USER MOD reduce.3.24.130724 H: found=0, std=0, add=673, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 675 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 43 THR OG1 : rot -83:sc= -0.533 USER MOD Set 1.2: A 46 GLN : amide:sc= -2.52 K(o=-3.1,f=-5.1!) USER MOD Single : A 32 TYR OH : rot 150:sc= -0.0401 USER MOD Single : A 45 GLN : amide:sc= -1.49 K(o=-1.5,f=-4.6!) USER MOD Single : A 54 MET CE :methyl -124:sc= -10! (180deg=-13.6!) USER MOD Single : A 57 HIS : no HE2:sc= -1.49 K(o=-1.5,f=-3!) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 MET CE :methyl -143:sc= -3.97! (180deg=-7.4!) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0.00163 USER MOD Single : A 113 GLN : amide:sc= -1.49 K(o=-1.5,f=-9.9!) USER MOD Single : A 115 MET CE :methyl -168:sc= -0.0494 (180deg=-0.204) USER MOD Single : A 123 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 124 LYS NZ :NH3+ -167:sc= -0.0822 (180deg=-0.235) USER MOD Single : A 128 LYS NZ :NH3+ 154:sc= -0.168 (180deg=-0.908) USER MOD Single : A 129 THR OG1 : rot -70:sc= -0.897 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 507 N ASP A 31 7.268 12.343 9.207 1.00 0.00 N ATOM 508 CA ASP A 31 8.345 11.555 9.798 1.00 0.00 C ATOM 509 C ASP A 31 8.105 10.061 9.598 1.00 0.00 C ATOM 510 O ASP A 31 9.048 9.272 9.535 1.00 0.00 O ATOM 511 CB ASP A 31 8.471 11.865 11.291 1.00 0.00 C ATOM 512 CG ASP A 31 9.141 13.200 11.549 1.00 0.00 C ATOM 513 OD1 ASP A 31 10.341 13.334 11.229 1.00 0.00 O ATOM 514 OD2 ASP A 31 8.466 14.112 12.072 1.00 0.00 O ATOM 0 HA ASP A 31 9.274 11.825 9.295 1.00 0.00 H new ATOM 0 HB2 ASP A 31 7.480 11.865 11.744 1.00 0.00 H new ATOM 0 HB3 ASP A 31 9.043 11.074 11.777 1.00 0.00 H new ATOM 519 N TYR A 32 6.836 9.680 9.498 1.00 0.00 N ATOM 520 CA TYR A 32 6.467 8.282 9.304 1.00 0.00 C ATOM 521 C TYR A 32 5.575 8.121 8.081 1.00 0.00 C ATOM 522 O TYR A 32 5.121 9.105 7.497 1.00 0.00 O ATOM 523 CB TYR A 32 5.743 7.748 10.538 1.00 0.00 C ATOM 524 CG TYR A 32 6.669 7.331 11.656 1.00 0.00 C ATOM 525 CD1 TYR A 32 7.653 6.372 11.451 1.00 0.00 C ATOM 526 CD2 TYR A 32 6.550 7.893 12.919 1.00 0.00 C ATOM 527 CE1 TYR A 32 8.493 5.984 12.477 1.00 0.00 C ATOM 528 CE2 TYR A 32 7.386 7.511 13.951 1.00 0.00 C ATOM 529 CZ TYR A 32 8.355 6.557 13.725 1.00 0.00 C ATOM 530 OH TYR A 32 9.190 6.172 14.750 1.00 0.00 O ATOM 0 H TYR A 32 6.044 10.321 9.548 1.00 0.00 H new ATOM 0 HA TYR A 32 7.383 7.712 9.148 1.00 0.00 H new ATOM 0 HB2 TYR A 32 5.063 8.515 10.909 1.00 0.00 H new ATOM 0 HB3 TYR A 32 5.132 6.894 10.248 1.00 0.00 H new ATOM 0 HD1 TYR A 32 7.763 5.923 10.475 1.00 0.00 H new ATOM 0 HD2 TYR A 32 5.792 8.641 13.098 1.00 0.00 H new ATOM 0 HE1 TYR A 32 9.253 5.237 12.303 1.00 0.00 H new ATOM 0 HE2 TYR A 32 7.281 7.957 14.929 1.00 0.00 H new ATOM 0 HH TYR A 32 9.318 6.922 15.367 1.00 0.00 H new ATOM 540 N GLY A 33 5.322 6.874 7.701 1.00 0.00 N ATOM 541 CA GLY A 33 4.480 6.610 6.551 1.00 0.00 C ATOM 542 C GLY A 33 3.870 5.222 6.579 1.00 0.00 C ATOM 543 O GLY A 33 4.552 4.242 6.873 1.00 0.00 O ATOM 0 H GLY A 33 5.684 6.043 8.168 1.00 0.00 H new ATOM 0 HA2 GLY A 33 3.683 7.352 6.512 1.00 0.00 H new ATOM 0 HA3 GLY A 33 5.068 6.726 5.641 1.00 0.00 H new ATOM 547 N LEU A 34 2.582 5.140 6.265 1.00 0.00 N ATOM 548 CA LEU A 34 1.883 3.862 6.246 1.00 0.00 C ATOM 549 C LEU A 34 1.930 3.259 4.848 1.00 0.00 C ATOM 550 O LEU A 34 1.315 3.779 3.917 1.00 0.00 O ATOM 551 CB LEU A 34 0.430 4.040 6.699 1.00 0.00 C ATOM 552 CG LEU A 34 -0.267 2.775 7.211 1.00 0.00 C ATOM 553 CD1 LEU A 34 -0.810 1.963 6.047 1.00 0.00 C ATOM 554 CD2 LEU A 34 0.679 1.931 8.058 1.00 0.00 C ATOM 0 H LEU A 34 2.002 5.943 6.021 1.00 0.00 H new ATOM 0 HA LEU A 34 2.380 3.183 6.938 1.00 0.00 H new ATOM 0 HB2 LEU A 34 0.404 4.791 7.488 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -0.146 4.437 5.863 1.00 0.00 H new ATOM 0 HG LEU A 34 -1.101 3.080 7.843 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -1.302 1.068 6.426 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -1.528 2.563 5.489 1.00 0.00 H new ATOM 0 HD13 LEU A 34 0.011 1.675 5.390 1.00 0.00 H new ATOM 0 HD21 LEU A 34 0.157 1.040 8.408 1.00 0.00 H new ATOM 0 HD22 LEU A 34 1.539 1.636 7.458 1.00 0.00 H new ATOM 0 HD23 LEU A 34 1.017 2.513 8.915 1.00 0.00 H new ATOM 566 N VAL A 35 2.680 2.172 4.702 1.00 0.00 N ATOM 567 CA VAL A 35 2.823 1.518 3.410 1.00 0.00 C ATOM 568 C VAL A 35 1.890 0.326 3.257 1.00 0.00 C ATOM 569 O VAL A 35 1.620 -0.402 4.211 1.00 0.00 O ATOM 570 CB VAL A 35 4.265 1.035 3.172 1.00 0.00 C ATOM 571 CG1 VAL A 35 4.690 0.062 4.261 1.00 0.00 C ATOM 572 CG2 VAL A 35 4.390 0.390 1.799 1.00 0.00 C ATOM 0 H VAL A 35 3.196 1.728 5.461 1.00 0.00 H new ATOM 0 HA VAL A 35 2.560 2.275 2.671 1.00 0.00 H new ATOM 0 HB VAL A 35 4.928 1.899 3.208 1.00 0.00 H new ATOM 0 HG11 VAL A 35 5.712 -0.268 4.075 1.00 0.00 H new ATOM 0 HG12 VAL A 35 4.639 0.557 5.231 1.00 0.00 H new ATOM 0 HG13 VAL A 35 4.024 -0.801 4.258 1.00 0.00 H new ATOM 0 HG21 VAL A 35 5.416 0.054 1.647 1.00 0.00 H new ATOM 0 HG22 VAL A 35 3.715 -0.464 1.735 1.00 0.00 H new ATOM 0 HG23 VAL A 35 4.129 1.117 1.030 1.00 0.00 H new ATOM 582 N ALA A 36 1.431 0.124 2.029 1.00 0.00 N ATOM 583 CA ALA A 36 0.558 -0.989 1.702 1.00 0.00 C ATOM 584 C ALA A 36 1.376 -2.122 1.096 1.00 0.00 C ATOM 585 O ALA A 36 1.984 -1.954 0.040 1.00 0.00 O ATOM 586 CB ALA A 36 -0.520 -0.539 0.733 1.00 0.00 C ATOM 0 H ALA A 36 1.654 0.726 1.236 1.00 0.00 H new ATOM 0 HA ALA A 36 0.078 -1.347 2.612 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -1.169 -1.381 0.494 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -1.110 0.256 1.189 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -0.056 -0.168 -0.181 1.00 0.00 H new ATOM 592 N LEU A 37 1.407 -3.263 1.775 1.00 0.00 N ATOM 593 CA LEU A 37 2.173 -4.414 1.306 1.00 0.00 C ATOM 594 C LEU A 37 1.329 -5.348 0.438 1.00 0.00 C ATOM 595 O LEU A 37 1.688 -6.508 0.237 1.00 0.00 O ATOM 596 CB LEU A 37 2.738 -5.185 2.499 1.00 0.00 C ATOM 597 CG LEU A 37 3.343 -4.314 3.600 1.00 0.00 C ATOM 598 CD1 LEU A 37 3.395 -5.072 4.917 1.00 0.00 C ATOM 599 CD2 LEU A 37 4.732 -3.841 3.197 1.00 0.00 C ATOM 0 H LEU A 37 0.911 -3.417 2.653 1.00 0.00 H new ATOM 0 HA LEU A 37 2.989 -4.037 0.690 1.00 0.00 H new ATOM 0 HB2 LEU A 37 1.942 -5.791 2.932 1.00 0.00 H new ATOM 0 HB3 LEU A 37 3.503 -5.873 2.139 1.00 0.00 H new ATOM 0 HG LEU A 37 2.707 -3.440 3.737 1.00 0.00 H new ATOM 0 HD11 LEU A 37 3.829 -4.434 5.687 1.00 0.00 H new ATOM 0 HD12 LEU A 37 2.386 -5.360 5.211 1.00 0.00 H new ATOM 0 HD13 LEU A 37 4.008 -5.966 4.799 1.00 0.00 H new ATOM 0 HD21 LEU A 37 5.150 -3.222 3.991 1.00 0.00 H new ATOM 0 HD22 LEU A 37 5.377 -4.704 3.032 1.00 0.00 H new ATOM 0 HD23 LEU A 37 4.665 -3.257 2.279 1.00 0.00 H new ATOM 611 N GLU A 38 0.214 -4.841 -0.079 1.00 0.00 N ATOM 612 CA GLU A 38 -0.662 -5.646 -0.926 1.00 0.00 C ATOM 613 C GLU A 38 -1.640 -4.761 -1.700 1.00 0.00 C ATOM 614 O GLU A 38 -2.138 -3.768 -1.172 1.00 0.00 O ATOM 615 CB GLU A 38 -1.430 -6.666 -0.085 1.00 0.00 C ATOM 616 CG GLU A 38 -1.730 -7.960 -0.823 1.00 0.00 C ATOM 617 CD GLU A 38 -1.802 -9.157 0.105 1.00 0.00 C ATOM 618 OE1 GLU A 38 -1.966 -8.953 1.326 1.00 0.00 O ATOM 619 OE2 GLU A 38 -1.695 -10.299 -0.391 1.00 0.00 O ATOM 0 H GLU A 38 -0.103 -3.883 0.072 1.00 0.00 H new ATOM 0 HA GLU A 38 -0.038 -6.179 -1.644 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -0.853 -6.894 0.811 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -2.368 -6.220 0.245 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -2.676 -7.860 -1.355 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -0.959 -8.133 -1.574 1.00 0.00 H new ATOM 626 N PRO A 39 -1.929 -5.111 -2.968 1.00 0.00 N ATOM 627 CA PRO A 39 -2.851 -4.340 -3.809 1.00 0.00 C ATOM 628 C PRO A 39 -4.260 -4.286 -3.227 1.00 0.00 C ATOM 629 O PRO A 39 -4.772 -5.286 -2.724 1.00 0.00 O ATOM 630 CB PRO A 39 -2.857 -5.097 -5.143 1.00 0.00 C ATOM 631 CG PRO A 39 -1.628 -5.940 -5.123 1.00 0.00 C ATOM 632 CD PRO A 39 -1.380 -6.277 -3.681 1.00 0.00 C ATOM 0 HA PRO A 39 -2.535 -3.301 -3.899 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -3.753 -5.710 -5.243 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -2.847 -4.407 -5.987 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -1.765 -6.844 -5.717 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -0.780 -5.404 -5.550 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -1.881 -7.200 -3.391 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -0.318 -6.412 -3.475 1.00 0.00 H new ATOM 640 N ALA A 40 -4.884 -3.113 -3.301 1.00 0.00 N ATOM 641 CA ALA A 40 -6.236 -2.935 -2.784 1.00 0.00 C ATOM 642 C ALA A 40 -6.854 -1.632 -3.281 1.00 0.00 C ATOM 643 O ALA A 40 -6.181 -0.809 -3.902 1.00 0.00 O ATOM 644 CB ALA A 40 -6.224 -2.969 -1.263 1.00 0.00 C ATOM 0 H ALA A 40 -4.475 -2.274 -3.713 1.00 0.00 H new ATOM 0 HA ALA A 40 -6.849 -3.757 -3.154 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -7.239 -2.835 -0.888 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -5.835 -3.929 -0.924 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -5.589 -2.167 -0.886 1.00 0.00 H new ATOM 650 N TRP A 41 -8.141 -1.454 -3.001 1.00 0.00 N ATOM 651 CA TRP A 41 -8.859 -0.254 -3.415 1.00 0.00 C ATOM 652 C TRP A 41 -9.301 0.558 -2.200 1.00 0.00 C ATOM 653 O TRP A 41 -10.207 0.156 -1.472 1.00 0.00 O ATOM 654 CB TRP A 41 -10.079 -0.629 -4.257 1.00 0.00 C ATOM 655 CG TRP A 41 -9.726 -1.183 -5.604 1.00 0.00 C ATOM 656 CD1 TRP A 41 -8.693 -0.792 -6.405 1.00 0.00 C ATOM 657 CD2 TRP A 41 -10.407 -2.228 -6.307 1.00 0.00 C ATOM 658 NE1 TRP A 41 -8.688 -1.530 -7.563 1.00 0.00 N ATOM 659 CE2 TRP A 41 -9.731 -2.419 -7.527 1.00 0.00 C ATOM 660 CE3 TRP A 41 -11.522 -3.022 -6.023 1.00 0.00 C ATOM 661 CZ2 TRP A 41 -10.134 -3.370 -8.461 1.00 0.00 C ATOM 662 CZ3 TRP A 41 -11.921 -3.966 -6.951 1.00 0.00 C ATOM 663 CH2 TRP A 41 -11.228 -4.133 -8.157 1.00 0.00 C ATOM 0 H TRP A 41 -8.709 -2.128 -2.488 1.00 0.00 H new ATOM 0 HA TRP A 41 -8.183 0.355 -4.016 1.00 0.00 H new ATOM 0 HB2 TRP A 41 -10.673 -1.364 -3.715 1.00 0.00 H new ATOM 0 HB3 TRP A 41 -10.706 0.253 -4.388 1.00 0.00 H new ATOM 0 HD1 TRP A 41 -7.983 -0.015 -6.163 1.00 0.00 H new ATOM 0 HE1 TRP A 41 -8.018 -1.433 -8.326 1.00 0.00 H new ATOM 0 HE3 TRP A 41 -12.062 -2.900 -5.096 1.00 0.00 H new ATOM 0 HZ2 TRP A 41 -9.602 -3.500 -9.392 1.00 0.00 H new ATOM 0 HZ3 TRP A 41 -12.781 -4.585 -6.743 1.00 0.00 H new ATOM 0 HH2 TRP A 41 -11.564 -4.880 -8.861 1.00 0.00 H new ATOM 674 N ILE A 42 -8.654 1.700 -1.985 1.00 0.00 N ATOM 675 CA ILE A 42 -8.985 2.562 -0.856 1.00 0.00 C ATOM 676 C ILE A 42 -10.151 3.486 -1.193 1.00 0.00 C ATOM 677 O ILE A 42 -10.051 4.329 -2.085 1.00 0.00 O ATOM 678 CB ILE A 42 -7.779 3.418 -0.422 1.00 0.00 C ATOM 679 CG1 ILE A 42 -6.504 2.571 -0.383 1.00 0.00 C ATOM 680 CG2 ILE A 42 -8.043 4.054 0.938 1.00 0.00 C ATOM 681 CD1 ILE A 42 -6.536 1.474 0.659 1.00 0.00 C ATOM 0 H ILE A 42 -7.900 2.049 -2.576 1.00 0.00 H new ATOM 0 HA ILE A 42 -9.267 1.905 -0.034 1.00 0.00 H new ATOM 0 HB ILE A 42 -7.638 4.213 -1.154 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -6.345 2.124 -1.364 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -5.652 3.222 -0.187 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -7.183 4.656 1.232 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -8.926 4.690 0.877 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -8.209 3.272 1.679 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -5.600 0.916 0.628 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -6.663 1.915 1.648 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -7.367 0.800 0.452 1.00 0.00 H new ATOM 693 N THR A 43 -11.257 3.321 -0.473 1.00 0.00 N ATOM 694 CA THR A 43 -12.441 4.141 -0.694 1.00 0.00 C ATOM 695 C THR A 43 -12.288 5.510 -0.048 1.00 0.00 C ATOM 696 O THR A 43 -11.312 5.772 0.656 1.00 0.00 O ATOM 697 CB THR A 43 -13.683 3.447 -0.133 1.00 0.00 C ATOM 698 OG1 THR A 43 -13.349 2.645 0.988 1.00 0.00 O ATOM 699 CG2 THR A 43 -14.379 2.563 -1.141 1.00 0.00 C ATOM 0 H THR A 43 -11.357 2.627 0.268 1.00 0.00 H new ATOM 0 HA THR A 43 -12.556 4.274 -1.770 1.00 0.00 H new ATOM 0 HB THR A 43 -14.361 4.252 0.149 1.00 0.00 H new ATOM 0 HG1 THR A 43 -13.024 1.773 0.681 1.00 0.00 H new ATOM 0 HG21 THR A 43 -15.251 2.101 -0.679 1.00 0.00 H new ATOM 0 HG22 THR A 43 -14.695 3.163 -1.994 1.00 0.00 H new ATOM 0 HG23 THR A 43 -13.693 1.786 -1.478 1.00 0.00 H new ATOM 707 N ALA A 44 -13.264 6.380 -0.287 1.00 0.00 N ATOM 708 CA ALA A 44 -13.242 7.720 0.277 1.00 0.00 C ATOM 709 C ALA A 44 -13.250 7.664 1.800 1.00 0.00 C ATOM 710 O ALA A 44 -12.509 8.391 2.462 1.00 0.00 O ATOM 711 CB ALA A 44 -14.427 8.527 -0.231 1.00 0.00 C ATOM 0 H ALA A 44 -14.078 6.179 -0.867 1.00 0.00 H new ATOM 0 HA ALA A 44 -12.323 8.212 -0.042 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -14.397 9.528 0.200 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -14.380 8.598 -1.318 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -15.355 8.034 0.060 1.00 0.00 H new ATOM 717 N GLN A 45 -14.095 6.797 2.351 1.00 0.00 N ATOM 718 CA GLN A 45 -14.215 6.637 3.769 1.00 0.00 C ATOM 719 C GLN A 45 -12.903 6.199 4.407 1.00 0.00 C ATOM 720 O GLN A 45 -12.536 6.683 5.467 1.00 0.00 O ATOM 721 CB GLN A 45 -15.294 5.605 4.021 1.00 0.00 C ATOM 722 CG GLN A 45 -16.488 6.164 4.748 1.00 0.00 C ATOM 723 CD GLN A 45 -16.633 5.622 6.156 1.00 0.00 C ATOM 724 OE1 GLN A 45 -15.690 5.070 6.722 1.00 0.00 O ATOM 725 NE2 GLN A 45 -17.821 5.778 6.731 1.00 0.00 N ATOM 0 H GLN A 45 -14.712 6.190 1.811 1.00 0.00 H new ATOM 0 HA GLN A 45 -14.475 7.594 4.221 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -15.619 5.188 3.068 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -14.874 4.784 4.602 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -16.405 7.250 4.790 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -17.391 5.935 4.182 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -18.575 6.242 6.225 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -17.978 5.434 7.678 1.00 0.00 H new ATOM 734 N GLN A 46 -12.202 5.279 3.766 1.00 0.00 N ATOM 735 CA GLN A 46 -10.942 4.786 4.309 1.00 0.00 C ATOM 736 C GLN A 46 -9.945 5.925 4.493 1.00 0.00 C ATOM 737 O GLN A 46 -9.154 5.921 5.436 1.00 0.00 O ATOM 738 CB GLN A 46 -10.355 3.703 3.401 1.00 0.00 C ATOM 739 CG GLN A 46 -10.701 2.291 3.847 1.00 0.00 C ATOM 740 CD GLN A 46 -11.003 1.367 2.684 1.00 0.00 C ATOM 741 OE1 GLN A 46 -12.159 1.028 2.429 1.00 0.00 O ATOM 742 NE2 GLN A 46 -9.963 0.949 1.973 1.00 0.00 N ATOM 0 H GLN A 46 -12.478 4.860 2.878 1.00 0.00 H new ATOM 0 HA GLN A 46 -11.142 4.349 5.287 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -10.718 3.855 2.385 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -9.271 3.812 3.372 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -9.871 1.883 4.424 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -11.564 2.326 4.512 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -9.021 1.254 2.219 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -10.105 0.322 1.181 1.00 0.00 H new ATOM 751 N ILE A 47 -9.989 6.900 3.594 1.00 0.00 N ATOM 752 CA ILE A 47 -9.088 8.043 3.668 1.00 0.00 C ATOM 753 C ILE A 47 -9.457 8.976 4.821 1.00 0.00 C ATOM 754 O ILE A 47 -8.597 9.367 5.610 1.00 0.00 O ATOM 755 CB ILE A 47 -9.085 8.843 2.350 1.00 0.00 C ATOM 756 CG1 ILE A 47 -8.836 7.910 1.164 1.00 0.00 C ATOM 757 CG2 ILE A 47 -8.033 9.941 2.397 1.00 0.00 C ATOM 758 CD1 ILE A 47 -9.403 8.427 -0.140 1.00 0.00 C ATOM 0 H ILE A 47 -10.637 6.922 2.807 1.00 0.00 H new ATOM 0 HA ILE A 47 -8.090 7.642 3.844 1.00 0.00 H new ATOM 0 HB ILE A 47 -10.062 9.310 2.224 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -7.763 7.759 1.050 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -9.274 6.935 1.380 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -8.044 10.496 1.459 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -8.251 10.619 3.222 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -7.049 9.496 2.543 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -9.189 7.715 -0.937 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -10.482 8.551 -0.044 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -8.947 9.388 -0.380 1.00 0.00 H new ATOM 770 N GLU A 48 -10.733 9.336 4.910 1.00 0.00 N ATOM 771 CA GLU A 48 -11.204 10.230 5.965 1.00 0.00 C ATOM 772 C GLU A 48 -11.479 9.469 7.259 1.00 0.00 C ATOM 773 O GLU A 48 -11.057 9.885 8.339 1.00 0.00 O ATOM 774 CB GLU A 48 -12.472 10.958 5.517 1.00 0.00 C ATOM 775 CG GLU A 48 -12.646 12.325 6.157 1.00 0.00 C ATOM 776 CD GLU A 48 -14.067 12.843 6.049 1.00 0.00 C ATOM 777 OE1 GLU A 48 -14.966 12.245 6.676 1.00 0.00 O ATOM 778 OE2 GLU A 48 -14.280 13.848 5.337 1.00 0.00 O ATOM 0 H GLU A 48 -11.460 9.024 4.266 1.00 0.00 H new ATOM 0 HA GLU A 48 -10.416 10.958 6.157 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -12.451 11.073 4.433 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -13.339 10.341 5.755 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -12.363 12.269 7.208 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -11.968 13.034 5.682 1.00 0.00 H new ATOM 785 N ALA A 49 -12.192 8.354 7.143 1.00 0.00 N ATOM 786 CA ALA A 49 -12.531 7.530 8.300 1.00 0.00 C ATOM 787 C ALA A 49 -11.280 7.134 9.077 1.00 0.00 C ATOM 788 O ALA A 49 -11.237 7.243 10.301 1.00 0.00 O ATOM 789 CB ALA A 49 -13.301 6.288 7.863 1.00 0.00 C ATOM 0 H ALA A 49 -12.548 7.998 6.256 1.00 0.00 H new ATOM 0 HA ALA A 49 -13.166 8.121 8.960 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -13.546 5.685 8.738 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -14.220 6.588 7.360 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -12.688 5.702 7.178 1.00 0.00 H new ATOM 795 N ALA A 50 -10.263 6.677 8.355 1.00 0.00 N ATOM 796 CA ALA A 50 -9.008 6.268 8.976 1.00 0.00 C ATOM 797 C ALA A 50 -8.289 7.464 9.592 1.00 0.00 C ATOM 798 O ALA A 50 -7.738 7.372 10.689 1.00 0.00 O ATOM 799 CB ALA A 50 -8.113 5.581 7.957 1.00 0.00 C ATOM 0 H ALA A 50 -10.283 6.580 7.340 1.00 0.00 H new ATOM 0 HA ALA A 50 -9.238 5.562 9.774 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -7.180 5.282 8.435 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -8.619 4.699 7.564 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -7.897 6.269 7.140 1.00 0.00 H new ATOM 805 N ARG A 51 -8.300 8.586 8.879 1.00 0.00 N ATOM 806 CA ARG A 51 -7.649 9.802 9.356 1.00 0.00 C ATOM 807 C ARG A 51 -8.246 10.247 10.687 1.00 0.00 C ATOM 808 O ARG A 51 -7.522 10.635 11.604 1.00 0.00 O ATOM 809 CB ARG A 51 -7.786 10.919 8.318 1.00 0.00 C ATOM 810 CG ARG A 51 -6.456 11.392 7.756 1.00 0.00 C ATOM 811 CD ARG A 51 -6.514 12.853 7.341 1.00 0.00 C ATOM 812 NE ARG A 51 -7.588 13.110 6.384 1.00 0.00 N ATOM 813 CZ ARG A 51 -7.637 14.179 5.591 1.00 0.00 C ATOM 814 NH1 ARG A 51 -6.676 15.093 5.639 1.00 0.00 N ATOM 815 NH2 ARG A 51 -8.650 14.333 4.750 1.00 0.00 N ATOM 0 H ARG A 51 -8.752 8.679 7.969 1.00 0.00 H new ATOM 0 HA ARG A 51 -6.591 9.587 9.507 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -8.413 10.568 7.499 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -8.301 11.765 8.773 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -5.675 11.256 8.504 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -6.184 10.779 6.896 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -6.660 13.475 8.224 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -5.560 13.143 6.901 1.00 0.00 H new ATOM 0 HE ARG A 51 -8.346 12.430 6.319 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -5.895 14.979 6.285 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -6.718 15.910 5.030 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -9.391 13.633 4.711 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -8.688 15.151 4.142 1.00 0.00 H new ATOM 829 N VAL A 52 -9.569 10.184 10.785 1.00 0.00 N ATOM 830 CA VAL A 52 -10.265 10.578 12.004 1.00 0.00 C ATOM 831 C VAL A 52 -9.786 9.753 13.196 1.00 0.00 C ATOM 832 O VAL A 52 -9.448 10.299 14.246 1.00 0.00 O ATOM 833 CB VAL A 52 -11.791 10.411 11.858 1.00 0.00 C ATOM 834 CG1 VAL A 52 -12.508 10.947 13.087 1.00 0.00 C ATOM 835 CG2 VAL A 52 -12.284 11.103 10.594 1.00 0.00 C ATOM 0 H VAL A 52 -10.181 9.864 10.035 1.00 0.00 H new ATOM 0 HA VAL A 52 -10.038 11.630 12.176 1.00 0.00 H new ATOM 0 HB VAL A 52 -12.017 9.348 11.773 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -13.584 10.820 12.965 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -12.176 10.400 13.969 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -12.279 12.006 13.209 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -13.363 10.975 10.506 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -12.047 12.166 10.645 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -11.795 10.664 9.724 1.00 0.00 H new ATOM 845 N ALA A 53 -9.757 8.437 13.021 1.00 0.00 N ATOM 846 CA ALA A 53 -9.318 7.533 14.078 1.00 0.00 C ATOM 847 C ALA A 53 -7.893 7.853 14.518 1.00 0.00 C ATOM 848 O ALA A 53 -7.568 7.785 15.703 1.00 0.00 O ATOM 849 CB ALA A 53 -9.415 6.090 13.605 1.00 0.00 C ATOM 0 H ALA A 53 -10.033 7.972 12.156 1.00 0.00 H new ATOM 0 HA ALA A 53 -9.974 7.670 14.938 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -9.085 5.423 14.401 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -10.448 5.861 13.345 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -8.781 5.951 12.729 1.00 0.00 H new ATOM 855 N MET A 54 -7.049 8.202 13.554 1.00 0.00 N ATOM 856 CA MET A 54 -5.656 8.531 13.835 1.00 0.00 C ATOM 857 C MET A 54 -5.542 9.869 14.558 1.00 0.00 C ATOM 858 O MET A 54 -4.844 9.984 15.565 1.00 0.00 O ATOM 859 CB MET A 54 -4.851 8.565 12.537 1.00 0.00 C ATOM 860 CG MET A 54 -4.687 7.200 11.892 1.00 0.00 C ATOM 861 SD MET A 54 -3.418 7.182 10.612 1.00 0.00 S ATOM 862 CE MET A 54 -4.361 7.743 9.197 1.00 0.00 C ATOM 0 H MET A 54 -7.305 8.265 12.569 1.00 0.00 H new ATOM 0 HA MET A 54 -5.250 7.757 14.487 1.00 0.00 H new ATOM 0 HB2 MET A 54 -5.342 9.235 11.831 1.00 0.00 H new ATOM 0 HB3 MET A 54 -3.865 8.983 12.741 1.00 0.00 H new ATOM 0 HG2 MET A 54 -4.433 6.468 12.659 1.00 0.00 H new ATOM 0 HG3 MET A 54 -5.638 6.891 11.459 1.00 0.00 H new ATOM 0 HE1 MET A 54 -4.283 7.010 8.394 1.00 0.00 H new ATOM 0 HE2 MET A 54 -5.407 7.861 9.480 1.00 0.00 H new ATOM 0 HE3 MET A 54 -3.968 8.700 8.854 1.00 0.00 H new ATOM 872 N VAL A 55 -6.229 10.881 14.037 1.00 0.00 N ATOM 873 CA VAL A 55 -6.202 12.212 14.633 1.00 0.00 C ATOM 874 C VAL A 55 -6.644 12.170 16.094 1.00 0.00 C ATOM 875 O VAL A 55 -6.146 12.929 16.925 1.00 0.00 O ATOM 876 CB VAL A 55 -7.110 13.190 13.861 1.00 0.00 C ATOM 877 CG1 VAL A 55 -7.015 14.592 14.445 1.00 0.00 C ATOM 878 CG2 VAL A 55 -6.752 13.195 12.382 1.00 0.00 C ATOM 0 H VAL A 55 -6.811 10.804 13.203 1.00 0.00 H new ATOM 0 HA VAL A 55 -5.172 12.563 14.578 1.00 0.00 H new ATOM 0 HB VAL A 55 -8.141 12.852 13.963 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -7.664 15.265 13.884 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -7.327 14.573 15.489 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -5.985 14.944 14.381 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -7.403 13.891 11.852 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -5.714 13.505 12.260 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -6.882 12.193 11.973 1.00 0.00 H new ATOM 888 N ARG A 56 -7.580 11.279 16.398 1.00 0.00 N ATOM 889 CA ARG A 56 -8.090 11.136 17.756 1.00 0.00 C ATOM 890 C ARG A 56 -7.084 10.415 18.649 1.00 0.00 C ATOM 891 O ARG A 56 -7.041 10.642 19.859 1.00 0.00 O ATOM 892 CB ARG A 56 -9.415 10.373 17.740 1.00 0.00 C ATOM 893 CG ARG A 56 -10.616 11.245 17.412 1.00 0.00 C ATOM 894 CD ARG A 56 -11.640 10.490 16.578 1.00 0.00 C ATOM 895 NE ARG A 56 -12.826 11.298 16.304 1.00 0.00 N ATOM 896 CZ ARG A 56 -13.833 11.453 17.161 1.00 0.00 C ATOM 897 NH1 ARG A 56 -13.802 10.862 18.349 1.00 0.00 N ATOM 898 NH2 ARG A 56 -14.875 12.203 16.828 1.00 0.00 N ATOM 0 H ARG A 56 -8.002 10.643 15.721 1.00 0.00 H new ATOM 0 HA ARG A 56 -8.253 12.134 18.164 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -9.352 9.567 17.009 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -9.569 9.909 18.714 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -11.080 11.590 18.336 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -10.286 12.132 16.871 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -11.185 10.183 15.636 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -11.934 9.580 17.101 1.00 0.00 H new ATOM 0 HE ARG A 56 -12.886 11.771 15.403 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -13.003 10.284 18.611 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -14.577 10.985 19.000 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -14.904 12.660 15.917 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -15.647 12.323 17.483 1.00 0.00 H new ATOM 912 N HIS A 57 -6.283 9.541 18.049 1.00 0.00 N ATOM 913 CA HIS A 57 -5.284 8.781 18.795 1.00 0.00 C ATOM 914 C HIS A 57 -4.201 9.694 19.364 1.00 0.00 C ATOM 915 O HIS A 57 -3.989 9.737 20.576 1.00 0.00 O ATOM 916 CB HIS A 57 -4.646 7.716 17.901 1.00 0.00 C ATOM 917 CG HIS A 57 -3.837 6.711 18.660 1.00 0.00 C ATOM 918 ND1 HIS A 57 -4.395 5.797 19.529 1.00 0.00 N ATOM 919 CD2 HIS A 57 -2.503 6.479 18.679 1.00 0.00 C ATOM 920 CE1 HIS A 57 -3.440 5.048 20.051 1.00 0.00 C ATOM 921 NE2 HIS A 57 -2.283 5.442 19.551 1.00 0.00 N ATOM 0 H HIS A 57 -6.305 9.341 17.049 1.00 0.00 H new ATOM 0 HA HIS A 57 -5.793 8.295 19.627 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -5.430 7.198 17.349 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -4.007 8.205 17.165 1.00 0.00 H new ATOM 0 HD1 HIS A 57 -5.390 5.712 19.736 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -1.752 7.011 18.113 1.00 0.00 H new ATOM 0 HE1 HIS A 57 -3.581 4.250 20.765 1.00 0.00 H new ATOM 930 N PHE A 58 -3.514 10.420 18.484 1.00 0.00 N ATOM 931 CA PHE A 58 -2.447 11.327 18.904 1.00 0.00 C ATOM 932 C PHE A 58 -2.895 12.201 20.074 1.00 0.00 C ATOM 933 O PHE A 58 -3.558 13.221 19.884 1.00 0.00 O ATOM 934 CB PHE A 58 -2.004 12.212 17.738 1.00 0.00 C ATOM 935 CG PHE A 58 -1.805 11.463 16.450 1.00 0.00 C ATOM 936 CD1 PHE A 58 -0.772 10.546 16.313 1.00 0.00 C ATOM 937 CD2 PHE A 58 -2.653 11.675 15.375 1.00 0.00 C ATOM 938 CE1 PHE A 58 -0.591 9.858 15.129 1.00 0.00 C ATOM 939 CE2 PHE A 58 -2.476 10.989 14.188 1.00 0.00 C ATOM 940 CZ PHE A 58 -1.444 10.080 14.065 1.00 0.00 C ATOM 0 H PHE A 58 -3.677 10.398 17.477 1.00 0.00 H new ATOM 0 HA PHE A 58 -1.604 10.717 19.230 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -2.749 12.992 17.582 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -1.072 12.710 18.006 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -0.102 10.368 17.141 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -3.462 12.385 15.466 1.00 0.00 H new ATOM 0 HE1 PHE A 58 0.217 9.147 15.035 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -3.144 11.164 13.358 1.00 0.00 H new ATOM 0 HZ PHE A 58 -1.304 9.543 13.138 1.00 0.00 H new ATOM 950 N ARG A 59 -2.528 11.792 21.284 1.00 0.00 N ATOM 951 CA ARG A 59 -2.889 12.532 22.487 1.00 0.00 C ATOM 952 C ARG A 59 -2.278 13.930 22.475 1.00 0.00 C ATOM 953 O ARG A 59 -2.872 14.882 22.981 1.00 0.00 O ATOM 954 CB ARG A 59 -2.430 11.776 23.733 1.00 0.00 C ATOM 955 CG ARG A 59 -3.219 10.504 23.996 1.00 0.00 C ATOM 956 CD ARG A 59 -2.507 9.600 24.992 1.00 0.00 C ATOM 957 NE ARG A 59 -2.520 8.202 24.569 1.00 0.00 N ATOM 958 CZ ARG A 59 -3.588 7.413 24.651 1.00 0.00 C ATOM 959 NH1 ARG A 59 -4.731 7.878 25.139 1.00 0.00 N ATOM 960 NH2 ARG A 59 -3.514 6.152 24.244 1.00 0.00 N ATOM 0 H ARG A 59 -1.979 10.950 21.457 1.00 0.00 H new ATOM 0 HA ARG A 59 -3.974 12.631 22.507 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -1.375 11.524 23.627 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -2.516 12.433 24.599 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -4.207 10.760 24.378 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -3.369 9.968 23.059 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -1.476 9.933 25.111 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -2.985 9.688 25.968 1.00 0.00 H new ATOM 0 HE ARG A 59 -1.660 7.808 24.188 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -4.795 8.846 25.454 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -5.546 7.267 25.199 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -2.638 5.788 23.868 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -4.333 5.547 24.307 1.00 0.00 H new ATOM 974 N ARG A 60 -1.089 14.046 21.895 1.00 0.00 N ATOM 975 CA ARG A 60 -0.397 15.327 21.818 1.00 0.00 C ATOM 976 C ARG A 60 -0.625 15.990 20.462 1.00 0.00 C ATOM 977 O ARG A 60 0.250 16.686 19.946 1.00 0.00 O ATOM 978 CB ARG A 60 1.102 15.137 22.059 1.00 0.00 C ATOM 979 CG ARG A 60 1.419 14.331 23.308 1.00 0.00 C ATOM 980 CD ARG A 60 2.770 13.643 23.199 1.00 0.00 C ATOM 981 NE ARG A 60 3.290 13.247 24.505 1.00 0.00 N ATOM 982 CZ ARG A 60 4.559 12.909 24.727 1.00 0.00 C ATOM 983 NH1 ARG A 60 5.440 12.919 23.734 1.00 0.00 N ATOM 984 NH2 ARG A 60 4.949 12.561 25.946 1.00 0.00 N ATOM 0 H ARG A 60 -0.584 13.268 21.471 1.00 0.00 H new ATOM 0 HA ARG A 60 -0.804 15.977 22.593 1.00 0.00 H new ATOM 0 HB2 ARG A 60 1.541 14.639 21.194 1.00 0.00 H new ATOM 0 HB3 ARG A 60 1.576 16.115 22.138 1.00 0.00 H new ATOM 0 HG2 ARG A 60 1.413 14.988 24.178 1.00 0.00 H new ATOM 0 HG3 ARG A 60 0.641 13.584 23.468 1.00 0.00 H new ATOM 0 HD2 ARG A 60 2.678 12.762 22.563 1.00 0.00 H new ATOM 0 HD3 ARG A 60 3.480 14.313 22.714 1.00 0.00 H new ATOM 0 HE ARG A 60 2.643 13.228 25.294 1.00 0.00 H new ATOM 0 HH11 ARG A 60 5.147 13.187 22.795 1.00 0.00 H new ATOM 0 HH12 ARG A 60 6.410 12.659 23.911 1.00 0.00 H new ATOM 0 HH21 ARG A 60 4.277 12.552 26.713 1.00 0.00 H new ATOM 0 HH22 ARG A 60 5.921 12.302 26.116 1.00 0.00 H new ATOM 998 N GLY A 61 -1.805 15.770 19.891 1.00 0.00 N ATOM 999 CA GLY A 61 -2.125 16.354 18.602 1.00 0.00 C ATOM 1000 C GLY A 61 -1.178 15.898 17.509 1.00 0.00 C ATOM 1001 O GLY A 61 -0.054 15.481 17.786 1.00 0.00 O ATOM 0 H GLY A 61 -2.545 15.198 20.298 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -3.146 16.087 18.329 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -2.089 17.441 18.680 1.00 0.00 H new ATOM 1005 N GLY A 62 -1.635 15.976 16.264 1.00 0.00 N ATOM 1006 CA GLY A 62 -0.808 15.565 15.146 1.00 0.00 C ATOM 1007 C GLY A 62 -1.471 15.820 13.807 1.00 0.00 C ATOM 1008 O GLY A 62 -2.645 16.182 13.746 1.00 0.00 O ATOM 0 H GLY A 62 -2.562 16.316 16.010 1.00 0.00 H new ATOM 0 HA2 GLY A 62 0.141 16.099 15.185 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -0.580 14.503 15.238 1.00 0.00 H new ATOM 1012 N LYS A 63 -0.715 15.631 12.731 1.00 0.00 N ATOM 1013 CA LYS A 63 -1.233 15.842 11.384 1.00 0.00 C ATOM 1014 C LYS A 63 -0.796 14.715 10.455 1.00 0.00 C ATOM 1015 O LYS A 63 0.358 14.285 10.482 1.00 0.00 O ATOM 1016 CB LYS A 63 -0.756 17.188 10.835 1.00 0.00 C ATOM 1017 CG LYS A 63 0.735 17.425 11.014 1.00 0.00 C ATOM 1018 CD LYS A 63 1.026 18.856 11.437 1.00 0.00 C ATOM 1019 CE LYS A 63 2.391 19.314 10.948 1.00 0.00 C ATOM 1020 NZ LYS A 63 2.983 20.347 11.841 1.00 0.00 N ATOM 0 H LYS A 63 0.260 15.332 12.765 1.00 0.00 H new ATOM 0 HA LYS A 63 -2.322 15.847 11.435 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -1.000 17.245 9.774 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -1.305 17.988 11.331 1.00 0.00 H new ATOM 0 HG2 LYS A 63 1.126 16.737 11.763 1.00 0.00 H new ATOM 0 HG3 LYS A 63 1.253 17.208 10.080 1.00 0.00 H new ATOM 0 HD2 LYS A 63 0.256 19.518 11.041 1.00 0.00 H new ATOM 0 HD3 LYS A 63 0.983 18.931 12.524 1.00 0.00 H new ATOM 0 HE2 LYS A 63 3.062 18.457 10.890 1.00 0.00 H new ATOM 0 HE3 LYS A 63 2.299 19.716 9.939 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 3.913 20.633 11.473 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 2.356 21.176 11.877 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 3.095 19.956 12.798 1.00 0.00 H new ATOM 1034 N ILE A 64 -1.726 14.238 9.632 1.00 0.00 N ATOM 1035 CA ILE A 64 -1.436 13.158 8.696 1.00 0.00 C ATOM 1036 C ILE A 64 -1.519 13.643 7.252 1.00 0.00 C ATOM 1037 O ILE A 64 -2.461 14.340 6.875 1.00 0.00 O ATOM 1038 CB ILE A 64 -2.402 11.968 8.874 1.00 0.00 C ATOM 1039 CG1 ILE A 64 -2.804 11.807 10.344 1.00 0.00 C ATOM 1040 CG2 ILE A 64 -1.762 10.689 8.355 1.00 0.00 C ATOM 1041 CD1 ILE A 64 -3.752 10.654 10.587 1.00 0.00 C ATOM 0 H ILE A 64 -2.685 14.582 9.595 1.00 0.00 H new ATOM 0 HA ILE A 64 -0.421 12.826 8.915 1.00 0.00 H new ATOM 0 HB ILE A 64 -3.304 12.169 8.296 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -1.906 11.661 10.944 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -3.271 12.730 10.688 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -2.454 9.857 8.486 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -1.528 10.803 7.297 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -0.845 10.490 8.910 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -3.994 10.599 11.648 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -4.666 10.808 10.014 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -3.280 9.723 10.274 1.00 0.00 H new ATOM 1053 N PHE A 65 -0.532 13.264 6.449 1.00 0.00 N ATOM 1054 CA PHE A 65 -0.494 13.652 5.045 1.00 0.00 C ATOM 1055 C PHE A 65 -0.938 12.495 4.158 1.00 0.00 C ATOM 1056 O PHE A 65 -0.234 11.492 4.029 1.00 0.00 O ATOM 1057 CB PHE A 65 0.916 14.100 4.654 1.00 0.00 C ATOM 1058 CG PHE A 65 1.467 15.186 5.535 1.00 0.00 C ATOM 1059 CD1 PHE A 65 2.113 14.872 6.721 1.00 0.00 C ATOM 1060 CD2 PHE A 65 1.340 16.518 5.178 1.00 0.00 C ATOM 1061 CE1 PHE A 65 2.621 15.867 7.533 1.00 0.00 C ATOM 1062 CE2 PHE A 65 1.846 17.518 5.986 1.00 0.00 C ATOM 1063 CZ PHE A 65 2.488 17.192 7.166 1.00 0.00 C ATOM 0 H PHE A 65 0.254 12.687 6.747 1.00 0.00 H new ATOM 0 HA PHE A 65 -1.181 14.486 4.902 1.00 0.00 H new ATOM 0 HB2 PHE A 65 1.585 13.240 4.690 1.00 0.00 H new ATOM 0 HB3 PHE A 65 0.904 14.451 3.622 1.00 0.00 H new ATOM 0 HD1 PHE A 65 2.220 13.838 7.013 1.00 0.00 H new ATOM 0 HD2 PHE A 65 0.839 16.778 4.257 1.00 0.00 H new ATOM 0 HE1 PHE A 65 3.122 15.609 8.454 1.00 0.00 H new ATOM 0 HE2 PHE A 65 1.740 18.553 5.696 1.00 0.00 H new ATOM 0 HZ PHE A 65 2.885 17.972 7.800 1.00 0.00 H new ATOM 1073 N ILE A 66 -2.114 12.635 3.554 1.00 0.00 N ATOM 1074 CA ILE A 66 -2.654 11.594 2.685 1.00 0.00 C ATOM 1075 C ILE A 66 -2.323 11.868 1.223 1.00 0.00 C ATOM 1076 O ILE A 66 -2.433 12.999 0.751 1.00 0.00 O ATOM 1077 CB ILE A 66 -4.184 11.466 2.835 1.00 0.00 C ATOM 1078 CG1 ILE A 66 -4.603 11.666 4.295 1.00 0.00 C ATOM 1079 CG2 ILE A 66 -4.652 10.110 2.329 1.00 0.00 C ATOM 1080 CD1 ILE A 66 -3.883 10.751 5.262 1.00 0.00 C ATOM 0 H ILE A 66 -2.710 13.457 3.650 1.00 0.00 H new ATOM 0 HA ILE A 66 -2.187 10.659 2.993 1.00 0.00 H new ATOM 0 HB ILE A 66 -4.655 12.244 2.235 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -4.416 12.701 4.580 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -5.677 11.501 4.382 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -5.734 10.033 2.441 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -4.388 10.003 1.277 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -4.171 9.320 2.906 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -4.230 10.948 6.276 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -4.090 9.713 5.003 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -2.810 10.932 5.204 1.00 0.00 H new ATOM 1092 N ARG A 67 -1.918 10.822 0.511 1.00 0.00 N ATOM 1093 CA ARG A 67 -1.570 10.943 -0.900 1.00 0.00 C ATOM 1094 C ARG A 67 -2.578 10.203 -1.774 1.00 0.00 C ATOM 1095 O ARG A 67 -2.839 10.599 -2.910 1.00 0.00 O ATOM 1096 CB ARG A 67 -0.161 10.399 -1.148 1.00 0.00 C ATOM 1097 CG ARG A 67 0.694 11.300 -2.023 1.00 0.00 C ATOM 1098 CD ARG A 67 1.525 12.264 -1.191 1.00 0.00 C ATOM 1099 NE ARG A 67 2.948 12.180 -1.514 1.00 0.00 N ATOM 1100 CZ ARG A 67 3.502 12.759 -2.577 1.00 0.00 C ATOM 1101 NH1 ARG A 67 2.758 13.461 -3.422 1.00 0.00 N ATOM 1102 NH2 ARG A 67 4.803 12.635 -2.796 1.00 0.00 N ATOM 0 H ARG A 67 -1.823 9.879 0.889 1.00 0.00 H new ATOM 0 HA ARG A 67 -1.594 12.000 -1.166 1.00 0.00 H new ATOM 0 HB2 ARG A 67 0.338 10.257 -0.190 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -0.237 9.418 -1.616 1.00 0.00 H new ATOM 0 HG2 ARG A 67 1.353 10.690 -2.640 1.00 0.00 H new ATOM 0 HG3 ARG A 67 0.053 11.863 -2.702 1.00 0.00 H new ATOM 0 HD2 ARG A 67 1.175 13.282 -1.359 1.00 0.00 H new ATOM 0 HD3 ARG A 67 1.380 12.047 -0.133 1.00 0.00 H new ATOM 0 HE ARG A 67 3.552 11.647 -0.888 1.00 0.00 H new ATOM 0 HH11 ARG A 67 1.756 13.559 -3.259 1.00 0.00 H new ATOM 0 HH12 ARG A 67 3.188 13.902 -4.235 1.00 0.00 H new ATOM 0 HH21 ARG A 67 5.380 12.096 -2.150 1.00 0.00 H new ATOM 0 HH22 ARG A 67 5.228 13.079 -3.610 1.00 0.00 H new ATOM 1116 N ILE A 68 -3.144 9.126 -1.236 1.00 0.00 N ATOM 1117 CA ILE A 68 -4.123 8.330 -1.966 1.00 0.00 C ATOM 1118 C ILE A 68 -5.386 9.137 -2.249 1.00 0.00 C ATOM 1119 O ILE A 68 -5.828 9.931 -1.420 1.00 0.00 O ATOM 1120 CB ILE A 68 -4.503 7.056 -1.188 1.00 0.00 C ATOM 1121 CG1 ILE A 68 -5.096 7.419 0.175 1.00 0.00 C ATOM 1122 CG2 ILE A 68 -3.289 6.155 -1.020 1.00 0.00 C ATOM 1123 CD1 ILE A 68 -5.491 6.216 1.003 1.00 0.00 C ATOM 0 H ILE A 68 -2.940 8.785 -0.296 1.00 0.00 H new ATOM 0 HA ILE A 68 -3.659 8.045 -2.910 1.00 0.00 H new ATOM 0 HB ILE A 68 -5.258 6.514 -1.758 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -4.369 8.010 0.732 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -5.972 8.050 0.024 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -3.574 5.259 -0.468 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -2.908 5.871 -2.001 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -2.513 6.688 -0.470 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -5.903 6.549 1.955 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -6.241 5.635 0.466 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -4.614 5.596 1.185 1.00 0.00 H new ATOM 1135 N PHE A 69 -5.963 8.927 -3.428 1.00 0.00 N ATOM 1136 CA PHE A 69 -7.176 9.633 -3.823 1.00 0.00 C ATOM 1137 C PHE A 69 -8.070 8.742 -4.685 1.00 0.00 C ATOM 1138 O PHE A 69 -7.583 8.024 -5.558 1.00 0.00 O ATOM 1139 CB PHE A 69 -6.817 10.911 -4.585 1.00 0.00 C ATOM 1140 CG PHE A 69 -7.181 12.167 -3.848 1.00 0.00 C ATOM 1141 CD1 PHE A 69 -8.454 12.704 -3.957 1.00 0.00 C ATOM 1142 CD2 PHE A 69 -6.252 12.810 -3.047 1.00 0.00 C ATOM 1143 CE1 PHE A 69 -8.793 13.860 -3.280 1.00 0.00 C ATOM 1144 CE2 PHE A 69 -6.585 13.966 -2.368 1.00 0.00 C ATOM 1145 CZ PHE A 69 -7.856 14.493 -2.485 1.00 0.00 C ATOM 0 H PHE A 69 -5.610 8.273 -4.127 1.00 0.00 H new ATOM 0 HA PHE A 69 -7.726 9.898 -2.920 1.00 0.00 H new ATOM 0 HB2 PHE A 69 -5.746 10.915 -4.788 1.00 0.00 H new ATOM 0 HB3 PHE A 69 -7.324 10.905 -5.550 1.00 0.00 H new ATOM 0 HD1 PHE A 69 -9.189 12.214 -4.578 1.00 0.00 H new ATOM 0 HD2 PHE A 69 -5.256 12.403 -2.952 1.00 0.00 H new ATOM 0 HE1 PHE A 69 -9.789 14.268 -3.372 1.00 0.00 H new ATOM 0 HE2 PHE A 69 -5.852 14.457 -1.746 1.00 0.00 H new ATOM 0 HZ PHE A 69 -8.117 15.398 -1.956 1.00 0.00 H new ATOM 1155 N PRO A 70 -9.395 8.775 -4.452 1.00 0.00 N ATOM 1156 CA PRO A 70 -10.349 7.965 -5.214 1.00 0.00 C ATOM 1157 C PRO A 70 -10.570 8.505 -6.624 1.00 0.00 C ATOM 1158 O PRO A 70 -11.201 9.546 -6.807 1.00 0.00 O ATOM 1159 CB PRO A 70 -11.633 8.071 -4.392 1.00 0.00 C ATOM 1160 CG PRO A 70 -11.530 9.389 -3.708 1.00 0.00 C ATOM 1161 CD PRO A 70 -10.066 9.602 -3.429 1.00 0.00 C ATOM 0 HA PRO A 70 -9.999 6.942 -5.354 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -12.517 8.022 -5.028 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -11.712 7.256 -3.673 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -11.927 10.186 -4.337 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -12.108 9.394 -2.784 1.00 0.00 H new ATOM 0 HD2 PRO A 70 -9.789 10.653 -3.518 1.00 0.00 H new ATOM 0 HD3 PRO A 70 -9.800 9.286 -2.420 1.00 0.00 H new ATOM 1539 N VAL A 94 -12.372 4.578 -5.971 1.00 0.00 N ATOM 1540 CA VAL A 94 -11.334 4.110 -5.060 1.00 0.00 C ATOM 1541 C VAL A 94 -9.945 4.436 -5.595 1.00 0.00 C ATOM 1542 O VAL A 94 -9.783 4.771 -6.768 1.00 0.00 O ATOM 1543 CB VAL A 94 -11.433 2.591 -4.825 1.00 0.00 C ATOM 1544 CG1 VAL A 94 -12.660 2.256 -3.991 1.00 0.00 C ATOM 1545 CG2 VAL A 94 -11.458 1.844 -6.152 1.00 0.00 C ATOM 0 HA VAL A 94 -11.490 4.629 -4.114 1.00 0.00 H new ATOM 0 HB VAL A 94 -10.550 2.271 -4.272 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -12.712 1.178 -3.836 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -12.592 2.758 -3.026 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -13.557 2.591 -4.512 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -11.528 0.772 -5.965 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -12.320 2.168 -6.736 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -10.544 2.056 -6.706 1.00 0.00 H new ATOM 1555 N ALA A 95 -8.944 4.329 -4.727 1.00 0.00 N ATOM 1556 CA ALA A 95 -7.566 4.607 -5.112 1.00 0.00 C ATOM 1557 C ALA A 95 -6.739 3.326 -5.135 1.00 0.00 C ATOM 1558 O ALA A 95 -6.339 2.814 -4.089 1.00 0.00 O ATOM 1559 CB ALA A 95 -6.946 5.621 -4.162 1.00 0.00 C ATOM 0 H ALA A 95 -9.062 4.052 -3.753 1.00 0.00 H new ATOM 0 HA ALA A 95 -7.571 5.027 -6.118 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -5.917 5.819 -4.462 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -7.518 6.548 -4.195 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -6.958 5.224 -3.147 1.00 0.00 H new ATOM 1565 N VAL A 96 -6.492 2.809 -6.335 1.00 0.00 N ATOM 1566 CA VAL A 96 -5.716 1.584 -6.493 1.00 0.00 C ATOM 1567 C VAL A 96 -4.318 1.738 -5.905 1.00 0.00 C ATOM 1568 O VAL A 96 -3.632 2.727 -6.159 1.00 0.00 O ATOM 1569 CB VAL A 96 -5.597 1.171 -7.973 1.00 0.00 C ATOM 1570 CG1 VAL A 96 -5.113 -0.266 -8.085 1.00 0.00 C ATOM 1571 CG2 VAL A 96 -6.926 1.349 -8.692 1.00 0.00 C ATOM 0 H VAL A 96 -6.817 3.219 -7.211 1.00 0.00 H new ATOM 0 HA VAL A 96 -6.252 0.804 -5.952 1.00 0.00 H new ATOM 0 HB VAL A 96 -4.864 1.820 -8.453 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -5.034 -0.542 -9.136 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -4.136 -0.359 -7.611 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -5.822 -0.928 -7.588 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -6.818 1.051 -9.735 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -7.684 0.729 -8.214 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -7.229 2.395 -8.643 1.00 0.00 H new ATOM 1581 N VAL A 97 -3.905 0.752 -5.116 1.00 0.00 N ATOM 1582 CA VAL A 97 -2.591 0.775 -4.487 1.00 0.00 C ATOM 1583 C VAL A 97 -1.814 -0.504 -4.788 1.00 0.00 C ATOM 1584 O VAL A 97 -2.398 -1.527 -5.140 1.00 0.00 O ATOM 1585 CB VAL A 97 -2.707 0.941 -2.958 1.00 0.00 C ATOM 1586 CG1 VAL A 97 -1.329 1.051 -2.324 1.00 0.00 C ATOM 1587 CG2 VAL A 97 -3.556 2.153 -2.615 1.00 0.00 C ATOM 0 H VAL A 97 -4.462 -0.074 -4.897 1.00 0.00 H new ATOM 0 HA VAL A 97 -2.055 1.629 -4.902 1.00 0.00 H new ATOM 0 HB VAL A 97 -3.197 0.056 -2.553 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -1.433 1.168 -1.245 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -0.757 0.148 -2.538 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -0.808 1.916 -2.734 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -3.626 2.253 -1.532 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -3.097 3.049 -3.033 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -4.555 2.028 -3.033 1.00 0.00 H new ATOM 1597 N LYS A 98 -0.495 -0.434 -4.641 1.00 0.00 N ATOM 1598 CA LYS A 98 0.367 -1.584 -4.887 1.00 0.00 C ATOM 1599 C LYS A 98 1.333 -1.789 -3.721 1.00 0.00 C ATOM 1600 O LYS A 98 1.591 -0.862 -2.954 1.00 0.00 O ATOM 1601 CB LYS A 98 1.151 -1.394 -6.187 1.00 0.00 C ATOM 1602 CG LYS A 98 1.896 -0.071 -6.261 1.00 0.00 C ATOM 1603 CD LYS A 98 2.706 0.041 -7.542 1.00 0.00 C ATOM 1604 CE LYS A 98 3.836 1.049 -7.402 1.00 0.00 C ATOM 1605 NZ LYS A 98 3.508 2.346 -8.056 1.00 0.00 N ATOM 0 H LYS A 98 0.001 0.409 -4.352 1.00 0.00 H new ATOM 0 HA LYS A 98 -0.262 -2.469 -4.980 1.00 0.00 H new ATOM 0 HB2 LYS A 98 1.866 -2.210 -6.293 1.00 0.00 H new ATOM 0 HB3 LYS A 98 0.463 -1.461 -7.030 1.00 0.00 H new ATOM 0 HG2 LYS A 98 1.184 0.752 -6.206 1.00 0.00 H new ATOM 0 HG3 LYS A 98 2.559 0.023 -5.401 1.00 0.00 H new ATOM 0 HD2 LYS A 98 3.118 -0.935 -7.800 1.00 0.00 H new ATOM 0 HD3 LYS A 98 2.052 0.338 -8.362 1.00 0.00 H new ATOM 0 HE2 LYS A 98 4.043 1.218 -6.345 1.00 0.00 H new ATOM 0 HE3 LYS A 98 4.745 0.639 -7.844 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 4.304 3.005 -7.938 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 3.335 2.190 -9.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 2.656 2.750 -7.618 1.00 0.00 H new ATOM 1619 N PRO A 99 1.884 -3.005 -3.569 1.00 0.00 N ATOM 1620 CA PRO A 99 2.826 -3.307 -2.488 1.00 0.00 C ATOM 1621 C PRO A 99 3.976 -2.308 -2.439 1.00 0.00 C ATOM 1622 O PRO A 99 4.692 -2.121 -3.423 1.00 0.00 O ATOM 1623 CB PRO A 99 3.338 -4.705 -2.836 1.00 0.00 C ATOM 1624 CG PRO A 99 2.263 -5.310 -3.673 1.00 0.00 C ATOM 1625 CD PRO A 99 1.640 -4.172 -4.436 1.00 0.00 C ATOM 0 HA PRO A 99 2.356 -3.251 -1.506 1.00 0.00 H new ATOM 0 HB2 PRO A 99 4.282 -4.656 -3.380 1.00 0.00 H new ATOM 0 HB3 PRO A 99 3.518 -5.295 -1.937 1.00 0.00 H new ATOM 0 HG2 PRO A 99 2.672 -6.058 -4.353 1.00 0.00 H new ATOM 0 HG3 PRO A 99 1.523 -5.815 -3.052 1.00 0.00 H new ATOM 0 HD2 PRO A 99 2.099 -4.047 -5.417 1.00 0.00 H new ATOM 0 HD3 PRO A 99 0.575 -4.334 -4.601 1.00 0.00 H new ATOM 1633 N GLY A 100 4.138 -1.660 -1.292 1.00 0.00 N ATOM 1634 CA GLY A 100 5.191 -0.676 -1.141 1.00 0.00 C ATOM 1635 C GLY A 100 4.718 0.719 -1.492 1.00 0.00 C ATOM 1636 O GLY A 100 5.454 1.499 -2.095 1.00 0.00 O ATOM 0 H GLY A 100 3.559 -1.799 -0.464 1.00 0.00 H new ATOM 0 HA2 GLY A 100 5.554 -0.688 -0.113 1.00 0.00 H new ATOM 0 HA3 GLY A 100 6.033 -0.945 -1.779 1.00 0.00 H new ATOM 1640 N ARG A 101 3.479 1.028 -1.123 1.00 0.00 N ATOM 1641 CA ARG A 101 2.898 2.336 -1.410 1.00 0.00 C ATOM 1642 C ARG A 101 2.561 3.089 -0.127 1.00 0.00 C ATOM 1643 O ARG A 101 1.748 2.630 0.675 1.00 0.00 O ATOM 1644 CB ARG A 101 1.630 2.173 -2.246 1.00 0.00 C ATOM 1645 CG ARG A 101 1.288 3.393 -3.083 1.00 0.00 C ATOM 1646 CD ARG A 101 2.050 3.394 -4.396 1.00 0.00 C ATOM 1647 NE ARG A 101 1.493 4.347 -5.353 1.00 0.00 N ATOM 1648 CZ ARG A 101 1.601 5.668 -5.233 1.00 0.00 C ATOM 1649 NH1 ARG A 101 2.247 6.197 -4.200 1.00 0.00 N ATOM 1650 NH2 ARG A 101 1.063 6.464 -6.147 1.00 0.00 N ATOM 0 H ARG A 101 2.858 0.391 -0.625 1.00 0.00 H new ATOM 0 HA ARG A 101 3.638 2.913 -1.965 1.00 0.00 H new ATOM 0 HB2 ARG A 101 1.748 1.313 -2.905 1.00 0.00 H new ATOM 0 HB3 ARG A 101 0.794 1.953 -1.582 1.00 0.00 H new ATOM 0 HG2 ARG A 101 0.217 3.411 -3.282 1.00 0.00 H new ATOM 0 HG3 ARG A 101 1.523 4.298 -2.523 1.00 0.00 H new ATOM 0 HD2 ARG A 101 3.095 3.639 -4.208 1.00 0.00 H new ATOM 0 HD3 ARG A 101 2.029 2.393 -4.828 1.00 0.00 H new ATOM 0 HE ARG A 101 0.992 3.978 -6.161 1.00 0.00 H new ATOM 0 HH11 ARG A 101 2.663 5.590 -3.494 1.00 0.00 H new ATOM 0 HH12 ARG A 101 2.327 7.210 -4.113 1.00 0.00 H new ATOM 0 HH21 ARG A 101 0.566 6.064 -6.943 1.00 0.00 H new ATOM 0 HH22 ARG A 101 1.146 7.476 -6.054 1.00 0.00 H new ATOM 1664 N VAL A 102 3.175 4.254 0.051 1.00 0.00 N ATOM 1665 CA VAL A 102 2.923 5.075 1.230 1.00 0.00 C ATOM 1666 C VAL A 102 1.618 5.849 1.069 1.00 0.00 C ATOM 1667 O VAL A 102 1.569 6.867 0.378 1.00 0.00 O ATOM 1668 CB VAL A 102 4.072 6.072 1.487 1.00 0.00 C ATOM 1669 CG1 VAL A 102 3.985 6.636 2.898 1.00 0.00 C ATOM 1670 CG2 VAL A 102 5.422 5.409 1.254 1.00 0.00 C ATOM 0 H VAL A 102 3.849 4.650 -0.604 1.00 0.00 H new ATOM 0 HA VAL A 102 2.852 4.401 2.083 1.00 0.00 H new ATOM 0 HB VAL A 102 3.973 6.898 0.782 1.00 0.00 H new ATOM 0 HG11 VAL A 102 4.804 7.337 3.061 1.00 0.00 H new ATOM 0 HG12 VAL A 102 3.034 7.153 3.025 1.00 0.00 H new ATOM 0 HG13 VAL A 102 4.055 5.822 3.620 1.00 0.00 H new ATOM 0 HG21 VAL A 102 6.218 6.130 1.441 1.00 0.00 H new ATOM 0 HG22 VAL A 102 5.533 4.562 1.931 1.00 0.00 H new ATOM 0 HG23 VAL A 102 5.483 5.060 0.223 1.00 0.00 H new ATOM 1680 N MET A 103 0.557 5.353 1.699 1.00 0.00 N ATOM 1681 CA MET A 103 -0.753 5.991 1.612 1.00 0.00 C ATOM 1682 C MET A 103 -0.917 7.070 2.677 1.00 0.00 C ATOM 1683 O MET A 103 -1.585 8.078 2.454 1.00 0.00 O ATOM 1684 CB MET A 103 -1.864 4.948 1.760 1.00 0.00 C ATOM 1685 CG MET A 103 -1.583 3.644 1.031 1.00 0.00 C ATOM 1686 SD MET A 103 -2.738 2.333 1.483 1.00 0.00 S ATOM 1687 CE MET A 103 -1.948 1.671 2.949 1.00 0.00 C ATOM 0 H MET A 103 0.579 4.512 2.275 1.00 0.00 H new ATOM 0 HA MET A 103 -0.827 6.462 0.632 1.00 0.00 H new ATOM 0 HB2 MET A 103 -2.012 4.737 2.819 1.00 0.00 H new ATOM 0 HB3 MET A 103 -2.797 5.369 1.385 1.00 0.00 H new ATOM 0 HG2 MET A 103 -1.636 3.815 -0.044 1.00 0.00 H new ATOM 0 HG3 MET A 103 -0.566 3.320 1.253 1.00 0.00 H new ATOM 0 HE1 MET A 103 -2.077 0.589 2.975 1.00 0.00 H new ATOM 0 HE2 MET A 103 -0.885 1.909 2.928 1.00 0.00 H new ATOM 0 HE3 MET A 103 -2.401 2.111 3.837 1.00 0.00 H new ATOM 1697 N PHE A 104 -0.312 6.847 3.838 1.00 0.00 N ATOM 1698 CA PHE A 104 -0.402 7.798 4.939 1.00 0.00 C ATOM 1699 C PHE A 104 0.982 8.223 5.417 1.00 0.00 C ATOM 1700 O PHE A 104 1.971 7.536 5.170 1.00 0.00 O ATOM 1701 CB PHE A 104 -1.185 7.180 6.097 1.00 0.00 C ATOM 1702 CG PHE A 104 -2.655 7.046 5.823 1.00 0.00 C ATOM 1703 CD1 PHE A 104 -3.139 5.993 5.063 1.00 0.00 C ATOM 1704 CD2 PHE A 104 -3.555 7.971 6.327 1.00 0.00 C ATOM 1705 CE1 PHE A 104 -4.492 5.866 4.811 1.00 0.00 C ATOM 1706 CE2 PHE A 104 -4.908 7.850 6.079 1.00 0.00 C ATOM 1707 CZ PHE A 104 -5.378 6.796 5.319 1.00 0.00 C ATOM 0 H PHE A 104 0.245 6.017 4.041 1.00 0.00 H new ATOM 0 HA PHE A 104 -0.923 8.685 4.579 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -0.774 6.195 6.318 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -1.044 7.792 6.988 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -2.451 5.263 4.663 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -3.194 8.797 6.921 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -4.856 5.040 4.217 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -5.598 8.578 6.479 1.00 0.00 H new ATOM 0 HZ PHE A 104 -6.436 6.700 5.123 1.00 0.00 H new ATOM 1717 N GLU A 105 1.040 9.362 6.104 1.00 0.00 N ATOM 1718 CA GLU A 105 2.300 9.885 6.624 1.00 0.00 C ATOM 1719 C GLU A 105 2.050 10.869 7.764 1.00 0.00 C ATOM 1720 O GLU A 105 1.346 11.863 7.592 1.00 0.00 O ATOM 1721 CB GLU A 105 3.088 10.578 5.509 1.00 0.00 C ATOM 1722 CG GLU A 105 3.822 9.616 4.589 1.00 0.00 C ATOM 1723 CD GLU A 105 3.159 9.490 3.230 1.00 0.00 C ATOM 1724 OE1 GLU A 105 1.911 9.484 3.176 1.00 0.00 O ATOM 1725 OE2 GLU A 105 3.888 9.396 2.220 1.00 0.00 O ATOM 0 H GLU A 105 0.227 9.941 6.313 1.00 0.00 H new ATOM 0 HA GLU A 105 2.881 9.046 7.007 1.00 0.00 H new ATOM 0 HB2 GLU A 105 2.403 11.183 4.915 1.00 0.00 H new ATOM 0 HB3 GLU A 105 3.810 11.260 5.957 1.00 0.00 H new ATOM 0 HG2 GLU A 105 4.849 9.956 4.458 1.00 0.00 H new ATOM 0 HG3 GLU A 105 3.869 8.634 5.059 1.00 0.00 H new ATOM 1732 N VAL A 106 2.631 10.590 8.928 1.00 0.00 N ATOM 1733 CA VAL A 106 2.464 11.461 10.086 1.00 0.00 C ATOM 1734 C VAL A 106 3.765 12.179 10.430 1.00 0.00 C ATOM 1735 O VAL A 106 4.849 11.742 10.040 1.00 0.00 O ATOM 1736 CB VAL A 106 1.979 10.680 11.325 1.00 0.00 C ATOM 1737 CG1 VAL A 106 0.621 10.050 11.059 1.00 0.00 C ATOM 1738 CG2 VAL A 106 2.997 9.623 11.734 1.00 0.00 C ATOM 0 H VAL A 106 3.218 9.772 9.093 1.00 0.00 H new ATOM 0 HA VAL A 106 1.706 12.195 9.814 1.00 0.00 H new ATOM 0 HB VAL A 106 1.875 11.382 12.152 1.00 0.00 H new ATOM 0 HG11 VAL A 106 0.294 9.503 11.943 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -0.103 10.831 10.827 1.00 0.00 H new ATOM 0 HG13 VAL A 106 0.697 9.364 10.216 1.00 0.00 H new ATOM 0 HG21 VAL A 106 2.632 9.086 12.610 1.00 0.00 H new ATOM 0 HG22 VAL A 106 3.143 8.921 10.913 1.00 0.00 H new ATOM 0 HG23 VAL A 106 3.945 10.104 11.973 1.00 0.00 H new ATOM 1748 N ALA A 107 3.650 13.282 11.162 1.00 0.00 N ATOM 1749 CA ALA A 107 4.816 14.060 11.560 1.00 0.00 C ATOM 1750 C ALA A 107 4.552 14.819 12.856 1.00 0.00 C ATOM 1751 O ALA A 107 3.447 15.310 13.087 1.00 0.00 O ATOM 1752 CB ALA A 107 5.211 15.025 10.451 1.00 0.00 C ATOM 0 H ALA A 107 2.760 13.657 11.491 1.00 0.00 H new ATOM 0 HA ALA A 107 5.641 13.369 11.735 1.00 0.00 H new ATOM 0 HB1 ALA A 107 6.083 15.600 10.762 1.00 0.00 H new ATOM 0 HB2 ALA A 107 5.450 14.463 9.548 1.00 0.00 H new ATOM 0 HB3 ALA A 107 4.383 15.704 10.248 1.00 0.00 H new ATOM 1758 N GLY A 108 5.575 14.911 13.700 1.00 0.00 N ATOM 1759 CA GLY A 108 5.435 15.612 14.962 1.00 0.00 C ATOM 1760 C GLY A 108 5.110 14.680 16.113 1.00 0.00 C ATOM 1761 O GLY A 108 5.644 14.831 17.211 1.00 0.00 O ATOM 0 H GLY A 108 6.499 14.512 13.532 1.00 0.00 H new ATOM 0 HA2 GLY A 108 6.360 16.146 15.181 1.00 0.00 H new ATOM 0 HA3 GLY A 108 4.648 16.361 14.872 1.00 0.00 H new ATOM 1765 N VAL A 109 4.230 13.715 15.864 1.00 0.00 N ATOM 1766 CA VAL A 109 3.836 12.759 16.892 1.00 0.00 C ATOM 1767 C VAL A 109 4.959 11.768 17.181 1.00 0.00 C ATOM 1768 O VAL A 109 5.822 11.529 16.337 1.00 0.00 O ATOM 1769 CB VAL A 109 2.565 11.987 16.487 1.00 0.00 C ATOM 1770 CG1 VAL A 109 1.399 12.945 16.301 1.00 0.00 C ATOM 1771 CG2 VAL A 109 2.806 11.172 15.223 1.00 0.00 C ATOM 0 H VAL A 109 3.777 13.575 14.961 1.00 0.00 H new ATOM 0 HA VAL A 109 3.625 13.333 17.794 1.00 0.00 H new ATOM 0 HB VAL A 109 2.314 11.293 17.289 1.00 0.00 H new ATOM 0 HG11 VAL A 109 0.509 12.384 16.015 1.00 0.00 H new ATOM 0 HG12 VAL A 109 1.210 13.474 17.235 1.00 0.00 H new ATOM 0 HG13 VAL A 109 1.641 13.665 15.519 1.00 0.00 H new ATOM 0 HG21 VAL A 109 1.895 10.636 14.957 1.00 0.00 H new ATOM 0 HG22 VAL A 109 3.086 11.839 14.408 1.00 0.00 H new ATOM 0 HG23 VAL A 109 3.610 10.457 15.399 1.00 0.00 H new ATOM 1781 N THR A 110 4.942 11.198 18.382 1.00 0.00 N ATOM 1782 CA THR A 110 5.961 10.235 18.786 1.00 0.00 C ATOM 1783 C THR A 110 5.835 8.937 17.994 1.00 0.00 C ATOM 1784 O THR A 110 4.984 8.816 17.112 1.00 0.00 O ATOM 1785 CB THR A 110 5.854 9.942 20.286 1.00 0.00 C ATOM 1786 OG1 THR A 110 4.798 9.035 20.545 1.00 0.00 O ATOM 1787 CG2 THR A 110 5.612 11.180 21.124 1.00 0.00 C ATOM 0 H THR A 110 4.234 11.386 19.092 1.00 0.00 H new ATOM 0 HA THR A 110 6.937 10.673 18.576 1.00 0.00 H new ATOM 0 HB THR A 110 6.818 9.517 20.566 1.00 0.00 H new ATOM 0 HG1 THR A 110 4.747 8.859 21.508 1.00 0.00 H new ATOM 0 HG21 THR A 110 5.547 10.901 22.176 1.00 0.00 H new ATOM 0 HG22 THR A 110 6.436 11.880 20.985 1.00 0.00 H new ATOM 0 HG23 THR A 110 4.679 11.652 20.815 1.00 0.00 H new ATOM 1795 N GLU A 111 6.690 7.971 18.314 1.00 0.00 N ATOM 1796 CA GLU A 111 6.680 6.680 17.635 1.00 0.00 C ATOM 1797 C GLU A 111 5.483 5.841 18.072 1.00 0.00 C ATOM 1798 O GLU A 111 4.849 5.173 17.255 1.00 0.00 O ATOM 1799 CB GLU A 111 7.981 5.924 17.920 1.00 0.00 C ATOM 1800 CG GLU A 111 8.039 4.545 17.284 1.00 0.00 C ATOM 1801 CD GLU A 111 9.382 3.868 17.481 1.00 0.00 C ATOM 1802 OE1 GLU A 111 10.377 4.583 17.725 1.00 0.00 O ATOM 1803 OE2 GLU A 111 9.439 2.623 17.391 1.00 0.00 O ATOM 0 H GLU A 111 7.400 8.058 19.041 1.00 0.00 H new ATOM 0 HA GLU A 111 6.598 6.861 16.563 1.00 0.00 H new ATOM 0 HB2 GLU A 111 8.822 6.516 17.559 1.00 0.00 H new ATOM 0 HB3 GLU A 111 8.103 5.822 18.998 1.00 0.00 H new ATOM 0 HG2 GLU A 111 7.255 3.919 17.710 1.00 0.00 H new ATOM 0 HG3 GLU A 111 7.833 4.632 16.217 1.00 0.00 H new ATOM 1810 N GLU A 112 5.181 5.879 19.366 1.00 0.00 N ATOM 1811 CA GLU A 112 4.062 5.119 19.914 1.00 0.00 C ATOM 1812 C GLU A 112 2.739 5.566 19.299 1.00 0.00 C ATOM 1813 O GLU A 112 1.916 4.740 18.906 1.00 0.00 O ATOM 1814 CB GLU A 112 4.013 5.275 21.437 1.00 0.00 C ATOM 1815 CG GLU A 112 4.164 3.963 22.188 1.00 0.00 C ATOM 1816 CD GLU A 112 5.454 3.242 21.848 1.00 0.00 C ATOM 1817 OE1 GLU A 112 5.475 2.505 20.840 1.00 0.00 O ATOM 1818 OE2 GLU A 112 6.443 3.413 22.590 1.00 0.00 O ATOM 0 H GLU A 112 5.695 6.428 20.055 1.00 0.00 H new ATOM 0 HA GLU A 112 4.214 4.068 19.666 1.00 0.00 H new ATOM 0 HB2 GLU A 112 4.804 5.956 21.750 1.00 0.00 H new ATOM 0 HB3 GLU A 112 3.066 5.737 21.716 1.00 0.00 H new ATOM 0 HG2 GLU A 112 4.132 4.157 23.260 1.00 0.00 H new ATOM 0 HG3 GLU A 112 3.318 3.316 21.955 1.00 0.00 H new ATOM 1825 N GLN A 113 2.539 6.878 19.221 1.00 0.00 N ATOM 1826 CA GLN A 113 1.314 7.431 18.657 1.00 0.00 C ATOM 1827 C GLN A 113 1.315 7.315 17.137 1.00 0.00 C ATOM 1828 O GLN A 113 0.289 7.021 16.524 1.00 0.00 O ATOM 1829 CB GLN A 113 1.151 8.895 19.069 1.00 0.00 C ATOM 1830 CG GLN A 113 1.383 9.138 20.553 1.00 0.00 C ATOM 1831 CD GLN A 113 0.205 9.814 21.226 1.00 0.00 C ATOM 1832 OE1 GLN A 113 -0.098 10.975 20.953 1.00 0.00 O ATOM 1833 NE2 GLN A 113 -0.467 9.088 22.112 1.00 0.00 N ATOM 0 H GLN A 113 3.209 7.577 19.541 1.00 0.00 H new ATOM 0 HA GLN A 113 0.473 6.857 19.047 1.00 0.00 H new ATOM 0 HB2 GLN A 113 1.849 9.505 18.496 1.00 0.00 H new ATOM 0 HB3 GLN A 113 0.147 9.228 18.807 1.00 0.00 H new ATOM 0 HG2 GLN A 113 1.581 8.186 21.046 1.00 0.00 H new ATOM 0 HG3 GLN A 113 2.273 9.755 20.681 1.00 0.00 H new ATOM 0 HE21 GLN A 113 -0.181 8.129 22.308 1.00 0.00 H new ATOM 0 HE22 GLN A 113 -1.270 9.490 22.597 1.00 0.00 H new ATOM 1842 N ALA A 114 2.475 7.551 16.535 1.00 0.00 N ATOM 1843 CA ALA A 114 2.616 7.478 15.087 1.00 0.00 C ATOM 1844 C ALA A 114 2.461 6.048 14.582 1.00 0.00 C ATOM 1845 O ALA A 114 1.726 5.793 13.628 1.00 0.00 O ATOM 1846 CB ALA A 114 3.964 8.040 14.670 1.00 0.00 C ATOM 0 H ALA A 114 3.333 7.795 17.029 1.00 0.00 H new ATOM 0 HA ALA A 114 1.822 8.075 14.639 1.00 0.00 H new ATOM 0 HB1 ALA A 114 4.063 7.982 13.586 1.00 0.00 H new ATOM 0 HB2 ALA A 114 4.038 9.080 14.986 1.00 0.00 H new ATOM 0 HB3 ALA A 114 4.760 7.461 15.138 1.00 0.00 H new ATOM 1852 N MET A 115 3.161 5.118 15.222 1.00 0.00 N ATOM 1853 CA MET A 115 3.102 3.715 14.831 1.00 0.00 C ATOM 1854 C MET A 115 1.696 3.156 15.015 1.00 0.00 C ATOM 1855 O MET A 115 1.173 2.465 14.140 1.00 0.00 O ATOM 1856 CB MET A 115 4.103 2.894 15.646 1.00 0.00 C ATOM 1857 CG MET A 115 5.554 3.204 15.316 1.00 0.00 C ATOM 1858 SD MET A 115 6.389 1.840 14.482 1.00 0.00 S ATOM 1859 CE MET A 115 7.535 2.733 13.435 1.00 0.00 C ATOM 0 H MET A 115 3.775 5.310 16.013 1.00 0.00 H new ATOM 0 HA MET A 115 3.363 3.647 13.775 1.00 0.00 H new ATOM 0 HB2 MET A 115 3.933 3.078 16.707 1.00 0.00 H new ATOM 0 HB3 MET A 115 3.918 1.834 15.472 1.00 0.00 H new ATOM 0 HG2 MET A 115 5.596 4.091 14.684 1.00 0.00 H new ATOM 0 HG3 MET A 115 6.088 3.443 16.236 1.00 0.00 H new ATOM 0 HE1 MET A 115 7.971 2.049 12.707 1.00 0.00 H new ATOM 0 HE2 MET A 115 7.005 3.530 12.913 1.00 0.00 H new ATOM 0 HE3 MET A 115 8.327 3.164 14.047 1.00 0.00 H new ATOM 1869 N GLU A 116 1.086 3.461 16.155 1.00 0.00 N ATOM 1870 CA GLU A 116 -0.261 2.989 16.448 1.00 0.00 C ATOM 1871 C GLU A 116 -1.273 3.615 15.495 1.00 0.00 C ATOM 1872 O GLU A 116 -2.102 2.920 14.910 1.00 0.00 O ATOM 1873 CB GLU A 116 -0.636 3.318 17.893 1.00 0.00 C ATOM 1874 CG GLU A 116 -1.662 2.365 18.486 1.00 0.00 C ATOM 1875 CD GLU A 116 -1.561 2.266 19.995 1.00 0.00 C ATOM 1876 OE1 GLU A 116 -0.439 2.405 20.526 1.00 0.00 O ATOM 1877 OE2 GLU A 116 -2.604 2.047 20.647 1.00 0.00 O ATOM 0 H GLU A 116 1.503 4.032 16.890 1.00 0.00 H new ATOM 0 HA GLU A 116 -0.278 1.908 16.312 1.00 0.00 H new ATOM 0 HB2 GLU A 116 0.264 3.298 18.507 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -1.028 4.334 17.936 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -2.663 2.699 18.214 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -1.527 1.375 18.051 1.00 0.00 H new ATOM 1884 N ALA A 117 -1.195 4.934 15.342 1.00 0.00 N ATOM 1885 CA ALA A 117 -2.104 5.654 14.458 1.00 0.00 C ATOM 1886 C ALA A 117 -2.017 5.123 13.033 1.00 0.00 C ATOM 1887 O ALA A 117 -3.033 4.831 12.403 1.00 0.00 O ATOM 1888 CB ALA A 117 -1.793 7.142 14.486 1.00 0.00 C ATOM 0 H ALA A 117 -0.513 5.524 15.818 1.00 0.00 H new ATOM 0 HA ALA A 117 -3.122 5.497 14.815 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -2.478 7.669 13.822 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -1.910 7.519 15.502 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -0.768 7.306 14.154 1.00 0.00 H new ATOM 1894 N LEU A 118 -0.795 4.993 12.531 1.00 0.00 N ATOM 1895 CA LEU A 118 -0.577 4.490 11.181 1.00 0.00 C ATOM 1896 C LEU A 118 -1.117 3.072 11.044 1.00 0.00 C ATOM 1897 O LEU A 118 -1.564 2.667 9.971 1.00 0.00 O ATOM 1898 CB LEU A 118 0.917 4.524 10.841 1.00 0.00 C ATOM 1899 CG LEU A 118 1.402 5.765 10.077 1.00 0.00 C ATOM 1900 CD1 LEU A 118 0.532 6.977 10.379 1.00 0.00 C ATOM 1901 CD2 LEU A 118 2.853 6.059 10.422 1.00 0.00 C ATOM 0 H LEU A 118 0.058 5.228 13.038 1.00 0.00 H new ATOM 0 HA LEU A 118 -1.113 5.131 10.481 1.00 0.00 H new ATOM 0 HB2 LEU A 118 1.483 4.448 11.769 1.00 0.00 H new ATOM 0 HB3 LEU A 118 1.156 3.640 10.249 1.00 0.00 H new ATOM 0 HG LEU A 118 1.324 5.555 9.010 1.00 0.00 H new ATOM 0 HD11 LEU A 118 0.902 7.838 9.823 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -0.497 6.769 10.084 1.00 0.00 H new ATOM 0 HD13 LEU A 118 0.567 7.193 11.447 1.00 0.00 H new ATOM 0 HD21 LEU A 118 3.186 6.941 9.874 1.00 0.00 H new ATOM 0 HD22 LEU A 118 2.943 6.242 11.493 1.00 0.00 H new ATOM 0 HD23 LEU A 118 3.473 5.206 10.146 1.00 0.00 H new ATOM 1913 N ARG A 119 -1.080 2.322 12.141 1.00 0.00 N ATOM 1914 CA ARG A 119 -1.573 0.952 12.144 1.00 0.00 C ATOM 1915 C ARG A 119 -3.099 0.929 12.129 1.00 0.00 C ATOM 1916 O ARG A 119 -3.710 0.090 11.468 1.00 0.00 O ATOM 1917 CB ARG A 119 -1.042 0.197 13.365 1.00 0.00 C ATOM 1918 CG ARG A 119 -0.059 -0.908 13.011 1.00 0.00 C ATOM 1919 CD ARG A 119 0.871 -1.225 14.170 1.00 0.00 C ATOM 1920 NE ARG A 119 2.245 -0.812 13.898 1.00 0.00 N ATOM 1921 CZ ARG A 119 3.257 -0.999 14.743 1.00 0.00 C ATOM 1922 NH1 ARG A 119 3.053 -1.590 15.914 1.00 0.00 N ATOM 1923 NH2 ARG A 119 4.476 -0.594 14.414 1.00 0.00 N ATOM 0 H ARG A 119 -0.714 2.641 13.038 1.00 0.00 H new ATOM 0 HA ARG A 119 -1.213 0.456 11.243 1.00 0.00 H new ATOM 0 HB2 ARG A 119 -0.556 0.904 14.037 1.00 0.00 H new ATOM 0 HB3 ARG A 119 -1.882 -0.235 13.910 1.00 0.00 H new ATOM 0 HG2 ARG A 119 -0.608 -1.806 12.728 1.00 0.00 H new ATOM 0 HG3 ARG A 119 0.529 -0.608 12.144 1.00 0.00 H new ATOM 0 HD2 ARG A 119 0.513 -0.724 15.069 1.00 0.00 H new ATOM 0 HD3 ARG A 119 0.847 -2.296 14.371 1.00 0.00 H new ATOM 0 HE ARG A 119 2.441 -0.353 13.008 1.00 0.00 H new ATOM 0 HH11 ARG A 119 2.117 -1.904 16.171 1.00 0.00 H new ATOM 0 HH12 ARG A 119 3.832 -1.730 16.557 1.00 0.00 H new ATOM 0 HH21 ARG A 119 4.637 -0.140 13.515 1.00 0.00 H new ATOM 0 HH22 ARG A 119 5.252 -0.736 15.060 1.00 0.00 H new ATOM 1937 N ILE A 120 -3.710 1.864 12.855 1.00 0.00 N ATOM 1938 CA ILE A 120 -5.165 1.954 12.914 1.00 0.00 C ATOM 1939 C ILE A 120 -5.749 2.125 11.515 1.00 0.00 C ATOM 1940 O ILE A 120 -6.752 1.502 11.169 1.00 0.00 O ATOM 1941 CB ILE A 120 -5.622 3.128 13.810 1.00 0.00 C ATOM 1942 CG1 ILE A 120 -5.200 2.883 15.260 1.00 0.00 C ATOM 1943 CG2 ILE A 120 -7.132 3.325 13.721 1.00 0.00 C ATOM 1944 CD1 ILE A 120 -5.140 4.146 16.092 1.00 0.00 C ATOM 0 H ILE A 120 -3.220 2.567 13.408 1.00 0.00 H new ATOM 0 HA ILE A 120 -5.531 1.024 13.348 1.00 0.00 H new ATOM 0 HB ILE A 120 -5.140 4.038 13.453 1.00 0.00 H new ATOM 0 HG12 ILE A 120 -5.900 2.186 15.721 1.00 0.00 H new ATOM 0 HG13 ILE A 120 -4.221 2.404 15.269 1.00 0.00 H new ATOM 0 HG21 ILE A 120 -7.429 4.157 14.360 1.00 0.00 H new ATOM 0 HG22 ILE A 120 -7.410 3.543 12.690 1.00 0.00 H new ATOM 0 HG23 ILE A 120 -7.637 2.417 14.049 1.00 0.00 H new ATOM 0 HD11 ILE A 120 -4.834 3.898 17.108 1.00 0.00 H new ATOM 0 HD12 ILE A 120 -4.419 4.836 15.654 1.00 0.00 H new ATOM 0 HD13 ILE A 120 -6.124 4.615 16.113 1.00 0.00 H new ATOM 1956 N ALA A 121 -5.109 2.969 10.712 1.00 0.00 N ATOM 1957 CA ALA A 121 -5.562 3.217 9.350 1.00 0.00 C ATOM 1958 C ALA A 121 -5.547 1.931 8.532 1.00 0.00 C ATOM 1959 O ALA A 121 -6.521 1.600 7.857 1.00 0.00 O ATOM 1960 CB ALA A 121 -4.694 4.277 8.688 1.00 0.00 C ATOM 0 H ALA A 121 -4.276 3.492 10.982 1.00 0.00 H new ATOM 0 HA ALA A 121 -6.588 3.582 9.392 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -5.045 4.451 7.671 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -4.755 5.205 9.257 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -3.659 3.935 8.661 1.00 0.00 H new ATOM 1966 N GLY A 122 -4.434 1.206 8.603 1.00 0.00 N ATOM 1967 CA GLY A 122 -4.312 -0.039 7.871 1.00 0.00 C ATOM 1968 C GLY A 122 -5.180 -1.141 8.449 1.00 0.00 C ATOM 1969 O GLY A 122 -5.469 -2.132 7.778 1.00 0.00 O ATOM 0 H GLY A 122 -3.615 1.460 9.155 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -4.587 0.127 6.830 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -3.270 -0.360 7.878 1.00 0.00 H new ATOM 1973 N HIS A 123 -5.599 -0.969 9.701 1.00 0.00 N ATOM 1974 CA HIS A 123 -6.439 -1.958 10.366 1.00 0.00 C ATOM 1975 C HIS A 123 -7.748 -2.154 9.608 1.00 0.00 C ATOM 1976 O HIS A 123 -8.205 -3.282 9.423 1.00 0.00 O ATOM 1977 CB HIS A 123 -6.727 -1.528 11.805 1.00 0.00 C ATOM 1978 CG HIS A 123 -6.995 -2.675 12.729 1.00 0.00 C ATOM 1979 ND1 HIS A 123 -8.231 -3.274 12.846 1.00 0.00 N ATOM 1980 CD2 HIS A 123 -6.177 -3.335 13.584 1.00 0.00 C ATOM 1981 CE1 HIS A 123 -8.163 -4.251 13.733 1.00 0.00 C ATOM 1982 NE2 HIS A 123 -6.928 -4.309 14.194 1.00 0.00 N ATOM 0 H HIS A 123 -5.370 -0.156 10.273 1.00 0.00 H new ATOM 0 HA HIS A 123 -5.902 -2.906 10.380 1.00 0.00 H new ATOM 0 HB2 HIS A 123 -5.878 -0.959 12.182 1.00 0.00 H new ATOM 0 HB3 HIS A 123 -7.587 -0.859 11.810 1.00 0.00 H new ATOM 0 HD2 HIS A 123 -5.130 -3.133 13.754 1.00 0.00 H new ATOM 0 HE1 HIS A 123 -8.979 -4.893 14.030 1.00 0.00 H new ATOM 0 HE2 HIS A 123 -6.586 -4.971 14.891 1.00 0.00 H new ATOM 1991 N LYS A 124 -8.344 -1.050 9.170 1.00 0.00 N ATOM 1992 CA LYS A 124 -9.600 -1.103 8.430 1.00 0.00 C ATOM 1993 C LYS A 124 -9.353 -1.274 6.930 1.00 0.00 C ATOM 1994 O LYS A 124 -10.295 -1.286 6.138 1.00 0.00 O ATOM 1995 CB LYS A 124 -10.421 0.164 8.681 1.00 0.00 C ATOM 1996 CG LYS A 124 -9.718 1.442 8.253 1.00 0.00 C ATOM 1997 CD LYS A 124 -9.144 2.189 9.446 1.00 0.00 C ATOM 1998 CE LYS A 124 -10.219 2.971 10.184 1.00 0.00 C ATOM 1999 NZ LYS A 124 -9.767 3.392 11.539 1.00 0.00 N ATOM 0 H LYS A 124 -7.978 -0.109 9.314 1.00 0.00 H new ATOM 0 HA LYS A 124 -10.159 -1.968 8.786 1.00 0.00 H new ATOM 0 HB2 LYS A 124 -11.368 0.084 8.147 1.00 0.00 H new ATOM 0 HB3 LYS A 124 -10.658 0.228 9.743 1.00 0.00 H new ATOM 0 HG2 LYS A 124 -8.917 1.201 7.554 1.00 0.00 H new ATOM 0 HG3 LYS A 124 -10.421 2.085 7.724 1.00 0.00 H new ATOM 0 HD2 LYS A 124 -8.675 1.481 10.129 1.00 0.00 H new ATOM 0 HD3 LYS A 124 -8.364 2.871 9.108 1.00 0.00 H new ATOM 0 HE2 LYS A 124 -10.491 3.852 9.602 1.00 0.00 H new ATOM 0 HE3 LYS A 124 -11.116 2.359 10.274 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 -10.584 3.723 12.090 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 -9.326 2.585 12.024 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 -9.074 4.163 11.450 1.00 0.00 H new ATOM 2013 N LEU A 125 -8.086 -1.412 6.545 1.00 0.00 N ATOM 2014 CA LEU A 125 -7.731 -1.586 5.141 1.00 0.00 C ATOM 2015 C LEU A 125 -7.841 -3.053 4.738 1.00 0.00 C ATOM 2016 O LEU A 125 -7.688 -3.947 5.571 1.00 0.00 O ATOM 2017 CB LEU A 125 -6.307 -1.084 4.882 1.00 0.00 C ATOM 2018 CG LEU A 125 -6.157 0.436 4.794 1.00 0.00 C ATOM 2019 CD1 LEU A 125 -4.727 0.810 4.438 1.00 0.00 C ATOM 2020 CD2 LEU A 125 -7.130 1.013 3.777 1.00 0.00 C ATOM 0 H LEU A 125 -7.291 -1.407 7.184 1.00 0.00 H new ATOM 0 HA LEU A 125 -8.428 -1.002 4.540 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -5.659 -1.451 5.678 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -5.948 -1.523 3.951 1.00 0.00 H new ATOM 0 HG LEU A 125 -6.391 0.861 5.770 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -4.638 1.895 4.380 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -4.050 0.431 5.204 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -4.466 0.372 3.475 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -7.007 2.095 3.729 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -6.930 0.582 2.796 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -8.151 0.776 4.076 1.00 0.00 H new ATOM 2032 N PRO A 126 -8.110 -3.323 3.449 1.00 0.00 N ATOM 2033 CA PRO A 126 -8.241 -4.684 2.938 1.00 0.00 C ATOM 2034 C PRO A 126 -6.902 -5.287 2.517 1.00 0.00 C ATOM 2035 O PRO A 126 -6.859 -6.216 1.712 1.00 0.00 O ATOM 2036 CB PRO A 126 -9.145 -4.488 1.725 1.00 0.00 C ATOM 2037 CG PRO A 126 -8.788 -3.135 1.204 1.00 0.00 C ATOM 2038 CD PRO A 126 -8.312 -2.322 2.386 1.00 0.00 C ATOM 0 HA PRO A 126 -8.629 -5.375 3.686 1.00 0.00 H new ATOM 0 HB2 PRO A 126 -8.974 -5.260 0.974 1.00 0.00 H new ATOM 0 HB3 PRO A 126 -10.198 -4.541 2.002 1.00 0.00 H new ATOM 0 HG2 PRO A 126 -8.009 -3.206 0.445 1.00 0.00 H new ATOM 0 HG3 PRO A 126 -9.650 -2.663 0.732 1.00 0.00 H new ATOM 0 HD2 PRO A 126 -7.389 -1.790 2.158 1.00 0.00 H new ATOM 0 HD3 PRO A 126 -9.048 -1.573 2.678 1.00 0.00 H new ATOM 2046 N ILE A 127 -5.813 -4.753 3.064 1.00 0.00 N ATOM 2047 CA ILE A 127 -4.479 -5.244 2.738 1.00 0.00 C ATOM 2048 C ILE A 127 -3.512 -5.024 3.896 1.00 0.00 C ATOM 2049 O ILE A 127 -3.764 -4.210 4.784 1.00 0.00 O ATOM 2050 CB ILE A 127 -3.918 -4.554 1.480 1.00 0.00 C ATOM 2051 CG1 ILE A 127 -4.128 -3.040 1.559 1.00 0.00 C ATOM 2052 CG2 ILE A 127 -4.577 -5.120 0.232 1.00 0.00 C ATOM 2053 CD1 ILE A 127 -3.172 -2.345 2.503 1.00 0.00 C ATOM 0 H ILE A 127 -5.829 -3.983 3.733 1.00 0.00 H new ATOM 0 HA ILE A 127 -4.575 -6.313 2.546 1.00 0.00 H new ATOM 0 HB ILE A 127 -2.847 -4.748 1.426 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -4.016 -2.613 0.562 1.00 0.00 H new ATOM 0 HG13 ILE A 127 -5.151 -2.840 1.878 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -4.172 -4.624 -0.650 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -4.379 -6.190 0.170 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -5.653 -4.952 0.281 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -3.379 -1.275 2.508 1.00 0.00 H new ATOM 0 HD12 ILE A 127 -3.300 -2.744 3.509 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -2.147 -2.514 2.173 1.00 0.00 H new ATOM 2065 N LYS A 128 -2.403 -5.757 3.880 1.00 0.00 N ATOM 2066 CA LYS A 128 -1.396 -5.644 4.927 1.00 0.00 C ATOM 2067 C LYS A 128 -0.595 -4.356 4.772 1.00 0.00 C ATOM 2068 O LYS A 128 -0.186 -3.996 3.669 1.00 0.00 O ATOM 2069 CB LYS A 128 -0.458 -6.854 4.893 1.00 0.00 C ATOM 2070 CG LYS A 128 -0.504 -7.692 6.161 1.00 0.00 C ATOM 2071 CD LYS A 128 -0.074 -6.888 7.377 1.00 0.00 C ATOM 2072 CE LYS A 128 0.325 -7.794 8.531 1.00 0.00 C ATOM 2073 NZ LYS A 128 1.436 -8.713 8.157 1.00 0.00 N ATOM 0 H LYS A 128 -2.180 -6.436 3.152 1.00 0.00 H new ATOM 0 HA LYS A 128 -1.907 -5.618 5.890 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -0.719 -7.483 4.042 1.00 0.00 H new ATOM 0 HB3 LYS A 128 0.563 -6.508 4.732 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -1.515 -8.069 6.312 1.00 0.00 H new ATOM 0 HG3 LYS A 128 0.146 -8.559 6.049 1.00 0.00 H new ATOM 0 HD2 LYS A 128 0.765 -6.245 7.111 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -0.889 -6.236 7.690 1.00 0.00 H new ATOM 0 HE2 LYS A 128 0.629 -7.185 9.382 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -0.538 -8.379 8.849 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 1.966 -8.982 9.010 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 1.045 -9.566 7.709 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 2.074 -8.233 7.490 1.00 0.00 H new ATOM 2087 N THR A 129 -0.376 -3.664 5.885 1.00 0.00 N ATOM 2088 CA THR A 129 0.375 -2.415 5.874 1.00 0.00 C ATOM 2089 C THR A 129 1.342 -2.354 7.053 1.00 0.00 C ATOM 2090 O THR A 129 1.122 -2.999 8.078 1.00 0.00 O ATOM 2091 CB THR A 129 -0.578 -1.221 5.923 1.00 0.00 C ATOM 2092 OG1 THR A 129 -1.184 -1.115 7.198 1.00 0.00 O ATOM 2093 CG2 THR A 129 -1.683 -1.296 4.893 1.00 0.00 C ATOM 0 H THR A 129 -0.708 -3.948 6.807 1.00 0.00 H new ATOM 0 HA THR A 129 0.950 -2.374 4.949 1.00 0.00 H new ATOM 0 HB THR A 129 0.039 -0.349 5.707 1.00 0.00 H new ATOM 0 HG1 THR A 129 -1.817 -1.853 7.322 1.00 0.00 H new ATOM 0 HG21 THR A 129 -2.323 -0.418 4.982 1.00 0.00 H new ATOM 0 HG22 THR A 129 -1.248 -1.328 3.894 1.00 0.00 H new ATOM 0 HG23 THR A 129 -2.275 -2.196 5.060 1.00 0.00 H new ATOM 2101 N LYS A 130 2.410 -1.578 6.903 1.00 0.00 N ATOM 2102 CA LYS A 130 3.404 -1.442 7.964 1.00 0.00 C ATOM 2103 C LYS A 130 3.856 0.006 8.114 1.00 0.00 C ATOM 2104 O LYS A 130 3.706 0.813 7.196 1.00 0.00 O ATOM 2105 CB LYS A 130 4.610 -2.337 7.677 1.00 0.00 C ATOM 2106 CG LYS A 130 5.350 -1.959 6.407 1.00 0.00 C ATOM 2107 CD LYS A 130 6.705 -2.638 6.328 1.00 0.00 C ATOM 2108 CE LYS A 130 7.582 -1.990 5.271 1.00 0.00 C ATOM 2109 NZ LYS A 130 9.017 -2.346 5.442 1.00 0.00 N ATOM 0 H LYS A 130 2.610 -1.036 6.062 1.00 0.00 H new ATOM 0 HA LYS A 130 2.940 -1.753 8.900 1.00 0.00 H new ATOM 0 HB2 LYS A 130 5.300 -2.287 8.520 1.00 0.00 H new ATOM 0 HB3 LYS A 130 4.276 -3.372 7.600 1.00 0.00 H new ATOM 0 HG2 LYS A 130 4.751 -2.238 5.540 1.00 0.00 H new ATOM 0 HG3 LYS A 130 5.481 -0.878 6.370 1.00 0.00 H new ATOM 0 HD2 LYS A 130 7.199 -2.584 7.298 1.00 0.00 H new ATOM 0 HD3 LYS A 130 6.572 -3.695 6.097 1.00 0.00 H new ATOM 0 HE2 LYS A 130 7.247 -2.301 4.282 1.00 0.00 H new ATOM 0 HE3 LYS A 130 7.469 -0.907 5.320 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 9.580 -1.883 4.700 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 9.345 -2.027 6.376 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 9.130 -3.377 5.369 1.00 0.00 H new ATOM 2123 N ILE A 131 4.418 0.326 9.277 1.00 0.00 N ATOM 2124 CA ILE A 131 4.901 1.677 9.547 1.00 0.00 C ATOM 2125 C ILE A 131 6.346 1.832 9.086 1.00 0.00 C ATOM 2126 O ILE A 131 7.163 0.931 9.273 1.00 0.00 O ATOM 2127 CB ILE A 131 4.833 2.033 11.049 1.00 0.00 C ATOM 2128 CG1 ILE A 131 3.676 1.304 11.742 1.00 0.00 C ATOM 2129 CG2 ILE A 131 4.708 3.539 11.231 1.00 0.00 C ATOM 2130 CD1 ILE A 131 2.315 1.618 11.162 1.00 0.00 C ATOM 0 H ILE A 131 4.550 -0.331 10.046 1.00 0.00 H new ATOM 0 HA ILE A 131 4.248 2.353 8.995 1.00 0.00 H new ATOM 0 HB ILE A 131 5.760 1.702 11.517 1.00 0.00 H new ATOM 0 HG12 ILE A 131 3.847 0.229 11.679 1.00 0.00 H new ATOM 0 HG13 ILE A 131 3.678 1.565 12.800 1.00 0.00 H new ATOM 0 HG21 ILE A 131 4.661 3.774 12.294 1.00 0.00 H new ATOM 0 HG22 ILE A 131 5.573 4.032 10.788 1.00 0.00 H new ATOM 0 HG23 ILE A 131 3.800 3.891 10.741 1.00 0.00 H new ATOM 0 HD11 ILE A 131 1.551 1.064 11.707 1.00 0.00 H new ATOM 0 HD12 ILE A 131 2.120 2.687 11.250 1.00 0.00 H new ATOM 0 HD13 ILE A 131 2.292 1.330 10.111 1.00 0.00 H new ATOM 2142 N VAL A 132 6.662 2.978 8.493 1.00 0.00 N ATOM 2143 CA VAL A 132 8.017 3.234 8.023 1.00 0.00 C ATOM 2144 C VAL A 132 8.375 4.715 8.129 1.00 0.00 C ATOM 2145 O VAL A 132 7.572 5.589 7.803 1.00 0.00 O ATOM 2146 CB VAL A 132 8.218 2.755 6.572 1.00 0.00 C ATOM 2147 CG1 VAL A 132 7.771 1.310 6.423 1.00 0.00 C ATOM 2148 CG2 VAL A 132 7.471 3.647 5.594 1.00 0.00 C ATOM 0 H VAL A 132 6.003 3.739 8.327 1.00 0.00 H new ATOM 0 HA VAL A 132 8.683 2.664 8.671 1.00 0.00 H new ATOM 0 HB VAL A 132 9.281 2.817 6.340 1.00 0.00 H new ATOM 0 HG11 VAL A 132 7.920 0.988 5.392 1.00 0.00 H new ATOM 0 HG12 VAL A 132 8.357 0.677 7.089 1.00 0.00 H new ATOM 0 HG13 VAL A 132 6.715 1.227 6.680 1.00 0.00 H new ATOM 0 HG21 VAL A 132 7.630 3.286 4.578 1.00 0.00 H new ATOM 0 HG22 VAL A 132 6.406 3.627 5.824 1.00 0.00 H new ATOM 0 HG23 VAL A 132 7.841 4.669 5.678 1.00 0.00 H new ATOM 2158 N ARG A 133 9.589 4.977 8.594 1.00 0.00 N ATOM 2159 CA ARG A 133 10.088 6.338 8.761 1.00 0.00 C ATOM 2160 C ARG A 133 10.703 6.866 7.477 1.00 0.00 C ATOM 2161 O ARG A 133 10.983 6.102 6.555 1.00 0.00 O ATOM 2162 CB ARG A 133 11.145 6.387 9.854 1.00 0.00 C ATOM 2163 CG ARG A 133 10.861 7.409 10.942 1.00 0.00 C ATOM 2164 CD ARG A 133 11.397 6.953 12.290 1.00 0.00 C ATOM 2165 NE ARG A 133 12.665 7.598 12.624 1.00 0.00 N ATOM 2166 CZ ARG A 133 13.852 7.169 12.200 1.00 0.00 C ATOM 2167 NH1 ARG A 133 13.942 6.096 11.424 1.00 0.00 N ATOM 2168 NH2 ARG A 133 14.954 7.816 12.553 1.00 0.00 N ATOM 0 H ARG A 133 10.256 4.255 8.866 1.00 0.00 H new ATOM 0 HA ARG A 133 9.235 6.960 9.033 1.00 0.00 H new ATOM 0 HB2 ARG A 133 11.228 5.400 10.309 1.00 0.00 H new ATOM 0 HB3 ARG A 133 12.111 6.612 9.402 1.00 0.00 H new ATOM 0 HG2 ARG A 133 11.314 8.363 10.673 1.00 0.00 H new ATOM 0 HG3 ARG A 133 9.786 7.576 11.014 1.00 0.00 H new ATOM 0 HD2 ARG A 133 10.663 7.174 13.065 1.00 0.00 H new ATOM 0 HD3 ARG A 133 11.533 5.872 12.279 1.00 0.00 H new ATOM 0 HE ARG A 133 12.639 8.427 13.218 1.00 0.00 H new ATOM 0 HH11 ARG A 133 13.098 5.594 11.148 1.00 0.00 H new ATOM 0 HH12 ARG A 133 14.855 5.774 11.103 1.00 0.00 H new ATOM 0 HH21 ARG A 133 14.892 8.642 13.149 1.00 0.00 H new ATOM 0 HH22 ARG A 133 15.864 7.488 12.229 1.00 0.00 H new