21 ILE A 459 -9.355 3.594 -0.074 1.00 0.00 H new ATOM 0 HG22 ILE A 459 -10.243 2.894 -1.449 1.00 0.00 H new ATOM 0 HG23 ILE A 459 -9.216 1.856 -0.431 1.00 0.00 H new ATOM 0 HD11 ILE A 459 -5.723 4.283 0.444 1.00 0.00 H new ATOM 0 HD12 ILE A 459 -6.680 5.250 -0.703 1.00 0.00 H new ATOM 0 HD13 ILE A 459 -7.491 4.386 0.624 1.00 0.00 H new ATOM 1222 N GLN A 460 -9.732 2.958 -4.444 1.00 0.00 N ATOM 1223 CA GLN A 460 -11.005 2.983 -5.153 1.00 0.00 C ATOM 1224 C GLN A 460 -11.417 1.578 -5.581 1.00 0.00 C ATOM 1225 O GLN A 460 -12.561 1.169 -5.382 1.00 0.00 O ATOM 1226 CB GLN A 460 -10.914 3.895 -6.379 1.00 0.00 C ATOM 1227 CG GLN A 460 -11.073 5.371 -6.051 1.00 0.00 C ATOM 1228 CD GLN A 460 -11.278 6.223 -7.287 1.00 0.00 C ATOM 1229 OE1 GLN A 460 -11.121 5.751 -8.415 1.00 0.00 O ATOM 1230 NE2 GLN A 460 -11.630 7.487 -7.084 1.00 0.00 N ATOM 0 H GLN A 460 -9.109 3.734 -4.669 1.00 0.00 H new ATOM 0 HA GLN A 460 -11.762 3.374 -4.473 1.00 0.00 H new ATOM 0 HB2 GLN A 460 -9.951 3.741 -6.866 1.00 0.00 H new ATOM 0 HB3 GLN A 460 -11.683 3.605 -7.095 1.00 0.00 H new ATOM 0 HG2 GLN A 460 -11.922 5.501 -5.380 1.00 0.00 H new ATOM 0 HG3 GLN A 460 -10.188 5.718 -5.517 1.00 0.00 H new ATOM 0 HE21 GLN A 460 -11.749 7.837 -6.133 1.00 0.00 H new ATOM 0 HE22 GLN A 460 -11.781 8.108 -7.879 1.00 0.00 H new ATOM 1239 N SER A 461 -10.478 0.843 -6.169 1.00 0.00 N ATOM 1240 CA SER A 461 -10.744 -0.514 -6.628 1.00 0.00 C ATOM 1241 C SER A 461 -10.271 -1.538 -5.600 1.00 0.00 C ATOM 1242 O SER A 461 -11.039 -2.395 -5.163 1.00 0.00 O ATOM 1243 CB SER A 461 -10.055 -0.766 -7.970 1.00 0.00 C ATOM 1244 OG SER A 461 -10.889 -0.385 -9.051 1.00 0.00 O ATOM 0 H SER A 461 -9.525 1.166 -6.338 1.00 0.00 H new ATOM 0 HA SER A 461 -11.821 -0.623 -6.755 1.00 0.00 H new ATOM 0 HB2 SER A 461 -9.120 -0.207 -8.013 1.00 0.00 H new ATOM 0 HB3 SER A 461 -9.799 -1.822 -8.058 1.00 0.00 H new ATOM 0 HG SER A 461 -10.425 -0.554 -9.898 1.00 0.00 H new ATOM 1250 N MET A 462 -9.002 -1.441 -5.219 1.00 0.00 N ATOM 1251 CA MET A 462 -8.425 -2.357 -4.242 1.00 0.00 C ATOM 1252 C MET A 462 -9.370 -2.557 -3.061 1.00 0.00 C ATOM 1253 O MET A 462 -9.763 -3.681 -2.752 1.00 0.00 O ATOM 1254 CB MET A 462 -7.077 -1.829 -3.748 1.00 0.00 C ATOM 1255 CG MET A 462 -6.060 -1.628 -4.859 1.00 0.00 C ATOM 1256 SD MET A 462 -5.986 -3.028 -5.995 1.00 0.00 S ATOM 1257 CE MET A 462 -5.370 -4.312 -4.910 1.00 0.00 C ATOM 0 H MET A 462 -8.353 -0.737 -5.572 1.00 0.00 H new ATOM 0 HA MET A 462 -8.272 -3.320 -4.730 1.00 0.00 H new ATOM 0 HB2 MET A 462 -7.234 -0.881 -3.234 1.00 0.00 H new ATOM 0 HB3 MET A 462 -6.670 -2.525 -3.015 1.00 0.00 H new ATOM 0 HG2 MET A 462 -6.310 -0.725 -5.417 1.00 0.00 H new ATOM 0 HG3 MET A 462 -5.075 -1.469 -4.420 1.00 0.00 H new ATOM 0 HE1 MET A 462 -5.203 -5.224 -5.484 1.00 0.00 H new ATOM 0 HE2 MET A 462 -4.431 -3.989 -4.460 1.00 0.00 H new ATOM 0 HE3 MET A 462 -6.101 -4.506 -4.125 1.00 0.00 H new ATOM 1267 N ASN A 463 -9.729 -1.459 -2.404 1.00 0.00 N ATOM 1268 CA ASN A 463 -10.626 -1.514 -1.255 1.00 0.00 C ATOM 1269 C ASN A 463 -11.689 -2.591 -1.448 1.00 0.00 C ATOM 1270 O ASN A 463 -12.684 -2.380 -2.139 1.00 0.00 O ATOM 1271 CB ASN A 463 -11.294 -0.156 -1.038 1.00 0.00 C ATOM 1272 CG ASN A 463 -11.985 -0.060 0.308 1.00 0.00 C ATOM 1273 OD1 ASN A 463 -13.159 0.303 0.392 1.00 0.00 O ATOM 1274 ND2 ASN A 463 -11.258 -0.383 1.371 1.00 0.00 N ATOM 0 H ASN A 463 -9.413 -0.520 -2.647 1.00 0.00 H new ATOM 0 HA ASN A 463 -10.034 -1.765 -0.374 1.00 0.00 H new ATOM 0 HB2 ASN A 463 -10.544 0.631 -1.115 1.00 0.00 H new ATOM 0 HB3 ASN A 463 -12.022 0.018 -1.830 1.00 0.00 H new ATOM 0 HD21 ASN A 463 -11.669 -0.336 2.303 1.00 0.00 H new ATOM 0 HD22 ASN A 463 -10.289 -0.679 1.255 1.00 0.00 H new ATOM 1281 N GLY A 464 -11.471 -3.748 -0.830 1.00 0.00 N ATOM 1282 CA GLY A 464 -12.418 -4.842 -0.945 1.00 0.00 C ATOM 1283 C GLY A 464 -12.109 -5.757 -2.113 1.00 0.00 C ATOM 1284 O GLY A 464 -13.013 -6.340 -2.710 1.00 0.00 O ATOM 0 H GLY A 464 -10.655 -3.947 -0.251 1.00 0.00 H new ATOM 0 HA2 GLY A 464 -12.412 -5.422 -0.022 1.00 0.00 H new ATOM 0 HA3 GLY A 464 -13.423 -4.437 -1.061 1.00 0.00 H new ATOM 1288 N PHE A 465 -10.828 -5.882 -2.441 1.00 0.00 N ATOM 1289 CA PHE A 465 -10.400 -6.731 -3.547 1.00 0.00 C ATOM 1290 C PHE A 465 -10.445 -8.204 -3.151 1.00 0.00 C ATOM 1291 O PHE A 465 -9.712 -8.640 -2.263 1.00 0.00 O ATOM 1292 CB PHE A 465 -8.986 -6.353 -3.992 1.00 0.00 C ATOM 1293 CG PHE A 465 -8.431 -7.257 -5.055 1.00 0.00 C ATOM 1294 CD1 PHE A 465 -7.807 -8.446 -4.714 1.00 0.00 C ATOM 1295 CD2 PHE A 465 -8.532 -6.917 -6.394 1.00 0.00 C ATOM 1296 CE1 PHE A 465 -7.295 -9.281 -5.690 1.00 0.00 C ATOM 1297 CE2 PHE A 465 -8.021 -7.747 -7.374 1.00 0.00 C ATOM 1298 CZ PHE A 465 -7.401 -8.930 -7.021 1.00 0.00 C ATOM 0 H PHE A 465 -10.067 -5.406 -1.956 1.00 0.00 H new ATOM 0 HA PHE A 465 -11.088 -6.575 -4.378 1.00 0.00 H new ATOM 0 HB2 PHE A 465 -8.992 -5.329 -4.364 1.00 0.00 H new ATOM 0 HB3 PHE A 465 -8.324 -6.373 -3.127 1.00 0.00 H new ATOM 0 HD1 PHE A 465 -7.719 -8.724 -3.674 1.00 0.00 H new ATOM 0 HD2 PHE A 465 -9.015 -5.993 -6.675 1.00 0.00 H new ATOM 0 HE1 PHE A 465 -6.813 -10.206 -5.412 1.00 0.00 H new ATOM 0 HE2 PHE A 465 -8.106 -7.471 -8.415 1.00 0.00 H new ATOM 0 HZ PHE A 465 -7.000 -9.579 -7.785 1.00 0.00 H new ATOM 1308 N GLN A 466 -11.310 -8.964 -3.816 1.00 0.00 N ATOM 1309 CA GLN A 466 -11.450 -10.387 -3.531 1.00 0.00 C ATOM 1310 C GLN A 466 -10.158 -11.134 -3.844 1.00 0.00 C ATOM 1311 O GLN A 466 -9.846 -11.397 -5.006 1.00 0.00 O ATOM 1312 CB GLN A 466 -12.604 -10.979 -4.343 1.00 0.00 C ATOM 1313 CG GLN A 466 -13.040 -12.355 -3.866 1.00 0.00 C ATOM 1314 CD GLN A 466 -13.861 -12.299 -2.593 1.00 0.00 C ATOM 1315 OE1 GLN A 466 -14.713 -11.425 -2.429 1.00 0.00 O ATOM 1316 NE2 GLN A 466 -13.609 -13.232 -1.684 1.00 0.00 N ATOM 0 H GLN A 466 -11.923 -8.619 -4.554 1.00 0.00 H new ATOM 0 HA GLN A 466 -11.666 -10.500 -2.469 1.00 0.00 H new ATOM 0 HB2 GLN A 466 -13.456 -10.301 -4.296 1.00 0.00 H new ATOM 0 HB3 GLN A 466 -12.305 -11.044 -5.389 1.00 0.00 H new ATOM 0 HG2 GLN A 466 -13.624 -12.839 -4.649 1.00 0.00 H new ATOM 0 HG3 GLN A 466 -12.158 -12.973 -3.698 1.00 0.00 H new ATOM 0 HE21 GLN A 466 -12.894 -13.937 -1.862 1.00 0.00 H new ATOM 0 HE22 GLN A 466 -14.130 -13.244 -0.807 1.00 0.00 H new ATOM 1325 N ILE A 467 -9.410 -11.475 -2.800 1.00 0.00 N ATOM 1326 CA ILE A 467 -8.152 -12.194 -2.963 1.00 0.00 C ATOM 1327 C ILE A 467 -8.237 -13.594 -2.365 1.00 0.00 C ATOM 1328 O ILE A 467 -8.803 -13.788 -1.290 1.00 0.00 O ATOM 1329 CB ILE A 467 -6.983 -11.437 -2.307 1.00 0.00 C ATOM 1330 CG1 ILE A 467 -5.657 -12.134 -2.617 1.00 0.00 C ATOM 1331 CG2 ILE A 467 -7.195 -11.335 -0.804 1.00 0.00 C ATOM 1332 CD1 ILE A 467 -4.443 -11.273 -2.346 1.00 0.00 C ATOM 0 H ILE A 467 -9.653 -11.265 -1.832 1.00 0.00 H new ATOM 0 HA ILE A 467 -7.969 -12.271 -4.035 1.00 0.00 H new ATOM 0 HB ILE A 467 -6.946 -10.428 -2.719 1.00 0.00 H new ATOM 0 HG12 ILE A 467 -5.587 -13.044 -2.022 1.00 0.00 H new ATOM 0 HG13 ILE A 467 -5.651 -12.437 -3.664 1.00 0.00 H new ATOM 0 HG21 ILE A 467 -6.360 -10.797 -0.354 1.00 0.00 H new ATOM 0 HG22 ILE A 467 -8.122 -10.799 -0.603 1.00 0.00 H new ATOM 0 HG23 ILE A 467 -7.254 -12.336 -0.376 1.00 0.00 H new ATOM 0 HD11 ILE A 467 -3.539 -11.832 -2.588 1.00 0.00 H new ATOM 0 HD12 ILE A 467 -4.490 -10.374 -2.961 1.00 0.00 H new ATOM 0 HD13 ILE A 467 -4.424 -10.992 -1.293 1.00 0.00 H new ATOM 1344 N GLY A 468 -7.668 -14.567 -3.068 1.00 0.00 N ATOM 1345 CA GLY A 468 -7.688 -15.937 -2.591 1.00 0.00 C ATOM 1346 C GLY A 468 -9.069 -16.375 -2.146 1.00 0.00 C ATOM 1347 O GLY A 468 -9.892 -16.781 -2.965 1.00 0.00 O ATOM 0 H GLY A 468 -7.193 -14.431 -3.960 1.00 0.00 H new ATOM 0 HA2 GLY A 468 -7.337 -16.599 -3.383 1.00 0.00 H new ATOM 0 HA3 GLY A 468 -6.992 -16.039 -1.758 1.00 0.00 H new ATOM 1351 N MET A 469 -9.322 -16.296 -0.844 1.00 0.00 N ATOM 1352 CA MET A 469 -10.613 -16.689 -0.292 1.00 0.00 C ATOM 1353 C MET A 469 -11.223 -15.554 0.524 1.00 0.00 C ATOM 1354 O MET A 469 -12.384 -15.621 0.931 1.00 0.00 O ATOM 1355 CB MET A 469 -10.461 -17.936 0.582 1.00 0.00 C ATOM 1356 CG MET A 469 -10.502 -19.236 -0.204 1.00 0.00 C ATOM 1357 SD MET A 469 -12.093 -19.515 -1.004 1.00 0.00 S ATOM 1358 CE MET A 469 -12.854 -20.660 0.145 1.00 0.00 C ATOM 0 H MET A 469 -8.651 -15.964 -0.152 1.00 0.00 H new ATOM 0 HA MET A 469 -11.281 -16.916 -1.123 1.00 0.00 H new ATOM 0 HB2 MET A 469 -9.517 -17.878 1.123 1.00 0.00 H new ATOM 0 HB3 MET A 469 -11.256 -17.946 1.328 1.00 0.00 H new ATOM 0 HG2 MET A 469 -9.717 -19.224 -0.960 1.00 0.00 H new ATOM 0 HG3 MET A 469 -10.286 -20.068 0.466 1.00 0.00 H new ATOM 0 HE1 MET A 469 -13.848 -20.928 -0.213 1.00 0.00 H new ATOM 0 HE2 MET A 469 -12.242 -21.558 0.222 1.00 0.00 H new ATOM 0 HE3 MET A 469 -12.936 -20.191 1.126 1.00 0.00 H new ATOM 1368 N LYS A 470 -10.435 -14.511 0.760 1.00 0.00 N ATOM 1369 CA LYS A 470 -10.897 -13.360 1.527 1.00 0.00 C ATOM 1370 C LYS A 470 -10.805 -12.082 0.699 1.00 0.00 C ATOM 1371 O LYS A 470 -10.367 -12.107 -0.451 1.00 0.00 O ATOM 1372 CB LYS A 470 -10.073 -13.209 2.808 1.00 0.00 C ATOM 1373 CG LYS A 470 -8.593 -12.986 2.555 1.00 0.00 C ATOM 1374 CD LYS A 470 -7.849 -12.669 3.843 1.00 0.00 C ATOM 1375 CE LYS A 470 -6.366 -12.986 3.723 1.00 0.00 C ATOM 1376 NZ LYS A 470 -6.112 -14.453 3.703 1.00 0.00 N ATOM 0 H LYS A 470 -9.472 -14.439 0.431 1.00 0.00 H new ATOM 0 HA LYS A 470 -11.941 -13.528 1.791 1.00 0.00 H new ATOM 0 HB2 LYS A 470 -10.465 -12.372 3.386 1.00 0.00 H new ATOM 0 HB3 LYS A 470 -10.198 -14.103 3.418 1.00 0.00 H new ATOM 0 HG2 LYS A 470 -8.163 -13.876 2.095 1.00 0.00 H new ATOM 0 HG3 LYS A 470 -8.463 -12.167 1.848 1.00 0.00 H new ATOM 0 HD2 LYS A 470 -7.978 -11.615 4.089 1.00 0.00 H new ATOM 0 HD3 LYS A 470 -8.279 -13.243 4.664 1.00 0.00 H new ATOM 0 HE2 LYS A 470 -5.971 -12.537 2.812 1.00 0.00 H new ATOM 0 HE3 LYS A 470 -5.830 -12.536 4.558 1.00 0.00 H new ATOM 0 HZ1 LYS A 470 -5.113 -14.635 3.926 1.00 0.00 H new ATOM 0 HZ2 LYS A 470 -6.715 -14.919 4.410 1.00 0.00 H new ATOM 0 HZ3 LYS A 470 -6.330 -14.830 2.759 1.00 0.00 H new ATOM 1390 N ARG A 471 -11.221 -10.967 1.291 1.00 0.00 N ATOM 1391 CA ARG A 471 -11.185 -9.680 0.608 1.00 0.00 C ATOM 1392 C ARG A 471 -10.128 -8.767 1.223 1.00 0.00 C ATOM 1393 O ARG A 471 -9.811 -8.877 2.408 1.00 0.00 O ATOM 1394 CB ARG A 471 -12.557 -9.006 0.672 1.00 0.00 C ATOM 1395 CG ARG A 471 -13.562 -9.575 -0.316 1.00 0.00 C ATOM 1396 CD ARG A 471 -14.950 -8.994 -0.095 1.00 0.00 C ATOM 1397 NE ARG A 471 -15.710 -9.752 0.895 1.00 0.00 N ATOM 1398 CZ ARG A 471 -16.886 -9.365 1.374 1.00 0.00 C ATOM 1399 NH1 ARG A 471 -17.436 -8.233 0.955 1.00 0.00 N ATOM 1400 NH2 ARG A 471 -17.516 -10.109 2.273 1.00 0.00 N ATOM 0 H ARG A 471 -11.587 -10.929 2.242 1.00 0.00 H new ATOM 0 HA ARG A 471 -10.924 -9.858 -0.435 1.00 0.00 H new ATOM 0 HB2 ARG A 471 -12.955 -9.107 1.682 1.00 0.00 H new ATOM 0 HB3 ARG A 471 -12.438 -7.939 0.482 1.00 0.00 H new ATOM 0 HG2 ARG A 471 -13.235 -9.361 -1.334 1.00 0.00 H new ATOM 0 HG3 ARG A 471 -13.600 -10.660 -0.214 1.00 0.00 H new ATOM 0 HD2 ARG A 471 -14.861 -7.958 0.232 1.00 0.00 H new ATOM 0 HD3 ARG A 471 -15.494 -8.985 -1.040 1.00 0.00 H new ATOM 0 HE ARG A 471 -15.315 -10.628 1.238 1.00 0.00 H new ATOM 0 HH11 ARG A 471 -16.955 -7.658 0.263 1.00 0.00 H new ATOM 0 HH12 ARG A 471 -18.340 -7.938 1.324 1.00 0.00 H new ATOM 0 HH21 ARG A 471 -17.097 -10.980 2.598 1.00 0.00 H new ATOM 0 HH22 ARG A 471 -18.420 -9.810 2.640 1.00 0.00 H new ATOM 1414 N LEU A 472 -9.585 -7.867 0.410 1.00 0.00 N ATOM 1415 CA LEU A 472 -8.563 -6.935 0.873 1.00 0.00 C ATOM 1416 C LEU A 472 -9.189 -5.613 1.306 1.00 0.00 C ATOM 1417 O LEU A 472 -10.296 -5.271 0.889 1.00 0.00 O ATOM 1418 CB LEU A 472 -7.532 -6.688 -0.229 1.00 0.00 C ATOM 1419 CG LEU A 472 -6.557 -7.833 -0.504 1.00 0.00 C ATOM 1420 CD1 LEU A 472 -5.790 -7.583 -1.794 1.00 0.00 C ATOM 1421 CD2 LEU A 472 -5.596 -8.006 0.663 1.00 0.00 C ATOM 0 H LEU A 472 -9.836 -7.763 -0.573 1.00 0.00 H new ATOM 0 HA LEU A 472 -8.064 -7.379 1.734 1.00 0.00 H new ATOM 0 HB2 LEU A 472 -8.064 -6.461 -1.153 1.00 0.00 H new ATOM 0 HB3 LEU A 472 -6.955 -5.801 0.033 1.00 0.00 H new ATOM 0 HG LEU A 472 -7.130 -8.753 -0.618 1.00 0.00 H new ATOM 0 HD11 LEU A 472 -5.101 -8.408 -1.973 1.00 0.00 H new ATOM 0 HD12 LEU A 472 -6.491 -7.508 -2.625 1.00 0.00 H new ATOM 0 HD13 LEU A 472 -5.228 -6.653 -1.709 1.00 0.00 H new ATOM 0 HD21 LEU A 472 -4.909 -8.825 0.450 1.00 0.00 H new ATOM 0 HD22 LEU A 472 -5.030 -7.086 0.807 1.00 0.00 H new ATOM 0 HD23 LEU A 472 -6.160 -8.231 1.568 1.00 0.00 H new ATOM 1433 N LYS A 473 -8.471 -4.871 2.143 1.00 0.00 N ATOM 1434 CA LYS A 473 -8.953 -3.584 2.629 1.00 0.00 C ATOM 1435 C LYS A 473 -7.834 -2.546 2.622 1.00 0.00 C ATOM 1436 O LYS A 473 -6.913 -2.607 3.435 1.00 0.00 O ATOM 1437 CB LYS A 473 -9.518 -3.730 4.045 1.00 0.00 C ATOM 1438 CG LYS A 473 -10.151 -2.457 4.581 1.00 0.00 C ATOM 1439 CD LYS A 473 -11.210 -2.760 5.628 1.00 0.00 C ATOM 1440 CE LYS A 473 -10.585 -3.176 6.949 1.00 0.00 C ATOM 1441 NZ LYS A 473 -11.613 -3.408 8.002 1.00 0.00 N ATOM 0 H LYS A 473 -7.553 -5.139 2.499 1.00 0.00 H new ATOM 0 HA LYS A 473 -9.744 -3.244 1.961 1.00 0.00 H new ATOM 0 HB2 LYS A 473 -10.263 -4.526 4.050 1.00 0.00 H new ATOM 0 HB3 LYS A 473 -8.717 -4.038 4.717 1.00 0.00 H new ATOM 0 HG2 LYS A 473 -9.380 -1.821 5.015 1.00 0.00 H new ATOM 0 HG3 LYS A 473 -10.599 -1.898 3.759 1.00 0.00 H new ATOM 0 HD2 LYS A 473 -11.834 -1.880 5.781 1.00 0.00 H new ATOM 0 HD3 LYS A 473 -11.863 -3.555 5.267 1.00 0.00 H new ATOM 0 HE2 LYS A 473 -10.002 -4.086 6.804 1.00 0.00 H new ATOM 0 HE3 LYS A 473 -9.892 -2.403 7.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 473 -11.146 -3.690 8.887 1.00 0.00 H new ATOM 0 HZ2 LYS A 473 -12.153 -2.533 8.159 1.00 0.00 H new ATOM 0 HZ3 LYS A 473 -12.259 -4.163 7.696 1.00 0.00 H new ATOM 1455 N VAL A 474 -7.924 -1.594 1.700 1.00 0.00 N ATOM 1456 CA VAL A 474 -6.921 -0.541 1.589 1.00 0.00 C ATOM 1457 C VAL A 474 -7.488 0.806 2.023 1.00 0.00 C ATOM 1458 O VAL A 474 -8.635 1.132 1.723 1.00 0.00 O ATOM 1459 CB VAL A 474 -6.390 -0.422 0.148 1.00 0.00 C ATOM 1460 CG1 VAL A 474 -5.065 0.327 0.127 1.00 0.00 C ATOM 1461 CG2 VAL A 474 -6.244 -1.799 -0.481 1.00 0.00 C ATOM 0 H VAL A 474 -8.681 -1.530 1.019 1.00 0.00 H new ATOM 0 HA VAL A 474 -6.099 -0.816 2.250 1.00 0.00 H new ATOM 0 HB VAL A 474 -7.110 0.146 -0.441 1.00 0.00 H new ATOM 0 HG11 VAL A 474 -4.705 0.401 -0.899 1.00 0.00 H new ATOM 0 HG12 VAL A 474 -5.206 1.328 0.535 1.00 0.00 H new ATOM 0 HG13 VAL A 474 -4.333 -0.211 0.730 1.00 0.00 H new ATOM 0 HG21 VAL A 474 -5.868 -1.696 -1.499 1.00 0.00 H new ATOM 0 HG22 VAL A 474 -5.545 -2.395 0.106 1.00 0.00 H new ATOM 0 HG23 VAL A 474 -7.215 -2.294 -0.501 1.00 0.00 H new ATOM 1471 N GLN A 475 -6.674 1.584 2.729 1.00 0.00 N ATOM 1472 CA GLN A 475 -7.095 2.897 3.204 1.00 0.00 C ATOM 1473 C GLN A 475 -5.889 3.792 3.470 1.00 0.00 C ATOM 1474 O GLN A 475 -4.863 3.335 3.975 1.00 0.00 O ATOM 1475 CB GLN A 475 -7.932 2.757 4.478 1.00 0.00 C ATOM 1476 CG GLN A 475 -9.421 2.601 4.213 1.00 0.00 C ATOM 1477 CD GLN A 475 -10.238 2.556 5.489 1.00 0.00 C ATOM 1478 OE1 GLN A 475 -10.649 1.485 5.939 1.00 0.00 O ATOM 1479 NE2 GLN A 475 -10.480 3.720 6.080 1.00 0.00 N ATOM 0 H GLN A 475 -5.720 1.328 2.985 1.00 0.00 H new ATOM 0 HA GLN A 475 -7.703 3.359 2.427 1.00 0.00 H new ATOM 0 HB2 GLN A 475 -7.579 1.893 5.042 1.00 0.00 H new ATOM 0 HB3 GLN A 475 -7.773 3.634 5.106 1.00 0.00 H new ATOM 0 HG2 GLN A 475 -9.765 3.430 3.595 1.00 0.00 H new ATOM 0 HG3 GLN A 475 -9.591 1.687 3.644 1.00 0.00 H new ATOM 0 HE21 GLN A 475 -10.120 4.583 5.673 1.00 0.00 H new ATOM 0 HE22 GLN A 475 -11.026 3.751 6.941 1.00 0.00 H new ATOM 1488 N LEU A 476 -6.019 5.068 3.126 1.00 0.00 N ATOM 1489 CA LEU A 476 -4.940 6.029 3.327 1.00 0.00 C ATOM 1490 C LEU A 476 -4.974 6.599 4.742 1.00 0.00 C ATOM 1491 O LEU A 476 -5.995 7.123 5.187 1.00 0.00 O ATOM 1492 CB LEU A 476 -5.043 7.163 2.306 1.00 0.00 C ATOM 1493 CG LEU A 476 -6.061 8.260 2.620 1.00 0.00 C ATOM 1494 CD1 LEU A 476 -5.510 9.213 3.669 1.00 0.00 C ATOM 1495 CD2 LEU A 476 -6.439 9.014 1.355 1.00 0.00 C ATOM 0 H LEU A 476 -6.861 5.462 2.706 1.00 0.00 H new ATOM 0 HA LEU A 476 -3.993 5.508 3.188 1.00 0.00 H new ATOM 0 HB2 LEU A 476 -4.061 7.625 2.206 1.00 0.00 H new ATOM 0 HB3 LEU A 476 -5.292 6.731 1.337 1.00 0.00 H new ATOM 0 HG LEU A 476 -6.960 7.792 3.021 1.00 0.00 H new ATOM 0 HD11 LEU A 476 -6.247 9.987 3.880 1.00 0.00 H new ATOM 0 HD12 LEU A 476 -5.291 8.661 4.583 1.00 0.00 H new ATOM 0 HD13 LEU A 476 -4.596 9.675 3.297 1.00 0.00 H new ATOM 0 HD21 LEU A 476 -7.164 9.791 1.597 1.00 0.00 H new ATOM 0 HD22 LEU A 476 -5.548 9.471 0.924 1.00 0.00 H new ATOM 0 HD23 LEU A 476 -6.876 8.322 0.636 1.00 0.00 H new ATOM 1507 N LYS A 477 -3.851 6.494 5.443 1.00 0.00 N ATOM 1508 CA LYS A 477 -3.750 7.001 6.807 1.00 0.00 C ATOM 1509 C LYS A 477 -4.379 8.386 6.920 1.00 0.00 C ATOM 1510 O LYS A 477 -3.915 9.343 6.300 1.00 0.00 O ATOM 1511 CB LYS A 477 -2.285 7.059 7.244 1.00 0.00 C ATOM 1512 CG LYS A 477 -2.078 7.728 8.592 1.00 0.00 C ATOM 1513 CD LYS A 477 -0.629 7.637 9.043 1.00 0.00 C ATOM 1514 CE LYS A 477 0.195 8.798 8.506 1.00 0.00 C ATOM 1515 NZ LYS A 477 1.567 8.817 9.084 1.00 0.00 N ATOM 0 H LYS A 477 -2.997 6.062 5.090 1.00 0.00 H new ATOM 0 HA LYS A 477 -4.292 6.319 7.462 1.00 0.00 H new ATOM 0 HB2 LYS A 477 -1.887 6.045 7.286 1.00 0.00 H new ATOM 0 HB3 LYS A 477 -1.710 7.596 6.489 1.00 0.00 H new ATOM 0 HG2 LYS A 477 -2.375 8.775 8.529 1.00 0.00 H new ATOM 0 HG3 LYS A 477 -2.722 7.258 9.335 1.00 0.00 H new ATOM 0 HD2 LYS A 477 -0.585 7.631 10.132 1.00 0.00 H new ATOM 0 HD3 LYS A 477 -0.199 6.695 8.702 1.00 0.00 H new ATOM 0 HE2 LYS A 477 0.259 8.727 7.420 1.00 0.00 H new ATOM 0 HE3 LYS A 477 -0.309 9.737 8.734 1.00 0.00 H new ATOM 0 HZ1 LYS A 477 2.097 9.622 8.694 1.00 0.00 H new ATOM 0 HZ2 LYS A 477 1.507 8.911 10.118 1.00 0.00 H new ATOM 0 HZ3 LYS A 477 2.057 7.931 8.845 1.00 0.00 H new