USER MOD reduce.3.24.130724 H: found=0, std=0, add=688, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 689 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 529 LYS NZ :NH3+ -141:sc= -2! (180deg=-4.08!) USER MOD Set 1.2: A 536 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 481 ASN : amide:sc=-0.00091 K(o=-0.71,f=-1.6) USER MOD Set 2.2: A 527 CYS SG : rot 85:sc= -0.712 USER MOD Set 3.1: A 470 GLN : amide:sc= -4.13! K(o=-7.9!,f=-0.017) USER MOD Set 3.2: A 471 GLN : amide:sc= -3.73! K(o=-7.9!,f=1.3) USER MOD Single : A 459 SER OG : rot 180:sc= 0 USER MOD Single : A 463 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 464 ASN : amide:sc= -2.92! K(o=-2.9!,f=-0.94) USER MOD Single : A 466 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 473 THR OG1 : rot -39:sc= -0.0693! USER MOD Single : A 474 CYS SG : rot 180:sc= -0.67 USER MOD Single : A 484 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 486 ASN : amide:sc= -10.6! C(o=-11!,f=-11!) USER MOD Single : A 489 ASN : amide:sc= -4.42! K(o=-4.4!,f=-2.8) USER MOD Single : A 490 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 491 GLN : amide:sc= -2.08! C(o=-2.1!,f=-3.6!) USER MOD Single : A 493 HIS : no HE2:sc= -9.04! C(o=-9!,f=-13!) USER MOD Single : A 501 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 505 GLN : amide:sc= -0.566 X(o=-0.57,f=-0.18) USER MOD Single : A 512 THR OG1 : rot 180:sc= 0 USER MOD Single : A 516 LYS NZ :NH3+ -159:sc= -0.988 (180deg=-1.91!) USER MOD Single : A 518 ASN : amide:sc= -1.23 K(o=-1.2,f=-2.6!) USER MOD Single : A 522 ASN : amide:sc= -8.18! C(o=-8.2!,f=-2.3!) USER MOD Single : A 525 LYS NZ :NH3+ -122:sc= -0.982 (180deg=-1.55) USER MOD Single : A 526 ASN : amide:sc= -3.63! K(o=-3.6!,f=-3) USER MOD Single : A 533 SER OG : rot -18:sc= 0.0372 USER MOD Single : A 534 THR OG1 : rot 180:sc= 0 USER MOD Single : A 537 LYS NZ :NH3+ -158:sc= 0 (180deg=-0.00359) USER MOD Single : A 538 ASN : amide:sc= -4.39! K(o=-4.4!,f=-1.9) USER MOD ----------------------------------------------------------------- ATOM 385 N ASP A 456 4.701 14.931 11.376 1.00 0.00 N ATOM 386 CA ASP A 456 3.297 15.194 11.093 1.00 0.00 C ATOM 387 C ASP A 456 2.794 14.277 9.986 1.00 0.00 C ATOM 388 O ASP A 456 1.608 13.964 9.919 1.00 0.00 O ATOM 389 CB ASP A 456 3.116 16.652 10.669 1.00 0.00 C ATOM 390 CG ASP A 456 3.992 16.952 9.458 1.00 0.00 C ATOM 391 OD1 ASP A 456 4.781 16.095 9.095 1.00 0.00 O ATOM 392 OD2 ASP A 456 3.864 18.035 8.912 1.00 0.00 O ATOM 0 HA ASP A 456 2.721 15.003 11.998 1.00 0.00 H new ATOM 0 HB2 ASP A 456 2.070 16.843 10.429 1.00 0.00 H new ATOM 0 HB3 ASP A 456 3.380 17.315 11.493 1.00 0.00 H new ATOM 397 N ASP A 457 3.708 13.844 9.123 1.00 0.00 N ATOM 398 CA ASP A 457 3.346 12.960 8.022 1.00 0.00 C ATOM 399 C ASP A 457 2.771 11.655 8.560 1.00 0.00 C ATOM 400 O ASP A 457 1.848 11.087 7.976 1.00 0.00 O ATOM 401 CB ASP A 457 4.581 12.662 7.167 1.00 0.00 C ATOM 402 CG ASP A 457 4.965 13.894 6.353 1.00 0.00 C ATOM 403 OD1 ASP A 457 4.159 14.807 6.278 1.00 0.00 O ATOM 404 OD2 ASP A 457 6.063 13.908 5.819 1.00 0.00 O ATOM 0 H ASP A 457 4.697 14.089 9.164 1.00 0.00 H new ATOM 0 HA ASP A 457 2.592 13.455 7.410 1.00 0.00 H new ATOM 0 HB2 ASP A 457 5.412 12.365 7.806 1.00 0.00 H new ATOM 0 HB3 ASP A 457 4.377 11.825 6.500 1.00 0.00 H new ATOM 409 N LEU A 458 3.314 11.188 9.683 1.00 0.00 N ATOM 410 CA LEU A 458 2.835 9.952 10.287 1.00 0.00 C ATOM 411 C LEU A 458 1.366 10.099 10.661 1.00 0.00 C ATOM 412 O LEU A 458 0.574 9.179 10.462 1.00 0.00 O ATOM 413 CB LEU A 458 3.666 9.614 11.536 1.00 0.00 C ATOM 414 CG LEU A 458 3.104 8.364 12.240 1.00 0.00 C ATOM 415 CD1 LEU A 458 3.079 7.173 11.268 1.00 0.00 C ATOM 416 CD2 LEU A 458 3.988 8.025 13.444 1.00 0.00 C ATOM 0 H LEU A 458 4.076 11.642 10.186 1.00 0.00 H new ATOM 0 HA LEU A 458 2.942 9.140 9.567 1.00 0.00 H new ATOM 0 HB2 LEU A 458 4.704 9.442 11.253 1.00 0.00 H new ATOM 0 HB3 LEU A 458 3.659 10.459 12.224 1.00 0.00 H new ATOM 0 HG LEU A 458 2.086 8.567 12.573 1.00 0.00 H new ATOM 0 HD11 LEU A 458 2.680 6.296 11.777 1.00 0.00 H new ATOM 0 HD12 LEU A 458 2.448 7.414 10.413 1.00 0.00 H new ATOM 0 HD13 LEU A 458 4.092 6.963 10.924 1.00 0.00 H new ATOM 0 HD21 LEU A 458 3.595 7.141 13.946 1.00 0.00 H new ATOM 0 HD22 LEU A 458 5.005 7.828 13.105 1.00 0.00 H new ATOM 0 HD23 LEU A 458 3.994 8.865 14.139 1.00 0.00 H new ATOM 428 N SER A 459 1.009 11.258 11.206 1.00 0.00 N ATOM 429 CA SER A 459 -0.371 11.512 11.599 1.00 0.00 C ATOM 430 C SER A 459 -1.288 11.455 10.384 1.00 0.00 C ATOM 431 O SER A 459 -2.401 10.937 10.460 1.00 0.00 O ATOM 432 CB SER A 459 -0.486 12.882 12.266 1.00 0.00 C ATOM 433 OG SER A 459 0.466 12.975 13.317 1.00 0.00 O ATOM 0 H SER A 459 1.651 12.030 11.384 1.00 0.00 H new ATOM 0 HA SER A 459 -0.674 10.742 12.308 1.00 0.00 H new ATOM 0 HB2 SER A 459 -0.314 13.671 11.534 1.00 0.00 H new ATOM 0 HB3 SER A 459 -1.493 13.025 12.658 1.00 0.00 H new ATOM 0 HG SER A 459 0.396 13.854 13.745 1.00 0.00 H new ATOM 439 N LEU A 460 -0.812 11.988 9.262 1.00 0.00 N ATOM 440 CA LEU A 460 -1.607 11.993 8.036 1.00 0.00 C ATOM 441 C LEU A 460 -1.924 10.561 7.601 1.00 0.00 C ATOM 442 O LEU A 460 -3.052 10.260 7.210 1.00 0.00 O ATOM 443 CB LEU A 460 -0.835 12.731 6.912 1.00 0.00 C ATOM 444 CG LEU A 460 -1.167 14.236 6.912 1.00 0.00 C ATOM 445 CD1 LEU A 460 -0.604 14.908 8.169 1.00 0.00 C ATOM 446 CD2 LEU A 460 -0.570 14.887 5.663 1.00 0.00 C ATOM 0 H LEU A 460 0.109 12.417 9.175 1.00 0.00 H new ATOM 0 HA LEU A 460 -2.545 12.514 8.227 1.00 0.00 H new ATOM 0 HB2 LEU A 460 0.237 12.591 7.050 1.00 0.00 H new ATOM 0 HB3 LEU A 460 -1.091 12.298 5.945 1.00 0.00 H new ATOM 0 HG LEU A 460 -2.250 14.361 6.908 1.00 0.00 H new ATOM 0 HD11 LEU A 460 -0.847 15.970 8.153 1.00 0.00 H new ATOM 0 HD12 LEU A 460 -1.042 14.448 9.055 1.00 0.00 H new ATOM 0 HD13 LEU A 460 0.479 14.784 8.194 1.00 0.00 H new ATOM 0 HD21 LEU A 460 -0.804 15.952 5.661 1.00 0.00 H new ATOM 0 HD22 LEU A 460 0.512 14.753 5.664 1.00 0.00 H new ATOM 0 HD23 LEU A 460 -0.992 14.421 4.773 1.00 0.00 H new ATOM 458 N ILE A 461 -0.930 9.683 7.668 1.00 0.00 N ATOM 459 CA ILE A 461 -1.132 8.294 7.275 1.00 0.00 C ATOM 460 C ILE A 461 -2.143 7.625 8.205 1.00 0.00 C ATOM 461 O ILE A 461 -3.035 6.906 7.752 1.00 0.00 O ATOM 462 CB ILE A 461 0.201 7.537 7.326 1.00 0.00 C ATOM 463 CG1 ILE A 461 1.139 8.085 6.247 1.00 0.00 C ATOM 464 CG2 ILE A 461 -0.041 6.046 7.069 1.00 0.00 C ATOM 465 CD1 ILE A 461 2.552 7.542 6.474 1.00 0.00 C ATOM 0 H ILE A 461 0.013 9.904 7.987 1.00 0.00 H new ATOM 0 HA ILE A 461 -1.519 8.270 6.256 1.00 0.00 H new ATOM 0 HB ILE A 461 0.651 7.669 8.310 1.00 0.00 H new ATOM 0 HG12 ILE A 461 0.782 7.796 5.259 1.00 0.00 H new ATOM 0 HG13 ILE A 461 1.148 9.175 6.277 1.00 0.00 H new ATOM 0 HG21 ILE A 461 0.908 5.512 7.106 1.00 0.00 H new ATOM 0 HG22 ILE A 461 -0.711 5.649 7.832 1.00 0.00 H new ATOM 0 HG23 ILE A 461 -0.493 5.915 6.086 1.00 0.00 H new ATOM 0 HD11 ILE A 461 3.220 7.932 5.706 1.00 0.00 H new ATOM 0 HD12 ILE A 461 2.908 7.853 7.456 1.00 0.00 H new ATOM 0 HD13 ILE A 461 2.536 6.453 6.422 1.00 0.00 H new ATOM 477 N ARG A 462 -1.996 7.864 9.506 1.00 0.00 N ATOM 478 CA ARG A 462 -2.901 7.276 10.488 1.00 0.00 C ATOM 479 C ARG A 462 -4.322 7.798 10.296 1.00 0.00 C ATOM 480 O ARG A 462 -5.285 7.038 10.344 1.00 0.00 O ATOM 481 CB ARG A 462 -2.421 7.608 11.903 1.00 0.00 C ATOM 482 CG ARG A 462 -3.323 6.917 12.927 1.00 0.00 C ATOM 483 CD ARG A 462 -2.767 7.144 14.334 1.00 0.00 C ATOM 484 NE ARG A 462 -2.822 8.564 14.672 1.00 0.00 N ATOM 485 CZ ARG A 462 -3.907 9.106 15.220 1.00 0.00 C ATOM 486 NH1 ARG A 462 -4.956 8.365 15.459 1.00 0.00 N ATOM 487 NH2 ARG A 462 -3.925 10.376 15.515 1.00 0.00 N ATOM 0 H ARG A 462 -1.265 8.456 9.901 1.00 0.00 H new ATOM 0 HA ARG A 462 -2.904 6.195 10.347 1.00 0.00 H new ATOM 0 HB2 ARG A 462 -1.389 7.282 12.034 1.00 0.00 H new ATOM 0 HB3 ARG A 462 -2.436 8.687 12.059 1.00 0.00 H new ATOM 0 HG2 ARG A 462 -4.337 7.310 12.858 1.00 0.00 H new ATOM 0 HG3 ARG A 462 -3.380 5.849 12.715 1.00 0.00 H new ATOM 0 HD2 ARG A 462 -3.342 6.567 15.058 1.00 0.00 H new ATOM 0 HD3 ARG A 462 -1.738 6.789 14.389 1.00 0.00 H new ATOM 0 HE ARG A 462 -2.011 9.153 14.484 1.00 0.00 H new ATOM 0 HH11 ARG A 462 -4.943 7.372 15.226 1.00 0.00 H new ATOM 0 HH12 ARG A 462 -5.788 8.779 15.879 1.00 0.00 H new ATOM 0 HH21 ARG A 462 -3.107 10.955 15.326 1.00 0.00 H new ATOM 0 HH22 ARG A 462 -4.757 10.790 15.935 1.00 0.00 H new ATOM 501 N LYS A 463 -4.447 9.100 10.084 1.00 0.00 N ATOM 502 CA LYS A 463 -5.757 9.713 9.888 1.00 0.00 C ATOM 503 C LYS A 463 -6.408 9.208 8.605 1.00 0.00 C ATOM 504 O LYS A 463 -7.617 8.982 8.560 1.00 0.00 O ATOM 505 CB LYS A 463 -5.619 11.240 9.830 1.00 0.00 C ATOM 506 CG LYS A 463 -5.168 11.798 11.192 1.00 0.00 C ATOM 507 CD LYS A 463 -6.361 11.923 12.150 1.00 0.00 C ATOM 508 CE LYS A 463 -5.890 12.540 13.468 1.00 0.00 C ATOM 509 NZ LYS A 463 -7.034 12.607 14.420 1.00 0.00 N ATOM 0 H LYS A 463 -3.663 9.751 10.043 1.00 0.00 H new ATOM 0 HA LYS A 463 -6.391 9.437 10.731 1.00 0.00 H new ATOM 0 HB2 LYS A 463 -4.897 11.516 9.061 1.00 0.00 H new ATOM 0 HB3 LYS A 463 -6.572 11.686 9.547 1.00 0.00 H new ATOM 0 HG2 LYS A 463 -4.413 11.143 11.627 1.00 0.00 H new ATOM 0 HG3 LYS A 463 -4.702 12.774 11.054 1.00 0.00 H new ATOM 0 HD2 LYS A 463 -7.138 12.543 11.702 1.00 0.00 H new ATOM 0 HD3 LYS A 463 -6.801 10.942 12.331 1.00 0.00 H new ATOM 0 HE2 LYS A 463 -5.083 11.944 13.894 1.00 0.00 H new ATOM 0 HE3 LYS A 463 -5.490 13.539 13.292 1.00 0.00 H new ATOM 0 HZ1 LYS A 463 -6.715 13.026 15.317 1.00 0.00 H new ATOM 0 HZ2 LYS A 463 -7.790 13.193 14.013 1.00 0.00 H new ATOM 0 HZ3 LYS A 463 -7.396 11.648 14.596 1.00 0.00 H new ATOM 523 N ASN A 464 -5.602 9.047 7.562 1.00 0.00 N ATOM 524 CA ASN A 464 -6.109 8.588 6.271 1.00 0.00 C ATOM 525 C ASN A 464 -6.103 7.065 6.190 1.00 0.00 C ATOM 526 O ASN A 464 -6.372 6.493 5.133 1.00 0.00 O ATOM 527 CB ASN A 464 -5.239 9.162 5.153 1.00 0.00 C ATOM 528 CG ASN A 464 -5.379 10.679 5.121 1.00 0.00 C ATOM 529 OD1 ASN A 464 -5.676 11.254 4.075 1.00 0.00 O ATOM 530 ND2 ASN A 464 -5.176 11.363 6.212 1.00 0.00 N ATOM 0 H ASN A 464 -4.598 9.226 7.583 1.00 0.00 H new ATOM 0 HA ASN A 464 -7.137 8.933 6.160 1.00 0.00 H new ATOM 0 HB2 ASN A 464 -4.196 8.887 5.313 1.00 0.00 H new ATOM 0 HB3 ASN A 464 -5.537 8.739 4.194 1.00 0.00 H new ATOM 0 HD21 ASN A 464 -5.263 12.379 6.201 1.00 0.00 H new ATOM 0 HD22 ASN A 464 -4.930 10.882 7.077 1.00 0.00 H new ATOM 537 N ARG A 465 -5.792 6.411 7.306 1.00 0.00 N ATOM 538 CA ARG A 465 -5.756 4.954 7.331 1.00 0.00 C ATOM 539 C ARG A 465 -7.138 4.385 7.016 1.00 0.00 C ATOM 540 O ARG A 465 -7.271 3.442 6.237 1.00 0.00 O ATOM 541 CB ARG A 465 -5.274 4.463 8.713 1.00 0.00 C ATOM 542 CG ARG A 465 -6.420 4.498 9.741 1.00 0.00 C ATOM 543 CD ARG A 465 -5.875 4.201 11.140 1.00 0.00 C ATOM 544 NE ARG A 465 -6.970 4.175 12.106 1.00 0.00 N ATOM 545 CZ ARG A 465 -7.387 5.285 12.713 1.00 0.00 C ATOM 546 NH1 ARG A 465 -6.801 6.426 12.466 1.00 0.00 N ATOM 547 NH2 ARG A 465 -8.381 5.233 13.557 1.00 0.00 N ATOM 0 H ARG A 465 -5.564 6.860 8.193 1.00 0.00 H new ATOM 0 HA ARG A 465 -5.057 4.604 6.571 1.00 0.00 H new ATOM 0 HB2 ARG A 465 -4.888 3.447 8.628 1.00 0.00 H new ATOM 0 HB3 ARG A 465 -4.451 5.089 9.059 1.00 0.00 H new ATOM 0 HG2 ARG A 465 -6.901 5.476 9.729 1.00 0.00 H new ATOM 0 HG3 ARG A 465 -7.181 3.765 9.475 1.00 0.00 H new ATOM 0 HD2 ARG A 465 -5.355 3.243 11.141 1.00 0.00 H new ATOM 0 HD3 ARG A 465 -5.146 4.960 11.424 1.00 0.00 H new ATOM 0 HE ARG A 465 -7.425 3.288 12.321 1.00 0.00 H new ATOM 0 HH11 ARG A 465 -6.023 6.468 11.808 1.00 0.00 H new ATOM 0 HH12 ARG A 465 -7.121 7.275 12.931 1.00 0.00 H new ATOM 0 HH21 ARG A 465 -8.839 4.342 13.752 1.00 0.00 H new ATOM 0 HH22 ARG A 465 -8.700 6.083 14.022 1.00 0.00 H new ATOM 561 N MET A 466 -8.157 4.956 7.653 1.00 0.00 N ATOM 562 CA MET A 466 -9.525 4.494 7.453 1.00 0.00 C ATOM 563 C MET A 466 -9.994 4.805 6.039 1.00 0.00 C ATOM 564 O MET A 466 -10.596 3.959 5.380 1.00 0.00 O ATOM 565 CB MET A 466 -10.457 5.164 8.462 1.00 0.00 C ATOM 566 CG MET A 466 -11.833 4.497 8.414 1.00 0.00 C ATOM 567 SD MET A 466 -12.958 5.367 9.533 1.00 0.00 S ATOM 568 CE MET A 466 -13.623 6.541 8.326 1.00 0.00 C ATOM 0 H MET A 466 -8.062 5.733 8.307 1.00 0.00 H new ATOM 0 HA MET A 466 -9.548 3.414 7.601 1.00 0.00 H new ATOM 0 HB2 MET A 466 -10.039 5.086 9.466 1.00 0.00 H new ATOM 0 HB3 MET A 466 -10.549 6.227 8.237 1.00 0.00 H new ATOM 0 HG2 MET A 466 -12.225 4.518 7.397 1.00 0.00 H new ATOM 0 HG3 MET A 466 -11.752 3.449 8.703 1.00 0.00 H new ATOM 0 HE1 MET A 466 -14.352 7.189 8.812 1.00 0.00 H new ATOM 0 HE2 MET A 466 -12.812 7.146 7.922 1.00 0.00 H new ATOM 0 HE3 MET A 466 -14.106 5.995 7.516 1.00 0.00 H new ATOM 578 N ALA A 467 -9.714 6.022 5.574 1.00 0.00 N ATOM 579 CA ALA A 467 -10.119 6.420 4.235 1.00 0.00 C ATOM 580 C ALA A 467 -9.585 5.423 3.215 1.00 0.00 C ATOM 581 O ALA A 467 -10.296 5.024 2.297 1.00 0.00 O ATOM 582 CB ALA A 467 -9.585 7.817 3.920 1.00 0.00 C ATOM 0 H ALA A 467 -9.214 6.739 6.100 1.00 0.00 H new ATOM 0 HA ALA A 467 -11.208 6.436 4.185 1.00 0.00 H new ATOM 0 HB1 ALA A 467 -9.893 8.106 2.915 1.00 0.00 H new ATOM 0 HB2 ALA A 467 -9.984 8.530 4.641 1.00 0.00 H new ATOM 0 HB3 ALA A 467 -8.497 7.812 3.978 1.00 0.00 H new ATOM 588 N LEU A 468 -8.336 5.016 3.390 1.00 0.00 N ATOM 589 CA LEU A 468 -7.730 4.058 2.475 1.00 0.00 C ATOM 590 C LEU A 468 -8.472 2.723 2.517 1.00 0.00 C ATOM 591 O LEU A 468 -8.677 2.092 1.481 1.00 0.00 O ATOM 592 CB LEU A 468 -6.249 3.847 2.830 1.00 0.00 C ATOM 593 CG LEU A 468 -5.487 3.253 1.618 1.00 0.00 C ATOM 594 CD1 LEU A 468 -5.026 4.382 0.679 1.00 0.00 C ATOM 595 CD2 LEU A 468 -4.262 2.474 2.114 1.00 0.00 C ATOM 0 H LEU A 468 -7.728 5.329 4.147 1.00 0.00 H new ATOM 0 HA LEU A 468 -7.800 4.461 1.465 1.00 0.00 H new ATOM 0 HB2 LEU A 468 -5.799 4.796 3.122 1.00 0.00 H new ATOM 0 HB3 LEU A 468 -6.165 3.177 3.686 1.00 0.00 H new ATOM 0 HG LEU A 468 -6.153 2.584 1.074 1.00 0.00 H new ATOM 0 HD11 LEU A 468 -4.492 3.954 -0.169 1.00 0.00 H new ATOM 0 HD12 LEU A 468 -5.895 4.934 0.320 1.00 0.00 H new ATOM 0 HD13 LEU A 468 -4.365 5.058 1.221 1.00 0.00 H new ATOM 0 HD21 LEU A 468 -3.727 2.057 1.261 1.00 0.00 H new ATOM 0 HD22 LEU A 468 -3.602 3.145 2.664 1.00 0.00 H new ATOM 0 HD23 LEU A 468 -4.586 1.666 2.770 1.00 0.00 H new ATOM 607 N PHE A 469 -8.856 2.288 3.715 1.00 0.00 N ATOM 608 CA PHE A 469 -9.557 1.016 3.860 1.00 0.00 C ATOM 609 C PHE A 469 -10.844 0.998 3.031 1.00 0.00 C ATOM 610 O PHE A 469 -11.080 0.062 2.269 1.00 0.00 O ATOM 611 CB PHE A 469 -9.889 0.775 5.344 1.00 0.00 C ATOM 612 CG PHE A 469 -10.852 -0.385 5.477 1.00 0.00 C ATOM 613 CD1 PHE A 469 -10.381 -1.700 5.404 1.00 0.00 C ATOM 614 CD2 PHE A 469 -12.217 -0.138 5.670 1.00 0.00 C ATOM 615 CE1 PHE A 469 -11.274 -2.771 5.521 1.00 0.00 C ATOM 616 CE2 PHE A 469 -13.110 -1.208 5.787 1.00 0.00 C ATOM 617 CZ PHE A 469 -12.639 -2.525 5.713 1.00 0.00 C ATOM 0 H PHE A 469 -8.696 2.790 4.588 1.00 0.00 H new ATOM 0 HA PHE A 469 -8.906 0.221 3.495 1.00 0.00 H new ATOM 0 HB2 PHE A 469 -8.975 0.565 5.900 1.00 0.00 H new ATOM 0 HB3 PHE A 469 -10.327 1.674 5.778 1.00 0.00 H new ATOM 0 HD1 PHE A 469 -9.328 -1.889 5.257 1.00 0.00 H new ATOM 0 HD2 PHE A 469 -12.580 0.878 5.728 1.00 0.00 H new ATOM 0 HE1 PHE A 469 -10.911 -3.786 5.463 1.00 0.00 H new ATOM 0 HE2 PHE A 469 -14.163 -1.019 5.934 1.00 0.00 H new ATOM 0 HZ PHE A 469 -13.329 -3.351 5.804 1.00 0.00 H new ATOM 627 N GLN A 470 -11.671 2.030 3.179 1.00 0.00 N ATOM 628 CA GLN A 470 -12.921 2.102 2.428 1.00 0.00 C ATOM 629 C GLN A 470 -12.633 2.358 0.948 1.00 0.00 C ATOM 630 O GLN A 470 -13.335 1.854 0.071 1.00 0.00 O ATOM 631 CB GLN A 470 -13.827 3.206 2.995 1.00 0.00 C ATOM 632 CG GLN A 470 -13.051 4.521 3.087 1.00 0.00 C ATOM 633 CD GLN A 470 -13.984 5.660 3.485 1.00 0.00 C ATOM 634 OE1 GLN A 470 -14.580 5.634 4.561 1.00 0.00 O ATOM 635 NE2 GLN A 470 -14.139 6.673 2.675 1.00 0.00 N ATOM 0 H GLN A 470 -11.502 2.818 3.804 1.00 0.00 H new ATOM 0 HA GLN A 470 -13.440 1.148 2.524 1.00 0.00 H new ATOM 0 HB2 GLN A 470 -14.702 3.334 2.357 1.00 0.00 H new ATOM 0 HB3 GLN A 470 -14.191 2.919 3.981 1.00 0.00 H new ATOM 0 HG2 GLN A 470 -12.248 4.427 3.818 1.00 0.00 H new ATOM 0 HG3 GLN A 470 -12.584 4.743 2.128 1.00 0.00 H new ATOM 0 HE21 GLN A 470 -13.644 6.693 1.783 1.00 0.00 H new ATOM 0 HE22 GLN A 470 -14.755 7.444 2.934 1.00 0.00 H new ATOM 644 N GLN A 471 -11.593 3.149 0.677 1.00 0.00 N ATOM 645 CA GLN A 471 -11.202 3.473 -0.701 1.00 0.00 C ATOM 646 C GLN A 471 -9.941 2.708 -1.076 1.00 0.00 C ATOM 647 O GLN A 471 -8.868 3.291 -1.228 1.00 0.00 O ATOM 648 CB GLN A 471 -10.947 4.979 -0.831 1.00 0.00 C ATOM 649 CG GLN A 471 -12.281 5.747 -0.748 1.00 0.00 C ATOM 650 CD GLN A 471 -12.041 7.163 -0.229 1.00 0.00 C ATOM 651 OE1 GLN A 471 -11.880 8.098 -1.014 1.00 0.00 O ATOM 652 NE2 GLN A 471 -11.996 7.369 1.061 1.00 0.00 N ATOM 0 H GLN A 471 -11.005 3.578 1.392 1.00 0.00 H new ATOM 0 HA GLN A 471 -12.010 3.186 -1.374 1.00 0.00 H new ATOM 0 HB2 GLN A 471 -10.276 5.312 -0.040 1.00 0.00 H new ATOM 0 HB3 GLN A 471 -10.453 5.192 -1.779 1.00 0.00 H new ATOM 0 HG2 GLN A 471 -12.748 5.787 -1.732 1.00 0.00 H new ATOM 0 HG3 GLN A 471 -12.971 5.222 -0.088 1.00 0.00 H new ATOM 0 HE21 GLN A 471 -12.130 6.591 1.707 1.00 0.00 H new ATOM 0 HE22 GLN A 471 -11.827 8.308 1.422 1.00 0.00 H new ATOM 661 N LEU A 472 -10.075 1.392 -1.219 1.00 0.00 N ATOM 662 CA LEU A 472 -8.939 0.539 -1.571 1.00 0.00 C ATOM 663 C LEU A 472 -8.988 0.179 -3.058 1.00 0.00 C ATOM 664 O LEU A 472 -10.033 -0.205 -3.583 1.00 0.00 O ATOM 665 CB LEU A 472 -8.975 -0.741 -0.707 1.00 0.00 C ATOM 666 CG LEU A 472 -10.175 -1.651 -1.123 1.00 0.00 C ATOM 667 CD1 LEU A 472 -9.695 -2.786 -2.045 1.00 0.00 C ATOM 668 CD2 LEU A 472 -10.839 -2.264 0.124 1.00 0.00 C ATOM 0 H LEU A 472 -10.956 0.892 -1.097 1.00 0.00 H new ATOM 0 HA LEU A 472 -8.010 1.076 -1.379 1.00 0.00 H new ATOM 0 HB2 LEU A 472 -8.040 -1.289 -0.820 1.00 0.00 H new ATOM 0 HB3 LEU A 472 -9.062 -0.473 0.346 1.00 0.00 H new ATOM 0 HG LEU A 472 -10.899 -1.034 -1.655 1.00 0.00 H new ATOM 0 HD11 LEU A 472 -10.543 -3.410 -2.325 1.00 0.00 H new ATOM 0 HD12 LEU A 472 -9.245 -2.360 -2.942 1.00 0.00 H new ATOM 0 HD13 LEU A 472 -8.956 -3.392 -1.521 1.00 0.00 H new ATOM 0 HD21 LEU A 472 -11.673 -2.895 -0.181 1.00 0.00 H new ATOM 0 HD22 LEU A 472 -10.109 -2.865 0.667 1.00 0.00 H new ATOM 0 HD23 LEU A 472 -11.205 -1.466 0.770 1.00 0.00 H new ATOM 680 N THR A 473 -7.852 0.319 -3.734 1.00 0.00 N ATOM 681 CA THR A 473 -7.770 0.007 -5.157 1.00 0.00 C ATOM 682 C THR A 473 -6.311 -0.201 -5.571 1.00 0.00 C ATOM 683 O THR A 473 -5.923 0.120 -6.692 1.00 0.00 O ATOM 684 CB THR A 473 -8.386 1.152 -5.982 1.00 0.00 C ATOM 685 OG1 THR A 473 -9.538 1.646 -5.314 1.00 0.00 O ATOM 686 CG2 THR A 473 -8.783 0.640 -7.374 1.00 0.00 C ATOM 0 H THR A 473 -6.978 0.645 -3.321 1.00 0.00 H new ATOM 0 HA THR A 473 -8.326 -0.912 -5.346 1.00 0.00 H new ATOM 0 HB THR A 473 -7.652 1.951 -6.091 1.00 0.00 H new ATOM 0 HG1 THR A 473 -10.034 0.898 -4.921 1.00 0.00 H new ATOM 0 HG21 THR A 473 -9.218 1.456 -7.951 1.00 0.00 H new ATOM 0 HG22 THR A 473 -7.899 0.262 -7.888 1.00 0.00 H new ATOM 0 HG23 THR A 473 -9.514 -0.162 -7.272 1.00 0.00 H new ATOM 694 N CYS A 474 -5.512 -0.745 -4.658 1.00 0.00 N ATOM 695 CA CYS A 474 -4.101 -0.993 -4.940 1.00 0.00 C ATOM 696 C CYS A 474 -3.389 -1.491 -3.686 1.00 0.00 C ATOM 697 O CYS A 474 -2.683 -0.731 -3.024 1.00 0.00 O ATOM 698 CB CYS A 474 -3.425 0.296 -5.427 1.00 0.00 C ATOM 699 SG CYS A 474 -4.084 1.709 -4.508 1.00 0.00 S ATOM 0 H CYS A 474 -5.814 -1.021 -3.724 1.00 0.00 H new ATOM 0 HA CYS A 474 -4.035 -1.754 -5.717 1.00 0.00 H new ATOM 0 HB2 CYS A 474 -2.346 0.229 -5.287 1.00 0.00 H new ATOM 0 HB3 CYS A 474 -3.600 0.430 -6.495 1.00 0.00 H new ATOM 0 HG CYS A 474 -3.510 2.800 -4.919 1.00 0.00 H new ATOM 705 N VAL A 475 -3.575 -2.770 -3.366 1.00 0.00 N ATOM 706 CA VAL A 475 -2.940 -3.364 -2.187 1.00 0.00 C ATOM 707 C VAL A 475 -1.822 -4.317 -2.606 1.00 0.00 C ATOM 708 O VAL A 475 -0.858 -4.517 -1.870 1.00 0.00 O ATOM 709 CB VAL A 475 -3.981 -4.127 -1.370 1.00 0.00 C ATOM 710 CG1 VAL A 475 -4.542 -5.279 -2.206 1.00 0.00 C ATOM 711 CG2 VAL A 475 -3.325 -4.683 -0.102 1.00 0.00 C ATOM 0 H VAL A 475 -4.157 -3.414 -3.902 1.00 0.00 H new ATOM 0 HA VAL A 475 -2.513 -2.565 -1.581 1.00 0.00 H new ATOM 0 HB VAL A 475 -4.792 -3.454 -1.093 1.00 0.00 H new ATOM 0 HG11 VAL A 475 -5.285 -5.824 -1.623 1.00 0.00 H new ATOM 0 HG12 VAL A 475 -5.008 -4.881 -3.107 1.00 0.00 H new ATOM 0 HG13 VAL A 475 -3.733 -5.954 -2.484 1.00 0.00 H new ATOM 0 HG21 VAL A 475 -4.066 -5.228 0.482 1.00 0.00 H new ATOM 0 HG22 VAL A 475 -2.514 -5.357 -0.378 1.00 0.00 H new ATOM 0 HG23 VAL A 475 -2.927 -3.861 0.493 1.00 0.00 H new ATOM 721 N LEU A 476 -1.961 -4.896 -3.798 1.00 0.00 N ATOM 722 CA LEU A 476 -0.964 -5.829 -4.320 1.00 0.00 C ATOM 723 C LEU A 476 0.339 -5.090 -4.640 1.00 0.00 C ATOM 724 O LEU A 476 1.423 -5.598 -4.360 1.00 0.00 O ATOM 725 CB LEU A 476 -1.498 -6.559 -5.582 1.00 0.00 C ATOM 726 CG LEU A 476 -2.965 -6.972 -5.369 1.00 0.00 C ATOM 727 CD1 LEU A 476 -3.587 -7.397 -6.701 1.00 0.00 C ATOM 728 CD2 LEU A 476 -3.034 -8.150 -4.391 1.00 0.00 C ATOM 0 H LEU A 476 -2.754 -4.735 -4.420 1.00 0.00 H new ATOM 0 HA LEU A 476 -0.762 -6.578 -3.555 1.00 0.00 H new ATOM 0 HB2 LEU A 476 -1.418 -5.906 -6.451 1.00 0.00 H new ATOM 0 HB3 LEU A 476 -0.890 -7.440 -5.788 1.00 0.00 H new ATOM 0 HG LEU A 476 -3.514 -6.122 -4.964 1.00 0.00 H new ATOM 0 HD11 LEU A 476 -4.625 -7.688 -6.541 1.00 0.00 H new ATOM 0 HD12 LEU A 476 -3.547 -6.564 -7.403 1.00 0.00 H new ATOM 0 HD13 LEU A 476 -3.032 -8.242 -7.108 1.00 0.00 H new ATOM 0 HD21 LEU A 476 -4.074 -8.439 -4.243 1.00 0.00 H new ATOM 0 HD22 LEU A 476 -2.477 -8.994 -4.798 1.00 0.00 H new ATOM 0 HD23 LEU A 476 -2.600 -7.856 -3.436 1.00 0.00 H new ATOM 740 N PRO A 477 0.262 -3.908 -5.220 1.00 0.00 N ATOM 741 CA PRO A 477 1.469 -3.092 -5.588 1.00 0.00 C ATOM 742 C PRO A 477 2.270 -2.622 -4.377 1.00 0.00 C ATOM 743 O PRO A 477 3.492 -2.762 -4.349 1.00 0.00 O ATOM 744 CB PRO A 477 0.863 -1.906 -6.383 1.00 0.00 C ATOM 745 CG PRO A 477 -0.470 -2.410 -6.806 1.00 0.00 C ATOM 746 CD PRO A 477 -0.965 -3.180 -5.601 1.00 0.00 C ATOM 0 HA PRO A 477 2.197 -3.668 -6.160 1.00 0.00 H new ATOM 0 HB2 PRO A 477 0.776 -1.013 -5.765 1.00 0.00 H new ATOM 0 HB3 PRO A 477 1.482 -1.641 -7.241 1.00 0.00 H new ATOM 0 HG2 PRO A 477 -1.144 -1.592 -7.062 1.00 0.00 H new ATOM 0 HG3 PRO A 477 -0.395 -3.049 -7.686 1.00 0.00 H new ATOM 0 HD2 PRO A 477 -1.320 -2.523 -4.807 1.00 0.00 H new ATOM 0 HD3 PRO A 477 -1.786 -3.853 -5.848 1.00 0.00 H new ATOM 754 N ILE A 478 1.586 -2.078 -3.373 1.00 0.00 N ATOM 755 CA ILE A 478 2.273 -1.616 -2.172 1.00 0.00 C ATOM 756 C ILE A 478 2.802 -2.832 -1.392 1.00 0.00 C ATOM 757 O ILE A 478 3.895 -2.812 -0.829 1.00 0.00 O ATOM 758 CB ILE A 478 1.294 -0.757 -1.291 1.00 0.00 C ATOM 759 CG1 ILE A 478 2.090 0.307 -0.491 1.00 0.00 C ATOM 760 CG2 ILE A 478 0.524 -1.665 -0.309 1.00 0.00 C ATOM 761 CD1 ILE A 478 3.212 -0.364 0.316 1.00 0.00 C ATOM 0 H ILE A 478 0.574 -1.948 -3.366 1.00 0.00 H new ATOM 0 HA ILE A 478 3.118 -0.984 -2.447 1.00 0.00 H new ATOM 0 HB ILE A 478 0.584 -0.257 -1.950 1.00 0.00 H new ATOM 0 HG12 ILE A 478 2.514 1.044 -1.174 1.00 0.00 H new ATOM 0 HG13 ILE A 478 1.420 0.844 0.181 1.00 0.00 H new ATOM 0 HG21 ILE A 478 -0.150 -1.058 0.295 1.00 0.00 H new ATOM 0 HG22 ILE A 478 -0.053 -2.400 -0.870 1.00 0.00 H new ATOM 0 HG23 ILE A 478 1.231 -2.179 0.342 1.00 0.00 H new ATOM 0 HD11 ILE A 478 3.763 0.394 0.873 1.00 0.00 H new ATOM 0 HD12 ILE A 478 2.780 -1.083 1.012 1.00 0.00 H new ATOM 0 HD13 ILE A 478 3.891 -0.880 -0.364 1.00 0.00 H new ATOM 773 N LEU A 479 1.991 -3.887 -1.356 1.00 0.00 N ATOM 774 CA LEU A 479 2.350 -5.096 -0.627 1.00 0.00 C ATOM 775 C LEU A 479 3.630 -5.688 -1.199 1.00 0.00 C ATOM 776 O LEU A 479 4.494 -6.157 -0.459 1.00 0.00 O ATOM 777 CB LEU A 479 1.213 -6.130 -0.714 1.00 0.00 C ATOM 778 CG LEU A 479 1.608 -7.430 0.015 1.00 0.00 C ATOM 779 CD1 LEU A 479 2.026 -7.126 1.465 1.00 0.00 C ATOM 780 CD2 LEU A 479 0.407 -8.394 0.024 1.00 0.00 C ATOM 0 H LEU A 479 1.085 -3.927 -1.822 1.00 0.00 H new ATOM 0 HA LEU A 479 2.512 -4.837 0.419 1.00 0.00 H new ATOM 0 HB2 LEU A 479 0.305 -5.719 -0.271 1.00 0.00 H new ATOM 0 HB3 LEU A 479 0.989 -6.346 -1.759 1.00 0.00 H new ATOM 0 HG LEU A 479 2.449 -7.886 -0.507 1.00 0.00 H new ATOM 0 HD11 LEU A 479 2.302 -8.054 1.966 1.00 0.00 H new ATOM 0 HD12 LEU A 479 2.879 -6.447 1.463 1.00 0.00 H new ATOM 0 HD13 LEU A 479 1.194 -6.662 1.994 1.00 0.00 H new ATOM 0 HD21 LEU A 479 0.683 -9.314 0.539 1.00 0.00 H new ATOM 0 HD22 LEU A 479 -0.431 -7.926 0.541 1.00 0.00 H new ATOM 0 HD23 LEU A 479 0.118 -8.625 -1.001 1.00 0.00 H new ATOM 792 N ASP A 480 3.750 -5.671 -2.520 1.00 0.00 N ATOM 793 CA ASP A 480 4.938 -6.211 -3.164 1.00 0.00 C ATOM 794 C ASP A 480 6.168 -5.409 -2.750 1.00 0.00 C ATOM 795 O ASP A 480 7.223 -5.979 -2.465 1.00 0.00 O ATOM 796 CB ASP A 480 4.780 -6.163 -4.685 1.00 0.00 C ATOM 797 CG ASP A 480 5.939 -6.897 -5.352 1.00 0.00 C ATOM 798 OD1 ASP A 480 6.852 -7.289 -4.644 1.00 0.00 O ATOM 799 OD2 ASP A 480 5.895 -7.059 -6.561 1.00 0.00 O ATOM 0 H ASP A 480 3.049 -5.294 -3.158 1.00 0.00 H new ATOM 0 HA ASP A 480 5.065 -7.247 -2.851 1.00 0.00 H new ATOM 0 HB2 ASP A 480 3.834 -6.620 -4.975 1.00 0.00 H new ATOM 0 HB3 ASP A 480 4.751 -5.127 -5.024 1.00 0.00 H new ATOM 804 N ASN A 481 6.029 -4.086 -2.725 1.00 0.00 N ATOM 805 CA ASN A 481 7.141 -3.220 -2.347 1.00 0.00 C ATOM 806 C ASN A 481 7.538 -3.445 -0.889 1.00 0.00 C ATOM 807 O ASN A 481 8.722 -3.488 -0.558 1.00 0.00 O ATOM 808 CB ASN A 481 6.745 -1.756 -2.542 1.00 0.00 C ATOM 809 CG ASN A 481 6.596 -1.446 -4.027 1.00 0.00 C ATOM 810 OD1 ASN A 481 7.370 -1.941 -4.847 1.00 0.00 O ATOM 811 ND2 ASN A 481 5.636 -0.657 -4.425 1.00 0.00 N ATOM 0 H ASN A 481 5.166 -3.595 -2.959 1.00 0.00 H new ATOM 0 HA ASN A 481 7.993 -3.462 -2.982 1.00 0.00 H new ATOM 0 HB2 ASN A 481 5.807 -1.553 -2.024 1.00 0.00 H new ATOM 0 HB3 ASN A 481 7.500 -1.105 -2.101 1.00 0.00 H new ATOM 0 HD21 ASN A 481 5.525 -0.449 -5.417 1.00 0.00 H new ATOM 0 HD22 ASN A 481 4.996 -0.248 -3.744 1.00 0.00 H new ATOM 818 N LEU A 482 6.539 -3.580 -0.024 1.00 0.00 N ATOM 819 CA LEU A 482 6.792 -3.791 1.399 1.00 0.00 C ATOM 820 C LEU A 482 7.481 -5.139 1.629 1.00 0.00 C ATOM 821 O LEU A 482 8.255 -5.300 2.573 1.00 0.00 O ATOM 822 CB LEU A 482 5.470 -3.735 2.190 1.00 0.00 C ATOM 823 CG LEU A 482 5.750 -3.371 3.669 1.00 0.00 C ATOM 824 CD1 LEU A 482 5.768 -1.849 3.841 1.00 0.00 C ATOM 825 CD2 LEU A 482 4.664 -3.962 4.579 1.00 0.00 C ATOM 0 H LEU A 482 5.552 -3.548 -0.280 1.00 0.00 H new ATOM 0 HA LEU A 482 7.451 -2.997 1.752 1.00 0.00 H new ATOM 0 HB2 LEU A 482 4.802 -2.997 1.746 1.00 0.00 H new ATOM 0 HB3 LEU A 482 4.963 -4.698 2.134 1.00 0.00 H new ATOM 0 HG LEU A 482 6.720 -3.784 3.946 1.00 0.00 H new ATOM 0 HD11 LEU A 482 5.966 -1.603 4.884 1.00 0.00 H new ATOM 0 HD12 LEU A 482 6.549 -1.421 3.213 1.00 0.00 H new ATOM 0 HD13 LEU A 482 4.802 -1.438 3.548 1.00 0.00 H new ATOM 0 HD21 LEU A 482 4.874 -3.698 5.615 1.00 0.00 H new ATOM 0 HD22 LEU A 482 3.692 -3.561 4.293 1.00 0.00 H new ATOM 0 HD23 LEU A 482 4.654 -5.047 4.476 1.00 0.00 H new ATOM 837 N LEU A 483 7.185 -6.103 0.764 1.00 0.00 N ATOM 838 CA LEU A 483 7.764 -7.439 0.888 1.00 0.00 C ATOM 839 C LEU A 483 9.294 -7.358 0.802 1.00 0.00 C ATOM 840 O LEU A 483 10.006 -8.070 1.508 1.00 0.00 O ATOM 841 CB LEU A 483 7.218 -8.359 -0.240 1.00 0.00 C ATOM 842 CG LEU A 483 7.157 -9.840 0.231 1.00 0.00 C ATOM 843 CD1 LEU A 483 8.499 -10.274 0.837 1.00 0.00 C ATOM 844 CD2 LEU A 483 6.043 -9.990 1.289 1.00 0.00 C ATOM 0 H LEU A 483 6.551 -5.987 -0.027 1.00 0.00 H new ATOM 0 HA LEU A 483 7.485 -7.858 1.855 1.00 0.00 H new ATOM 0 HB2 LEU A 483 6.223 -8.026 -0.536 1.00 0.00 H new ATOM 0 HB3 LEU A 483 7.856 -8.279 -1.120 1.00 0.00 H new ATOM 0 HG LEU A 483 6.945 -10.474 -0.630 1.00 0.00 H new ATOM 0 HD11 LEU A 483 8.433 -11.313 1.160 1.00 0.00 H new ATOM 0 HD12 LEU A 483 9.285 -10.175 0.088 1.00 0.00 H new ATOM 0 HD13 LEU A 483 8.733 -9.642 1.694 1.00 0.00 H new ATOM 0 HD21 LEU A 483 5.996 -11.026 1.623 1.00 0.00 H new ATOM 0 HD22 LEU A 483 6.260 -9.344 2.140 1.00 0.00 H new ATOM 0 HD23 LEU A 483 5.086 -9.705 0.852 1.00 0.00 H new ATOM 856 N LYS A 484 9.795 -6.494 -0.073 1.00 0.00 N ATOM 857 CA LYS A 484 11.238 -6.350 -0.254 1.00 0.00 C ATOM 858 C LYS A 484 11.971 -6.371 1.091 1.00 0.00 C ATOM 859 O LYS A 484 12.957 -7.090 1.255 1.00 0.00 O ATOM 860 CB LYS A 484 11.544 -5.034 -0.972 1.00 0.00 C ATOM 861 CG LYS A 484 13.033 -4.975 -1.332 1.00 0.00 C ATOM 862 CD LYS A 484 13.308 -3.729 -2.191 1.00 0.00 C ATOM 863 CE LYS A 484 13.236 -2.467 -1.319 1.00 0.00 C ATOM 864 NZ LYS A 484 13.862 -1.322 -2.040 1.00 0.00 N ATOM 0 H LYS A 484 9.230 -5.886 -0.665 1.00 0.00 H new ATOM 0 HA LYS A 484 11.586 -7.192 -0.853 1.00 0.00 H new ATOM 0 HB2 LYS A 484 10.938 -4.952 -1.875 1.00 0.00 H new ATOM 0 HB3 LYS A 484 11.281 -4.191 -0.334 1.00 0.00 H new ATOM 0 HG2 LYS A 484 13.636 -4.943 -0.424 1.00 0.00 H new ATOM 0 HG3 LYS A 484 13.322 -5.875 -1.875 1.00 0.00 H new ATOM 0 HD2 LYS A 484 14.292 -3.806 -2.654 1.00 0.00 H new ATOM 0 HD3 LYS A 484 12.579 -3.665 -2.999 1.00 0.00 H new ATOM 0 HE2 LYS A 484 12.198 -2.236 -1.082 1.00 0.00 H new ATOM 0 HE3 LYS A 484 13.749 -2.637 -0.372 1.00 0.00 H new ATOM 0 HZ1 LYS A 484 13.812 -0.469 -1.447 1.00 0.00 H new ATOM 0 HZ2 LYS A 484 14.857 -1.543 -2.245 1.00 0.00 H new ATOM 0 HZ3 LYS A 484 13.354 -1.154 -2.932 1.00 0.00 H new ATOM 878 N ALA A 485 11.483 -5.588 2.053 1.00 0.00 N ATOM 879 CA ALA A 485 12.108 -5.535 3.377 1.00 0.00 C ATOM 880 C ALA A 485 11.081 -5.200 4.455 1.00 0.00 C ATOM 881 O ALA A 485 10.638 -4.057 4.570 1.00 0.00 O ATOM 882 CB ALA A 485 13.215 -4.482 3.385 1.00 0.00 C ATOM 0 H ALA A 485 10.666 -4.987 1.944 1.00 0.00 H new ATOM 0 HA ALA A 485 12.530 -6.517 3.593 1.00 0.00 H new ATOM 0 HB1 ALA A 485 13.676 -4.447 4.372 1.00 0.00 H new ATOM 0 HB2 ALA A 485 13.969 -4.741 2.641 1.00 0.00 H new ATOM 0 HB3 ALA A 485 12.791 -3.506 3.148 1.00 0.00 H new ATOM 888 N ASN A 486 10.705 -6.206 5.242 1.00 0.00 N ATOM 889 CA ASN A 486 9.731 -6.010 6.310 1.00 0.00 C ATOM 890 C ASN A 486 9.803 -7.144 7.327 1.00 0.00 C ATOM 891 O ASN A 486 10.674 -8.011 7.246 1.00 0.00 O ATOM 892 CB ASN A 486 8.323 -5.931 5.725 1.00 0.00 C ATOM 893 CG ASN A 486 8.112 -7.055 4.722 1.00 0.00 C ATOM 894 OD1 ASN A 486 7.094 -7.087 4.031 1.00 0.00 O ATOM 895 ND2 ASN A 486 9.017 -7.988 4.599 1.00 0.00 N ATOM 0 H ASN A 486 11.058 -7.159 5.160 1.00 0.00 H new ATOM 0 HA ASN A 486 9.966 -5.074 6.818 1.00 0.00 H new ATOM 0 HB2 ASN A 486 7.584 -6.002 6.523 1.00 0.00 H new ATOM 0 HB3 ASN A 486 8.176 -4.967 5.239 1.00 0.00 H new ATOM 0 HD21 ASN A 486 8.881 -8.745 3.929 1.00 0.00 H new ATOM 0 HD22 ASN A 486 9.860 -7.960 5.173 1.00 0.00 H new ATOM 902 N VAL A 487 8.881 -7.130 8.284 1.00 0.00 N ATOM 903 CA VAL A 487 8.846 -8.162 9.311 1.00 0.00 C ATOM 904 C VAL A 487 8.221 -9.441 8.760 1.00 0.00 C ATOM 905 O VAL A 487 8.481 -10.535 9.261 1.00 0.00 O ATOM 906 CB VAL A 487 8.035 -7.675 10.516 1.00 0.00 C ATOM 907 CG1 VAL A 487 8.571 -6.319 10.977 1.00 0.00 C ATOM 908 CG2 VAL A 487 6.562 -7.531 10.119 1.00 0.00 C ATOM 0 H VAL A 487 8.153 -6.420 8.369 1.00 0.00 H new ATOM 0 HA VAL A 487 9.869 -8.373 9.624 1.00 0.00 H new ATOM 0 HB VAL A 487 8.124 -8.398 11.327 1.00 0.00 H new ATOM 0 HG11 VAL A 487 7.994 -5.972 11.834 1.00 0.00 H new ATOM 0 HG12 VAL A 487 9.619 -6.419 11.261 1.00 0.00 H new ATOM 0 HG13 VAL A 487 8.483 -5.598 10.165 1.00 0.00 H new ATOM 0 HG21 VAL A 487 5.986 -7.185 10.977 1.00 0.00 H new ATOM 0 HG22 VAL A 487 6.473 -6.809 9.307 1.00 0.00 H new ATOM 0 HG23 VAL A 487 6.178 -8.497 9.790 1.00 0.00 H new ATOM 918 N ILE A 488 7.400 -9.290 7.722 1.00 0.00 N ATOM 919 CA ILE A 488 6.744 -10.438 7.102 1.00 0.00 C ATOM 920 C ILE A 488 7.643 -11.066 6.044 1.00 0.00 C ATOM 921 O ILE A 488 8.671 -10.498 5.674 1.00 0.00 O ATOM 922 CB ILE A 488 5.419 -10.003 6.463 1.00 0.00 C ATOM 923 CG1 ILE A 488 5.673 -8.905 5.421 1.00 0.00 C ATOM 924 CG2 ILE A 488 4.485 -9.462 7.544 1.00 0.00 C ATOM 925 CD1 ILE A 488 4.380 -8.624 4.653 1.00 0.00 C ATOM 0 H ILE A 488 7.175 -8.391 7.296 1.00 0.00 H new ATOM 0 HA ILE A 488 6.546 -11.180 7.876 1.00 0.00 H new ATOM 0 HB ILE A 488 4.961 -10.864 5.975 1.00 0.00 H new ATOM 0 HG12 ILE A 488 6.022 -7.996 5.912 1.00 0.00 H new ATOM 0 HG13 ILE A 488 6.458 -9.217 4.732 1.00 0.00 H new ATOM 0 HG21 ILE A 488 3.544 -9.153 7.090 1.00 0.00 H new ATOM 0 HG22 ILE A 488 4.293 -10.241 8.282 1.00 0.00 H new ATOM 0 HG23 ILE A 488 4.951 -8.606 8.032 1.00 0.00 H new ATOM 0 HD11 ILE A 488 4.559 -7.844 3.913 1.00 0.00 H new ATOM 0 HD12 ILE A 488 4.051 -9.533 4.150 1.00 0.00 H new ATOM 0 HD13 ILE A 488 3.608 -8.294 5.348 1.00 0.00 H new ATOM 937 N ASN A 489 7.246 -12.240 5.565 1.00 0.00 N ATOM 938 CA ASN A 489 8.017 -12.948 4.547 1.00 0.00 C ATOM 939 C ASN A 489 7.090 -13.781 3.670 1.00 0.00 C ATOM 940 O ASN A 489 5.895 -13.888 3.935 1.00 0.00 O ATOM 941 CB ASN A 489 9.052 -13.858 5.210 1.00 0.00 C ATOM 942 CG ASN A 489 8.409 -14.655 6.339 1.00 0.00 C ATOM 943 OD1 ASN A 489 8.468 -15.885 6.346 1.00 0.00 O ATOM 944 ND2 ASN A 489 7.790 -14.025 7.301 1.00 0.00 N ATOM 0 H ASN A 489 6.398 -12.721 5.864 1.00 0.00 H new ATOM 0 HA ASN A 489 8.531 -12.214 3.926 1.00 0.00 H new ATOM 0 HB2 ASN A 489 9.475 -14.538 4.471 1.00 0.00 H new ATOM 0 HB3 ASN A 489 9.875 -13.260 5.601 1.00 0.00 H new ATOM 0 HD21 ASN A 489 7.355 -14.552 8.059 1.00 0.00 H new ATOM 0 HD22 ASN A 489 7.741 -13.006 7.295 1.00 0.00 H new ATOM 951 N LYS A 490 7.649 -14.367 2.623 1.00 0.00 N ATOM 952 CA LYS A 490 6.863 -15.186 1.708 1.00 0.00 C ATOM 953 C LYS A 490 5.943 -16.125 2.484 1.00 0.00 C ATOM 954 O LYS A 490 4.944 -16.609 1.952 1.00 0.00 O ATOM 955 CB LYS A 490 7.795 -16.001 0.808 1.00 0.00 C ATOM 956 CG LYS A 490 6.983 -16.685 -0.294 1.00 0.00 C ATOM 957 CD LYS A 490 7.929 -17.453 -1.221 1.00 0.00 C ATOM 958 CE LYS A 490 7.121 -18.110 -2.341 1.00 0.00 C ATOM 959 NZ LYS A 490 8.043 -18.844 -3.254 1.00 0.00 N ATOM 0 H LYS A 490 8.638 -14.293 2.385 1.00 0.00 H new ATOM 0 HA LYS A 490 6.250 -14.528 1.092 1.00 0.00 H new ATOM 0 HB2 LYS A 490 8.550 -15.350 0.366 1.00 0.00 H new ATOM 0 HB3 LYS A 490 8.325 -16.748 1.399 1.00 0.00 H new ATOM 0 HG2 LYS A 490 6.254 -17.366 0.146 1.00 0.00 H new ATOM 0 HG3 LYS A 490 6.423 -15.942 -0.862 1.00 0.00 H new ATOM 0 HD2 LYS A 490 8.672 -16.776 -1.643 1.00 0.00 H new ATOM 0 HD3 LYS A 490 8.473 -18.211 -0.657 1.00 0.00 H new ATOM 0 HE2 LYS A 490 6.387 -18.796 -1.920 1.00 0.00 H new ATOM 0 HE3 LYS A 490 6.568 -17.353 -2.897 1.00 0.00 H new ATOM 0 HZ1 LYS A 490 7.494 -19.291 -4.016 1.00 0.00 H new ATOM 0 HZ2 LYS A 490 8.727 -18.178 -3.665 1.00 0.00 H new ATOM 0 HZ3 LYS A 490 8.552 -19.576 -2.718 1.00 0.00 H new ATOM 973 N GLN A 491 6.283 -16.385 3.744 1.00 0.00 N ATOM 974 CA GLN A 491 5.471 -17.273 4.576 1.00 0.00 C ATOM 975 C GLN A 491 4.270 -16.528 5.167 1.00 0.00 C ATOM 976 O GLN A 491 3.120 -16.908 4.941 1.00 0.00 O ATOM 977 CB GLN A 491 6.333 -17.857 5.711 1.00 0.00 C ATOM 978 CG GLN A 491 5.739 -19.184 6.199 1.00 0.00 C ATOM 979 CD GLN A 491 4.383 -18.937 6.845 1.00 0.00 C ATOM 980 OE1 GLN A 491 4.265 -18.098 7.738 1.00 0.00 O ATOM 981 NE2 GLN A 491 3.345 -19.620 6.445 1.00 0.00 N ATOM 0 H GLN A 491 7.105 -15.999 4.208 1.00 0.00 H new ATOM 0 HA GLN A 491 5.096 -18.082 3.949 1.00 0.00 H new ATOM 0 HB2 GLN A 491 7.353 -18.014 5.359 1.00 0.00 H new ATOM 0 HB3 GLN A 491 6.387 -17.149 6.538 1.00 0.00 H new ATOM 0 HG2 GLN A 491 5.633 -19.875 5.362 1.00 0.00 H new ATOM 0 HG3 GLN A 491 6.413 -19.653 6.916 1.00 0.00 H new ATOM 0 HE21 GLN A 491 3.446 -20.315 5.705 1.00 0.00 H new ATOM 0 HE22 GLN A 491 2.433 -19.459 6.873 1.00 0.00 H new ATOM 990 N GLU A 492 4.544 -15.474 5.930 1.00 0.00 N ATOM 991 CA GLU A 492 3.478 -14.691 6.551 1.00 0.00 C ATOM 992 C GLU A 492 2.669 -13.949 5.491 1.00 0.00 C ATOM 993 O GLU A 492 1.454 -13.796 5.618 1.00 0.00 O ATOM 994 CB GLU A 492 4.065 -13.688 7.547 1.00 0.00 C ATOM 995 CG GLU A 492 4.642 -14.431 8.754 1.00 0.00 C ATOM 996 CD GLU A 492 5.295 -13.440 9.713 1.00 0.00 C ATOM 997 OE1 GLU A 492 5.180 -12.250 9.471 1.00 0.00 O ATOM 998 OE2 GLU A 492 5.900 -13.887 10.673 1.00 0.00 O ATOM 0 H GLU A 492 5.487 -15.143 6.133 1.00 0.00 H new ATOM 0 HA GLU A 492 2.818 -15.377 7.082 1.00 0.00 H new ATOM 0 HB2 GLU A 492 4.845 -13.098 7.065 1.00 0.00 H new ATOM 0 HB3 GLU A 492 3.293 -12.991 7.873 1.00 0.00 H new ATOM 0 HG2 GLU A 492 3.851 -14.979 9.267 1.00 0.00 H new ATOM 0 HG3 GLU A 492 5.375 -15.166 8.422 1.00 0.00 H new ATOM 1005 N HIS A 493 3.350 -13.497 4.447 1.00 0.00 N ATOM 1006 CA HIS A 493 2.683 -12.782 3.367 1.00 0.00 C ATOM 1007 C HIS A 493 1.579 -13.648 2.759 1.00 0.00 C ATOM 1008 O HIS A 493 0.503 -13.155 2.421 1.00 0.00 O ATOM 1009 CB HIS A 493 3.698 -12.400 2.291 1.00 0.00 C ATOM 1010 CG HIS A 493 2.984 -11.790 1.109 1.00 0.00 C ATOM 1011 ND1 HIS A 493 2.279 -12.561 0.194 1.00 0.00 N ATOM 1012 CD2 HIS A 493 2.858 -10.491 0.668 1.00 0.00 C ATOM 1013 CE1 HIS A 493 1.772 -11.727 -0.734 1.00 0.00 C ATOM 1014 NE2 HIS A 493 2.096 -10.457 -0.492 1.00 0.00 N ATOM 0 H HIS A 493 4.356 -13.611 4.325 1.00 0.00 H new ATOM 0 HA HIS A 493 2.233 -11.875 3.772 1.00 0.00 H new ATOM 0 HB2 HIS A 493 4.422 -11.692 2.695 1.00 0.00 H new ATOM 0 HB3 HIS A 493 4.256 -13.281 1.975 1.00 0.00 H new ATOM 0 HD1 HIS A 493 2.166 -13.574 0.220 1.00 0.00 H new ATOM 0 HD2 HIS A 493 3.288 -9.627 1.153 1.00 0.00 H new ATOM 0 HE1 HIS A 493 1.174 -12.049 -1.574 1.00 0.00 H new ATOM 1022 N ASP A 494 1.858 -14.940 2.618 1.00 0.00 N ATOM 1023 CA ASP A 494 0.887 -15.872 2.051 1.00 0.00 C ATOM 1024 C ASP A 494 -0.309 -16.065 2.988 1.00 0.00 C ATOM 1025 O ASP A 494 -1.441 -16.240 2.537 1.00 0.00 O ATOM 1026 CB ASP A 494 1.550 -17.226 1.797 1.00 0.00 C ATOM 1027 CG ASP A 494 0.642 -18.097 0.935 1.00 0.00 C ATOM 1028 OD1 ASP A 494 0.377 -17.711 -0.191 1.00 0.00 O ATOM 1029 OD2 ASP A 494 0.222 -19.137 1.416 1.00 0.00 O ATOM 0 H ASP A 494 2.745 -15.365 2.887 1.00 0.00 H new ATOM 0 HA ASP A 494 0.529 -15.451 1.111 1.00 0.00 H new ATOM 0 HB2 ASP A 494 2.509 -17.083 1.300 1.00 0.00 H new ATOM 0 HB3 ASP A 494 1.753 -17.724 2.745 1.00 0.00 H new ATOM 1034 N ILE A 495 -0.047 -16.052 4.294 1.00 0.00 N ATOM 1035 CA ILE A 495 -1.107 -16.247 5.285 1.00 0.00 C ATOM 1036 C ILE A 495 -2.141 -15.123 5.208 1.00 0.00 C ATOM 1037 O ILE A 495 -3.345 -15.375 5.244 1.00 0.00 O ATOM 1038 CB ILE A 495 -0.500 -16.288 6.696 1.00 0.00 C ATOM 1039 CG1 ILE A 495 0.348 -17.560 6.858 1.00 0.00 C ATOM 1040 CG2 ILE A 495 -1.613 -16.257 7.757 1.00 0.00 C ATOM 1041 CD1 ILE A 495 1.051 -17.574 8.219 1.00 0.00 C ATOM 0 H ILE A 495 0.882 -15.910 4.690 1.00 0.00 H new ATOM 0 HA ILE A 495 -1.605 -17.193 5.070 1.00 0.00 H new ATOM 0 HB ILE A 495 0.136 -15.413 6.834 1.00 0.00 H new ATOM 0 HG12 ILE A 495 -0.287 -18.441 6.762 1.00 0.00 H new ATOM 0 HG13 ILE A 495 1.089 -17.613 6.060 1.00 0.00 H new ATOM 0 HG21 ILE A 495 -1.168 -16.287 8.752 1.00 0.00 H new ATOM 0 HG22 ILE A 495 -2.195 -15.342 7.647 1.00 0.00 H new ATOM 0 HG23 ILE A 495 -2.265 -17.120 7.625 1.00 0.00 H new ATOM 0 HD11 ILE A 495 1.645 -18.483 8.312 1.00 0.00 H new ATOM 0 HD12 ILE A 495 1.703 -16.704 8.301 1.00 0.00 H new ATOM 0 HD13 ILE A 495 0.306 -17.545 9.014 1.00 0.00 H new ATOM 1147 N GLN A 501 -8.549 -11.504 2.711 1.00 0.00 N ATOM 1148 CA GLN A 501 -8.694 -11.117 1.300 1.00 0.00 C ATOM 1149 C GLN A 501 -8.249 -9.672 1.096 1.00 0.00 C ATOM 1150 O GLN A 501 -7.820 -9.010 2.035 1.00 0.00 O ATOM 1151 CB GLN A 501 -10.160 -11.271 0.874 1.00 0.00 C ATOM 1152 CG GLN A 501 -10.570 -12.746 0.911 1.00 0.00 C ATOM 1153 CD GLN A 501 -12.031 -12.882 0.499 1.00 0.00 C ATOM 1154 OE1 GLN A 501 -12.922 -12.391 1.194 1.00 0.00 O ATOM 1155 NE2 GLN A 501 -12.336 -13.520 -0.598 1.00 0.00 N ATOM 0 HA GLN A 501 -8.065 -11.766 0.690 1.00 0.00 H new ATOM 0 HB2 GLN A 501 -10.802 -10.691 1.537 1.00 0.00 H new ATOM 0 HB3 GLN A 501 -10.298 -10.873 -0.131 1.00 0.00 H new ATOM 0 HG2 GLN A 501 -9.937 -13.327 0.240 1.00 0.00 H new ATOM 0 HG3 GLN A 501 -10.426 -13.149 1.913 1.00 0.00 H new ATOM 0 HE21 GLN A 501 -11.598 -13.926 -1.173 1.00 0.00 H new ATOM 0 HE22 GLN A 501 -13.312 -13.612 -0.880 1.00 0.00 H new ATOM 1164 N ILE A 502 -8.375 -9.186 -0.134 1.00 0.00 N ATOM 1165 CA ILE A 502 -7.998 -7.811 -0.451 1.00 0.00 C ATOM 1166 C ILE A 502 -8.519 -6.835 0.630 1.00 0.00 C ATOM 1167 O ILE A 502 -7.727 -6.127 1.250 1.00 0.00 O ATOM 1168 CB ILE A 502 -8.546 -7.427 -1.851 1.00 0.00 C ATOM 1169 CG1 ILE A 502 -7.588 -7.923 -2.944 1.00 0.00 C ATOM 1170 CG2 ILE A 502 -8.694 -5.903 -1.978 1.00 0.00 C ATOM 1171 CD1 ILE A 502 -7.349 -9.424 -2.773 1.00 0.00 C ATOM 0 H ILE A 502 -8.734 -9.720 -0.926 1.00 0.00 H new ATOM 0 HA ILE A 502 -6.911 -7.739 -0.467 1.00 0.00 H new ATOM 0 HB ILE A 502 -9.523 -7.895 -1.971 1.00 0.00 H new ATOM 0 HG12 ILE A 502 -8.008 -7.721 -3.929 1.00 0.00 H new ATOM 0 HG13 ILE A 502 -6.642 -7.385 -2.885 1.00 0.00 H new ATOM 0 HG21 ILE A 502 -9.080 -5.656 -2.967 1.00 0.00 H new ATOM 0 HG22 ILE A 502 -9.386 -5.540 -1.218 1.00 0.00 H new ATOM 0 HG23 ILE A 502 -7.722 -5.430 -1.839 1.00 0.00 H new ATOM 0 HD11 ILE A 502 -6.669 -9.775 -3.549 1.00 0.00 H new ATOM 0 HD12 ILE A 502 -6.910 -9.613 -1.793 1.00 0.00 H new ATOM 0 HD13 ILE A 502 -8.297 -9.955 -2.854 1.00 0.00 H new ATOM 1183 N PRO A 503 -9.818 -6.764 0.865 1.00 0.00 N ATOM 1184 CA PRO A 503 -10.397 -5.827 1.887 1.00 0.00 C ATOM 1185 C PRO A 503 -9.738 -5.980 3.262 1.00 0.00 C ATOM 1186 O PRO A 503 -9.519 -4.995 3.965 1.00 0.00 O ATOM 1187 CB PRO A 503 -11.899 -6.199 1.930 1.00 0.00 C ATOM 1188 CG PRO A 503 -11.991 -7.533 1.262 1.00 0.00 C ATOM 1189 CD PRO A 503 -10.887 -7.540 0.217 1.00 0.00 C ATOM 0 HA PRO A 503 -10.229 -4.783 1.622 1.00 0.00 H new ATOM 0 HB2 PRO A 503 -12.264 -6.246 2.956 1.00 0.00 H new ATOM 0 HB3 PRO A 503 -12.504 -5.456 1.411 1.00 0.00 H new ATOM 0 HG2 PRO A 503 -11.857 -8.342 1.980 1.00 0.00 H new ATOM 0 HG3 PRO A 503 -12.969 -7.675 0.801 1.00 0.00 H new ATOM 0 HD2 PRO A 503 -10.563 -8.553 -0.022 1.00 0.00 H new ATOM 0 HD3 PRO A 503 -11.211 -7.080 -0.717 1.00 0.00 H new ATOM 1197 N LEU A 504 -9.419 -7.214 3.639 1.00 0.00 N ATOM 1198 CA LEU A 504 -8.781 -7.471 4.931 1.00 0.00 C ATOM 1199 C LEU A 504 -7.264 -7.424 4.787 1.00 0.00 C ATOM 1200 O LEU A 504 -6.536 -7.361 5.778 1.00 0.00 O ATOM 1201 CB LEU A 504 -9.216 -8.838 5.463 1.00 0.00 C ATOM 1202 CG LEU A 504 -10.738 -8.868 5.652 1.00 0.00 C ATOM 1203 CD1 LEU A 504 -11.167 -10.277 6.077 1.00 0.00 C ATOM 1204 CD2 LEU A 504 -11.166 -7.848 6.723 1.00 0.00 C ATOM 0 H LEU A 504 -9.589 -8.047 3.076 1.00 0.00 H new ATOM 0 HA LEU A 504 -9.089 -6.700 5.637 1.00 0.00 H new ATOM 0 HB2 LEU A 504 -8.912 -9.621 4.768 1.00 0.00 H new ATOM 0 HB3 LEU A 504 -8.719 -9.043 6.411 1.00 0.00 H new ATOM 0 HG LEU A 504 -11.220 -8.605 4.710 1.00 0.00 H new ATOM 0 HD11 LEU A 504 -12.248 -10.303 6.212 1.00 0.00 H new ATOM 0 HD12 LEU A 504 -10.881 -10.993 5.306 1.00 0.00 H new ATOM 0 HD13 LEU A 504 -10.677 -10.539 7.015 1.00 0.00 H new ATOM 0 HD21 LEU A 504 -12.249 -7.882 6.845 1.00 0.00 H new ATOM 0 HD22 LEU A 504 -10.686 -8.092 7.671 1.00 0.00 H new ATOM 0 HD23 LEU A 504 -10.867 -6.847 6.412 1.00 0.00 H new ATOM 1216 N GLN A 505 -6.793 -7.442 3.547 1.00 0.00 N ATOM 1217 CA GLN A 505 -5.361 -7.388 3.286 1.00 0.00 C ATOM 1218 C GLN A 505 -4.811 -6.032 3.701 1.00 0.00 C ATOM 1219 O GLN A 505 -3.723 -5.940 4.269 1.00 0.00 O ATOM 1220 CB GLN A 505 -5.085 -7.630 1.798 1.00 0.00 C ATOM 1221 CG GLN A 505 -3.577 -7.778 1.571 1.00 0.00 C ATOM 1222 CD GLN A 505 -3.101 -9.114 2.124 1.00 0.00 C ATOM 1223 OE1 GLN A 505 -2.118 -9.171 2.863 1.00 0.00 O ATOM 1224 NE2 GLN A 505 -3.742 -10.201 1.795 1.00 0.00 N ATOM 0 H GLN A 505 -7.377 -7.493 2.712 1.00 0.00 H new ATOM 0 HA GLN A 505 -4.867 -8.167 3.866 1.00 0.00 H new ATOM 0 HB2 GLN A 505 -5.603 -8.529 1.463 1.00 0.00 H new ATOM 0 HB3 GLN A 505 -5.472 -6.800 1.207 1.00 0.00 H new ATOM 0 HG2 GLN A 505 -3.352 -7.714 0.506 1.00 0.00 H new ATOM 0 HG3 GLN A 505 -3.045 -6.962 2.059 1.00 0.00 H new ATOM 0 HE21 GLN A 505 -4.556 -10.148 1.182 1.00 0.00 H new ATOM 0 HE22 GLN A 505 -3.430 -11.105 2.150 1.00 0.00 H new ATOM 1233 N ALA A 506 -5.567 -4.982 3.409 1.00 0.00 N ATOM 1234 CA ALA A 506 -5.145 -3.637 3.760 1.00 0.00 C ATOM 1235 C ALA A 506 -5.178 -3.445 5.272 1.00 0.00 C ATOM 1236 O ALA A 506 -4.313 -2.781 5.841 1.00 0.00 O ATOM 1237 CB ALA A 506 -6.056 -2.608 3.088 1.00 0.00 C ATOM 0 H ALA A 506 -6.468 -5.036 2.934 1.00 0.00 H new ATOM 0 HA ALA A 506 -4.123 -3.494 3.410 1.00 0.00 H new ATOM 0 HB1 ALA A 506 -5.731 -1.603 3.358 1.00 0.00 H new ATOM 0 HB2 ALA A 506 -6.004 -2.728 2.006 1.00 0.00 H new ATOM 0 HB3 ALA A 506 -7.083 -2.759 3.421 1.00 0.00 H new ATOM 1243 N ARG A 507 -6.182 -4.032 5.916 1.00 0.00 N ATOM 1244 CA ARG A 507 -6.312 -3.908 7.364 1.00 0.00 C ATOM 1245 C ARG A 507 -5.117 -4.525 8.067 1.00 0.00 C ATOM 1246 O ARG A 507 -4.498 -3.901 8.928 1.00 0.00 O ATOM 1247 CB ARG A 507 -7.598 -4.592 7.832 1.00 0.00 C ATOM 1248 CG ARG A 507 -7.811 -4.326 9.326 1.00 0.00 C ATOM 1249 CD ARG A 507 -9.092 -5.020 9.790 1.00 0.00 C ATOM 1250 NE ARG A 507 -8.930 -6.468 9.727 1.00 0.00 N ATOM 1251 CZ ARG A 507 -9.936 -7.290 10.015 1.00 0.00 C ATOM 1252 NH1 ARG A 507 -11.093 -6.805 10.373 1.00 0.00 N ATOM 1253 NH2 ARG A 507 -9.762 -8.580 9.943 1.00 0.00 N ATOM 0 H ARG A 507 -6.908 -4.590 5.467 1.00 0.00 H new ATOM 0 HA ARG A 507 -6.353 -2.848 7.616 1.00 0.00 H new ATOM 0 HB2 ARG A 507 -8.448 -4.218 7.262 1.00 0.00 H new ATOM 0 HB3 ARG A 507 -7.538 -5.665 7.649 1.00 0.00 H new ATOM 0 HG2 ARG A 507 -6.958 -4.694 9.897 1.00 0.00 H new ATOM 0 HG3 ARG A 507 -7.879 -3.254 9.509 1.00 0.00 H new ATOM 0 HD2 ARG A 507 -9.330 -4.717 10.810 1.00 0.00 H new ATOM 0 HD3 ARG A 507 -9.929 -4.712 9.163 1.00 0.00 H new ATOM 0 HE ARG A 507 -8.027 -6.859 9.457 1.00 0.00 H new ATOM 0 HH11 ARG A 507 -11.227 -5.796 10.432 1.00 0.00 H new ATOM 0 HH12 ARG A 507 -11.864 -7.435 10.594 1.00 0.00 H new ATOM 0 HH21 ARG A 507 -8.856 -8.958 9.666 1.00 0.00 H new ATOM 0 HH22 ARG A 507 -10.532 -9.212 10.163 1.00 0.00 H new ATOM 1267 N GLU A 508 -4.790 -5.751 7.693 1.00 0.00 N ATOM 1268 CA GLU A 508 -3.655 -6.429 8.302 1.00 0.00 C ATOM 1269 C GLU A 508 -2.359 -5.727 7.907 1.00 0.00 C ATOM 1270 O GLU A 508 -1.409 -5.669 8.689 1.00 0.00 O ATOM 1271 CB GLU A 508 -3.619 -7.894 7.860 1.00 0.00 C ATOM 1272 CG GLU A 508 -2.740 -8.699 8.823 1.00 0.00 C ATOM 1273 CD GLU A 508 -3.442 -8.849 10.168 1.00 0.00 C ATOM 1274 OE1 GLU A 508 -4.598 -8.470 10.258 1.00 0.00 O ATOM 1275 OE2 GLU A 508 -2.811 -9.341 11.090 1.00 0.00 O ATOM 0 H GLU A 508 -5.284 -6.291 6.983 1.00 0.00 H new ATOM 0 HA GLU A 508 -3.760 -6.394 9.386 1.00 0.00 H new ATOM 0 HB2 GLU A 508 -4.629 -8.304 7.844 1.00 0.00 H new ATOM 0 HB3 GLU A 508 -3.228 -7.969 6.845 1.00 0.00 H new ATOM 0 HG2 GLU A 508 -2.530 -9.682 8.401 1.00 0.00 H new ATOM 0 HG3 GLU A 508 -1.781 -8.199 8.958 1.00 0.00 H new ATOM 1282 N LEU A 509 -2.332 -5.194 6.690 1.00 0.00 N ATOM 1283 CA LEU A 509 -1.150 -4.492 6.198 1.00 0.00 C ATOM 1284 C LEU A 509 -0.871 -3.250 7.042 1.00 0.00 C ATOM 1285 O LEU A 509 0.273 -2.992 7.404 1.00 0.00 O ATOM 1286 CB LEU A 509 -1.368 -4.080 4.740 1.00 0.00 C ATOM 1287 CG LEU A 509 -0.106 -3.402 4.185 1.00 0.00 C ATOM 1288 CD1 LEU A 509 1.062 -4.405 4.150 1.00 0.00 C ATOM 1289 CD2 LEU A 509 -0.398 -2.879 2.770 1.00 0.00 C ATOM 0 H LEU A 509 -3.108 -5.233 6.030 1.00 0.00 H new ATOM 0 HA LEU A 509 -0.293 -5.162 6.268 1.00 0.00 H new ATOM 0 HB2 LEU A 509 -1.613 -4.956 4.140 1.00 0.00 H new ATOM 0 HB3 LEU A 509 -2.216 -3.399 4.670 1.00 0.00 H new ATOM 0 HG LEU A 509 0.174 -2.569 4.830 1.00 0.00 H new ATOM 0 HD11 LEU A 509 1.951 -3.914 3.755 1.00 0.00 H new ATOM 0 HD12 LEU A 509 1.264 -4.764 5.159 1.00 0.00 H new ATOM 0 HD13 LEU A 509 0.799 -5.248 3.511 1.00 0.00 H new ATOM 0 HD21 LEU A 509 0.493 -2.396 2.369 1.00 0.00 H new ATOM 0 HD22 LEU A 509 -0.681 -3.711 2.126 1.00 0.00 H new ATOM 0 HD23 LEU A 509 -1.214 -2.158 2.810 1.00 0.00 H new ATOM 1301 N ILE A 510 -1.915 -2.488 7.357 1.00 0.00 N ATOM 1302 CA ILE A 510 -1.745 -1.276 8.157 1.00 0.00 C ATOM 1303 C ILE A 510 -1.191 -1.621 9.532 1.00 0.00 C ATOM 1304 O ILE A 510 -0.300 -0.939 10.040 1.00 0.00 O ATOM 1305 CB ILE A 510 -3.087 -0.546 8.291 1.00 0.00 C ATOM 1306 CG1 ILE A 510 -3.474 0.040 6.925 1.00 0.00 C ATOM 1307 CG2 ILE A 510 -2.971 0.585 9.319 1.00 0.00 C ATOM 1308 CD1 ILE A 510 -4.965 0.386 6.913 1.00 0.00 C ATOM 0 H ILE A 510 -2.876 -2.683 7.076 1.00 0.00 H new ATOM 0 HA ILE A 510 -1.034 -0.620 7.655 1.00 0.00 H new ATOM 0 HB ILE A 510 -3.850 -1.249 8.625 1.00 0.00 H new ATOM 0 HG12 ILE A 510 -2.883 0.933 6.721 1.00 0.00 H new ATOM 0 HG13 ILE A 510 -3.251 -0.677 6.135 1.00 0.00 H new ATOM 0 HG21 ILE A 510 -3.929 1.097 9.406 1.00 0.00 H new ATOM 0 HG22 ILE A 510 -2.692 0.169 10.287 1.00 0.00 H new ATOM 0 HG23 ILE A 510 -2.209 1.294 8.995 1.00 0.00 H new ATOM 0 HD11 ILE A 510 -5.234 0.801 5.942 1.00 0.00 H new ATOM 0 HD12 ILE A 510 -5.549 -0.516 7.097 1.00 0.00 H new ATOM 0 HD13 ILE A 510 -5.175 1.119 7.692 1.00 0.00 H new ATOM 1320 N ASP A 511 -1.721 -2.674 10.132 1.00 0.00 N ATOM 1321 CA ASP A 511 -1.264 -3.091 11.453 1.00 0.00 C ATOM 1322 C ASP A 511 0.263 -3.062 11.521 1.00 0.00 C ATOM 1323 O ASP A 511 0.838 -2.582 12.498 1.00 0.00 O ATOM 1324 CB ASP A 511 -1.769 -4.502 11.752 1.00 0.00 C ATOM 1325 CG ASP A 511 -1.477 -4.867 13.203 1.00 0.00 C ATOM 1326 OD1 ASP A 511 -0.700 -4.162 13.827 1.00 0.00 O ATOM 1327 OD2 ASP A 511 -2.034 -5.845 13.671 1.00 0.00 O ATOM 0 H ASP A 511 -2.460 -3.252 9.733 1.00 0.00 H new ATOM 0 HA ASP A 511 -1.661 -2.400 12.197 1.00 0.00 H new ATOM 0 HB2 ASP A 511 -2.841 -4.561 11.563 1.00 0.00 H new ATOM 0 HB3 ASP A 511 -1.288 -5.218 11.085 1.00 0.00 H new ATOM 1332 N THR A 512 0.915 -3.576 10.482 1.00 0.00 N ATOM 1333 CA THR A 512 2.374 -3.595 10.439 1.00 0.00 C ATOM 1334 C THR A 512 2.929 -2.171 10.381 1.00 0.00 C ATOM 1335 O THR A 512 3.918 -1.855 11.042 1.00 0.00 O ATOM 1336 CB THR A 512 2.862 -4.391 9.224 1.00 0.00 C ATOM 1337 OG1 THR A 512 2.403 -5.732 9.315 1.00 0.00 O ATOM 1338 CG2 THR A 512 4.391 -4.376 9.177 1.00 0.00 C ATOM 0 H THR A 512 0.460 -3.982 9.664 1.00 0.00 H new ATOM 0 HA THR A 512 2.735 -4.077 11.348 1.00 0.00 H new ATOM 0 HB THR A 512 2.469 -3.935 8.316 1.00 0.00 H new ATOM 0 HG1 THR A 512 2.715 -6.238 8.536 1.00 0.00 H new ATOM 0 HG21 THR A 512 4.734 -4.943 8.312 1.00 0.00 H new ATOM 0 HG22 THR A 512 4.743 -3.347 9.099 1.00 0.00 H new ATOM 0 HG23 THR A 512 4.787 -4.827 10.087 1.00 0.00 H new ATOM 1346 N ILE A 513 2.283 -1.315 9.592 1.00 0.00 N ATOM 1347 CA ILE A 513 2.720 0.074 9.458 1.00 0.00 C ATOM 1348 C ILE A 513 2.688 0.761 10.819 1.00 0.00 C ATOM 1349 O ILE A 513 3.590 1.523 11.160 1.00 0.00 O ATOM 1350 CB ILE A 513 1.811 0.835 8.484 1.00 0.00 C ATOM 1351 CG1 ILE A 513 1.746 0.075 7.156 1.00 0.00 C ATOM 1352 CG2 ILE A 513 2.360 2.249 8.243 1.00 0.00 C ATOM 1353 CD1 ILE A 513 0.968 0.885 6.118 1.00 0.00 C ATOM 0 H ILE A 513 1.461 -1.556 9.039 1.00 0.00 H new ATOM 0 HA ILE A 513 3.738 0.078 9.068 1.00 0.00 H new ATOM 0 HB ILE A 513 0.812 0.914 8.913 1.00 0.00 H new ATOM 0 HG12 ILE A 513 2.754 -0.122 6.792 1.00 0.00 H new ATOM 0 HG13 ILE A 513 1.267 -0.892 7.306 1.00 0.00 H new ATOM 0 HG21 ILE A 513 1.707 2.780 7.550 1.00 0.00 H new ATOM 0 HG22 ILE A 513 2.402 2.789 9.189 1.00 0.00 H new ATOM 0 HG23 ILE A 513 3.362 2.183 7.819 1.00 0.00 H new ATOM 0 HD11 ILE A 513 0.930 0.332 5.179 1.00 0.00 H new ATOM 0 HD12 ILE A 513 -0.046 1.059 6.478 1.00 0.00 H new ATOM 0 HD13 ILE A 513 1.465 1.842 5.956 1.00 0.00 H new ATOM 1365 N LEU A 514 1.639 0.493 11.587 1.00 0.00 N ATOM 1366 CA LEU A 514 1.497 1.105 12.902 1.00 0.00 C ATOM 1367 C LEU A 514 2.715 0.793 13.768 1.00 0.00 C ATOM 1368 O LEU A 514 3.257 1.678 14.428 1.00 0.00 O ATOM 1369 CB LEU A 514 0.230 0.571 13.589 1.00 0.00 C ATOM 1370 CG LEU A 514 0.086 1.176 14.998 1.00 0.00 C ATOM 1371 CD1 LEU A 514 0.089 2.714 14.924 1.00 0.00 C ATOM 1372 CD2 LEU A 514 -1.229 0.694 15.620 1.00 0.00 C ATOM 0 H LEU A 514 0.881 -0.138 11.326 1.00 0.00 H new ATOM 0 HA LEU A 514 1.418 2.185 12.778 1.00 0.00 H new ATOM 0 HB2 LEU A 514 -0.647 0.816 12.990 1.00 0.00 H new ATOM 0 HB3 LEU A 514 0.276 -0.516 13.656 1.00 0.00 H new ATOM 0 HG LEU A 514 0.927 0.855 15.612 1.00 0.00 H new ATOM 0 HD11 LEU A 514 -0.014 3.127 15.928 1.00 0.00 H new ATOM 0 HD12 LEU A 514 1.027 3.055 14.485 1.00 0.00 H new ATOM 0 HD13 LEU A 514 -0.744 3.050 14.307 1.00 0.00 H new ATOM 0 HD21 LEU A 514 -1.337 1.119 16.618 1.00 0.00 H new ATOM 0 HD22 LEU A 514 -2.065 1.013 14.997 1.00 0.00 H new ATOM 0 HD23 LEU A 514 -1.222 -0.394 15.688 1.00 0.00 H new ATOM 1384 N VAL A 515 3.137 -0.467 13.768 1.00 0.00 N ATOM 1385 CA VAL A 515 4.291 -0.868 14.566 1.00 0.00 C ATOM 1386 C VAL A 515 5.559 -0.176 14.064 1.00 0.00 C ATOM 1387 O VAL A 515 6.330 0.373 14.852 1.00 0.00 O ATOM 1388 CB VAL A 515 4.471 -2.386 14.498 1.00 0.00 C ATOM 1389 CG1 VAL A 515 5.756 -2.790 15.224 1.00 0.00 C ATOM 1390 CG2 VAL A 515 3.275 -3.074 15.160 1.00 0.00 C ATOM 0 H VAL A 515 2.704 -1.220 13.232 1.00 0.00 H new ATOM 0 HA VAL A 515 4.116 -0.570 15.600 1.00 0.00 H new ATOM 0 HB VAL A 515 4.536 -2.692 13.454 1.00 0.00 H new ATOM 0 HG11 VAL A 515 5.878 -3.872 15.172 1.00 0.00 H new ATOM 0 HG12 VAL A 515 6.609 -2.305 14.750 1.00 0.00 H new ATOM 0 HG13 VAL A 515 5.697 -2.481 16.268 1.00 0.00 H new ATOM 0 HG21 VAL A 515 3.404 -4.155 15.111 1.00 0.00 H new ATOM 0 HG22 VAL A 515 3.208 -2.763 16.203 1.00 0.00 H new ATOM 0 HG23 VAL A 515 2.360 -2.794 14.638 1.00 0.00 H new ATOM 1400 N LYS A 516 5.772 -0.212 12.752 1.00 0.00 N ATOM 1401 CA LYS A 516 6.954 0.408 12.157 1.00 0.00 C ATOM 1402 C LYS A 516 6.939 1.924 12.355 1.00 0.00 C ATOM 1403 O LYS A 516 7.959 2.527 12.685 1.00 0.00 O ATOM 1404 CB LYS A 516 7.014 0.086 10.663 1.00 0.00 C ATOM 1405 CG LYS A 516 7.320 -1.404 10.462 1.00 0.00 C ATOM 1406 CD LYS A 516 7.376 -1.726 8.965 1.00 0.00 C ATOM 1407 CE LYS A 516 7.676 -3.212 8.770 1.00 0.00 C ATOM 1408 NZ LYS A 516 9.079 -3.493 9.188 1.00 0.00 N ATOM 0 H LYS A 516 5.146 -0.661 12.083 1.00 0.00 H new ATOM 0 HA LYS A 516 7.836 0.004 12.655 1.00 0.00 H new ATOM 0 HB2 LYS A 516 6.065 0.339 10.189 1.00 0.00 H new ATOM 0 HB3 LYS A 516 7.782 0.692 10.182 1.00 0.00 H new ATOM 0 HG2 LYS A 516 8.270 -1.656 10.933 1.00 0.00 H new ATOM 0 HG3 LYS A 516 6.554 -2.010 10.945 1.00 0.00 H new ATOM 0 HD2 LYS A 516 6.427 -1.471 8.492 1.00 0.00 H new ATOM 0 HD3 LYS A 516 8.145 -1.123 8.482 1.00 0.00 H new ATOM 0 HE2 LYS A 516 6.983 -3.814 9.357 1.00 0.00 H new ATOM 0 HE3 LYS A 516 7.534 -3.489 7.725 1.00 0.00 H new ATOM 0 HZ1 LYS A 516 9.403 -4.376 8.744 1.00 0.00 H new ATOM 0 HZ2 LYS A 516 9.694 -2.709 8.889 1.00 0.00 H new ATOM 0 HZ3 LYS A 516 9.120 -3.590 10.223 1.00 0.00 H new ATOM 1422 N GLY A 517 5.773 2.530 12.153 1.00 0.00 N ATOM 1423 CA GLY A 517 5.628 3.974 12.314 1.00 0.00 C ATOM 1424 C GLY A 517 6.224 4.737 11.136 1.00 0.00 C ATOM 1425 O GLY A 517 6.042 4.358 9.981 1.00 0.00 O ATOM 0 H GLY A 517 4.918 2.047 11.879 1.00 0.00 H new ATOM 0 HA2 GLY A 517 4.572 4.225 12.413 1.00 0.00 H new ATOM 0 HA3 GLY A 517 6.118 4.288 13.236 1.00 0.00 H new ATOM 1429 N ASN A 518 6.927 5.826 11.441 1.00 0.00 N ATOM 1430 CA ASN A 518 7.535 6.651 10.402 1.00 0.00 C ATOM 1431 C ASN A 518 8.473 5.817 9.537 1.00 0.00 C ATOM 1432 O ASN A 518 8.659 6.104 8.354 1.00 0.00 O ATOM 1433 CB ASN A 518 8.307 7.808 11.043 1.00 0.00 C ATOM 1434 CG ASN A 518 8.690 8.842 9.990 1.00 0.00 C ATOM 1435 OD1 ASN A 518 8.711 8.541 8.795 1.00 0.00 O ATOM 1436 ND2 ASN A 518 9.004 10.051 10.369 1.00 0.00 N ATOM 0 H ASN A 518 7.088 6.155 12.393 1.00 0.00 H new ATOM 0 HA ASN A 518 6.744 7.053 9.768 1.00 0.00 H new ATOM 0 HB2 ASN A 518 7.697 8.276 11.816 1.00 0.00 H new ATOM 0 HB3 ASN A 518 9.204 7.428 11.531 1.00 0.00 H new ATOM 0 HD21 ASN A 518 9.268 10.751 9.675 1.00 0.00 H new ATOM 0 HD22 ASN A 518 8.985 10.296 11.359 1.00 0.00 H new ATOM 1443 N ALA A 519 9.058 4.784 10.126 1.00 0.00 N ATOM 1444 CA ALA A 519 9.967 3.920 9.388 1.00 0.00 C ATOM 1445 C ALA A 519 9.262 3.336 8.164 1.00 0.00 C ATOM 1446 O ALA A 519 9.899 3.041 7.154 1.00 0.00 O ATOM 1447 CB ALA A 519 10.469 2.797 10.302 1.00 0.00 C ATOM 0 H ALA A 519 8.921 4.526 11.103 1.00 0.00 H new ATOM 0 HA ALA A 519 10.820 4.506 9.047 1.00 0.00 H new ATOM 0 HB1 ALA A 519 11.149 2.152 9.746 1.00 0.00 H new ATOM 0 HB2 ALA A 519 10.994 3.229 11.154 1.00 0.00 H new ATOM 0 HB3 ALA A 519 9.622 2.210 10.657 1.00 0.00 H new ATOM 1453 N ALA A 520 7.938 3.180 8.250 1.00 0.00 N ATOM 1454 CA ALA A 520 7.163 2.640 7.127 1.00 0.00 C ATOM 1455 C ALA A 520 6.495 3.764 6.336 1.00 0.00 C ATOM 1456 O ALA A 520 6.021 3.551 5.221 1.00 0.00 O ATOM 1457 CB ALA A 520 6.094 1.679 7.644 1.00 0.00 C ATOM 0 H ALA A 520 7.385 3.416 9.074 1.00 0.00 H new ATOM 0 HA ALA A 520 7.848 2.106 6.468 1.00 0.00 H new ATOM 0 HB1 ALA A 520 5.524 1.283 6.804 1.00 0.00 H new ATOM 0 HB2 ALA A 520 6.571 0.857 8.178 1.00 0.00 H new ATOM 0 HB3 ALA A 520 5.423 2.210 8.320 1.00 0.00 H new ATOM 1463 N ALA A 521 6.449 4.956 6.918 1.00 0.00 N ATOM 1464 CA ALA A 521 5.823 6.088 6.243 1.00 0.00 C ATOM 1465 C ALA A 521 6.545 6.405 4.936 1.00 0.00 C ATOM 1466 O ALA A 521 5.909 6.662 3.914 1.00 0.00 O ATOM 1467 CB ALA A 521 5.848 7.323 7.146 1.00 0.00 C ATOM 0 H ALA A 521 6.831 5.163 7.841 1.00 0.00 H new ATOM 0 HA ALA A 521 4.790 5.819 6.022 1.00 0.00 H new ATOM 0 HB1 ALA A 521 5.378 8.160 6.630 1.00 0.00 H new ATOM 0 HB2 ALA A 521 5.304 7.112 8.066 1.00 0.00 H new ATOM 0 HB3 ALA A 521 6.880 7.578 7.385 1.00 0.00 H new ATOM 1473 N ASN A 522 7.875 6.380 4.971 1.00 0.00 N ATOM 1474 CA ASN A 522 8.664 6.671 3.777 1.00 0.00 C ATOM 1475 C ASN A 522 8.365 5.656 2.676 1.00 0.00 C ATOM 1476 O ASN A 522 8.148 6.025 1.525 1.00 0.00 O ATOM 1477 CB ASN A 522 10.160 6.640 4.119 1.00 0.00 C ATOM 1478 CG ASN A 522 10.621 5.198 4.321 1.00 0.00 C ATOM 1479 OD1 ASN A 522 11.587 4.758 3.699 1.00 0.00 O ATOM 1480 ND2 ASN A 522 9.973 4.429 5.148 1.00 0.00 N ATOM 0 H ASN A 522 8.424 6.164 5.803 1.00 0.00 H new ATOM 0 HA ASN A 522 8.396 7.665 3.418 1.00 0.00 H new ATOM 0 HB2 ASN A 522 10.734 7.105 3.318 1.00 0.00 H new ATOM 0 HB3 ASN A 522 10.347 7.220 5.023 1.00 0.00 H new ATOM 0 HD21 ASN A 522 10.266 3.461 5.281 1.00 0.00 H new ATOM 0 HD22 ASN A 522 9.172 4.795 5.663 1.00 0.00 H new ATOM 1487 N ILE A 523 8.350 4.377 3.037 1.00 0.00 N ATOM 1488 CA ILE A 523 8.066 3.331 2.062 1.00 0.00 C ATOM 1489 C ILE A 523 6.633 3.461 1.560 1.00 0.00 C ATOM 1490 O ILE A 523 6.372 3.349 0.363 1.00 0.00 O ATOM 1491 CB ILE A 523 8.283 1.948 2.691 1.00 0.00 C ATOM 1492 CG1 ILE A 523 9.779 1.732 2.948 1.00 0.00 C ATOM 1493 CG2 ILE A 523 7.770 0.856 1.741 1.00 0.00 C ATOM 1494 CD1 ILE A 523 9.976 0.496 3.831 1.00 0.00 C ATOM 0 H ILE A 523 8.529 4.043 3.984 1.00 0.00 H new ATOM 0 HA ILE A 523 8.747 3.442 1.218 1.00 0.00 H new ATOM 0 HB ILE A 523 7.736 1.894 3.632 1.00 0.00 H new ATOM 0 HG12 ILE A 523 10.306 1.603 2.002 1.00 0.00 H new ATOM 0 HG13 ILE A 523 10.205 2.610 3.434 1.00 0.00 H new ATOM 0 HG21 ILE A 523 7.927 -0.123 2.194 1.00 0.00 H new ATOM 0 HG22 ILE A 523 6.706 1.004 1.557 1.00 0.00 H new ATOM 0 HG23 ILE A 523 8.312 0.911 0.797 1.00 0.00 H new ATOM 0 HD11 ILE A 523 11.040 0.344 4.012 1.00 0.00 H new ATOM 0 HD12 ILE A 523 9.463 0.642 4.782 1.00 0.00 H new ATOM 0 HD13 ILE A 523 9.565 -0.380 3.328 1.00 0.00 H new ATOM 1506 N PHE A 524 5.708 3.694 2.483 1.00 0.00 N ATOM 1507 CA PHE A 524 4.308 3.831 2.118 1.00 0.00 C ATOM 1508 C PHE A 524 4.144 5.014 1.167 1.00 0.00 C ATOM 1509 O PHE A 524 3.502 4.904 0.123 1.00 0.00 O ATOM 1510 CB PHE A 524 3.460 4.038 3.385 1.00 0.00 C ATOM 1511 CG PHE A 524 2.037 3.582 3.140 1.00 0.00 C ATOM 1512 CD1 PHE A 524 1.776 2.230 2.880 1.00 0.00 C ATOM 1513 CD2 PHE A 524 0.980 4.502 3.176 1.00 0.00 C ATOM 1514 CE1 PHE A 524 0.465 1.799 2.653 1.00 0.00 C ATOM 1515 CE2 PHE A 524 -0.332 4.071 2.948 1.00 0.00 C ATOM 1516 CZ PHE A 524 -0.590 2.719 2.686 1.00 0.00 C ATOM 0 H PHE A 524 5.901 3.791 3.480 1.00 0.00 H new ATOM 0 HA PHE A 524 3.969 2.925 1.616 1.00 0.00 H new ATOM 0 HB2 PHE A 524 3.891 3.479 4.216 1.00 0.00 H new ATOM 0 HB3 PHE A 524 3.469 5.090 3.670 1.00 0.00 H new ATOM 0 HD1 PHE A 524 2.589 1.519 2.855 1.00 0.00 H new ATOM 0 HD2 PHE A 524 1.178 5.544 3.380 1.00 0.00 H new ATOM 0 HE1 PHE A 524 0.266 0.757 2.452 1.00 0.00 H new ATOM 0 HE2 PHE A 524 -1.146 4.781 2.974 1.00 0.00 H new ATOM 0 HZ PHE A 524 -1.602 2.387 2.510 1.00 0.00 H new ATOM 1526 N LYS A 525 4.743 6.141 1.538 1.00 0.00 N ATOM 1527 CA LYS A 525 4.673 7.348 0.723 1.00 0.00 C ATOM 1528 C LYS A 525 5.375 7.153 -0.618 1.00 0.00 C ATOM 1529 O LYS A 525 4.871 7.583 -1.654 1.00 0.00 O ATOM 1530 CB LYS A 525 5.328 8.511 1.471 1.00 0.00 C ATOM 1531 CG LYS A 525 4.438 8.932 2.641 1.00 0.00 C ATOM 1532 CD LYS A 525 5.201 9.900 3.549 1.00 0.00 C ATOM 1533 CE LYS A 525 5.522 11.190 2.790 1.00 0.00 C ATOM 1534 NZ LYS A 525 5.849 12.269 3.764 1.00 0.00 N ATOM 0 H LYS A 525 5.282 6.243 2.398 1.00 0.00 H new ATOM 0 HA LYS A 525 3.622 7.567 0.533 1.00 0.00 H new ATOM 0 HB2 LYS A 525 6.311 8.214 1.837 1.00 0.00 H new ATOM 0 HB3 LYS A 525 5.480 9.352 0.795 1.00 0.00 H new ATOM 0 HG2 LYS A 525 3.531 9.407 2.268 1.00 0.00 H new ATOM 0 HG3 LYS A 525 4.128 8.054 3.208 1.00 0.00 H new ATOM 0 HD2 LYS A 525 4.606 10.128 4.433 1.00 0.00 H new ATOM 0 HD3 LYS A 525 6.123 9.434 3.897 1.00 0.00 H new ATOM 0 HE2 LYS A 525 6.362 11.028 2.114 1.00 0.00 H new ATOM 0 HE3 LYS A 525 4.671 11.485 2.176 1.00 0.00 H new ATOM 0 HZ1 LYS A 525 5.198 13.069 3.627 1.00 0.00 H new ATOM 0 HZ2 LYS A 525 5.750 11.904 4.733 1.00 0.00 H new ATOM 0 HZ3 LYS A 525 6.827 12.589 3.613 1.00 0.00 H new ATOM 1548 N ASN A 526 6.543 6.526 -0.592 1.00 0.00 N ATOM 1549 CA ASN A 526 7.305 6.316 -1.813 1.00 0.00 C ATOM 1550 C ASN A 526 6.538 5.434 -2.793 1.00 0.00 C ATOM 1551 O ASN A 526 6.530 5.691 -3.998 1.00 0.00 O ATOM 1552 CB ASN A 526 8.653 5.671 -1.476 1.00 0.00 C ATOM 1553 CG ASN A 526 9.548 6.631 -0.702 1.00 0.00 C ATOM 1554 OD1 ASN A 526 9.641 7.813 -1.029 1.00 0.00 O ATOM 1555 ND2 ASN A 526 10.225 6.176 0.318 1.00 0.00 N ATOM 0 H ASN A 526 6.980 6.157 0.253 1.00 0.00 H new ATOM 0 HA ASN A 526 7.471 7.284 -2.285 1.00 0.00 H new ATOM 0 HB2 ASN A 526 8.490 4.768 -0.887 1.00 0.00 H new ATOM 0 HB3 ASN A 526 9.153 5.366 -2.395 1.00 0.00 H new ATOM 0 HD21 ASN A 526 10.833 6.802 0.846 1.00 0.00 H new ATOM 0 HD22 ASN A 526 10.145 5.195 0.586 1.00 0.00 H new ATOM 1562 N CYS A 527 5.897 4.400 -2.268 1.00 0.00 N ATOM 1563 CA CYS A 527 5.125 3.481 -3.091 1.00 0.00 C ATOM 1564 C CYS A 527 3.856 4.155 -3.613 1.00 0.00 C ATOM 1565 O CYS A 527 3.470 3.965 -4.764 1.00 0.00 O ATOM 1566 CB CYS A 527 4.765 2.250 -2.258 1.00 0.00 C ATOM 1567 SG CYS A 527 6.276 1.348 -1.837 1.00 0.00 S ATOM 0 H CYS A 527 5.896 4.176 -1.273 1.00 0.00 H new ATOM 0 HA CYS A 527 5.724 3.182 -3.951 1.00 0.00 H new ATOM 0 HB2 CYS A 527 4.243 2.552 -1.350 1.00 0.00 H new ATOM 0 HB3 CYS A 527 4.087 1.605 -2.816 1.00 0.00 H new ATOM 0 HG CYS A 527 6.809 1.868 -0.771 1.00 0.00 H new ATOM 1573 N LEU A 528 3.213 4.944 -2.754 1.00 0.00 N ATOM 1574 CA LEU A 528 1.985 5.643 -3.128 1.00 0.00 C ATOM 1575 C LEU A 528 2.253 6.615 -4.273 1.00 0.00 C ATOM 1576 O LEU A 528 1.434 6.758 -5.180 1.00 0.00 O ATOM 1577 CB LEU A 528 1.424 6.410 -1.919 1.00 0.00 C ATOM 1578 CG LEU A 528 0.689 5.443 -0.969 1.00 0.00 C ATOM 1579 CD1 LEU A 528 0.368 6.174 0.343 1.00 0.00 C ATOM 1580 CD2 LEU A 528 -0.626 4.934 -1.614 1.00 0.00 C ATOM 0 H LEU A 528 3.521 5.115 -1.797 1.00 0.00 H new ATOM 0 HA LEU A 528 1.254 4.904 -3.456 1.00 0.00 H new ATOM 0 HB2 LEU A 528 2.235 6.908 -1.387 1.00 0.00 H new ATOM 0 HB3 LEU A 528 0.740 7.188 -2.258 1.00 0.00 H new ATOM 0 HG LEU A 528 1.332 4.585 -0.772 1.00 0.00 H new ATOM 0 HD11 LEU A 528 -0.152 5.496 1.020 1.00 0.00 H new ATOM 0 HD12 LEU A 528 1.295 6.511 0.808 1.00 0.00 H new ATOM 0 HD13 LEU A 528 -0.267 7.035 0.134 1.00 0.00 H new ATOM 0 HD21 LEU A 528 -1.129 4.253 -0.927 1.00 0.00 H new ATOM 0 HD22 LEU A 528 -1.278 5.781 -1.828 1.00 0.00 H new ATOM 0 HD23 LEU A 528 -0.397 4.410 -2.542 1.00 0.00 H new ATOM 1592 N LYS A 529 3.397 7.283 -4.225 1.00 0.00 N ATOM 1593 CA LYS A 529 3.743 8.233 -5.270 1.00 0.00 C ATOM 1594 C LYS A 529 3.850 7.529 -6.617 1.00 0.00 C ATOM 1595 O LYS A 529 3.370 8.038 -7.631 1.00 0.00 O ATOM 1596 CB LYS A 529 5.077 8.906 -4.940 1.00 0.00 C ATOM 1597 CG LYS A 529 4.880 9.924 -3.814 1.00 0.00 C ATOM 1598 CD LYS A 529 6.240 10.484 -3.391 1.00 0.00 C ATOM 1599 CE LYS A 529 6.034 11.581 -2.349 1.00 0.00 C ATOM 1600 NZ LYS A 529 5.432 12.776 -3.002 1.00 0.00 N ATOM 0 H LYS A 529 4.092 7.187 -3.485 1.00 0.00 H new ATOM 0 HA LYS A 529 2.958 8.987 -5.326 1.00 0.00 H new ATOM 0 HB2 LYS A 529 5.809 8.156 -4.640 1.00 0.00 H new ATOM 0 HB3 LYS A 529 5.473 9.402 -5.826 1.00 0.00 H new ATOM 0 HG2 LYS A 529 4.230 10.732 -4.149 1.00 0.00 H new ATOM 0 HG3 LYS A 529 4.389 9.451 -2.964 1.00 0.00 H new ATOM 0 HD2 LYS A 529 6.861 9.688 -2.980 1.00 0.00 H new ATOM 0 HD3 LYS A 529 6.766 10.884 -4.257 1.00 0.00 H new ATOM 0 HE2 LYS A 529 5.384 11.223 -1.551 1.00 0.00 H new ATOM 0 HE3 LYS A 529 6.987 11.845 -1.890 1.00 0.00 H new ATOM 0 HZ1 LYS A 529 5.855 13.639 -2.605 1.00 0.00 H new ATOM 0 HZ2 LYS A 529 5.614 12.741 -4.025 1.00 0.00 H new ATOM 0 HZ3 LYS A 529 4.406 12.784 -2.833 1.00 0.00 H new ATOM 1614 N GLU A 530 4.484 6.362 -6.625 1.00 0.00 N ATOM 1615 CA GLU A 530 4.643 5.606 -7.865 1.00 0.00 C ATOM 1616 C GLU A 530 3.356 4.881 -8.241 1.00 0.00 C ATOM 1617 O GLU A 530 2.934 4.907 -9.397 1.00 0.00 O ATOM 1618 CB GLU A 530 5.776 4.588 -7.707 1.00 0.00 C ATOM 1619 CG GLU A 530 7.108 5.324 -7.532 1.00 0.00 C ATOM 1620 CD GLU A 530 7.477 6.048 -8.822 1.00 0.00 C ATOM 1621 OE1 GLU A 530 6.952 5.674 -9.857 1.00 0.00 O ATOM 1622 OE2 GLU A 530 8.281 6.965 -8.757 1.00 0.00 O ATOM 0 H GLU A 530 4.892 5.922 -5.800 1.00 0.00 H new ATOM 0 HA GLU A 530 4.884 6.310 -8.662 1.00 0.00 H new ATOM 0 HB2 GLU A 530 5.586 3.949 -6.845 1.00 0.00 H new ATOM 0 HB3 GLU A 530 5.820 3.939 -8.582 1.00 0.00 H new ATOM 0 HG2 GLU A 530 7.033 6.039 -6.713 1.00 0.00 H new ATOM 0 HG3 GLU A 530 7.892 4.615 -7.266 1.00 0.00 H new ATOM 1629 N ILE A 531 2.738 4.230 -7.264 1.00 0.00 N ATOM 1630 CA ILE A 531 1.504 3.494 -7.514 1.00 0.00 C ATOM 1631 C ILE A 531 0.397 4.441 -7.955 1.00 0.00 C ATOM 1632 O ILE A 531 -0.329 4.163 -8.909 1.00 0.00 O ATOM 1633 CB ILE A 531 1.078 2.772 -6.235 1.00 0.00 C ATOM 1634 CG1 ILE A 531 2.090 1.668 -5.919 1.00 0.00 C ATOM 1635 CG2 ILE A 531 -0.306 2.151 -6.425 1.00 0.00 C ATOM 1636 CD1 ILE A 531 1.909 1.211 -4.471 1.00 0.00 C ATOM 0 H ILE A 531 3.067 4.196 -6.299 1.00 0.00 H new ATOM 0 HA ILE A 531 1.681 2.769 -8.309 1.00 0.00 H new ATOM 0 HB ILE A 531 1.040 3.487 -5.413 1.00 0.00 H new ATOM 0 HG12 ILE A 531 1.950 0.826 -6.598 1.00 0.00 H new ATOM 0 HG13 ILE A 531 3.105 2.035 -6.072 1.00 0.00 H new ATOM 0 HG21 ILE A 531 -0.603 1.638 -5.510 1.00 0.00 H new ATOM 0 HG22 ILE A 531 -1.028 2.935 -6.653 1.00 0.00 H new ATOM 0 HG23 ILE A 531 -0.274 1.436 -7.248 1.00 0.00 H new ATOM 0 HD11 ILE A 531 2.629 0.425 -4.245 1.00 0.00 H new ATOM 0 HD12 ILE A 531 2.070 2.055 -3.800 1.00 0.00 H new ATOM 0 HD13 ILE A 531 0.898 0.827 -4.334 1.00 0.00 H new ATOM 1648 N ASP A 532 0.282 5.557 -7.249 1.00 0.00 N ATOM 1649 CA ASP A 532 -0.737 6.552 -7.560 1.00 0.00 C ATOM 1650 C ASP A 532 -0.312 7.931 -7.081 1.00 0.00 C ATOM 1651 O ASP A 532 -0.617 8.332 -5.958 1.00 0.00 O ATOM 1652 CB ASP A 532 -2.060 6.160 -6.905 1.00 0.00 C ATOM 1653 CG ASP A 532 -3.176 7.093 -7.367 1.00 0.00 C ATOM 1654 OD1 ASP A 532 -3.520 7.041 -8.535 1.00 0.00 O ATOM 1655 OD2 ASP A 532 -3.665 7.850 -6.545 1.00 0.00 O ATOM 0 H ASP A 532 0.880 5.797 -6.458 1.00 0.00 H new ATOM 0 HA ASP A 532 -0.864 6.588 -8.642 1.00 0.00 H new ATOM 0 HB2 ASP A 532 -2.309 5.130 -7.160 1.00 0.00 H new ATOM 0 HB3 ASP A 532 -1.964 6.206 -5.820 1.00 0.00 H new ATOM 1660 N SER A 533 0.389 8.657 -7.944 1.00 0.00 N ATOM 1661 CA SER A 533 0.842 9.997 -7.607 1.00 0.00 C ATOM 1662 C SER A 533 -0.349 10.913 -7.367 1.00 0.00 C ATOM 1663 O SER A 533 -0.220 11.966 -6.742 1.00 0.00 O ATOM 1664 CB SER A 533 1.708 10.557 -8.738 1.00 0.00 C ATOM 1665 OG SER A 533 2.175 11.849 -8.374 1.00 0.00 O ATOM 0 H SER A 533 0.654 8.341 -8.877 1.00 0.00 H new ATOM 0 HA SER A 533 1.435 9.945 -6.694 1.00 0.00 H new ATOM 0 HB2 SER A 533 2.551 9.893 -8.929 1.00 0.00 H new ATOM 0 HB3 SER A 533 1.130 10.613 -9.661 1.00 0.00 H new ATOM 0 HG SER A 533 1.625 12.202 -7.644 1.00 0.00 H new ATOM 1671 N THR A 534 -1.511 10.502 -7.865 1.00 0.00 N ATOM 1672 CA THR A 534 -2.725 11.288 -7.696 1.00 0.00 C ATOM 1673 C THR A 534 -3.097 11.386 -6.218 1.00 0.00 C ATOM 1674 O THR A 534 -3.455 12.457 -5.731 1.00 0.00 O ATOM 1675 CB THR A 534 -3.879 10.651 -8.472 1.00 0.00 C ATOM 1676 OG1 THR A 534 -3.456 10.372 -9.800 1.00 0.00 O ATOM 1677 CG2 THR A 534 -5.066 11.615 -8.508 1.00 0.00 C ATOM 0 H THR A 534 -1.636 9.634 -8.386 1.00 0.00 H new ATOM 0 HA THR A 534 -2.540 12.290 -8.083 1.00 0.00 H new ATOM 0 HB THR A 534 -4.179 9.725 -7.982 1.00 0.00 H new ATOM 0 HG1 THR A 534 -4.193 9.962 -10.299 1.00 0.00 H new ATOM 0 HG21 THR A 534 -5.888 11.160 -9.061 1.00 0.00 H new ATOM 0 HG22 THR A 534 -5.390 11.831 -7.490 1.00 0.00 H new ATOM 0 HG23 THR A 534 -4.768 12.542 -8.999 1.00 0.00 H new ATOM 1685 N LEU A 535 -3.011 10.261 -5.507 1.00 0.00 N ATOM 1686 CA LEU A 535 -3.348 10.243 -4.084 1.00 0.00 C ATOM 1687 C LEU A 535 -2.432 11.186 -3.314 1.00 0.00 C ATOM 1688 O LEU A 535 -2.888 11.932 -2.451 1.00 0.00 O ATOM 1689 CB LEU A 535 -3.214 8.808 -3.522 1.00 0.00 C ATOM 1690 CG LEU A 535 -4.538 8.018 -3.699 1.00 0.00 C ATOM 1691 CD1 LEU A 535 -4.257 6.503 -3.747 1.00 0.00 C ATOM 1692 CD2 LEU A 535 -5.479 8.330 -2.520 1.00 0.00 C ATOM 0 H LEU A 535 -2.715 9.362 -5.887 1.00 0.00 H new ATOM 0 HA LEU A 535 -4.379 10.576 -3.967 1.00 0.00 H new ATOM 0 HB2 LEU A 535 -2.404 8.287 -4.033 1.00 0.00 H new ATOM 0 HB3 LEU A 535 -2.949 8.850 -2.465 1.00 0.00 H new ATOM 0 HG LEU A 535 -5.007 8.318 -4.636 1.00 0.00 H new ATOM 0 HD11 LEU A 535 -5.195 5.963 -3.871 1.00 0.00 H new ATOM 0 HD12 LEU A 535 -3.597 6.282 -4.586 1.00 0.00 H new ATOM 0 HD13 LEU A 535 -3.780 6.192 -2.818 1.00 0.00 H new ATOM 0 HD21 LEU A 535 -6.410 7.777 -2.641 1.00 0.00 H new ATOM 0 HD22 LEU A 535 -5.001 8.036 -1.585 1.00 0.00 H new ATOM 0 HD23 LEU A 535 -5.692 9.399 -2.498 1.00 0.00 H new ATOM 1704 N TYR A 536 -1.144 11.151 -3.632 1.00 0.00 N ATOM 1705 CA TYR A 536 -0.193 12.016 -2.955 1.00 0.00 C ATOM 1706 C TYR A 536 -0.583 13.474 -3.161 1.00 0.00 C ATOM 1707 O TYR A 536 -0.503 14.283 -2.237 1.00 0.00 O ATOM 1708 CB TYR A 536 1.216 11.774 -3.497 1.00 0.00 C ATOM 1709 CG TYR A 536 2.188 12.696 -2.803 1.00 0.00 C ATOM 1710 CD1 TYR A 536 2.818 12.290 -1.619 1.00 0.00 C ATOM 1711 CD2 TYR A 536 2.454 13.964 -3.334 1.00 0.00 C ATOM 1712 CE1 TYR A 536 3.716 13.148 -0.972 1.00 0.00 C ATOM 1713 CE2 TYR A 536 3.351 14.822 -2.689 1.00 0.00 C ATOM 1714 CZ TYR A 536 3.983 14.414 -1.507 1.00 0.00 C ATOM 1715 OH TYR A 536 4.867 15.261 -0.870 1.00 0.00 O ATOM 0 H TYR A 536 -0.741 10.542 -4.344 1.00 0.00 H new ATOM 0 HA TYR A 536 -0.205 11.789 -1.889 1.00 0.00 H new ATOM 0 HB2 TYR A 536 1.505 10.736 -3.336 1.00 0.00 H new ATOM 0 HB3 TYR A 536 1.238 11.948 -4.573 1.00 0.00 H new ATOM 0 HD1 TYR A 536 2.611 11.314 -1.205 1.00 0.00 H new ATOM 0 HD2 TYR A 536 1.965 14.280 -4.244 1.00 0.00 H new ATOM 0 HE1 TYR A 536 4.202 12.833 -0.061 1.00 0.00 H new ATOM 0 HE2 TYR A 536 3.556 15.799 -3.102 1.00 0.00 H new ATOM 0 HH TYR A 536 4.939 16.098 -1.374 1.00 0.00 H new ATOM 1725 N LYS A 537 -1.000 13.801 -4.381 1.00 0.00 N ATOM 1726 CA LYS A 537 -1.398 15.164 -4.703 1.00 0.00 C ATOM 1727 C LYS A 537 -2.727 15.506 -4.027 1.00 0.00 C ATOM 1728 O LYS A 537 -3.232 16.621 -4.160 1.00 0.00 O ATOM 1729 CB LYS A 537 -1.531 15.334 -6.228 1.00 0.00 C ATOM 1730 CG LYS A 537 -1.385 16.827 -6.612 1.00 0.00 C ATOM 1731 CD LYS A 537 0.109 17.177 -6.820 1.00 0.00 C ATOM 1732 CE LYS A 537 0.519 16.876 -8.269 1.00 0.00 C ATOM 1733 NZ LYS A 537 0.085 17.996 -9.150 1.00 0.00 N ATOM 0 H LYS A 537 -1.070 13.143 -5.158 1.00 0.00 H new ATOM 0 HA LYS A 537 -0.629 15.843 -4.334 1.00 0.00 H new ATOM 0 HB2 LYS A 537 -0.768 14.744 -6.735 1.00 0.00 H new ATOM 0 HB3 LYS A 537 -2.498 14.958 -6.561 1.00 0.00 H new ATOM 0 HG2 LYS A 537 -1.946 17.033 -7.524 1.00 0.00 H new ATOM 0 HG3 LYS A 537 -1.809 17.456 -5.829 1.00 0.00 H new ATOM 0 HD2 LYS A 537 0.280 18.230 -6.596 1.00 0.00 H new ATOM 0 HD3 LYS A 537 0.726 16.600 -6.131 1.00 0.00 H new ATOM 0 HE2 LYS A 537 1.599 16.746 -8.333 1.00 0.00 H new ATOM 0 HE3 LYS A 537 0.065 15.942 -8.600 1.00 0.00 H new ATOM 0 HZ1 LYS A 537 0.013 17.658 -10.131 1.00 0.00 H new ATOM 0 HZ2 LYS A 537 -0.843 18.346 -8.835 1.00 0.00 H new ATOM 0 HZ3 LYS A 537 0.781 18.767 -9.100 1.00 0.00 H new ATOM 1747 N ASN A 538 -3.298 14.537 -3.306 1.00 0.00 N ATOM 1748 CA ASN A 538 -4.575 14.743 -2.609 1.00 0.00 C ATOM 1749 C ASN A 538 -4.390 14.604 -1.100 1.00 0.00 C ATOM 1750 O ASN A 538 -5.268 14.970 -0.318 1.00 0.00 O ATOM 1751 CB ASN A 538 -5.599 13.712 -3.092 1.00 0.00 C ATOM 1752 CG ASN A 538 -5.905 13.936 -4.569 1.00 0.00 C ATOM 1753 OD1 ASN A 538 -6.249 15.046 -4.971 1.00 0.00 O ATOM 1754 ND2 ASN A 538 -5.791 12.940 -5.408 1.00 0.00 N ATOM 0 H ASN A 538 -2.900 13.605 -3.189 1.00 0.00 H new ATOM 0 HA ASN A 538 -4.933 15.749 -2.830 1.00 0.00 H new ATOM 0 HB2 ASN A 538 -5.212 12.704 -2.941 1.00 0.00 H new ATOM 0 HB3 ASN A 538 -6.514 13.794 -2.506 1.00 0.00 H new ATOM 0 HD21 ASN A 538 -5.988 13.083 -6.399 1.00 0.00 H new ATOM 0 HD22 ASN A 538 -5.505 12.020 -5.072 1.00 0.00 H new ATOM 1761 N LEU A 539 -3.242 14.068 -0.695 1.00 0.00 N ATOM 1762 CA LEU A 539 -2.952 13.882 0.727 1.00 0.00 C ATOM 1763 C LEU A 539 -2.250 15.111 1.312 1.00 0.00 C ATOM 1764 O LEU A 539 -2.876 15.961 1.935 1.00 0.00 O ATOM 1765 CB LEU A 539 -2.067 12.619 0.916 1.00 0.00 C ATOM 1766 CG LEU A 539 -2.916 11.411 1.354 1.00 0.00 C ATOM 1767 CD1 LEU A 539 -3.882 11.015 0.232 1.00 0.00 C ATOM 1768 CD2 LEU A 539 -1.993 10.233 1.679 1.00 0.00 C ATOM 0 H LEU A 539 -2.502 13.757 -1.324 1.00 0.00 H new ATOM 0 HA LEU A 539 -3.894 13.749 1.259 1.00 0.00 H new ATOM 0 HB2 LEU A 539 -1.553 12.388 -0.017 1.00 0.00 H new ATOM 0 HB3 LEU A 539 -1.298 12.818 1.663 1.00 0.00 H new ATOM 0 HG LEU A 539 -3.493 11.679 2.239 1.00 0.00 H new ATOM 0 HD11 LEU A 539 -4.478 10.160 0.550 1.00 0.00 H new ATOM 0 HD12 LEU A 539 -4.541 11.853 0.007 1.00 0.00 H new ATOM 0 HD13 LEU A 539 -3.314 10.750 -0.660 1.00 0.00 H new ATOM 0 HD21 LEU A 539 -2.592 9.377 1.989 1.00 0.00 H new ATOM 0 HD22 LEU A 539 -1.414 9.969 0.794 1.00 0.00 H new ATOM 0 HD23 LEU A 539 -1.315 10.513 2.485 1.00 0.00 H new ATOM 1780 N PHE A 540 -0.940 15.183 1.114 1.00 0.00 N ATOM 1781 CA PHE A 540 -0.146 16.293 1.639 1.00 0.00 C ATOM 1782 C PHE A 540 -0.530 17.629 0.999 1.00 0.00 C ATOM 1783 O PHE A 540 -0.582 18.655 1.672 1.00 0.00 O ATOM 1784 CB PHE A 540 1.332 16.018 1.384 1.00 0.00 C ATOM 1785 CG PHE A 540 1.713 14.714 2.043 1.00 0.00 C ATOM 1786 CD1 PHE A 540 2.071 14.691 3.395 1.00 0.00 C ATOM 1787 CD2 PHE A 540 1.700 13.526 1.301 1.00 0.00 C ATOM 1788 CE1 PHE A 540 2.418 13.480 4.005 1.00 0.00 C ATOM 1789 CE2 PHE A 540 2.048 12.316 1.913 1.00 0.00 C ATOM 1790 CZ PHE A 540 2.408 12.292 3.265 1.00 0.00 C ATOM 0 H PHE A 540 -0.403 14.488 0.595 1.00 0.00 H new ATOM 0 HA PHE A 540 -0.345 16.368 2.708 1.00 0.00 H new ATOM 0 HB2 PHE A 540 1.526 15.968 0.313 1.00 0.00 H new ATOM 0 HB3 PHE A 540 1.940 16.831 1.781 1.00 0.00 H new ATOM 0 HD1 PHE A 540 2.080 15.607 3.968 1.00 0.00 H new ATOM 0 HD2 PHE A 540 1.422 13.544 0.258 1.00 0.00 H new ATOM 0 HE1 PHE A 540 2.694 13.462 5.049 1.00 0.00 H new ATOM 0 HE2 PHE A 540 2.039 11.400 1.341 1.00 0.00 H new ATOM 0 HZ PHE A 540 2.678 11.359 3.737 1.00 0.00 H new ATOM 1800 N VAL A 541 -0.774 17.611 -0.305 1.00 0.00 N ATOM 1801 CA VAL A 541 -1.129 18.832 -1.030 1.00 0.00 C ATOM 1802 C VAL A 541 -2.491 19.381 -0.587 1.00 0.00 C ATOM 1803 O VAL A 541 -2.569 20.426 0.058 1.00 0.00 O ATOM 1804 CB VAL A 541 -1.158 18.540 -2.533 1.00 0.00 C ATOM 1805 CG1 VAL A 541 -1.723 19.747 -3.293 1.00 0.00 C ATOM 1806 CG2 VAL A 541 0.261 18.248 -3.028 1.00 0.00 C ATOM 0 H VAL A 541 -0.734 16.771 -0.883 1.00 0.00 H new ATOM 0 HA VAL A 541 -0.376 19.588 -0.806 1.00 0.00 H new ATOM 0 HB VAL A 541 -1.794 17.673 -2.712 1.00 0.00 H new ATOM 0 HG11 VAL A 541 -1.739 19.529 -4.361 1.00 0.00 H new ATOM 0 HG12 VAL A 541 -2.737 19.952 -2.949 1.00 0.00 H new ATOM 0 HG13 VAL A 541 -1.095 20.619 -3.110 1.00 0.00 H new ATOM 0 HG21 VAL A 541 0.238 18.041 -4.098 1.00 0.00 H new ATOM 0 HG22 VAL A 541 0.897 19.113 -2.840 1.00 0.00 H new ATOM 0 HG23 VAL A 541 0.660 17.382 -2.499 1.00 0.00 H new