ATOM 431 N PRO A 31 7.131 0.148 6.912 1.00 0.89 N ATOM 432 CA PRO A 31 7.883 0.457 5.692 1.00 0.91 C ATOM 433 C PRO A 31 7.760 -0.597 4.582 1.00 0.73 C ATOM 434 O PRO A 31 7.793 -0.231 3.404 1.00 0.77 O ATOM 435 CB PRO A 31 9.341 0.639 6.140 1.00 1.11 C ATOM 436 CG PRO A 31 9.421 -0.123 7.461 1.00 1.08 C ATOM 437 CD PRO A 31 8.040 0.130 8.053 1.00 1.00 C ATOM 438 HA PRO A 31 7.528 1.405 5.288 1.00 1.06 H ATOM 439 HB2 PRO A 31 10.052 0.251 5.410 1.00 1.22 H ATOM 440 HB3 PRO A 31 9.534 1.698 6.322 1.00 1.30 H ATOM 441 HG2 PRO A 31 9.550 -1.189 7.272 1.00 1.07 H ATOM 442 HG3 PRO A 31 10.214 0.258 8.106 1.00 1.26 H ATOM 443 HD2 PRO A 31 7.791 -0.650 8.773 1.00 1.06 H ATOM 444 HD3 PRO A 31 8.028 1.105 8.542 1.00 1.14 H ATOM 445 N GLU A 32 7.555 -1.878 4.906 1.00 0.64 N ATOM 446 CA GLU A 32 7.369 -2.912 3.878 1.00 0.59 C ATOM 447 C GLU A 32 6.053 -2.747 3.126 1.00 0.55 C ATOM 448 O GLU A 32 6.039 -2.953 1.910 1.00 0.50 O ATOM 449 CB GLU A 32 7.442 -4.331 4.462 1.00 0.78 C ATOM 450 CG GLU A 32 8.806 -4.656 5.066 1.00 2.01 C ATOM 451 CD GLU A 32 9.946 -4.480 4.057 1.00 3.64 C ATOM 452 OE1 GLU A 32 9.802 -4.931 2.890 1.00 5.01 O ATOM 453 OE2 GLU A 32 10.983 -3.874 4.424 1.00 4.46 O ATOM 454 H GLU A 32 7.452 -2.138 5.880 1.00 0.70 H ATOM 455 HA GLU A 32 8.161 -2.803 3.136 1.00 0.58 H ATOM 456 HB2 GLU A 32 6.674 -4.463 5.221 1.00 1.12 H ATOM 457 HB3 GLU A 32 7.234 -5.050 3.668 1.00 1.62 H ATOM 458 HG2 GLU A 32 8.963 -4.003 5.927 1.00 2.44 H ATOM 459 HG3 GLU A 32 8.785 -5.691 5.411 1.00 2.92 H ATOM 460 N THR A 33 4.976 -2.316 3.802 1.00 0.65 N ATOM 461 CA THR A 33 3.710 -2.019 3.114 1.00 0.64 C ATOM 462 C THR A 33 3.838 -0.793 2.207 1.00 0.60 C ATOM 463 O THR A 33 3.290 -0.787 1.109 1.00 0.54 O ATOM 464 CB THR A 33 2.505 -1.820 4.052 1.00 0.78 C ATOM 465 OG1 THR A 33 2.600 -0.627 4.796 1.00 0.83 O ATOM 466 CG2 THR A 33 2.261 -2.977 5.016 1.00 0.80 C ATOM 467 H THR A 33 5.059 -2.162 4.802 1.00 0.80 H ATOM 468 HA THR A 33 3.494 -2.878 2.481 1.00 0.62 H ATOM 469 HB THR A 33 1.620 -1.734 3.422 1.00 0.92 H ATOM 470 HG1 THR A 33 3.377 -0.657 5.379 1.00 1.19 H ATOM 471 HG21 THR A 33 1.334 -2.802 5.563 1.00 1.57 H ATOM 472 HG22 THR A 33 3.086 -3.066 5.722 1.00 1.59 H ATOM 473 HG23 THR A 33 2.160 -3.907 4.456 1.00 1.91 H ATOM 474 N LYS A 34 4.612 0.219 2.624 1.00 0.69 N ATOM 475 CA LYS A 34 4.930 1.427 1.839 1.00 0.75 C ATOM 476 C LYS A 34 5.691 1.077 0.554 1.00 0.63 C ATOM 477 O LYS A 34 5.236 1.433 -0.536 1.00 0.63 O ATOM 478 CB LYS A 34 5.658 2.425 2.768 1.00 1.01 C ATOM 479 CG LYS A 34 6.663 3.367 2.088 1.00 1.02 C ATOM 480 CD LYS A 34 7.256 4.348 3.114 1.00 1.85 C ATOM 481 CE LYS A 34 8.530 5.035 2.610 1.00 2.13 C ATOM 482 NZ LYS A 34 8.296 5.875 1.416 1.00 2.57 N ATOM 483 H LYS A 34 5.002 0.139 3.556 1.00 0.77 H ATOM 484 HA LYS A 34 4.000 1.891 1.510 1.00 0.80 H ATOM 485 HB2 LYS A 34 4.903 3.021 3.286 1.00 1.32 H ATOM 486 HB3 LYS A 34 6.202 1.868 3.529 1.00 1.47 H ATOM 487 HG2 LYS A 34 7.474 2.771 1.669 1.00 1.62 H ATOM 488 HG3 LYS A 34 6.170 3.920 1.287 1.00 1.37 H ATOM 489 HD2 LYS A 34 6.508 5.098 3.378 1.00 2.32 H ATOM 490 HD3 LYS A 34 7.519 3.801 4.020 1.00 2.48 H ATOM 491 HE2 LYS A 34 8.931 5.654 3.419 1.00 2.58 H ATOM 492 HE3 LYS A 34 9.273 4.264 2.375 1.00 2.27 H ATOM 493 HZ1 LYS A 34 8.247 5.292 0.584 1.00 3.23 H ATOM 494 HZ2 LYS A 34 9.072 6.515 1.268 1.00 3.13 H ATOM 495 HZ3 LYS A 34 7.457 6.441 1.511 1.00 2.96 H ATOM 496 N LYS A 35 6.788 0.314 0.666 1.00 0.59 N ATOM 497 CA LYS A 35 7.541 -0.189 -0.497 1.00 0.56 C ATOM 498 C LYS A 35 6.645 -1.038 -1.413 1.00 0.44 C ATOM 499 O LYS A 35 6.595 -0.787 -2.612 1.00 0.55 O ATOM 500 CB LYS A 35 8.794 -0.973 -0.048 1.00 0.67 C ATOM 501 CG LYS A 35 10.090 -0.145 0.077 1.00 0.91 C ATOM 502 CD LYS A 35 10.299 0.567 1.424 1.00 1.32 C ATOM 503 CE LYS A 35 11.755 1.059 1.532 1.00 1.79 C ATOM 504 NZ LYS A 35 12.133 1.346 2.938 1.00 3.45 N ATOM 505 H LYS A 35 7.098 0.062 1.601 1.00 0.63 H ATOM 506 HA LYS A 35 7.861 0.656 -1.111 1.00 0.66 H ATOM 507 HB2 LYS A 35 8.596 -1.510 0.882 1.00 0.68 H ATOM 508 HB3 LYS A 35 8.994 -1.731 -0.805 1.00 0.76 H ATOM 509 HG2 LYS A 35 10.920 -0.841 -0.057 1.00 1.14 H ATOM 510 HG3 LYS A 35 10.142 0.585 -0.733 1.00 1.10 H ATOM 511 HD2 LYS A 35 9.613 1.410 1.528 1.00 1.54 H ATOM 512 HD3 LYS A 35 10.110 -0.153 2.221 1.00 1.58 H ATOM 513 HE2 LYS A 35 12.417 0.281 1.140 1.00 2.82 H ATOM 514 HE3 LYS A 35 11.883 1.952 0.914 1.00 1.90 H ATOM 515 HZ1 LYS A 35 13.100 1.654 3.016 1.00 4.14 H ATOM 516 HZ2 LYS A 35 12.013 0.511 3.509 1.00 4.47 H ATOM 517 HZ3 LYS A 35 11.573 2.105 3.318 1.00 3.93 H ATOM 518 N ALA A 36 5.866 -1.970 -0.859 1.00 0.41 N ATOM 519 CA ALA A 36 4.981 -2.845 -1.640 1.00 0.41 C ATOM 520 C ALA A 36 3.841 -2.087 -2.356 1.00 0.35 C ATOM 521 O ALA A 36 3.513 -2.420 -3.499 1.00 0.34 O ATOM 522 CB ALA A 36 4.431 -3.939 -0.718 1.00 0.52 C ATOM 523 H ALA A 36 5.937 -2.124 0.141 1.00 0.49 H ATOM 524 HA ALA A 36 5.578 -3.329 -2.414 1.00 0.46 H ATOM 525 HB1 ALA A 36 3.857 -3.495 0.094 1.00 1.31 H ATOM 526 HB2 ALA A 36 3.787 -4.609 -1.290 1.00 1.61 H ATOM 527 HB3 ALA A 36 5.255 -4.520 -0.302 1.00 1.75 H ATOM 528 N ARG A 37 3.274 -1.047 -1.722 1.00 0.41 N ATOM 529 CA ARG A 37 2.278 -0.132 -2.309 1.00 0.50 C ATOM 530 C ARG A 37 2.866 0.620 -3.500 1.00 0.49 C ATOM 531 O ARG A 37 2.307 0.560 -4.588 1.00 0.49 O ATOM 532 CB ARG A 37 1.760 0.835 -1.233 1.00 0.73 C ATOM 533 CG ARG A 37 0.679 1.788 -1.772 1.00 0.81 C ATOM 534 CD ARG A 37 0.162 2.762 -0.703 1.00 1.21 C ATOM 535 NE ARG A 37 1.246 3.486 -0.020 1.00 2.32 N ATOM 536 CZ ARG A 37 2.064 4.413 -0.553 1.00 2.72 C ATOM 537 NH1 ARG A 37 1.920 4.849 -1.813 1.00 2.87 N ATOM 538 NH2 ARG A 37 3.054 4.908 0.203 1.00 4.05 N ATOM 539 H ARG A 37 3.555 -0.877 -0.762 1.00 0.48 H ATOM 540 HA ARG A 37 1.436 -0.731 -2.659 1.00 0.52 H ATOM 541 HB2 ARG A 37 1.339 0.268 -0.404 1.00 1.13 H ATOM 542 HB3 ARG A 37 2.602 1.414 -0.854 1.00 0.95 H ATOM 543 HG2 ARG A 37 1.081 2.368 -2.600 1.00 1.43 H ATOM 544 HG3 ARG A 37 -0.162 1.202 -2.145 1.00 1.66 H ATOM 545 HD2 ARG A 37 -0.517 3.476 -1.166 1.00 1.95 H ATOM 546 HD3 ARG A 37 -0.396 2.196 0.044 1.00 1.49 H ATOM 547 HE ARG A 37 1.411 3.222 0.941 1.00 3.46 H ATOM 548 HH11 ARG A 37 1.182 4.478 -2.394 1.00 2.75 H ATOM 549 HH12 ARG A 37 2.553 5.545 -2.183 1.00 3.81 H ATOM 550 HH21 ARG A 37 3.174 4.584 1.151 1.00 4.84 H ATOM 551 HH22 ARG A 37 3.680 5.604 -0.177 1.00 4.56 H ATOM 552 N ASP A 38 4.010 1.277 -3.320 1.00 0.56 N ATOM 553 CA ASP A 38 4.669 2.085 -4.349 1.00 0.75 C ATOM 554 C ASP A 38 5.191 1.212 -5.510 1.00 0.69 C ATOM 555 O ASP A 38 5.117 1.606 -6.676 1.00 0.77 O ATOM 556 CB ASP A 38 5.776 2.884 -3.649 1.00 1.09 C ATOM 557 CG ASP A 38 6.450 3.912 -4.554 1.00 1.84 C ATOM 558 OD1 ASP A 38 5.873 5.001 -4.787 1.00 3.14 O ATOM 559 OD2 ASP A 38 7.600 3.657 -4.982 1.00 2.84 O ATOM 560 H ASP A 38 4.455 1.228 -2.416 1.00 0.53 H ATOM 561 HA ASP A 38 3.947 2.792 -4.761 1.00 0.88 H ATOM 562 HB2 ASP A 38 5.345 3.414 -2.797 1.00 2.22 H ATOM 563 HB3 ASP A 38 6.529 2.193 -3.263 1.00 1.61 H ATOM 564 N ALA A 39 5.642 -0.013 -5.223 1.00 0.65 N ATOM 565 CA ALA A 39 5.980 -1.011 -6.236 1.00 0.74 C ATOM 566 C ALA A 39 4.740 -1.511 -7.002 1.00 0.63 C ATOM 567 O ALA A 39 4.788 -1.607 -8.224 1.00 0.78 O ATOM 568 CB ALA A 39 6.747 -2.149 -5.558 1.00 0.83 C ATOM 569 H ALA A 39 5.770 -0.268 -4.251 1.00 0.59 H ATOM 570 HA ALA A 39 6.648 -0.557 -6.969 1.00 0.89 H ATOM 571 HB1 ALA A 39 6.143 -2.589 -4.767 1.00 1.44 H ATOM 572 HB2 ALA A 39 6.999 -2.914 -6.293 1.00 1.61 H ATOM 573 HB3 ALA A 39 7.669 -1.762 -5.122 1.00 2.10 H ATOM 574 N CYS A 40 3.599 -1.738 -6.338 1.00 0.44 N ATOM 575 CA CYS A 40 2.345 -2.091 -7.018 1.00 0.38 C ATOM 576 C CYS A 40 1.839 -0.937 -7.907 1.00 0.33 C ATOM 577 O CYS A 40 1.468 -1.149 -9.065 1.00 0.40 O ATOM 578 CB CYS A 40 1.304 -2.515 -5.967 1.00 0.36 C ATOM 579 SG CYS A 40 -0.216 -3.251 -6.634 1.00 0.45 S ATOM 580 H CYS A 40 3.596 -1.651 -5.327 1.00 0.38 H ATOM 581 HA CYS A 40 2.541 -2.946 -7.668 1.00 0.51 H ATOM 582 HB2 CYS A 40 1.765 -3.263 -5.320 1.00 0.46 H ATOM 583 HB3 CYS A 40 1.040 -1.657 -5.348 1.00 0.31 H ATOM 584 N ILE A 41 1.904 0.306 -7.411 1.00 0.34 N ATOM 585 CA ILE A 41 1.616 1.514 -8.200 1.00 0.48 C ATOM 586 C ILE A 41 2.560 1.635 -9.412 1.00 0.64 C ATOM 587 O ILE A 41 2.107 2.073 -10.474 1.00 0.75 O ATOM 588 CB ILE A 41 1.589 2.770 -7.285 1.00 0.62 C ATOM 589 CG1 ILE A 41 0.172 3.039 -6.726 1.00 0.67 C ATOM 590 CG2 ILE A 41 2.005 4.063 -8.011 1.00 0.85 C ATOM 591 CD1 ILE A 41 -0.396 1.973 -5.787 1.00 0.62 C ATOM 592 H ILE A 41 2.151 0.414 -6.430 1.00 0.35 H ATOM 593 HA ILE A 41 0.617 1.398 -8.621 1.00 0.44 H ATOM 594 HB ILE A 41 2.281 2.628 -6.454 1.00 0.62 H ATOM 595 HG12 ILE A 41 0.182 3.979 -6.171 1.00 0.82 H ATOM 596 HG13 ILE A 41 -0.517 3.156 -7.564 1.00 0.71 H ATOM 597 HG21 ILE A 41 3.043 4.002 -8.337 1.00 1.67 H ATOM 598 HG22 ILE A 41 1.350 4.244 -8.866 1.00 1.59 H ATOM 599 HG23 ILE A 41 1.927 4.909 -7.328 1.00 2.02 H ATOM 600 HD11 ILE A 41 0.217 1.906 -4.891 1.00 1.82 H ATOM 601 HD12 ILE A 41 -1.400 2.269 -5.488 1.00 1.89 H ATOM 602 HD13 ILE A 41 -0.448 1.008 -6.283 1.00 1.54 H ATOM 603 N ILE A 42 3.820 1.180 -9.323 1.00 0.68 N ATOM 604 CA ILE A 42 4.691 1.067 -10.516 1.00 0.86 C ATOM 605 C ILE A 42 4.302 -0.105 -11.443 1.00 0.84 C ATOM 606 O ILE A 42 4.219 0.090 -12.661 1.00 1.01 O ATOM 607 CB ILE A 42 6.187 1.057 -10.114 1.00 1.05 C ATOM 608 CG1 ILE A 42 6.661 2.446 -9.622 1.00 1.16 C ATOM 609 CG2 ILE A 42 7.114 0.573 -11.247 1.00 1.25 C ATOM 610 CD1 ILE A 42 6.611 3.600 -10.634 1.00 2.87 C ATOM 611 H ILE A 42 4.179 0.913 -8.399 1.00 0.61 H ATOM 612 HA ILE A 42 4.535 1.954 -11.125 1.00 0.96 H ATOM 613 HB ILE A 42 6.312 0.357 -9.288 1.00 1.00 H ATOM 614 HG12 ILE A 42 6.068 2.740 -8.757 1.00 1.89 H ATOM 615 HG13 ILE A 42 7.696 2.353 -9.290 1.00 1.65 H ATOM 616 HG21 ILE A 42 8.157 0.699 -10.955 1.00 2.00 H ATOM 617 HG22 ILE A 42 6.953 -0.489 -11.437 1.00 1.58 H ATOM 618 HG23 ILE A 42 6.928 1.131 -12.165 1.00 2.26 H ATOM 619 HD11 ILE A 42 7.029 4.494 -10.170 1.00 3.60 H ATOM 620 HD12 ILE A 42 7.199 3.361 -11.518 1.00 3.34 H ATOM 621 HD13 ILE A 42 5.582 3.815 -10.920 1.00 4.02 H ATOM 622 N GLU A 43 4.004 -1.297 -10.925 1.00 0.74 N ATOM 623 CA GLU A 43 3.776 -2.503 -11.742 1.00 0.85 C ATOM 624 C GLU A 43 2.387 -2.603 -12.404 1.00 0.78 C ATOM 625 O GLU A 43 2.285 -3.137 -13.517 1.00 1.04 O ATOM 626 CB GLU A 43 4.042 -3.764 -10.903 1.00 1.02 C ATOM 627 CG GLU A 43 5.537 -3.999 -10.634 1.00 1.62 C ATOM 628 CD GLU A 43 5.840 -5.477 -10.362 1.00 2.09 C ATOM 629 OE1 GLU A 43 5.157 -6.113 -9.520 1.00 2.96 O ATOM 630 OE2 GLU A 43 6.742 -6.042 -11.033 1.00 2.96 O ATOM 631 H GLU A 43 4.116 -1.416 -9.921 1.00 0.69 H ATOM 632 HA GLU A 43 4.496 -2.498 -12.561 1.00 1.02 H ATOM 633 HB2 GLU A 43 3.505 -3.688 -9.955 1.00 0.90 H ATOM 634 HB3 GLU A 43 3.656 -4.623 -11.456 1.00 1.42 H ATOM 635 HG2 GLU A 43 6.110 -3.680 -11.507 1.00 2.10 H ATOM 636 HG3 GLU A 43 5.850 -3.397 -9.781 1.00 2.18 H ATOM 637 N LYS A 44 1.323 -2.114 -11.752 1.00 0.56 N ATOM 638 CA LYS A 44 -0.054 -2.140 -12.293 1.00 0.65 C ATOM 639 C LYS A 44 -0.933 -0.919 -12.015 1.00 0.59 C ATOM 640 O LYS A 44 -1.958 -0.773 -12.681 1.00 0.88 O ATOM 641 CB LYS A 44 -0.779 -3.442 -11.908 1.00 1.11 C ATOM 642 CG LYS A 44 -0.811 -3.782 -10.406 1.00 1.30 C ATOM 643 CD LYS A 44 -1.342 -5.203 -10.146 1.00 1.07 C ATOM 644 CE LYS A 44 -0.321 -6.268 -10.579 1.00 1.81 C ATOM 645 NZ LYS A 44 -0.804 -7.650 -10.355 1.00 2.38 N ATOM 646 H LYS A 44 1.478 -1.747 -10.818 1.00 0.45 H ATOM 647 HA LYS A 44 0.024 -2.142 -13.381 1.00 0.90 H ATOM 648 HB2 LYS A 44 -1.807 -3.350 -12.263 1.00 2.31 H ATOM 649 HB3 LYS A 44 -0.307 -4.260 -12.447 1.00 2.35 H ATOM 650 HG2 LYS A 44 0.186 -3.702 -9.974 1.00 2.56 H ATOM 651 HG3 LYS A 44 -1.460 -3.066 -9.904 1.00 2.52 H ATOM 652 HD2 LYS A 44 -1.531 -5.309 -9.077 1.00 1.20 H ATOM 653 HD3 LYS A 44 -2.282 -5.350 -10.681 1.00 1.32 H ATOM 654 HE2 LYS A 44 -0.090 -6.142 -11.639 1.00 2.46 H ATOM 655 HE3 LYS A 44 0.603 -6.118 -10.011 1.00 2.48 H ATOM 656 HZ1 LYS A 44 -1.043 -7.808 -9.380 1.00 2.36 H ATOM 657 HZ2 LYS A 44 -0.066 -8.310 -10.600 1.00 3.30 H ATOM 658 HZ3 LYS A 44 -1.607 -7.878 -10.939 1.00 3.13 H ATOM 659 N GLY A 45 -0.543 -0.022 -11.110 1.00 0.52 N ATOM 660 CA GLY A 45 -1.252 1.249 -10.927 1.00 0.64 C ATOM 661 C GLY A 45 -2.358 1.227 -9.867 1.00 0.70 C ATOM 662 O GLY A 45 -2.841 0.172 -9.462 1.00 0.79 O ATOM 663 H GLY A 45 0.257 -0.232 -10.530 1.00 0.56 H ATOM 664 HA2 GLY A 45 -0.535 2.031 -10.678 1.00 0.73 H ATOM 665 HA3 GLY A 45 -1.720 1.506 -11.876 1.00 0.74 H ATOM 666 N GLU A 46 -2.762 2.417 -9.413 1.00 0.82 N ATOM 667 CA GLU A 46 -3.630 2.621 -8.236 1.00 0.97 C ATOM 668 C GLU A 46 -4.937 1.812 -8.293 1.00 1.00 C ATOM 669 O GLU A 46 -5.330 1.171 -7.318 1.00 1.25 O ATOM 670 CB GLU A 46 -4.002 4.109 -8.115 1.00 1.20 C ATOM 671 CG GLU A 46 -2.805 5.058 -7.980 1.00 1.38 C ATOM 672 CD GLU A 46 -3.293 6.509 -7.965 1.00 2.11 C ATOM 673 OE1 GLU A 46 -3.512 7.084 -9.058 1.00 3.19 O ATOM 674 OE2 GLU A 46 -3.527 7.070 -6.866 1.00 2.75 O ATOM 675 H GLU A 46 -2.385 3.242 -9.858 1.00 0.89 H ATOM 676 HA GLU A 46 -3.088 2.319 -7.339 1.00 0.97 H ATOM 677 HB2 GLU A 46 -4.576 4.400 -8.997 1.00 1.27 H ATOM 678 HB3 GLU A 46 -4.640 4.236 -7.240 1.00 1.32 H ATOM 679 HG2 GLU A 46 -2.270 4.833 -7.056 1.00 1.61 H ATOM 680 HG3 GLU A 46 -2.127 4.916 -8.823 1.00 1.49 H ATOM 681 N GLU A 47 -5.590 1.801 -9.457 1.00 0.89 N ATOM 682 CA GLU A 47 -6.874 1.123 -9.695 1.00 1.01 C ATOM 683 C GLU A 47 -6.800 -0.418 -9.676 1.00 0.98 C ATOM 684 O GLU A 47 -7.839 -1.080 -9.683 1.00 1.60 O ATOM 685 CB GLU A 47 -7.461 1.642 -11.017 1.00 1.17 C ATOM 686 CG GLU A 47 -6.643 1.198 -12.238 1.00 2.02 C ATOM 687 CD GLU A 47 -7.085 1.947 -13.492 1.00 2.62 C ATOM 688 OE1 GLU A 47 -6.584 3.076 -13.714 1.00 2.99 O ATOM 689 OE2 GLU A 47 -7.962 1.436 -14.234 1.00 3.77 O ATOM 690 H GLU A 47 -5.194 2.340 -10.218 1.00 0.86 H ATOM 691 HA GLU A 47 -7.560 1.407 -8.898 1.00 1.16 H ATOM 692 HB2 GLU A 47 -8.483 1.281 -11.126 1.00 1.67 H ATOM 693 HB3 GLU A 47 -7.490 2.734 -10.980 1.00 1.28 H ATOM 694 HG2 GLU A 47 -5.580 1.384 -12.066 1.00 2.17 H ATOM 695 HG3 GLU A 47 -6.781 0.128 -12.379 1.00 2.69 H ATOM 696 N HIS A 48 -5.592 -0.990 -9.638 1.00 0.71 N ATOM 697 CA HIS A 48 -5.330 -2.432 -9.568 1.00 0.72 C ATOM 698 C HIS A 48 -4.641 -2.849 -8.246 1.00 0.63 C ATOM 699 O HIS A 48 -4.292 -4.025 -8.083 1.00 0.78 O ATOM 700 CB HIS A 48 -4.524 -2.851 -10.811 1.00 0.79 C ATOM 701 CG HIS A 48 -5.151 -2.479 -12.139 1.00 1.04 C ATOM 702 ND1 HIS A 48 -4.595 -1.639 -13.077 1.00 1.59 N ATOM 703 CD2 HIS A 48 -6.350 -2.905 -12.648 1.00 1.63 C ATOM 704 CE1 HIS A 48 -5.436 -1.550 -14.119 1.00 1.63 C ATOM 705 NE2 HIS A 48 -6.533 -2.299 -13.905 1.00 1.67 N ATOM 706 H HIS A 48 -4.782 -0.378 -9.654 1.00 1.02 H ATOM 707 HA HIS A 48 -6.281 -2.966 -9.596 1.00 0.85 H ATOM 708 HB2 HIS A 48 -3.544 -2.377 -10.753 1.00 0.72 H ATOM 709 HB3 HIS A 48 -4.371 -3.932 -10.798 1.00 0.90 H ATOM 710 HD1 HIS A 48 -3.695 -1.165 -12.986 1.00 2.29 H ATOM 711 HD2 HIS A 48 -7.036 -3.584 -12.160 1.00 2.38 H ATOM 712 HE1 HIS A 48 -5.261 -0.945 -15.002 1.00 2.13 H ATOM 713 N CYS A 49 -4.459 -1.910 -7.302 1.00 0.52 N ATOM 714 CA CYS A 49 -3.730 -2.074 -6.032 1.00 0.46 C ATOM 715 C CYS A 49 -4.570 -1.750 -4.776 1.00 0.45 C ATOM 716 O CYS A 49 -4.011 -1.507 -3.704 1.00 0.46 O ATOM 717 CB CYS A 49 -2.452 -1.222 -6.088 1.00 0.43 C ATOM 718 SG CYS A 49 -1.282 -1.688 -7.388 1.00 0.38 S ATOM 719 H CYS A 49 -4.771 -0.972 -7.526 1.00 0.55 H ATOM 720 HA CYS A 49 -3.426 -3.113 -5.930 1.00 0.49 H ATOM 721 HB2 CYS A 49 -2.743 -0.184 -6.243 1.00 0.45 H ATOM 722 HB3 CYS A 49 -1.934 -1.286 -5.130 1.00 0.45 H ATOM 723 N GLY A 50 -5.904 -1.724 -4.886 1.00 0.49 N ATOM 724 CA GLY A 50 -6.817 -1.279 -3.821 1.00 0.51 C ATOM 725 C GLY A 50 -6.661 -2.027 -2.494 1.00 0.42 C ATOM 726 O GLY A 50 -6.632 -1.396 -1.440 1.00 0.51 O ATOM 727 H GLY A 50 -6.313 -1.993 -5.772 1.00 0.55 H ATOM 728 HA2 GLY A 50 -6.664 -0.217 -3.635 1.00 0.58 H ATOM 729 HA3 GLY A 50 -7.843 -1.417 -4.161 1.00 0.58 H ATOM 730 N HIS A 51 -6.461 -3.346 -2.525 1.00 0.40 N ATOM 731 CA HIS A 51 -6.253 -4.159 -1.320 1.00 0.43 C ATOM 732 C HIS A 51 -4.955 -3.796 -0.571 1.00 0.41 C ATOM 733 O HIS A 51 -4.949 -3.782 0.663 1.00 0.48 O ATOM 734 CB HIS A 51 -6.279 -5.634 -1.736 1.00 0.64 C ATOM 735 CG HIS A 51 -6.250 -6.620 -0.599 1.00 1.85 C ATOM 736 ND1 HIS A 51 -7.344 -7.133 0.057 1.00 2.58 N ATOM 737 CD2 HIS A 51 -5.151 -7.286 -0.131 1.00 3.63 C ATOM 738 CE1 HIS A 51 -6.922 -8.088 0.897 1.00 4.02 C ATOM 739 NE2 HIS A 51 -5.588 -8.233 0.804 1.00 4.79 N ATOM 740 H HIS A 51 -6.471 -3.816 -3.422 1.00 0.47 H ATOM 741 HA HIS A 51 -7.086 -3.982 -0.638 1.00 0.46 H ATOM 742 HB2 HIS A 51 -7.189 -5.816 -2.310 1.00 1.77 H ATOM 743 HB3 HIS A 51 -5.432 -5.842 -2.385 1.00 1.54 H ATOM 744 HD1 HIS A 51 -8.320 -6.900 -0.133 1.00 2.83 H ATOM 745 HD2 HIS A 51 -4.135 -7.153 -0.482 1.00 4.35 H ATOM 746 HE1 HIS A 51 -7.572 -8.683 1.528 1.00 4.88 H ATOM 747 N LEU A 52 -3.879 -3.445 -1.295 1.00 0.47 N ATOM 748 CA LEU A 52 -2.621 -2.940 -0.731 1.00 0.53 C ATOM 749 C LEU A 52 -2.778 -1.521 -0.165 1.00 0.46 C ATOM 750 O LEU A 52 -2.253 -1.217 0.906 1.00 0.47 O ATOM 751 CB LEU A 52 -1.519 -2.960 -1.819 1.00 0.72 C ATOM 752 CG LEU A 52 -0.130 -3.453 -1.365 1.00 0.78 C ATOM 753 CD1 LEU A 52 0.369 -2.753 -0.103 1.00 0.85 C ATOM 754 CD2 LEU A 52 -0.120 -4.963 -1.119 1.00 1.16 C ATOM 755 H LEU A 52 -3.939 -3.510 -2.304 1.00 0.56 H ATOM 756 HA LEU A 52 -2.338 -3.599 0.090 1.00 0.58 H ATOM 757 HB2 LEU A 52 -1.826 -3.587 -2.651 1.00 1.10 H ATOM 758 HB3 LEU A 52 -1.407 -1.954 -2.231 1.00 0.86 H ATOM 759 HG LEU A 52 0.574 -3.240 -2.169 1.00 0.89 H ATOM 760 HD11 LEU A 52 -0.211 -3.067 0.763 1.00 1.93 H ATOM 761 HD12 LEU A 52 0.268 -1.678 -0.222 1.00 1.59 H ATOM 762 HD13 LEU A 52 1.418 -2.997 0.062 1.00 1.40 H ATOM 763 HD21 LEU A 52 0.891 -5.286 -0.868 1.00 1.92 H ATOM 764 HD22 LEU A 52 -0.439 -5.482 -2.022 1.00 1.52 H ATOM 765 HD23 LEU A 52 -0.790 -5.225 -0.302 1.00 1.77 H ATOM 766 N ILE A 53 -3.519 -0.653 -0.860 1.00 0.47 N ATOM 767 CA ILE A 53 -3.807 0.717 -0.409 1.00 0.58 C ATOM 768 C ILE A 53 -4.653 0.683 0.875 1.00 0.52 C ATOM 769 O ILE A 53 -4.345 1.393 1.835 1.00 0.62 O ATOM 770 CB ILE A 53 -4.462 1.528 -1.547 1.00 0.76 C ATOM 771 CG1 ILE A 53 -3.488 1.674 -2.739 1.00 0.92 C ATOM 772 CG2 ILE A 53 -4.872 2.928 -1.059 1.00 1.09 C ATOM 773 CD1 ILE A 53 -4.233 2.028 -4.026 1.00 0.91 C ATOM 774 H ILE A 53 -3.911 -0.966 -1.743 1.00 0.49 H ATOM 775 HA ILE A 53 -2.868 1.215 -0.181 1.00 0.70 H ATOM 776 HB ILE A 53 -5.359 0.998 -1.873 1.00 0.68 H ATOM 777 HG12 ILE A 53 -2.743 2.442 -2.524 1.00 1.23 H ATOM 778 HG13 ILE A 53 -2.957 0.742 -2.921 1.00 1.21 H ATOM 779 HG21 ILE A 53 -4.016 3.452 -0.632 1.00 2.30 H ATOM 780 HG22 ILE A 53 -5.281 3.519 -1.876 1.00 1.64 H ATOM 781 HG23 ILE A 53 -5.652 2.834 -0.311 1.00 1.39 H ATOM 782 HD11 ILE A 53 -4.667 3.022 -3.951 1.00 1.62 H ATOM 783 HD12 ILE A 53 -3.543 2.002 -4.864 1.00 2.03 H ATOM 784 HD13 ILE A 53 -5.018 1.294 -4.192 1.00 1.59 H ATOM 785 N GLU A 54 -5.649 -0.207 0.934 1.00 0.48 N ATOM 786 CA GLU A 54 -6.443 -0.495 2.139 1.00 0.57 C ATOM 787 C GLU A 54 -5.553 -1.029 3.272 1.00 0.49 C ATOM 788 O GLU A 54 -5.628 -0.551 4.407 1.00 0.55 O ATOM 789 CB GLU A 54 -7.572 -1.495 1.821 1.00 0.69 C ATOM 790 CG GLU A 54 -8.491 -1.732 3.036 1.00 0.85 C ATOM 791 CD GLU A 54 -9.510 -2.858 2.819 1.00 1.05 C ATOM 792 OE1 GLU A 54 -9.116 -3.954 2.349 1.00 1.84 O ATOM 793 OE2 GLU A 54 -10.699 -2.688 3.194 1.00 2.16 O ATOM 794 H GLU A 54 -5.857 -0.727 0.085 1.00 0.44 H ATOM 795 HA GLU A 54 -6.912 0.429 2.473 1.00 0.69 H ATOM 796 HB2 GLU A 54 -8.172 -1.110 0.998 1.00 0.76 H ATOM 797 HB3 GLU A 54 -7.127 -2.439 1.504 1.00 0.68 H ATOM 798 HG2 GLU A 54 -7.890 -2.004 3.905 1.00 0.87 H ATOM 799 HG3 GLU A 54 -9.011 -0.803 3.265 1.00 0.94 H ATOM 800 N ALA A 55 -4.663 -1.979 2.966 1.00 0.41 N ATOM 801 CA ALA A 55 -3.753 -2.561 3.950 1.00 0.44 C ATOM 802 C ALA A 55 -2.836 -1.502 4.566 1.00 0.44 C ATOM 803 O ALA A 55 -2.686 -1.469 5.789 1.00 0.53 O ATOM 804 CB ALA A 55 -2.953 -3.705 3.316 1.00 0.52 C ATOM 805 H ALA A 55 -4.646 -2.335 2.019 1.00 0.40 H ATOM 806 HA ALA A 55 -4.351 -2.962 4.760 1.00 0.55 H ATOM 807 HB1 ALA A 55 -2.273 -4.130 4.058 1.00 1.53 H ATOM 808 HB2 ALA A 55 -3.631 -4.484 2.967 1.00 1.79 H ATOM 809 HB3 ALA A 55 -2.366 -3.334 2.477 1.00 1.47 H ATOM 810 N HIS A 56 -2.296 -0.612 3.731 1.00 0.47 N ATOM 811 CA HIS A 56 -1.449 0.511 4.121 1.00 0.57 C ATOM 812 C HIS A 56 -2.200 1.526 5.001 1.00 0.56 C ATOM 813 O HIS A 56 -1.670 1.931 6.034 1.00 0.60 O ATOM 814 CB HIS A 56 -0.899 1.141 2.834 1.00 0.64 C ATOM 815 CG HIS A 56 0.112 2.235 3.047 1.00 1.07 C ATOM 816 ND1 HIS A 56 -0.141 3.586 3.087 1.00 1.56 N ATOM 817 CD2 HIS A 56 1.470 2.082 3.124 1.00 1.92 C ATOM 818 CE1 HIS A 56 1.027 4.232 3.210 1.00 2.36 C ATOM 819 NE2 HIS A 56 2.048 3.357 3.187 1.00 2.62 N ATOM 820 H HIS A 56 -2.472 -0.738 2.739 1.00 0.47 H ATOM 821 HA HIS A 56 -0.607 0.129 4.702 1.00 0.65 H ATOM 822 HB2 HIS A 56 -0.424 0.360 2.238 1.00 1.25 H ATOM 823 HB3 HIS A 56 -1.726 1.543 2.248 1.00 1.13 H ATOM 824 HD1 HIS A 56 -1.055 4.041 3.026 1.00 1.70 H ATOM 825 HD2 HIS A 56 2.000 1.142 3.081 1.00 2.25 H ATOM 826 HE1 HIS A 56 1.134 5.308 3.270 1.00 2.93 H ATOM 827 N LYS A 57 -3.447 1.900 4.672 1.00 0.57 N ATOM 828 CA LYS A 57 -4.211 2.879 5.478 1.00 0.69 C ATOM 829 C LYS A 57 -4.764 2.316 6.790 1.00 0.64 C ATOM 830 O LYS A 57 -4.733 3.015 7.798 1.00 0.71 O ATOM 831 CB LYS A 57 -5.270 3.582 4.619 1.00 0.89 C ATOM 832 CG LYS A 57 -6.421 2.692 4.138 1.00 0.93 C ATOM 833 CD LYS A 57 -7.385 3.397 3.167 1.00 1.43 C ATOM 834 CE LYS A 57 -6.661 4.092 2.005 1.00 2.90 C ATOM 835 NZ LYS A 57 -7.594 4.502 0.931 1.00 3.19 N ATOM 836 H LYS A 57 -3.845 1.556 3.798 1.00 0.56 H ATOM 837 HA LYS A 57 -3.508 3.655 5.781 1.00 0.80 H ATOM 838 HB2 LYS A 57 -5.678 4.432 5.167 1.00 0.99 H ATOM 839 HB3 LYS A 57 -4.741 3.943 3.744 1.00 1.01 H ATOM 840 HG2 LYS A 57 -5.985 1.843 3.632 1.00 0.87 H ATOM 841 HG3 LYS A 57 -6.986 2.318 4.990 1.00 0.95 H ATOM 842 HD2 LYS A 57 -8.072 2.649 2.768 1.00 2.02 H ATOM 843 HD3 LYS A 57 -7.966 4.136 3.718 1.00 1.72 H ATOM 844 HE2 LYS A 57 -6.150 4.976 2.393 1.00 3.60 H ATOM 845 HE3 LYS A 57 -5.907 3.410 1.603 1.00 3.73 H ATOM 846 HZ1 LYS A 57 -7.138 5.104 0.249 1.00 4.34 H ATOM 847 HZ2 LYS A 57 -8.391 5.011 1.309 1.00 2.98 H ATOM 848 HZ3 LYS A 57 -7.942 3.689 0.424 1.00 3.15 H ATOM 849 N GLU A 58 -5.175 1.049 6.820 1.00 0.61 N ATOM 850 CA GLU A 58 -5.521 0.336 8.071 1.00 0.71 C ATOM 851 C GLU A 58 -4.284 0.155 8.977 1.00 0.68 C ATOM 852 O GLU A 58 -4.332 0.419 10.186 1.00 0.79 O ATOM 853 CB GLU A 58 -6.159 -1.032 7.756 1.00 0.83 C ATOM 854 CG GLU A 58 -7.581 -0.896 7.186 1.00 0.96 C ATOM 855 CD GLU A 58 -8.283 -2.240 6.889 1.00 1.21 C ATOM 856 OE1 GLU A 58 -7.661 -3.333 6.959 1.00 1.89 O ATOM 857 OE2 GLU A 58 -9.516 -2.218 6.630 1.00 2.24 O ATOM 858 H GLU A 58 -5.236 0.564 5.927 1.00 0.57 H ATOM 859 HA GLU A 58 -6.241 0.929 8.633 1.00 0.80 H ATOM 860 HB2 GLU A 58 -5.529 -1.572 7.048 1.00 0.76 H ATOM 861 HB3 GLU A 58 -6.216 -1.609 8.681 1.00 0.97 H ATOM 862 HG2 GLU A 58 -8.184 -0.341 7.907 1.00 1.11 H ATOM 863 HG3 GLU A 58 -7.532 -0.288 6.281 1.00 0.86 H ATOM 864 N SER A 59 -3.148 -0.206 8.374 1.00 0.65 N ATOM 865 CA SER A 59 -1.846 -0.282 9.041 1.00 0.73 C ATOM 866 C SER A 59 -1.425 1.077 9.609 1.00 0.72 C ATOM 867 O SER A 59 -0.988 1.150 10.755 1.00 0.84 O ATOM 868 CB SER A 59 -0.804 -0.808 8.047 1.00 0.90 C ATOM 869 OG SER A 59 0.503 -0.760 8.570 1.00 1.33 O ATOM 870 H SER A 59 -3.179 -0.415 7.381 1.00 0.64 H ATOM 871 HA SER A 59 -1.920 -0.987 9.868 1.00 0.82 H ATOM 872 HB2 SER A 59 -1.045 -1.838 7.783 1.00 1.81 H ATOM 873 HB3 SER A 59 -0.830 -0.198 7.144 1.00 1.59 H ATOM 874 HG SER A 59 0.498 -1.109 9.487 1.00 2.22 H ATOM 875 N MET A 60 -1.627 2.168 8.865 1.00 0.71 N ATOM 876 CA MET A 60 -1.317 3.524 9.323 1.00 0.87 C ATOM 877 C MET A 60 -2.336 4.070 10.340 1.00 0.89 C ATOM 878 O MET A 60 -1.953 4.845 11.219 1.00 1.04 O ATOM 879 CB MET A 60 -1.121 4.435 8.108 1.00 1.06 C ATOM 880 CG MET A 60 -0.345 5.702 8.478 1.00 1.55 C ATOM 881 SD MET A 60 0.070 6.764 7.066 1.00 3.39 S ATOM 882 CE MET A 60 1.392 5.780 6.301 1.00 2.77 C ATOM 883 H MET A 60 -1.896 2.036 7.894 1.00 0.69 H ATOM 884 HA MET A 60 -0.361 3.477 9.840 1.00 0.96 H ATOM 885 HB2 MET A 60 -0.543 3.897 7.356 1.00 1.66 H ATOM 886 HB3 MET A 60 -2.088 4.696 7.681 1.00 1.87 H ATOM 887 HG2 MET A 60 -0.932 6.283 9.188 1.00 2.89 H ATOM 888 HG3 MET A 60 0.583 5.414 8.974 1.00 1.90 H ATOM 889 HE1 MET A 60 1.000 4.818 5.972 1.00 2.85 H ATOM 890 HE2 MET A 60 1.795 6.313 5.440 1.00 3.64 H ATOM 891 HE3 MET A 60 2.195 5.608 7.020 1.00 2.82 H ATOM 892 N ARG A 61 -3.597 3.602 10.335 1.00 0.84 N ATOM 893 CA ARG A 61 -4.529 3.807 11.463 1.00 0.98 C ATOM 894 C ARG A 61 -4.039 3.111 12.734 1.00 0.94 C ATOM 895 O ARG A 61 -4.182 3.675 13.821 1.00 1.09 O ATOM 896 CB ARG A 61 -5.935 3.342 11.057 1.00 1.05 C ATOM 897 CG ARG A 61 -6.963 3.400 12.200 1.00 1.23 C ATOM 898 CD ARG A 61 -8.364 3.017 11.710 1.00 1.93 C ATOM 899 NE ARG A 61 -9.294 2.824 12.833 1.00 2.61 N ATOM 900 CZ ARG A 61 -10.034 3.775 13.431 1.00 4.50 C ATOM 901 NH1 ARG A 61 -10.003 5.056 13.031 1.00 5.88 N ATOM 902 NH2 ARG A 61 -10.826 3.432 14.455 1.00 5.54 N ATOM 903 H ARG A 61 -3.907 3.030 9.548 1.00 0.76 H ATOM 904 HA ARG A 61 -4.582 4.878 11.666 1.00 1.15 H ATOM 905 HB2 ARG A 61 -6.263 3.985 10.245 1.00 1.20 H ATOM 906 HB3 ARG A 61 -5.893 2.321 10.686 1.00 0.98 H ATOM 907 HG2 ARG A 61 -6.671 2.696 12.979 1.00 1.53 H ATOM 908 HG3 ARG A 61 -6.986 4.404 12.624 1.00 2.14 H ATOM 909 HD2 ARG A 61 -8.745 3.789 11.040 1.00 3.32 H ATOM 910 HD3 ARG A 61 -8.304 2.080 11.156 1.00 2.36 H ATOM 911 HE ARG A 61 -9.370 1.882 13.188 1.00 2.52 H ATOM 912 HH11 ARG A 61 -9.410 5.329 12.262 1.00 5.70 H ATOM 913 HH12 ARG A 61 -10.572 5.746 13.502 1.00 7.37 H ATOM 914 HH21 ARG A 61 -10.857 2.473 14.769 1.00 5.25 H ATOM 915 HH22 ARG A 61 -11.390 4.134 14.915 1.00 6.96 H ATOM 916 N ALA A 62 -3.345 1.979 12.604 1.00 0.80 N ATOM 917 CA ALA A 62 -2.636 1.376 13.742 1.00 0.81 C ATOM 918 C ALA A 62 -1.439 2.215 14.261 1.00 0.92 C ATOM 919 O ALA A 62 -0.919 1.884 15.332 1.00 1.06 O ATOM 920 CB ALA A 62 -2.248 -0.078 13.438 1.00 0.78 C ATOM 921 H ALA A 62 -3.359 1.506 11.703 1.00 0.71 H ATOM 922 HA ALA A 62 -3.351 1.335 14.565 1.00 0.93 H ATOM 923 HB1 ALA A 62 -2.033 -0.596 14.372 1.00 1.52 H ATOM 924 HB2 ALA A 62 -3.061 -0.597 12.931 1.00 1.68 H ATOM 925 HB3 ALA A 62 -1.355 -0.111 12.823 1.00 1.73 H ATOM 926 N LEU A 63 -1.032 3.302 13.576 1.00 0.98 N ATOM 927 CA LEU A 63 -0.130 4.338 14.122 1.00 1.16 C ATOM 928 C LEU A 63 -0.870 5.635 14.515 1.00 1.40 C ATOM 929 O LEU A 63 -0.323 6.457 15.256 1.00 1.59 O ATOM 930 CB LEU A 63 1.022 4.654 13.145 1.00 1.24 C ATOM 931 CG LEU A 63 2.114 3.587 12.934 1.00 1.25 C ATOM 932 CD1 LEU A 63 2.692 3.046 14.241 1.00 1.50 C ATOM 933 CD2 LEU A 63 1.633 2.415 12.085 1.00 1.12 C ATOM 934 H LEU A 63 -1.409 3.468 12.644 1.00 0.94 H ATOM 935 HA LEU A 63 0.317 3.970 15.045 1.00 1.17 H ATOM 936 HB2 LEU A 63 0.608 4.940 12.176 1.00 1.23 H ATOM 937 HB3 LEU A 63 1.538 5.530 13.536 1.00 1.43 H ATOM 938 HG LEU A 63 2.921 4.072 12.386 1.00 1.49 H ATOM 939 HD11 LEU A 63 3.021 3.876 14.866 1.00 1.89 H ATOM 940 HD12 LEU A 63 3.553 2.416 14.019 1.00 2.41 H ATOM 941 HD13 LEU A 63 1.950 2.454 14.773 1.00 2.19 H ATOM 942 HD21 LEU A 63 2.464 1.741 11.879 1.00 2.04 H ATOM 943 HD22 LEU A 63 1.234 2.789 11.146 1.00 2.18 H ATOM 944 HD23 LEU A 63 0.856 1.864 12.609 1.00 1.66 H