USER MOD reduce.3.24.130724 H: found=0, std=0, add=673, rem=0, adj=12 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 180:sc= -1.23 USER MOD Set 1.2: A 46 GLN : amide:sc= -4.12 K(o=-5.4,f=-9.8!) USER MOD Single : A 32 TYR OH : rot 30:sc= -2.71 USER MOD Single : A 45 GLN : amide:sc= -0.236 K(o=-0.24,f=-0.89) USER MOD Single : A 54 MET CE :methyl 144:sc= -9.34! (180deg=-12.9!) USER MOD Single : A 57 HIS : no HE2:sc= -2.67 K(o=-2.7,f=-6!) USER MOD Single : A 63 LYS NZ :NH3+ 173:sc= -0.0149 (180deg=-0.0686) USER MOD Single : A 98 LYS NZ :NH3+ -120:sc= -0.243 (180deg=-2.47!) USER MOD Single : A 103 MET CE :methyl -141:sc= -4.21! (180deg=-7.58!) USER MOD Single : A 110 THR OG1 : rot 180:sc= -0.174 USER MOD Single : A 113 GLN : amide:sc= -0.88 K(o=-0.88,f=-11!) USER MOD Single : A 115 MET CE :methyl -174:sc= -0.446 (180deg=-0.57) USER MOD Single : A 123 HIS : no HD1:sc= -0.303 X(o=-0.3,f=-0.42) USER MOD Single : A 124 LYS NZ :NH3+ 150:sc= -0.229 (180deg=-1.18) USER MOD Single : A 128 LYS NZ :NH3+ 144:sc= -0.236 (180deg=-1.03) USER MOD Single : A 129 THR OG1 : rot -66:sc= -1.17 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 507 N ASP A 31 7.271 12.439 8.928 1.00 0.00 N ATOM 508 CA ASP A 31 8.332 11.633 9.520 1.00 0.00 C ATOM 509 C ASP A 31 8.052 10.146 9.328 1.00 0.00 C ATOM 510 O ASP A 31 8.938 9.380 8.950 1.00 0.00 O ATOM 511 CB ASP A 31 8.471 11.949 11.010 1.00 0.00 C ATOM 512 CG ASP A 31 8.845 13.397 11.261 1.00 0.00 C ATOM 513 OD1 ASP A 31 8.188 14.289 10.684 1.00 0.00 O ATOM 514 OD2 ASP A 31 9.794 13.638 12.037 1.00 0.00 O ATOM 0 HA ASP A 31 9.267 11.879 9.016 1.00 0.00 H new ATOM 0 HB2 ASP A 31 7.531 11.726 11.515 1.00 0.00 H new ATOM 0 HB3 ASP A 31 9.229 11.300 11.447 1.00 0.00 H new ATOM 519 N TYR A 32 6.812 9.746 9.588 1.00 0.00 N ATOM 520 CA TYR A 32 6.410 8.354 9.443 1.00 0.00 C ATOM 521 C TYR A 32 5.557 8.165 8.194 1.00 0.00 C ATOM 522 O TYR A 32 5.159 9.137 7.551 1.00 0.00 O ATOM 523 CB TYR A 32 5.634 7.892 10.675 1.00 0.00 C ATOM 524 CG TYR A 32 6.518 7.541 11.851 1.00 0.00 C ATOM 525 CD1 TYR A 32 7.460 6.523 11.755 1.00 0.00 C ATOM 526 CD2 TYR A 32 6.406 8.222 13.055 1.00 0.00 C ATOM 527 CE1 TYR A 32 8.267 6.198 12.828 1.00 0.00 C ATOM 528 CE2 TYR A 32 7.211 7.902 14.132 1.00 0.00 C ATOM 529 CZ TYR A 32 8.139 6.889 14.014 1.00 0.00 C ATOM 530 OH TYR A 32 8.942 6.567 15.084 1.00 0.00 O ATOM 0 H TYR A 32 6.067 10.369 9.901 1.00 0.00 H new ATOM 0 HA TYR A 32 7.312 7.750 9.344 1.00 0.00 H new ATOM 0 HB2 TYR A 32 4.941 8.679 10.974 1.00 0.00 H new ATOM 0 HB3 TYR A 32 5.033 7.022 10.410 1.00 0.00 H new ATOM 0 HD1 TYR A 32 7.562 5.978 10.828 1.00 0.00 H new ATOM 0 HD2 TYR A 32 5.679 9.014 13.152 1.00 0.00 H new ATOM 0 HE1 TYR A 32 8.995 5.406 12.738 1.00 0.00 H new ATOM 0 HE2 TYR A 32 7.114 8.443 15.062 1.00 0.00 H new ATOM 0 HH TYR A 32 9.801 6.226 14.758 1.00 0.00 H new ATOM 540 N GLY A 33 5.280 6.911 7.852 1.00 0.00 N ATOM 541 CA GLY A 33 4.479 6.628 6.679 1.00 0.00 C ATOM 542 C GLY A 33 3.860 5.245 6.703 1.00 0.00 C ATOM 543 O GLY A 33 4.502 4.275 7.102 1.00 0.00 O ATOM 0 H GLY A 33 5.596 6.088 8.366 1.00 0.00 H new ATOM 0 HA2 GLY A 33 3.687 7.373 6.598 1.00 0.00 H new ATOM 0 HA3 GLY A 33 5.101 6.726 5.789 1.00 0.00 H new ATOM 547 N LEU A 34 2.609 5.156 6.265 1.00 0.00 N ATOM 548 CA LEU A 34 1.899 3.884 6.224 1.00 0.00 C ATOM 549 C LEU A 34 1.920 3.315 4.811 1.00 0.00 C ATOM 550 O LEU A 34 1.315 3.877 3.897 1.00 0.00 O ATOM 551 CB LEU A 34 0.454 4.063 6.699 1.00 0.00 C ATOM 552 CG LEU A 34 -0.258 2.786 7.159 1.00 0.00 C ATOM 553 CD1 LEU A 34 -0.818 2.032 5.965 1.00 0.00 C ATOM 554 CD2 LEU A 34 0.680 1.894 7.964 1.00 0.00 C ATOM 0 H LEU A 34 2.065 5.952 5.933 1.00 0.00 H new ATOM 0 HA LEU A 34 2.401 3.185 6.893 1.00 0.00 H new ATOM 0 HB2 LEU A 34 0.448 4.777 7.522 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -0.123 4.507 5.888 1.00 0.00 H new ATOM 0 HG LEU A 34 -1.085 3.075 7.808 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -1.320 1.128 6.309 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -1.531 2.665 5.437 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -0.005 1.761 5.291 1.00 0.00 H new ATOM 0 HD21 LEU A 34 0.148 0.996 8.277 1.00 0.00 H new ATOM 0 HD22 LEU A 34 1.534 1.614 7.347 1.00 0.00 H new ATOM 0 HD23 LEU A 34 1.030 2.434 8.844 1.00 0.00 H new ATOM 566 N VAL A 35 2.628 2.206 4.633 1.00 0.00 N ATOM 567 CA VAL A 35 2.738 1.575 3.325 1.00 0.00 C ATOM 568 C VAL A 35 1.806 0.378 3.192 1.00 0.00 C ATOM 569 O VAL A 35 1.591 -0.368 4.147 1.00 0.00 O ATOM 570 CB VAL A 35 4.179 1.101 3.050 1.00 0.00 C ATOM 571 CG1 VAL A 35 4.675 0.237 4.197 1.00 0.00 C ATOM 572 CG2 VAL A 35 4.255 0.337 1.732 1.00 0.00 C ATOM 0 H VAL A 35 3.134 1.726 5.378 1.00 0.00 H new ATOM 0 HA VAL A 35 2.454 2.335 2.597 1.00 0.00 H new ATOM 0 HB VAL A 35 4.821 1.978 2.970 1.00 0.00 H new ATOM 0 HG11 VAL A 35 5.694 -0.092 3.991 1.00 0.00 H new ATOM 0 HG12 VAL A 35 4.660 0.815 5.121 1.00 0.00 H new ATOM 0 HG13 VAL A 35 4.028 -0.633 4.303 1.00 0.00 H new ATOM 0 HG21 VAL A 35 5.281 0.012 1.558 1.00 0.00 H new ATOM 0 HG22 VAL A 35 3.601 -0.534 1.778 1.00 0.00 H new ATOM 0 HG23 VAL A 35 3.937 0.986 0.916 1.00 0.00 H new ATOM 582 N ALA A 36 1.291 0.187 1.986 1.00 0.00 N ATOM 583 CA ALA A 36 0.419 -0.937 1.698 1.00 0.00 C ATOM 584 C ALA A 36 1.242 -2.073 1.108 1.00 0.00 C ATOM 585 O ALA A 36 1.754 -1.959 -0.005 1.00 0.00 O ATOM 586 CB ALA A 36 -0.687 -0.522 0.740 1.00 0.00 C ATOM 0 H ALA A 36 1.464 0.800 1.190 1.00 0.00 H new ATOM 0 HA ALA A 36 -0.049 -1.276 2.622 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -1.331 -1.377 0.535 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -1.277 0.277 1.189 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -0.247 -0.168 -0.192 1.00 0.00 H new ATOM 592 N LEU A 37 1.392 -3.151 1.872 1.00 0.00 N ATOM 593 CA LEU A 37 2.183 -4.300 1.435 1.00 0.00 C ATOM 594 C LEU A 37 1.396 -5.222 0.504 1.00 0.00 C ATOM 595 O LEU A 37 1.884 -6.287 0.127 1.00 0.00 O ATOM 596 CB LEU A 37 2.674 -5.091 2.649 1.00 0.00 C ATOM 597 CG LEU A 37 3.238 -4.243 3.790 1.00 0.00 C ATOM 598 CD1 LEU A 37 3.230 -5.028 5.093 1.00 0.00 C ATOM 599 CD2 LEU A 37 4.646 -3.772 3.458 1.00 0.00 C ATOM 0 H LEU A 37 0.976 -3.254 2.798 1.00 0.00 H new ATOM 0 HA LEU A 37 3.034 -3.913 0.875 1.00 0.00 H new ATOM 0 HB2 LEU A 37 1.846 -5.687 3.034 1.00 0.00 H new ATOM 0 HB3 LEU A 37 3.444 -5.790 2.321 1.00 0.00 H new ATOM 0 HG LEU A 37 2.603 -3.366 3.914 1.00 0.00 H new ATOM 0 HD11 LEU A 37 3.635 -4.409 5.893 1.00 0.00 H new ATOM 0 HD12 LEU A 37 2.208 -5.315 5.338 1.00 0.00 H new ATOM 0 HD13 LEU A 37 3.842 -5.923 4.982 1.00 0.00 H new ATOM 0 HD21 LEU A 37 5.032 -3.170 4.281 1.00 0.00 H new ATOM 0 HD22 LEU A 37 5.293 -4.636 3.306 1.00 0.00 H new ATOM 0 HD23 LEU A 37 4.624 -3.172 2.549 1.00 0.00 H new ATOM 611 N GLU A 38 0.186 -4.820 0.133 1.00 0.00 N ATOM 612 CA GLU A 38 -0.639 -5.633 -0.754 1.00 0.00 C ATOM 613 C GLU A 38 -1.579 -4.762 -1.586 1.00 0.00 C ATOM 614 O GLU A 38 -2.042 -3.719 -1.122 1.00 0.00 O ATOM 615 CB GLU A 38 -1.444 -6.652 0.056 1.00 0.00 C ATOM 616 CG GLU A 38 -1.364 -8.066 -0.495 1.00 0.00 C ATOM 617 CD GLU A 38 -2.710 -8.764 -0.505 1.00 0.00 C ATOM 618 OE1 GLU A 38 -3.442 -8.656 0.501 1.00 0.00 O ATOM 619 OE2 GLU A 38 -3.031 -9.420 -1.518 1.00 0.00 O ATOM 0 H GLU A 38 -0.243 -3.944 0.429 1.00 0.00 H new ATOM 0 HA GLU A 38 0.024 -6.165 -1.437 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -1.085 -6.651 1.085 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -2.488 -6.340 0.082 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -0.967 -8.035 -1.510 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -0.662 -8.646 0.104 1.00 0.00 H new ATOM 626 N PRO A 39 -1.875 -5.177 -2.832 1.00 0.00 N ATOM 627 CA PRO A 39 -2.764 -4.426 -3.725 1.00 0.00 C ATOM 628 C PRO A 39 -4.195 -4.376 -3.199 1.00 0.00 C ATOM 629 O PRO A 39 -4.733 -5.386 -2.745 1.00 0.00 O ATOM 630 CB PRO A 39 -2.711 -5.206 -5.047 1.00 0.00 C ATOM 631 CG PRO A 39 -1.527 -6.105 -4.932 1.00 0.00 C ATOM 632 CD PRO A 39 -1.371 -6.404 -3.470 1.00 0.00 C ATOM 0 HA PRO A 39 -2.451 -3.387 -3.823 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -3.625 -5.779 -5.201 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -2.610 -4.531 -5.897 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -1.677 -7.021 -5.503 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -0.633 -5.624 -5.329 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -1.947 -7.281 -3.173 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -0.332 -6.600 -3.206 1.00 0.00 H new ATOM 640 N ALA A 40 -4.808 -3.197 -3.262 1.00 0.00 N ATOM 641 CA ALA A 40 -6.177 -3.031 -2.788 1.00 0.00 C ATOM 642 C ALA A 40 -6.789 -1.726 -3.284 1.00 0.00 C ATOM 643 O ALA A 40 -6.106 -0.886 -3.870 1.00 0.00 O ATOM 644 CB ALA A 40 -6.215 -3.089 -1.268 1.00 0.00 C ATOM 0 H ALA A 40 -4.381 -2.349 -3.634 1.00 0.00 H new ATOM 0 HA ALA A 40 -6.772 -3.849 -3.193 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -7.242 -2.964 -0.925 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -5.835 -4.053 -0.931 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -5.596 -2.291 -0.858 1.00 0.00 H new ATOM 650 N TRP A 41 -8.087 -1.564 -3.038 1.00 0.00 N ATOM 651 CA TRP A 41 -8.807 -0.365 -3.450 1.00 0.00 C ATOM 652 C TRP A 41 -9.252 0.440 -2.233 1.00 0.00 C ATOM 653 O TRP A 41 -10.185 0.053 -1.529 1.00 0.00 O ATOM 654 CB TRP A 41 -10.024 -0.743 -4.297 1.00 0.00 C ATOM 655 CG TRP A 41 -9.669 -1.347 -5.622 1.00 0.00 C ATOM 656 CD1 TRP A 41 -8.639 -0.982 -6.438 1.00 0.00 C ATOM 657 CD2 TRP A 41 -10.345 -2.422 -6.283 1.00 0.00 C ATOM 658 NE1 TRP A 41 -8.631 -1.765 -7.568 1.00 0.00 N ATOM 659 CE2 TRP A 41 -9.670 -2.657 -7.495 1.00 0.00 C ATOM 660 CE3 TRP A 41 -11.456 -3.210 -5.967 1.00 0.00 C ATOM 661 CZ2 TRP A 41 -10.069 -3.645 -8.390 1.00 0.00 C ATOM 662 CZ3 TRP A 41 -11.851 -4.191 -6.857 1.00 0.00 C ATOM 663 CH2 TRP A 41 -11.159 -4.401 -8.057 1.00 0.00 C ATOM 0 H TRP A 41 -8.663 -2.252 -2.553 1.00 0.00 H new ATOM 0 HA TRP A 41 -8.134 0.250 -4.048 1.00 0.00 H new ATOM 0 HB2 TRP A 41 -10.640 -1.448 -3.739 1.00 0.00 H new ATOM 0 HB3 TRP A 41 -10.631 0.147 -4.464 1.00 0.00 H new ATOM 0 HD1 TRP A 41 -7.933 -0.193 -6.227 1.00 0.00 H new ATOM 0 HE1 TRP A 41 -7.962 -1.694 -8.335 1.00 0.00 H new ATOM 0 HE3 TRP A 41 -11.996 -3.055 -5.044 1.00 0.00 H new ATOM 0 HZ2 TRP A 41 -9.537 -3.809 -9.315 1.00 0.00 H new ATOM 0 HZ3 TRP A 41 -12.708 -4.806 -6.623 1.00 0.00 H new ATOM 0 HH2 TRP A 41 -11.493 -5.175 -8.732 1.00 0.00 H new ATOM 674 N ILE A 42 -8.581 1.561 -1.988 1.00 0.00 N ATOM 675 CA ILE A 42 -8.911 2.416 -0.852 1.00 0.00 C ATOM 676 C ILE A 42 -10.063 3.356 -1.187 1.00 0.00 C ATOM 677 O ILE A 42 -9.963 4.172 -2.104 1.00 0.00 O ATOM 678 CB ILE A 42 -7.697 3.253 -0.401 1.00 0.00 C ATOM 679 CG1 ILE A 42 -6.436 2.388 -0.354 1.00 0.00 C ATOM 680 CG2 ILE A 42 -7.965 3.887 0.956 1.00 0.00 C ATOM 681 CD1 ILE A 42 -6.505 1.273 0.668 1.00 0.00 C ATOM 0 H ILE A 42 -7.807 1.899 -2.560 1.00 0.00 H new ATOM 0 HA ILE A 42 -9.208 1.754 -0.038 1.00 0.00 H new ATOM 0 HB ILE A 42 -7.537 4.050 -1.127 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -6.265 1.956 -1.340 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -5.578 3.022 -0.130 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -7.099 4.474 1.261 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -8.838 4.536 0.888 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -8.150 3.105 1.693 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -5.577 0.701 0.646 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -6.645 1.698 1.662 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -7.342 0.616 0.433 1.00 0.00 H new ATOM 693 N THR A 43 -11.154 3.239 -0.439 1.00 0.00 N ATOM 694 CA THR A 43 -12.324 4.080 -0.658 1.00 0.00 C ATOM 695 C THR A 43 -12.122 5.462 -0.051 1.00 0.00 C ATOM 696 O THR A 43 -11.167 5.694 0.690 1.00 0.00 O ATOM 697 CB THR A 43 -13.568 3.430 -0.050 1.00 0.00 C ATOM 698 OG1 THR A 43 -13.226 2.656 1.085 1.00 0.00 O ATOM 699 CG2 THR A 43 -14.304 2.529 -1.015 1.00 0.00 C ATOM 0 H THR A 43 -11.252 2.570 0.324 1.00 0.00 H new ATOM 0 HA THR A 43 -12.463 4.187 -1.734 1.00 0.00 H new ATOM 0 HB THR A 43 -14.223 4.258 0.220 1.00 0.00 H new ATOM 0 HG1 THR A 43 -14.035 2.250 1.460 1.00 0.00 H new ATOM 0 HG21 THR A 43 -15.176 2.100 -0.520 1.00 0.00 H new ATOM 0 HG22 THR A 43 -14.626 3.108 -1.880 1.00 0.00 H new ATOM 0 HG23 THR A 43 -13.642 1.727 -1.342 1.00 0.00 H new ATOM 707 N ALA A 44 -13.031 6.377 -0.368 1.00 0.00 N ATOM 708 CA ALA A 44 -12.958 7.735 0.149 1.00 0.00 C ATOM 709 C ALA A 44 -12.998 7.736 1.672 1.00 0.00 C ATOM 710 O ALA A 44 -12.237 8.450 2.323 1.00 0.00 O ATOM 711 CB ALA A 44 -14.093 8.577 -0.414 1.00 0.00 C ATOM 0 H ALA A 44 -13.827 6.201 -0.981 1.00 0.00 H new ATOM 0 HA ALA A 44 -12.011 8.172 -0.167 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -14.025 9.590 -0.018 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -14.020 8.606 -1.501 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -15.049 8.138 -0.127 1.00 0.00 H new ATOM 717 N GLN A 45 -13.895 6.931 2.235 1.00 0.00 N ATOM 718 CA GLN A 45 -14.050 6.827 3.655 1.00 0.00 C ATOM 719 C GLN A 45 -12.765 6.377 4.337 1.00 0.00 C ATOM 720 O GLN A 45 -12.431 6.852 5.412 1.00 0.00 O ATOM 721 CB GLN A 45 -15.165 5.837 3.918 1.00 0.00 C ATOM 722 CG GLN A 45 -16.357 6.453 4.599 1.00 0.00 C ATOM 723 CD GLN A 45 -16.537 5.977 6.028 1.00 0.00 C ATOM 724 OE1 GLN A 45 -16.262 4.820 6.347 1.00 0.00 O ATOM 725 NE2 GLN A 45 -17.000 6.868 6.895 1.00 0.00 N ATOM 0 H GLN A 45 -14.530 6.336 1.703 1.00 0.00 H new ATOM 0 HA GLN A 45 -14.291 7.806 4.068 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -15.482 5.397 2.972 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -14.782 5.024 4.535 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -16.250 7.538 4.594 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -17.256 6.219 4.028 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -17.215 7.816 6.586 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -17.141 6.605 7.870 1.00 0.00 H new ATOM 734 N GLN A 46 -12.048 5.454 3.716 1.00 0.00 N ATOM 735 CA GLN A 46 -10.811 4.948 4.296 1.00 0.00 C ATOM 736 C GLN A 46 -9.810 6.079 4.519 1.00 0.00 C ATOM 737 O GLN A 46 -9.050 6.063 5.486 1.00 0.00 O ATOM 738 CB GLN A 46 -10.200 3.872 3.397 1.00 0.00 C ATOM 739 CG GLN A 46 -10.556 2.456 3.819 1.00 0.00 C ATOM 740 CD GLN A 46 -10.515 1.474 2.665 1.00 0.00 C ATOM 741 OE1 GLN A 46 -9.450 1.180 2.123 1.00 0.00 O ATOM 742 NE2 GLN A 46 -11.678 0.961 2.283 1.00 0.00 N ATOM 0 H GLN A 46 -12.297 5.042 2.817 1.00 0.00 H new ATOM 0 HA GLN A 46 -11.048 4.505 5.263 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -10.535 4.032 2.372 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -9.115 3.981 3.398 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -9.864 2.128 4.595 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -11.553 2.452 4.259 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -12.537 1.233 2.761 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -11.713 0.295 1.511 1.00 0.00 H new ATOM 751 N ILE A 47 -9.816 7.056 3.622 1.00 0.00 N ATOM 752 CA ILE A 47 -8.906 8.190 3.728 1.00 0.00 C ATOM 753 C ILE A 47 -9.292 9.117 4.879 1.00 0.00 C ATOM 754 O ILE A 47 -8.449 9.489 5.695 1.00 0.00 O ATOM 755 CB ILE A 47 -8.866 9.002 2.417 1.00 0.00 C ATOM 756 CG1 ILE A 47 -8.601 8.077 1.227 1.00 0.00 C ATOM 757 CG2 ILE A 47 -7.803 10.088 2.496 1.00 0.00 C ATOM 758 CD1 ILE A 47 -9.138 8.608 -0.085 1.00 0.00 C ATOM 0 H ILE A 47 -10.439 7.087 2.815 1.00 0.00 H new ATOM 0 HA ILE A 47 -7.917 7.777 3.925 1.00 0.00 H new ATOM 0 HB ILE A 47 -9.835 9.480 2.275 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -7.527 7.919 1.133 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -9.050 7.104 1.427 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -7.788 10.651 1.563 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -8.031 10.761 3.323 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -6.827 9.631 2.659 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -8.914 7.900 -0.883 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -10.217 8.740 -0.010 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -8.670 9.567 -0.308 1.00 0.00 H new ATOM 770 N GLU A 48 -10.566 9.495 4.938 1.00 0.00 N ATOM 771 CA GLU A 48 -11.052 10.386 5.987 1.00 0.00 C ATOM 772 C GLU A 48 -11.377 9.620 7.267 1.00 0.00 C ATOM 773 O GLU A 48 -10.991 10.028 8.363 1.00 0.00 O ATOM 774 CB GLU A 48 -12.293 11.140 5.507 1.00 0.00 C ATOM 775 CG GLU A 48 -12.387 12.561 6.041 1.00 0.00 C ATOM 776 CD GLU A 48 -12.218 13.606 4.956 1.00 0.00 C ATOM 777 OE1 GLU A 48 -13.108 13.708 4.086 1.00 0.00 O ATOM 778 OE2 GLU A 48 -11.194 14.323 4.977 1.00 0.00 O ATOM 0 H GLU A 48 -11.280 9.198 4.272 1.00 0.00 H new ATOM 0 HA GLU A 48 -10.257 11.098 6.210 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -12.291 11.170 4.417 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -13.183 10.588 5.809 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -13.353 12.699 6.526 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -11.623 12.709 6.805 1.00 0.00 H new ATOM 785 N ALA A 49 -12.093 8.511 7.122 1.00 0.00 N ATOM 786 CA ALA A 49 -12.479 7.685 8.264 1.00 0.00 C ATOM 787 C ALA A 49 -11.260 7.261 9.075 1.00 0.00 C ATOM 788 O ALA A 49 -11.252 7.362 10.302 1.00 0.00 O ATOM 789 CB ALA A 49 -13.258 6.460 7.799 1.00 0.00 C ATOM 0 H ALA A 49 -12.420 8.161 6.222 1.00 0.00 H new ATOM 0 HA ALA A 49 -13.121 8.285 8.908 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -13.537 5.857 8.663 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -14.158 6.779 7.273 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -12.637 5.867 7.128 1.00 0.00 H new ATOM 795 N ALA A 50 -10.232 6.785 8.382 1.00 0.00 N ATOM 796 CA ALA A 50 -9.008 6.345 9.038 1.00 0.00 C ATOM 797 C ALA A 50 -8.296 7.515 9.709 1.00 0.00 C ATOM 798 O ALA A 50 -7.793 7.390 10.825 1.00 0.00 O ATOM 799 CB ALA A 50 -8.085 5.668 8.036 1.00 0.00 C ATOM 0 H ALA A 50 -10.222 6.694 7.366 1.00 0.00 H new ATOM 0 HA ALA A 50 -9.277 5.625 9.810 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -7.175 5.345 8.541 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -8.588 4.802 7.605 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -7.830 6.371 7.243 1.00 0.00 H new ATOM 805 N ARG A 51 -8.260 8.652 9.023 1.00 0.00 N ATOM 806 CA ARG A 51 -7.608 9.843 9.554 1.00 0.00 C ATOM 807 C ARG A 51 -8.244 10.266 10.874 1.00 0.00 C ATOM 808 O ARG A 51 -7.548 10.615 11.826 1.00 0.00 O ATOM 809 CB ARG A 51 -7.690 10.990 8.546 1.00 0.00 C ATOM 810 CG ARG A 51 -6.471 11.898 8.561 1.00 0.00 C ATOM 811 CD ARG A 51 -6.613 13.039 7.567 1.00 0.00 C ATOM 812 NE ARG A 51 -7.699 13.948 7.930 1.00 0.00 N ATOM 813 CZ ARG A 51 -7.888 15.138 7.365 1.00 0.00 C ATOM 814 NH1 ARG A 51 -7.070 15.566 6.411 1.00 0.00 N ATOM 815 NH2 ARG A 51 -8.898 15.904 7.755 1.00 0.00 N ATOM 0 H ARG A 51 -8.674 8.774 8.099 1.00 0.00 H new ATOM 0 HA ARG A 51 -6.560 9.603 9.734 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -7.812 10.576 7.545 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -8.579 11.585 8.756 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -6.330 12.303 9.563 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -5.580 11.316 8.324 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -5.677 13.595 7.516 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -6.797 12.633 6.572 1.00 0.00 H new ATOM 0 HE ARG A 51 -8.349 13.653 8.658 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -6.291 14.982 6.107 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -7.220 16.479 5.982 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -9.530 15.581 8.488 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -9.043 16.816 7.322 1.00 0.00 H new ATOM 829 N VAL A 52 -9.573 10.228 10.925 1.00 0.00 N ATOM 830 CA VAL A 52 -10.302 10.605 12.129 1.00 0.00 C ATOM 831 C VAL A 52 -9.873 9.750 13.318 1.00 0.00 C ATOM 832 O VAL A 52 -9.814 10.230 14.452 1.00 0.00 O ATOM 833 CB VAL A 52 -11.824 10.462 11.931 1.00 0.00 C ATOM 834 CG1 VAL A 52 -12.575 10.957 13.159 1.00 0.00 C ATOM 835 CG2 VAL A 52 -12.274 11.209 10.683 1.00 0.00 C ATOM 0 H VAL A 52 -10.165 9.940 10.146 1.00 0.00 H new ATOM 0 HA VAL A 52 -10.066 11.650 12.330 1.00 0.00 H new ATOM 0 HB VAL A 52 -12.055 9.405 11.797 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -13.647 10.847 12.998 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -12.277 10.371 14.029 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -12.339 12.007 13.331 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -13.351 11.096 10.560 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -12.029 12.266 10.784 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -11.765 10.800 9.811 1.00 0.00 H new ATOM 845 N ALA A 53 -9.573 8.485 13.051 1.00 0.00 N ATOM 846 CA ALA A 53 -9.146 7.564 14.095 1.00 0.00 C ATOM 847 C ALA A 53 -7.693 7.813 14.484 1.00 0.00 C ATOM 848 O ALA A 53 -7.330 7.734 15.657 1.00 0.00 O ATOM 849 CB ALA A 53 -9.331 6.126 13.633 1.00 0.00 C ATOM 0 H ALA A 53 -9.618 8.074 12.119 1.00 0.00 H new ATOM 0 HA ALA A 53 -9.765 7.736 14.976 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -9.008 5.446 14.422 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -10.383 5.948 13.408 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -8.734 5.952 12.737 1.00 0.00 H new ATOM 855 N MET A 54 -6.867 8.114 13.488 1.00 0.00 N ATOM 856 CA MET A 54 -5.451 8.374 13.718 1.00 0.00 C ATOM 857 C MET A 54 -5.239 9.711 14.424 1.00 0.00 C ATOM 858 O MET A 54 -4.534 9.785 15.430 1.00 0.00 O ATOM 859 CB MET A 54 -4.692 8.358 12.391 1.00 0.00 C ATOM 860 CG MET A 54 -4.735 7.014 11.685 1.00 0.00 C ATOM 861 SD MET A 54 -3.422 6.829 10.465 1.00 0.00 S ATOM 862 CE MET A 54 -4.074 7.820 9.123 1.00 0.00 C ATOM 0 H MET A 54 -7.155 8.184 12.512 1.00 0.00 H new ATOM 0 HA MET A 54 -5.065 7.586 14.365 1.00 0.00 H new ATOM 0 HB2 MET A 54 -5.111 9.119 11.733 1.00 0.00 H new ATOM 0 HB3 MET A 54 -3.653 8.631 12.573 1.00 0.00 H new ATOM 0 HG2 MET A 54 -4.654 6.217 12.424 1.00 0.00 H new ATOM 0 HG3 MET A 54 -5.701 6.896 11.194 1.00 0.00 H new ATOM 0 HE1 MET A 54 -3.255 8.335 8.620 1.00 0.00 H new ATOM 0 HE2 MET A 54 -4.589 7.175 8.411 1.00 0.00 H new ATOM 0 HE3 MET A 54 -4.775 8.554 9.520 1.00 0.00 H new ATOM 872 N VAL A 55 -5.848 10.765 13.889 1.00 0.00 N ATOM 873 CA VAL A 55 -5.719 12.099 14.469 1.00 0.00 C ATOM 874 C VAL A 55 -6.164 12.112 15.928 1.00 0.00 C ATOM 875 O VAL A 55 -5.568 12.792 16.764 1.00 0.00 O ATOM 876 CB VAL A 55 -6.539 13.140 13.679 1.00 0.00 C ATOM 877 CG1 VAL A 55 -6.384 14.526 14.289 1.00 0.00 C ATOM 878 CG2 VAL A 55 -6.123 13.148 12.214 1.00 0.00 C ATOM 0 H VAL A 55 -6.435 10.722 13.056 1.00 0.00 H new ATOM 0 HA VAL A 55 -4.664 12.366 14.414 1.00 0.00 H new ATOM 0 HB VAL A 55 -7.591 12.860 13.736 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -6.971 15.244 13.716 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -6.736 14.511 15.320 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -5.334 14.817 14.268 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -6.712 13.888 11.673 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -5.065 13.399 12.138 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -6.294 12.162 11.782 1.00 0.00 H new ATOM 888 N ARG A 56 -7.215 11.357 16.228 1.00 0.00 N ATOM 889 CA ARG A 56 -7.739 11.282 17.587 1.00 0.00 C ATOM 890 C ARG A 56 -6.837 10.428 18.474 1.00 0.00 C ATOM 891 O ARG A 56 -6.756 10.643 19.683 1.00 0.00 O ATOM 892 CB ARG A 56 -9.156 10.708 17.576 1.00 0.00 C ATOM 893 CG ARG A 56 -10.234 11.756 17.351 1.00 0.00 C ATOM 894 CD ARG A 56 -11.463 11.158 16.686 1.00 0.00 C ATOM 895 NE ARG A 56 -12.700 11.765 17.172 1.00 0.00 N ATOM 896 CZ ARG A 56 -13.225 11.520 18.370 1.00 0.00 C ATOM 897 NH1 ARG A 56 -12.623 10.683 19.207 1.00 0.00 N ATOM 898 NH2 ARG A 56 -14.354 12.113 18.733 1.00 0.00 N ATOM 0 H ARG A 56 -7.721 10.788 15.549 1.00 0.00 H new ATOM 0 HA ARG A 56 -7.766 12.292 17.996 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -9.227 9.952 16.794 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -9.343 10.204 18.524 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -10.516 12.200 18.306 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -9.838 12.559 16.730 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -11.393 11.293 15.607 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -11.489 10.084 16.872 1.00 0.00 H new ATOM 0 HE ARG A 56 -13.190 12.415 16.557 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -11.754 10.225 18.933 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -13.030 10.499 20.124 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -14.820 12.757 18.094 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -14.756 11.925 19.651 1.00 0.00 H new ATOM 912 N HIS A 57 -6.165 9.458 17.865 1.00 0.00 N ATOM 913 CA HIS A 57 -5.271 8.567 18.598 1.00 0.00 C ATOM 914 C HIS A 57 -4.148 9.348 19.276 1.00 0.00 C ATOM 915 O HIS A 57 -3.840 9.120 20.446 1.00 0.00 O ATOM 916 CB HIS A 57 -4.682 7.515 17.657 1.00 0.00 C ATOM 917 CG HIS A 57 -4.115 6.327 18.371 1.00 0.00 C ATOM 918 ND1 HIS A 57 -4.880 5.468 19.129 1.00 0.00 N ATOM 919 CD2 HIS A 57 -2.847 5.856 18.438 1.00 0.00 C ATOM 920 CE1 HIS A 57 -4.109 4.520 19.633 1.00 0.00 C ATOM 921 NE2 HIS A 57 -2.871 4.733 19.227 1.00 0.00 N ATOM 0 H HIS A 57 -6.222 9.268 16.865 1.00 0.00 H new ATOM 0 HA HIS A 57 -5.855 8.068 19.372 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -5.458 7.179 16.969 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -3.899 7.975 17.055 1.00 0.00 H new ATOM 0 HD1 HIS A 57 -5.886 5.551 19.278 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -1.979 6.284 17.960 1.00 0.00 H new ATOM 0 HE1 HIS A 57 -4.436 3.710 20.268 1.00 0.00 H new ATOM 930 N PHE A 58 -3.534 10.266 18.533 1.00 0.00 N ATOM 931 CA PHE A 58 -2.441 11.075 19.067 1.00 0.00 C ATOM 932 C PHE A 58 -2.856 11.771 20.361 1.00 0.00 C ATOM 933 O PHE A 58 -3.857 12.486 20.400 1.00 0.00 O ATOM 934 CB PHE A 58 -1.996 12.115 18.037 1.00 0.00 C ATOM 935 CG PHE A 58 -1.768 11.548 16.664 1.00 0.00 C ATOM 936 CD1 PHE A 58 -0.817 10.562 16.452 1.00 0.00 C ATOM 937 CD2 PHE A 58 -2.507 12.003 15.584 1.00 0.00 C ATOM 938 CE1 PHE A 58 -0.607 10.042 15.189 1.00 0.00 C ATOM 939 CE2 PHE A 58 -2.303 11.486 14.319 1.00 0.00 C ATOM 940 CZ PHE A 58 -1.351 10.504 14.121 1.00 0.00 C ATOM 0 H PHE A 58 -3.774 10.468 17.562 1.00 0.00 H new ATOM 0 HA PHE A 58 -1.606 10.409 19.286 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -2.751 12.899 17.976 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -1.076 12.585 18.383 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -0.233 10.196 17.284 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -3.252 12.771 15.733 1.00 0.00 H new ATOM 0 HE1 PHE A 58 0.138 9.275 15.037 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -2.887 11.849 13.486 1.00 0.00 H new ATOM 0 HZ PHE A 58 -1.189 10.099 13.133 1.00 0.00 H new ATOM 950 N ARG A 59 -2.079 11.555 21.419 1.00 0.00 N ATOM 951 CA ARG A 59 -2.366 12.160 22.715 1.00 0.00 C ATOM 952 C ARG A 59 -2.058 13.654 22.701 1.00 0.00 C ATOM 953 O ARG A 59 -2.759 14.447 23.329 1.00 0.00 O ATOM 954 CB ARG A 59 -1.554 11.471 23.814 1.00 0.00 C ATOM 955 CG ARG A 59 -1.973 10.029 24.065 1.00 0.00 C ATOM 956 CD ARG A 59 -2.143 9.742 25.550 1.00 0.00 C ATOM 957 NE ARG A 59 -3.512 9.349 25.877 1.00 0.00 N ATOM 958 CZ ARG A 59 -4.510 10.213 26.055 1.00 0.00 C ATOM 959 NH1 ARG A 59 -4.297 11.517 25.944 1.00 0.00 N ATOM 960 NH2 ARG A 59 -5.725 9.769 26.347 1.00 0.00 N ATOM 0 H ARG A 59 -1.246 10.966 21.404 1.00 0.00 H new ATOM 0 HA ARG A 59 -3.428 12.029 22.920 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -0.499 11.492 23.543 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -1.657 12.037 24.740 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -2.910 9.827 23.546 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -1.225 9.355 23.647 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -1.457 8.949 25.847 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -1.873 10.628 26.124 1.00 0.00 H new ATOM 0 HE ARG A 59 -3.715 8.354 25.975 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -3.364 11.864 25.721 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -5.066 12.173 26.082 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -5.894 8.767 26.435 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -6.490 10.429 26.484 1.00 0.00 H new ATOM 974 N ARG A 60 -1.007 14.030 21.981 1.00 0.00 N ATOM 975 CA ARG A 60 -0.607 15.429 21.886 1.00 0.00 C ATOM 976 C ARG A 60 -0.928 15.995 20.507 1.00 0.00 C ATOM 977 O ARG A 60 -0.209 16.851 19.994 1.00 0.00 O ATOM 978 CB ARG A 60 0.889 15.573 22.172 1.00 0.00 C ATOM 979 CG ARG A 60 1.285 15.144 23.576 1.00 0.00 C ATOM 980 CD ARG A 60 2.756 14.768 23.649 1.00 0.00 C ATOM 981 NE ARG A 60 3.012 13.761 24.677 1.00 0.00 N ATOM 982 CZ ARG A 60 4.113 13.013 24.723 1.00 0.00 C ATOM 983 NH1 ARG A 60 5.059 13.155 23.803 1.00 0.00 N ATOM 984 NH2 ARG A 60 4.268 12.120 25.692 1.00 0.00 N ATOM 0 H ARG A 60 -0.417 13.386 21.455 1.00 0.00 H new ATOM 0 HA ARG A 60 -1.170 15.993 22.630 1.00 0.00 H new ATOM 0 HB2 ARG A 60 1.447 14.979 21.449 1.00 0.00 H new ATOM 0 HB3 ARG A 60 1.180 16.613 22.023 1.00 0.00 H new ATOM 0 HG2 ARG A 60 1.080 15.954 24.276 1.00 0.00 H new ATOM 0 HG3 ARG A 60 0.675 14.294 23.884 1.00 0.00 H new ATOM 0 HD2 ARG A 60 3.082 14.389 22.680 1.00 0.00 H new ATOM 0 HD3 ARG A 60 3.348 15.659 23.858 1.00 0.00 H new ATOM 0 HE ARG A 60 2.307 13.623 25.401 1.00 0.00 H new ATOM 0 HH11 ARG A 60 4.945 13.840 23.056 1.00 0.00 H new ATOM 0 HH12 ARG A 60 5.900 12.579 23.843 1.00 0.00 H new ATOM 0 HH21 ARG A 60 3.544 12.006 26.401 1.00 0.00 H new ATOM 0 HH22 ARG A 60 5.111 11.547 25.727 1.00 0.00 H new ATOM 998 N GLY A 61 -2.015 15.510 19.913 1.00 0.00 N ATOM 999 CA GLY A 61 -2.411 15.980 18.599 1.00 0.00 C ATOM 1000 C GLY A 61 -1.447 15.542 17.514 1.00 0.00 C ATOM 1001 O GLY A 61 -0.397 14.971 17.801 1.00 0.00 O ATOM 0 H GLY A 61 -2.627 14.801 20.318 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -3.408 15.606 18.368 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -2.473 17.068 18.609 1.00 0.00 H new ATOM 1005 N GLY A 62 -1.807 15.810 16.263 1.00 0.00 N ATOM 1006 CA GLY A 62 -0.956 15.431 15.150 1.00 0.00 C ATOM 1007 C GLY A 62 -1.646 15.594 13.810 1.00 0.00 C ATOM 1008 O GLY A 62 -2.871 15.509 13.722 1.00 0.00 O ATOM 0 H GLY A 62 -2.672 16.282 16.000 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -0.051 16.039 15.165 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -0.645 14.393 15.271 1.00 0.00 H new ATOM 1012 N LYS A 63 -0.858 15.828 12.766 1.00 0.00 N ATOM 1013 CA LYS A 63 -1.400 16.003 11.423 1.00 0.00 C ATOM 1014 C LYS A 63 -0.964 14.864 10.509 1.00 0.00 C ATOM 1015 O LYS A 63 0.153 14.356 10.623 1.00 0.00 O ATOM 1016 CB LYS A 63 -0.951 17.343 10.837 1.00 0.00 C ATOM 1017 CG LYS A 63 0.558 17.477 10.709 1.00 0.00 C ATOM 1018 CD LYS A 63 1.009 18.913 10.914 1.00 0.00 C ATOM 1019 CE LYS A 63 2.522 19.012 11.016 1.00 0.00 C ATOM 1020 NZ LYS A 63 3.167 19.075 9.675 1.00 0.00 N ATOM 0 H LYS A 63 0.158 15.901 12.824 1.00 0.00 H new ATOM 0 HA LYS A 63 -2.488 15.993 11.494 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -1.403 17.470 9.853 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -1.327 18.149 11.467 1.00 0.00 H new ATOM 0 HG2 LYS A 63 1.045 16.834 11.442 1.00 0.00 H new ATOM 0 HG3 LYS A 63 0.873 17.133 9.724 1.00 0.00 H new ATOM 0 HD2 LYS A 63 0.658 19.528 10.085 1.00 0.00 H new ATOM 0 HD3 LYS A 63 0.555 19.312 11.821 1.00 0.00 H new ATOM 0 HE2 LYS A 63 2.790 19.899 11.589 1.00 0.00 H new ATOM 0 HE3 LYS A 63 2.906 18.151 11.563 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 4.184 19.261 9.787 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 3.033 18.169 9.182 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 2.735 19.839 9.118 1.00 0.00 H new ATOM 1034 N ILE A 64 -1.851 14.466 9.602 1.00 0.00 N ATOM 1035 CA ILE A 64 -1.556 13.386 8.668 1.00 0.00 C ATOM 1036 C ILE A 64 -1.642 13.864 7.225 1.00 0.00 C ATOM 1037 O ILE A 64 -2.517 14.654 6.870 1.00 0.00 O ATOM 1038 CB ILE A 64 -2.517 12.192 8.843 1.00 0.00 C ATOM 1039 CG1 ILE A 64 -2.964 12.058 10.300 1.00 0.00 C ATOM 1040 CG2 ILE A 64 -1.851 10.908 8.370 1.00 0.00 C ATOM 1041 CD1 ILE A 64 -3.927 10.914 10.529 1.00 0.00 C ATOM 0 H ILE A 64 -2.779 14.875 9.494 1.00 0.00 H new ATOM 0 HA ILE A 64 -0.539 13.062 8.891 1.00 0.00 H new ATOM 0 HB ILE A 64 -3.403 12.373 8.234 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -2.086 11.916 10.930 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -3.435 12.989 10.615 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -2.539 10.072 8.499 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -1.587 11.002 7.317 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -0.949 10.729 8.956 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -4.203 10.876 11.583 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -4.821 11.065 9.925 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -3.451 9.975 10.245 1.00 0.00 H new ATOM 1053 N PHE A 65 -0.734 13.369 6.394 1.00 0.00 N ATOM 1054 CA PHE A 65 -0.708 13.730 4.983 1.00 0.00 C ATOM 1055 C PHE A 65 -1.096 12.531 4.126 1.00 0.00 C ATOM 1056 O PHE A 65 -0.420 11.502 4.139 1.00 0.00 O ATOM 1057 CB PHE A 65 0.681 14.236 4.586 1.00 0.00 C ATOM 1058 CG PHE A 65 1.141 15.419 5.390 1.00 0.00 C ATOM 1059 CD1 PHE A 65 1.722 15.243 6.636 1.00 0.00 C ATOM 1060 CD2 PHE A 65 0.995 16.706 4.900 1.00 0.00 C ATOM 1061 CE1 PHE A 65 2.148 16.329 7.377 1.00 0.00 C ATOM 1062 CE2 PHE A 65 1.419 17.796 5.637 1.00 0.00 C ATOM 1063 CZ PHE A 65 1.996 17.607 6.877 1.00 0.00 C ATOM 0 H PHE A 65 -0.004 12.714 6.674 1.00 0.00 H new ATOM 0 HA PHE A 65 -1.429 14.530 4.816 1.00 0.00 H new ATOM 0 HB2 PHE A 65 1.401 13.426 4.702 1.00 0.00 H new ATOM 0 HB3 PHE A 65 0.672 14.506 3.530 1.00 0.00 H new ATOM 0 HD1 PHE A 65 1.843 14.246 7.032 1.00 0.00 H new ATOM 0 HD2 PHE A 65 0.545 16.860 3.931 1.00 0.00 H new ATOM 0 HE1 PHE A 65 2.599 16.178 8.346 1.00 0.00 H new ATOM 0 HE2 PHE A 65 1.299 18.794 5.243 1.00 0.00 H new ATOM 0 HZ PHE A 65 2.328 18.457 7.455 1.00 0.00 H new ATOM 1073 N ILE A 66 -2.194 12.664 3.391 1.00 0.00 N ATOM 1074 CA ILE A 66 -2.674 11.585 2.537 1.00 0.00 C ATOM 1075 C ILE A 66 -2.336 11.848 1.073 1.00 0.00 C ATOM 1076 O ILE A 66 -2.531 12.954 0.570 1.00 0.00 O ATOM 1077 CB ILE A 66 -4.200 11.387 2.671 1.00 0.00 C ATOM 1078 CG1 ILE A 66 -4.664 11.669 4.104 1.00 0.00 C ATOM 1079 CG2 ILE A 66 -4.586 9.974 2.253 1.00 0.00 C ATOM 1080 CD1 ILE A 66 -3.901 10.893 5.157 1.00 0.00 C ATOM 0 H ILE A 66 -2.768 13.507 3.369 1.00 0.00 H new ATOM 0 HA ILE A 66 -2.169 10.678 2.869 1.00 0.00 H new ATOM 0 HB ILE A 66 -4.698 12.096 2.010 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -4.561 12.735 4.306 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -5.724 11.430 4.187 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -5.664 9.847 2.352 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -4.295 9.809 1.216 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -4.076 9.253 2.892 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -4.286 11.145 6.145 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -4.024 9.824 4.982 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -2.843 11.150 5.103 1.00 0.00 H new ATOM 1092 N ARG A 67 -1.830 10.823 0.395 1.00 0.00 N ATOM 1093 CA ARG A 67 -1.466 10.943 -1.012 1.00 0.00 C ATOM 1094 C ARG A 67 -2.481 10.224 -1.895 1.00 0.00 C ATOM 1095 O ARG A 67 -2.734 10.635 -3.028 1.00 0.00 O ATOM 1096 CB ARG A 67 -0.070 10.366 -1.250 1.00 0.00 C ATOM 1097 CG ARG A 67 1.047 11.381 -1.068 1.00 0.00 C ATOM 1098 CD ARG A 67 1.230 12.238 -2.309 1.00 0.00 C ATOM 1099 NE ARG A 67 1.328 11.432 -3.523 1.00 0.00 N ATOM 1100 CZ ARG A 67 1.139 11.912 -4.750 1.00 0.00 C ATOM 1101 NH1 ARG A 67 0.840 13.193 -4.931 1.00 0.00 N ATOM 1102 NH2 ARG A 67 1.250 11.109 -5.801 1.00 0.00 N ATOM 0 H ARG A 67 -1.663 9.901 0.797 1.00 0.00 H new ATOM 0 HA ARG A 67 -1.464 12.001 -1.274 1.00 0.00 H new ATOM 0 HB2 ARG A 67 0.092 9.534 -0.565 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -0.021 9.961 -2.261 1.00 0.00 H new ATOM 0 HG2 ARG A 67 0.824 12.020 -0.213 1.00 0.00 H new ATOM 0 HG3 ARG A 67 1.979 10.862 -0.843 1.00 0.00 H new ATOM 0 HD2 ARG A 67 0.391 12.928 -2.399 1.00 0.00 H new ATOM 0 HD3 ARG A 67 2.131 12.843 -2.202 1.00 0.00 H new ATOM 0 HE ARG A 67 1.555 10.442 -3.425 1.00 0.00 H new ATOM 0 HH11 ARG A 67 0.754 13.815 -4.127 1.00 0.00 H new ATOM 0 HH12 ARG A 67 0.696 13.555 -5.874 1.00 0.00 H new ATOM 0 HH21 ARG A 67 1.480 10.124 -5.668 1.00 0.00 H new ATOM 0 HH22 ARG A 67 1.105 11.477 -6.741 1.00 0.00 H new ATOM 1116 N ILE A 68 -3.060 9.151 -1.369 1.00 0.00 N ATOM 1117 CA ILE A 68 -4.047 8.374 -2.107 1.00 0.00 C ATOM 1118 C ILE A 68 -5.311 9.187 -2.363 1.00 0.00 C ATOM 1119 O ILE A 68 -5.747 9.961 -1.509 1.00 0.00 O ATOM 1120 CB ILE A 68 -4.424 7.082 -1.356 1.00 0.00 C ATOM 1121 CG1 ILE A 68 -4.988 7.415 0.028 1.00 0.00 C ATOM 1122 CG2 ILE A 68 -3.213 6.168 -1.234 1.00 0.00 C ATOM 1123 CD1 ILE A 68 -5.393 6.193 0.822 1.00 0.00 C ATOM 0 H ILE A 68 -2.862 8.799 -0.432 1.00 0.00 H new ATOM 0 HA ILE A 68 -3.590 8.110 -3.061 1.00 0.00 H new ATOM 0 HB ILE A 68 -5.194 6.560 -1.925 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -4.241 7.974 0.592 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -5.854 8.067 -0.088 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -3.495 5.260 -0.701 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -2.852 5.908 -2.229 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -2.424 6.681 -0.684 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -5.784 6.502 1.792 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -6.163 5.645 0.279 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -4.525 5.550 0.969 1.00 0.00 H new ATOM 1135 N PHE A 69 -5.893 9.008 -3.543 1.00 0.00 N ATOM 1136 CA PHE A 69 -7.107 9.724 -3.916 1.00 0.00 C ATOM 1137 C PHE A 69 -8.028 8.832 -4.747 1.00 0.00 C ATOM 1138 O PHE A 69 -7.576 8.151 -5.668 1.00 0.00 O ATOM 1139 CB PHE A 69 -6.751 10.988 -4.702 1.00 0.00 C ATOM 1140 CG PHE A 69 -7.260 12.251 -4.068 1.00 0.00 C ATOM 1141 CD1 PHE A 69 -8.567 12.660 -4.263 1.00 0.00 C ATOM 1142 CD2 PHE A 69 -6.428 13.028 -3.279 1.00 0.00 C ATOM 1143 CE1 PHE A 69 -9.038 13.824 -3.683 1.00 0.00 C ATOM 1144 CE2 PHE A 69 -6.892 14.191 -2.696 1.00 0.00 C ATOM 1145 CZ PHE A 69 -8.199 14.590 -2.898 1.00 0.00 C ATOM 0 H PHE A 69 -5.543 8.372 -4.259 1.00 0.00 H new ATOM 0 HA PHE A 69 -7.633 10.007 -3.004 1.00 0.00 H new ATOM 0 HB2 PHE A 69 -5.667 11.052 -4.801 1.00 0.00 H new ATOM 0 HB3 PHE A 69 -7.159 10.907 -5.710 1.00 0.00 H new ATOM 0 HD1 PHE A 69 -9.227 12.064 -4.875 1.00 0.00 H new ATOM 0 HD2 PHE A 69 -5.405 12.721 -3.118 1.00 0.00 H new ATOM 0 HE1 PHE A 69 -10.060 14.133 -3.844 1.00 0.00 H new ATOM 0 HE2 PHE A 69 -6.233 14.788 -2.083 1.00 0.00 H new ATOM 0 HZ PHE A 69 -8.564 15.499 -2.443 1.00 0.00 H new ATOM 1155 N PRO A 70 -9.337 8.821 -4.438 1.00 0.00 N ATOM 1156 CA PRO A 70 -10.311 8.005 -5.169 1.00 0.00 C ATOM 1157 C PRO A 70 -10.455 8.446 -6.622 1.00 0.00 C ATOM 1158 O PRO A 70 -10.992 9.517 -6.904 1.00 0.00 O ATOM 1159 CB PRO A 70 -11.621 8.231 -4.409 1.00 0.00 C ATOM 1160 CG PRO A 70 -11.433 9.522 -3.693 1.00 0.00 C ATOM 1161 CD PRO A 70 -9.971 9.600 -3.359 1.00 0.00 C ATOM 0 HA PRO A 70 -10.010 6.958 -5.214 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -12.470 8.278 -5.091 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -11.818 7.417 -3.711 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -11.736 10.362 -4.317 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -12.042 9.560 -2.790 1.00 0.00 H new ATOM 0 HD2 PRO A 70 -9.616 10.630 -3.344 1.00 0.00 H new ATOM 0 HD3 PRO A 70 -9.759 9.175 -2.378 1.00 0.00 H new ATOM 1539 N VAL A 94 -12.550 4.514 -5.465 1.00 0.00 N ATOM 1540 CA VAL A 94 -11.448 3.995 -4.662 1.00 0.00 C ATOM 1541 C VAL A 94 -10.100 4.389 -5.256 1.00 0.00 C ATOM 1542 O VAL A 94 -10.030 4.947 -6.350 1.00 0.00 O ATOM 1543 CB VAL A 94 -11.507 2.459 -4.544 1.00 0.00 C ATOM 1544 CG1 VAL A 94 -12.535 2.038 -3.506 1.00 0.00 C ATOM 1545 CG2 VAL A 94 -11.813 1.828 -5.894 1.00 0.00 C ATOM 0 HA VAL A 94 -11.552 4.434 -3.670 1.00 0.00 H new ATOM 0 HB VAL A 94 -10.530 2.104 -4.216 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -12.560 0.950 -3.439 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -12.264 2.455 -2.536 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -13.519 2.406 -3.798 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -11.850 0.744 -5.789 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -12.775 2.191 -6.255 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -11.033 2.097 -6.606 1.00 0.00 H new ATOM 1555 N ALA A 95 -9.029 4.089 -4.526 1.00 0.00 N ATOM 1556 CA ALA A 95 -7.680 4.405 -4.979 1.00 0.00 C ATOM 1557 C ALA A 95 -6.827 3.144 -5.064 1.00 0.00 C ATOM 1558 O ALA A 95 -6.416 2.591 -4.043 1.00 0.00 O ATOM 1559 CB ALA A 95 -7.033 5.421 -4.049 1.00 0.00 C ATOM 0 H ALA A 95 -9.071 3.627 -3.618 1.00 0.00 H new ATOM 0 HA ALA A 95 -7.748 4.838 -5.977 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -6.026 5.647 -4.401 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -7.627 6.335 -4.039 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -6.982 5.010 -3.041 1.00 0.00 H new ATOM 1565 N VAL A 96 -6.571 2.688 -6.285 1.00 0.00 N ATOM 1566 CA VAL A 96 -5.775 1.486 -6.500 1.00 0.00 C ATOM 1567 C VAL A 96 -4.364 1.648 -5.945 1.00 0.00 C ATOM 1568 O VAL A 96 -3.669 2.615 -6.255 1.00 0.00 O ATOM 1569 CB VAL A 96 -5.688 1.121 -7.995 1.00 0.00 C ATOM 1570 CG1 VAL A 96 -5.159 -0.296 -8.165 1.00 0.00 C ATOM 1571 CG2 VAL A 96 -7.045 1.272 -8.665 1.00 0.00 C ATOM 0 H VAL A 96 -6.903 3.133 -7.141 1.00 0.00 H new ATOM 0 HA VAL A 96 -6.281 0.680 -5.968 1.00 0.00 H new ATOM 0 HB VAL A 96 -4.993 1.808 -8.478 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -5.103 -0.539 -9.226 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -4.165 -0.369 -7.724 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -5.829 -0.997 -7.667 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -6.961 1.010 -9.720 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -7.765 0.611 -8.182 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -7.383 2.304 -8.574 1.00 0.00 H new ATOM 1581 N VAL A 97 -3.952 0.691 -5.121 1.00 0.00 N ATOM 1582 CA VAL A 97 -2.626 0.718 -4.516 1.00 0.00 C ATOM 1583 C VAL A 97 -1.878 -0.586 -4.776 1.00 0.00 C ATOM 1584 O VAL A 97 -2.487 -1.609 -5.088 1.00 0.00 O ATOM 1585 CB VAL A 97 -2.714 0.954 -2.996 1.00 0.00 C ATOM 1586 CG1 VAL A 97 -1.327 1.125 -2.399 1.00 0.00 C ATOM 1587 CG2 VAL A 97 -3.587 2.162 -2.693 1.00 0.00 C ATOM 0 H VAL A 97 -4.519 -0.115 -4.856 1.00 0.00 H new ATOM 0 HA VAL A 97 -2.081 1.542 -4.975 1.00 0.00 H new ATOM 0 HB VAL A 97 -3.174 0.078 -2.538 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -1.411 1.291 -1.325 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -0.738 0.226 -2.583 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -0.835 1.981 -2.861 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -3.637 2.313 -1.615 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -3.159 3.047 -3.164 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -4.591 1.993 -3.083 1.00 0.00 H new ATOM 1597 N LYS A 98 -0.555 -0.543 -4.647 1.00 0.00 N ATOM 1598 CA LYS A 98 0.276 -1.722 -4.868 1.00 0.00 C ATOM 1599 C LYS A 98 1.254 -1.922 -3.709 1.00 0.00 C ATOM 1600 O LYS A 98 1.602 -0.971 -3.013 1.00 0.00 O ATOM 1601 CB LYS A 98 1.043 -1.590 -6.185 1.00 0.00 C ATOM 1602 CG LYS A 98 0.159 -1.236 -7.370 1.00 0.00 C ATOM 1603 CD LYS A 98 0.586 -1.975 -8.628 1.00 0.00 C ATOM 1604 CE LYS A 98 0.526 -1.074 -9.852 1.00 0.00 C ATOM 1605 NZ LYS A 98 1.859 -0.502 -10.190 1.00 0.00 N ATOM 0 H LYS A 98 -0.035 0.296 -4.390 1.00 0.00 H new ATOM 0 HA LYS A 98 -0.376 -2.594 -4.923 1.00 0.00 H new ATOM 0 HB2 LYS A 98 1.811 -0.825 -6.074 1.00 0.00 H new ATOM 0 HB3 LYS A 98 1.556 -2.529 -6.393 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -0.877 -1.481 -7.138 1.00 0.00 H new ATOM 0 HG3 LYS A 98 0.200 -0.161 -7.547 1.00 0.00 H new ATOM 0 HD2 LYS A 98 1.601 -2.353 -8.502 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -0.060 -2.840 -8.780 1.00 0.00 H new ATOM 0 HE2 LYS A 98 0.149 -1.642 -10.702 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -0.181 -0.264 -9.672 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 1.812 0.536 -10.150 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 2.566 -0.843 -9.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 2.131 -0.799 -11.149 1.00 0.00 H new ATOM 1619 N PRO A 99 1.714 -3.166 -3.487 1.00 0.00 N ATOM 1620 CA PRO A 99 2.657 -3.482 -2.410 1.00 0.00 C ATOM 1621 C PRO A 99 3.849 -2.533 -2.392 1.00 0.00 C ATOM 1622 O PRO A 99 4.650 -2.503 -3.327 1.00 0.00 O ATOM 1623 CB PRO A 99 3.112 -4.918 -2.721 1.00 0.00 C ATOM 1624 CG PRO A 99 2.567 -5.235 -4.077 1.00 0.00 C ATOM 1625 CD PRO A 99 1.362 -4.360 -4.263 1.00 0.00 C ATOM 0 HA PRO A 99 2.195 -3.381 -1.428 1.00 0.00 H new ATOM 0 HB2 PRO A 99 4.199 -4.995 -2.709 1.00 0.00 H new ATOM 0 HB3 PRO A 99 2.735 -5.618 -1.975 1.00 0.00 H new ATOM 0 HG2 PRO A 99 3.311 -5.041 -4.850 1.00 0.00 H new ATOM 0 HG3 PRO A 99 2.297 -6.289 -4.151 1.00 0.00 H new ATOM 0 HD2 PRO A 99 1.189 -4.125 -5.313 1.00 0.00 H new ATOM 0 HD3 PRO A 99 0.455 -4.834 -3.889 1.00 0.00 H new ATOM 1633 N GLY A 100 3.954 -1.753 -1.322 1.00 0.00 N ATOM 1634 CA GLY A 100 5.042 -0.804 -1.198 1.00 0.00 C ATOM 1635 C GLY A 100 4.619 0.601 -1.573 1.00 0.00 C ATOM 1636 O GLY A 100 5.390 1.349 -2.172 1.00 0.00 O ATOM 0 H GLY A 100 3.303 -1.762 -0.537 1.00 0.00 H new ATOM 0 HA2 GLY A 100 5.412 -0.809 -0.173 1.00 0.00 H new ATOM 0 HA3 GLY A 100 5.869 -1.116 -1.836 1.00 0.00 H new ATOM 1640 N ARG A 101 3.386 0.958 -1.226 1.00 0.00 N ATOM 1641 CA ARG A 101 2.859 2.284 -1.538 1.00 0.00 C ATOM 1642 C ARG A 101 2.545 3.075 -0.271 1.00 0.00 C ATOM 1643 O ARG A 101 1.721 2.661 0.543 1.00 0.00 O ATOM 1644 CB ARG A 101 1.595 2.161 -2.391 1.00 0.00 C ATOM 1645 CG ARG A 101 1.562 3.105 -3.580 1.00 0.00 C ATOM 1646 CD ARG A 101 2.167 2.463 -4.817 1.00 0.00 C ATOM 1647 NE ARG A 101 1.434 2.812 -6.032 1.00 0.00 N ATOM 1648 CZ ARG A 101 1.549 2.153 -7.182 1.00 0.00 C ATOM 1649 NH1 ARG A 101 2.369 1.113 -7.281 1.00 0.00 N ATOM 1650 NH2 ARG A 101 0.842 2.535 -8.238 1.00 0.00 N ATOM 0 H ARG A 101 2.734 0.350 -0.730 1.00 0.00 H new ATOM 0 HA ARG A 101 3.627 2.822 -2.094 1.00 0.00 H new ATOM 0 HB2 ARG A 101 1.510 1.136 -2.751 1.00 0.00 H new ATOM 0 HB3 ARG A 101 0.725 2.352 -1.763 1.00 0.00 H new ATOM 0 HG2 ARG A 101 0.532 3.396 -3.786 1.00 0.00 H new ATOM 0 HG3 ARG A 101 2.108 4.017 -3.338 1.00 0.00 H new ATOM 0 HD2 ARG A 101 3.205 2.778 -4.917 1.00 0.00 H new ATOM 0 HD3 ARG A 101 2.173 1.380 -4.696 1.00 0.00 H new ATOM 0 HE ARG A 101 0.797 3.608 -5.996 1.00 0.00 H new ATOM 0 HH11 ARG A 101 2.915 0.815 -6.473 1.00 0.00 H new ATOM 0 HH12 ARG A 101 2.453 0.612 -8.165 1.00 0.00 H new ATOM 0 HH21 ARG A 101 0.211 3.333 -8.168 1.00 0.00 H new ATOM 0 HH22 ARG A 101 0.930 2.030 -9.120 1.00 0.00 H new ATOM 1664 N VAL A 102 3.197 4.226 -0.119 1.00 0.00 N ATOM 1665 CA VAL A 102 2.973 5.082 1.041 1.00 0.00 C ATOM 1666 C VAL A 102 1.638 5.808 0.914 1.00 0.00 C ATOM 1667 O VAL A 102 1.509 6.761 0.145 1.00 0.00 O ATOM 1668 CB VAL A 102 4.101 6.122 1.201 1.00 0.00 C ATOM 1669 CG1 VAL A 102 3.937 6.896 2.501 1.00 0.00 C ATOM 1670 CG2 VAL A 102 5.464 5.448 1.143 1.00 0.00 C ATOM 0 H VAL A 102 3.883 4.585 -0.783 1.00 0.00 H new ATOM 0 HA VAL A 102 2.962 4.441 1.922 1.00 0.00 H new ATOM 0 HB VAL A 102 4.035 6.829 0.374 1.00 0.00 H new ATOM 0 HG11 VAL A 102 4.742 7.624 2.595 1.00 0.00 H new ATOM 0 HG12 VAL A 102 2.978 7.414 2.498 1.00 0.00 H new ATOM 0 HG13 VAL A 102 3.973 6.205 3.343 1.00 0.00 H new ATOM 0 HG21 VAL A 102 6.246 6.198 1.258 1.00 0.00 H new ATOM 0 HG22 VAL A 102 5.543 4.716 1.947 1.00 0.00 H new ATOM 0 HG23 VAL A 102 5.581 4.946 0.183 1.00 0.00 H new ATOM 1680 N MET A 103 0.641 5.341 1.658 1.00 0.00 N ATOM 1681 CA MET A 103 -0.691 5.936 1.613 1.00 0.00 C ATOM 1682 C MET A 103 -0.857 7.020 2.675 1.00 0.00 C ATOM 1683 O MET A 103 -1.621 7.967 2.490 1.00 0.00 O ATOM 1684 CB MET A 103 -1.758 4.855 1.804 1.00 0.00 C ATOM 1685 CG MET A 103 -1.482 3.581 1.021 1.00 0.00 C ATOM 1686 SD MET A 103 -2.632 2.253 1.428 1.00 0.00 S ATOM 1687 CE MET A 103 -1.927 1.649 2.961 1.00 0.00 C ATOM 0 H MET A 103 0.729 4.553 2.299 1.00 0.00 H new ATOM 0 HA MET A 103 -0.814 6.400 0.634 1.00 0.00 H new ATOM 0 HB2 MET A 103 -1.831 4.611 2.864 1.00 0.00 H new ATOM 0 HB3 MET A 103 -2.726 5.255 1.502 1.00 0.00 H new ATOM 0 HG2 MET A 103 -1.543 3.795 -0.046 1.00 0.00 H new ATOM 0 HG3 MET A 103 -0.464 3.249 1.222 1.00 0.00 H new ATOM 0 HE1 MET A 103 -1.999 0.562 2.991 1.00 0.00 H new ATOM 0 HE2 MET A 103 -0.880 1.946 3.022 1.00 0.00 H new ATOM 0 HE3 MET A 103 -2.473 2.072 3.804 1.00 0.00 H new ATOM 1697 N PHE A 104 -0.148 6.874 3.789 1.00 0.00 N ATOM 1698 CA PHE A 104 -0.232 7.843 4.876 1.00 0.00 C ATOM 1699 C PHE A 104 1.152 8.238 5.377 1.00 0.00 C ATOM 1700 O PHE A 104 2.139 7.552 5.117 1.00 0.00 O ATOM 1701 CB PHE A 104 -1.048 7.267 6.034 1.00 0.00 C ATOM 1702 CG PHE A 104 -2.518 7.166 5.748 1.00 0.00 C ATOM 1703 CD1 PHE A 104 -3.020 6.124 4.987 1.00 0.00 C ATOM 1704 CD2 PHE A 104 -3.398 8.113 6.245 1.00 0.00 C ATOM 1705 CE1 PHE A 104 -4.374 6.026 4.726 1.00 0.00 C ATOM 1706 CE2 PHE A 104 -4.752 8.023 5.988 1.00 0.00 C ATOM 1707 CZ PHE A 104 -5.242 6.979 5.228 1.00 0.00 C ATOM 0 H PHE A 104 0.489 6.097 3.963 1.00 0.00 H new ATOM 0 HA PHE A 104 -0.725 8.734 4.488 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -0.666 6.276 6.278 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -0.901 7.891 6.916 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -2.345 5.379 4.592 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -3.021 8.931 6.840 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -4.753 5.208 4.132 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -5.427 8.769 6.381 1.00 0.00 H new ATOM 0 HZ PHE A 104 -6.300 6.907 5.026 1.00 0.00 H new ATOM 1717 N GLU A 105 1.208 9.350 6.106 1.00 0.00 N ATOM 1718 CA GLU A 105 2.461 9.846 6.662 1.00 0.00 C ATOM 1719 C GLU A 105 2.192 10.925 7.706 1.00 0.00 C ATOM 1720 O GLU A 105 1.675 11.996 7.386 1.00 0.00 O ATOM 1721 CB GLU A 105 3.362 10.396 5.554 1.00 0.00 C ATOM 1722 CG GLU A 105 2.644 11.331 4.595 1.00 0.00 C ATOM 1723 CD GLU A 105 2.574 10.782 3.183 1.00 0.00 C ATOM 1724 OE1 GLU A 105 3.645 10.567 2.577 1.00 0.00 O ATOM 1725 OE2 GLU A 105 1.450 10.570 2.683 1.00 0.00 O ATOM 0 H GLU A 105 0.395 9.926 6.325 1.00 0.00 H new ATOM 0 HA GLU A 105 2.973 9.014 7.144 1.00 0.00 H new ATOM 0 HB2 GLU A 105 4.199 10.927 6.008 1.00 0.00 H new ATOM 0 HB3 GLU A 105 3.781 9.562 4.990 1.00 0.00 H new ATOM 0 HG2 GLU A 105 1.633 11.513 4.960 1.00 0.00 H new ATOM 0 HG3 GLU A 105 3.156 12.293 4.581 1.00 0.00 H new ATOM 1732 N VAL A 106 2.538 10.633 8.956 1.00 0.00 N ATOM 1733 CA VAL A 106 2.325 11.578 10.047 1.00 0.00 C ATOM 1734 C VAL A 106 3.609 12.320 10.400 1.00 0.00 C ATOM 1735 O VAL A 106 4.696 11.947 9.957 1.00 0.00 O ATOM 1736 CB VAL A 106 1.787 10.874 11.308 1.00 0.00 C ATOM 1737 CG1 VAL A 106 0.423 10.258 11.036 1.00 0.00 C ATOM 1738 CG2 VAL A 106 2.769 9.818 11.794 1.00 0.00 C ATOM 0 H VAL A 106 2.966 9.751 9.238 1.00 0.00 H new ATOM 0 HA VAL A 106 1.583 12.295 9.696 1.00 0.00 H new ATOM 0 HB VAL A 106 1.674 11.620 12.095 1.00 0.00 H new ATOM 0 HG11 VAL A 106 0.060 9.766 11.938 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -0.277 11.040 10.742 1.00 0.00 H new ATOM 0 HG13 VAL A 106 0.508 9.526 10.232 1.00 0.00 H new ATOM 0 HG21 VAL A 106 2.370 9.333 12.685 1.00 0.00 H new ATOM 0 HG22 VAL A 106 2.919 9.074 11.012 1.00 0.00 H new ATOM 0 HG23 VAL A 106 3.722 10.290 12.034 1.00 0.00 H new ATOM 1748 N ALA A 107 3.476 13.371 11.204 1.00 0.00 N ATOM 1749 CA ALA A 107 4.625 14.166 11.620 1.00 0.00 C ATOM 1750 C ALA A 107 4.314 14.962 12.883 1.00 0.00 C ATOM 1751 O ALA A 107 3.220 15.505 13.032 1.00 0.00 O ATOM 1752 CB ALA A 107 5.053 15.102 10.499 1.00 0.00 C ATOM 0 H ALA A 107 2.584 13.691 11.580 1.00 0.00 H new ATOM 0 HA ALA A 107 5.445 13.483 11.843 1.00 0.00 H new ATOM 0 HB1 ALA A 107 5.912 15.689 10.824 1.00 0.00 H new ATOM 0 HB2 ALA A 107 5.325 14.517 9.620 1.00 0.00 H new ATOM 0 HB3 ALA A 107 4.229 15.771 10.249 1.00 0.00 H new ATOM 1758 N GLY A 108 5.285 15.027 13.788 1.00 0.00 N ATOM 1759 CA GLY A 108 5.096 15.761 15.026 1.00 0.00 C ATOM 1760 C GLY A 108 4.765 14.858 16.199 1.00 0.00 C ATOM 1761 O GLY A 108 5.127 15.154 17.338 1.00 0.00 O ATOM 0 H GLY A 108 6.199 14.585 13.687 1.00 0.00 H new ATOM 0 HA2 GLY A 108 6.002 16.324 15.251 1.00 0.00 H new ATOM 0 HA3 GLY A 108 4.294 16.487 14.894 1.00 0.00 H new ATOM 1765 N VAL A 109 4.074 13.758 15.923 1.00 0.00 N ATOM 1766 CA VAL A 109 3.695 12.815 16.970 1.00 0.00 C ATOM 1767 C VAL A 109 4.833 11.847 17.282 1.00 0.00 C ATOM 1768 O VAL A 109 5.792 11.734 16.519 1.00 0.00 O ATOM 1769 CB VAL A 109 2.441 12.011 16.578 1.00 0.00 C ATOM 1770 CG1 VAL A 109 1.244 12.937 16.415 1.00 0.00 C ATOM 1771 CG2 VAL A 109 2.689 11.211 15.306 1.00 0.00 C ATOM 0 H VAL A 109 3.765 13.497 14.986 1.00 0.00 H new ATOM 0 HA VAL A 109 3.474 13.406 17.859 1.00 0.00 H new ATOM 0 HB VAL A 109 2.219 11.306 17.379 1.00 0.00 H new ATOM 0 HG11 VAL A 109 0.367 12.352 16.138 1.00 0.00 H new ATOM 0 HG12 VAL A 109 1.053 13.454 17.355 1.00 0.00 H new ATOM 0 HG13 VAL A 109 1.454 13.669 15.635 1.00 0.00 H new ATOM 0 HG21 VAL A 109 1.790 10.651 15.048 1.00 0.00 H new ATOM 0 HG22 VAL A 109 2.940 11.891 14.492 1.00 0.00 H new ATOM 0 HG23 VAL A 109 3.515 10.518 15.467 1.00 0.00 H new ATOM 1781 N THR A 110 4.717 11.152 18.409 1.00 0.00 N ATOM 1782 CA THR A 110 5.737 10.195 18.825 1.00 0.00 C ATOM 1783 C THR A 110 5.643 8.909 18.009 1.00 0.00 C ATOM 1784 O THR A 110 4.703 8.716 17.238 1.00 0.00 O ATOM 1785 CB THR A 110 5.590 9.878 20.313 1.00 0.00 C ATOM 1786 OG1 THR A 110 4.465 9.050 20.542 1.00 0.00 O ATOM 1787 CG2 THR A 110 5.436 11.112 21.176 1.00 0.00 C ATOM 0 H THR A 110 3.928 11.233 19.050 1.00 0.00 H new ATOM 0 HA THR A 110 6.714 10.645 18.650 1.00 0.00 H new ATOM 0 HB THR A 110 6.514 9.372 20.592 1.00 0.00 H new ATOM 0 HG1 THR A 110 4.390 8.858 21.500 1.00 0.00 H new ATOM 0 HG21 THR A 110 5.336 10.816 22.220 1.00 0.00 H new ATOM 0 HG22 THR A 110 6.314 11.748 21.061 1.00 0.00 H new ATOM 0 HG23 THR A 110 4.547 11.662 20.869 1.00 0.00 H new ATOM 1795 N GLU A 111 6.626 8.031 18.186 1.00 0.00 N ATOM 1796 CA GLU A 111 6.658 6.762 17.468 1.00 0.00 C ATOM 1797 C GLU A 111 5.508 5.861 17.904 1.00 0.00 C ATOM 1798 O GLU A 111 4.905 5.168 17.083 1.00 0.00 O ATOM 1799 CB GLU A 111 7.993 6.053 17.704 1.00 0.00 C ATOM 1800 CG GLU A 111 8.120 4.731 16.965 1.00 0.00 C ATOM 1801 CD GLU A 111 9.547 4.224 16.917 1.00 0.00 C ATOM 1802 OE1 GLU A 111 10.301 4.476 17.881 1.00 0.00 O ATOM 1803 OE2 GLU A 111 9.913 3.573 15.914 1.00 0.00 O ATOM 0 H GLU A 111 7.411 8.176 18.821 1.00 0.00 H new ATOM 0 HA GLU A 111 6.548 6.972 16.404 1.00 0.00 H new ATOM 0 HB2 GLU A 111 8.804 6.712 17.394 1.00 0.00 H new ATOM 0 HB3 GLU A 111 8.117 5.876 18.772 1.00 0.00 H new ATOM 0 HG2 GLU A 111 7.490 3.986 17.451 1.00 0.00 H new ATOM 0 HG3 GLU A 111 7.747 4.850 15.948 1.00 0.00 H new ATOM 1810 N GLU A 112 5.207 5.873 19.198 1.00 0.00 N ATOM 1811 CA GLU A 112 4.128 5.056 19.740 1.00 0.00 C ATOM 1812 C GLU A 112 2.779 5.492 19.177 1.00 0.00 C ATOM 1813 O GLU A 112 1.971 4.662 18.761 1.00 0.00 O ATOM 1814 CB GLU A 112 4.112 5.142 21.268 1.00 0.00 C ATOM 1815 CG GLU A 112 4.638 3.892 21.953 1.00 0.00 C ATOM 1816 CD GLU A 112 6.138 3.731 21.802 1.00 0.00 C ATOM 1817 OE1 GLU A 112 6.640 3.882 20.668 1.00 0.00 O ATOM 1818 OE2 GLU A 112 6.810 3.452 22.816 1.00 0.00 O ATOM 0 H GLU A 112 5.695 6.440 19.891 1.00 0.00 H new ATOM 0 HA GLU A 112 4.305 4.022 19.445 1.00 0.00 H new ATOM 0 HB2 GLU A 112 4.710 5.997 21.582 1.00 0.00 H new ATOM 0 HB3 GLU A 112 3.091 5.327 21.602 1.00 0.00 H new ATOM 0 HG2 GLU A 112 4.385 3.929 23.013 1.00 0.00 H new ATOM 0 HG3 GLU A 112 4.139 3.017 21.537 1.00 0.00 H new ATOM 1825 N GLN A 113 2.543 6.799 19.164 1.00 0.00 N ATOM 1826 CA GLN A 113 1.293 7.345 18.649 1.00 0.00 C ATOM 1827 C GLN A 113 1.271 7.297 17.126 1.00 0.00 C ATOM 1828 O GLN A 113 0.237 7.025 16.516 1.00 0.00 O ATOM 1829 CB GLN A 113 1.102 8.784 19.131 1.00 0.00 C ATOM 1830 CG GLN A 113 1.333 8.960 20.623 1.00 0.00 C ATOM 1831 CD GLN A 113 0.128 8.559 21.450 1.00 0.00 C ATOM 1832 OE1 GLN A 113 -0.893 9.247 21.455 1.00 0.00 O ATOM 1833 NE2 GLN A 113 0.241 7.440 22.157 1.00 0.00 N ATOM 0 H GLN A 113 3.201 7.500 19.504 1.00 0.00 H new ATOM 0 HA GLN A 113 0.473 6.734 19.027 1.00 0.00 H new ATOM 0 HB2 GLN A 113 1.786 9.435 18.586 1.00 0.00 H new ATOM 0 HB3 GLN A 113 0.091 9.109 18.887 1.00 0.00 H new ATOM 0 HG2 GLN A 113 2.193 8.363 20.927 1.00 0.00 H new ATOM 0 HG3 GLN A 113 1.580 10.002 20.828 1.00 0.00 H new ATOM 0 HE21 GLN A 113 1.106 6.901 22.123 1.00 0.00 H new ATOM 0 HE22 GLN A 113 -0.537 7.120 22.734 1.00 0.00 H new ATOM 1842 N ALA A 114 2.421 7.564 16.517 1.00 0.00 N ATOM 1843 CA ALA A 114 2.541 7.553 15.066 1.00 0.00 C ATOM 1844 C ALA A 114 2.415 6.136 14.516 1.00 0.00 C ATOM 1845 O ALA A 114 1.668 5.891 13.568 1.00 0.00 O ATOM 1846 CB ALA A 114 3.866 8.169 14.646 1.00 0.00 C ATOM 0 H ALA A 114 3.285 7.791 17.009 1.00 0.00 H new ATOM 0 HA ALA A 114 1.727 8.148 14.652 1.00 0.00 H new ATOM 0 HB1 ALA A 114 3.945 8.156 13.559 1.00 0.00 H new ATOM 0 HB2 ALA A 114 3.917 9.198 15.001 1.00 0.00 H new ATOM 0 HB3 ALA A 114 4.687 7.595 15.077 1.00 0.00 H new ATOM 1852 N MET A 115 3.148 5.206 15.119 1.00 0.00 N ATOM 1853 CA MET A 115 3.117 3.812 14.690 1.00 0.00 C ATOM 1854 C MET A 115 1.725 3.219 14.875 1.00 0.00 C ATOM 1855 O MET A 115 1.160 2.636 13.949 1.00 0.00 O ATOM 1856 CB MET A 115 4.141 2.992 15.478 1.00 0.00 C ATOM 1857 CG MET A 115 5.584 3.332 15.137 1.00 0.00 C ATOM 1858 SD MET A 115 6.433 1.992 14.280 1.00 0.00 S ATOM 1859 CE MET A 115 7.555 2.919 13.235 1.00 0.00 C ATOM 0 H MET A 115 3.770 5.392 15.906 1.00 0.00 H new ATOM 0 HA MET A 115 3.371 3.777 13.631 1.00 0.00 H new ATOM 0 HB2 MET A 115 3.980 3.153 16.544 1.00 0.00 H new ATOM 0 HB3 MET A 115 3.971 1.933 15.286 1.00 0.00 H new ATOM 0 HG2 MET A 115 5.604 4.226 14.514 1.00 0.00 H new ATOM 0 HG3 MET A 115 6.123 3.570 16.054 1.00 0.00 H new ATOM 0 HE1 MET A 115 8.076 2.236 12.565 1.00 0.00 H new ATOM 0 HE2 MET A 115 6.991 3.643 12.648 1.00 0.00 H new ATOM 0 HE3 MET A 115 8.282 3.443 13.856 1.00 0.00 H new ATOM 1869 N GLU A 116 1.176 3.373 16.076 1.00 0.00 N ATOM 1870 CA GLU A 116 -0.150 2.852 16.379 1.00 0.00 C ATOM 1871 C GLU A 116 -1.200 3.483 15.472 1.00 0.00 C ATOM 1872 O GLU A 116 -2.020 2.785 14.877 1.00 0.00 O ATOM 1873 CB GLU A 116 -0.503 3.121 17.842 1.00 0.00 C ATOM 1874 CG GLU A 116 -1.490 2.122 18.421 1.00 0.00 C ATOM 1875 CD GLU A 116 -1.149 1.723 19.844 1.00 0.00 C ATOM 1876 OE1 GLU A 116 -0.601 2.568 20.582 1.00 0.00 O ATOM 1877 OE2 GLU A 116 -1.431 0.566 20.220 1.00 0.00 O ATOM 0 H GLU A 116 1.629 3.854 16.853 1.00 0.00 H new ATOM 0 HA GLU A 116 -0.139 1.776 16.204 1.00 0.00 H new ATOM 0 HB2 GLU A 116 0.410 3.104 18.437 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -0.921 4.124 17.928 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -2.492 2.551 18.398 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -1.511 1.231 17.793 1.00 0.00 H new ATOM 1884 N ALA A 117 -1.164 4.808 15.365 1.00 0.00 N ATOM 1885 CA ALA A 117 -2.111 5.531 14.525 1.00 0.00 C ATOM 1886 C ALA A 117 -2.036 5.042 13.083 1.00 0.00 C ATOM 1887 O ALA A 117 -3.056 4.737 12.467 1.00 0.00 O ATOM 1888 CB ALA A 117 -1.842 7.026 14.593 1.00 0.00 C ATOM 0 H ALA A 117 -0.490 5.401 15.849 1.00 0.00 H new ATOM 0 HA ALA A 117 -3.117 5.340 14.898 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -2.557 7.553 13.961 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -1.947 7.368 15.623 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -0.830 7.230 14.244 1.00 0.00 H new ATOM 1894 N LEU A 118 -0.820 4.959 12.557 1.00 0.00 N ATOM 1895 CA LEU A 118 -0.613 4.494 11.191 1.00 0.00 C ATOM 1896 C LEU A 118 -1.126 3.067 11.030 1.00 0.00 C ATOM 1897 O LEU A 118 -1.554 2.669 9.948 1.00 0.00 O ATOM 1898 CB LEU A 118 0.875 4.568 10.826 1.00 0.00 C ATOM 1899 CG LEU A 118 1.320 5.837 10.084 1.00 0.00 C ATOM 1900 CD1 LEU A 118 0.415 7.019 10.406 1.00 0.00 C ATOM 1901 CD2 LEU A 118 2.763 6.168 10.430 1.00 0.00 C ATOM 0 H LEU A 118 0.036 5.207 13.054 1.00 0.00 H new ATOM 0 HA LEU A 118 -1.173 5.141 10.516 1.00 0.00 H new ATOM 0 HB2 LEU A 118 1.459 4.482 11.742 1.00 0.00 H new ATOM 0 HB3 LEU A 118 1.122 3.704 10.209 1.00 0.00 H new ATOM 0 HG LEU A 118 1.244 5.643 9.014 1.00 0.00 H new ATOM 0 HD11 LEU A 118 0.760 7.899 9.864 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -0.607 6.786 10.108 1.00 0.00 H new ATOM 0 HD13 LEU A 118 0.444 7.218 11.477 1.00 0.00 H new ATOM 0 HD21 LEU A 118 3.067 7.069 9.898 1.00 0.00 H new ATOM 0 HD22 LEU A 118 2.851 6.333 11.504 1.00 0.00 H new ATOM 0 HD23 LEU A 118 3.407 5.339 10.137 1.00 0.00 H new ATOM 1913 N ARG A 119 -1.087 2.306 12.119 1.00 0.00 N ATOM 1914 CA ARG A 119 -1.556 0.926 12.105 1.00 0.00 C ATOM 1915 C ARG A 119 -3.081 0.884 12.074 1.00 0.00 C ATOM 1916 O ARG A 119 -3.676 0.058 11.382 1.00 0.00 O ATOM 1917 CB ARG A 119 -1.032 0.172 13.328 1.00 0.00 C ATOM 1918 CG ARG A 119 -0.486 -1.209 13.003 1.00 0.00 C ATOM 1919 CD ARG A 119 0.372 -1.751 14.134 1.00 0.00 C ATOM 1920 NE ARG A 119 -0.405 -2.558 15.074 1.00 0.00 N ATOM 1921 CZ ARG A 119 -0.811 -2.132 16.270 1.00 0.00 C ATOM 1922 NH1 ARG A 119 -0.528 -0.901 16.682 1.00 0.00 N ATOM 1923 NH2 ARG A 119 -1.508 -2.940 17.057 1.00 0.00 N ATOM 0 H ARG A 119 -0.735 2.622 13.023 1.00 0.00 H new ATOM 0 HA ARG A 119 -1.175 0.441 11.207 1.00 0.00 H new ATOM 0 HB2 ARG A 119 -0.246 0.762 13.800 1.00 0.00 H new ATOM 0 HB3 ARG A 119 -1.837 0.073 14.056 1.00 0.00 H new ATOM 0 HG2 ARG A 119 -1.313 -1.893 12.813 1.00 0.00 H new ATOM 0 HG3 ARG A 119 0.104 -1.162 12.088 1.00 0.00 H new ATOM 0 HD2 ARG A 119 1.179 -2.355 13.719 1.00 0.00 H new ATOM 0 HD3 ARG A 119 0.836 -0.921 14.667 1.00 0.00 H new ATOM 0 HE ARG A 119 -0.652 -3.508 14.797 1.00 0.00 H new ATOM 0 HH11 ARG A 119 0.005 -0.272 16.081 1.00 0.00 H new ATOM 0 HH12 ARG A 119 -0.843 -0.585 17.599 1.00 0.00 H new ATOM 0 HH21 ARG A 119 -1.732 -3.885 16.747 1.00 0.00 H new ATOM 0 HH22 ARG A 119 -1.820 -2.616 17.973 1.00 0.00 H new ATOM 1937 N ILE A 120 -3.706 1.787 12.826 1.00 0.00 N ATOM 1938 CA ILE A 120 -5.161 1.862 12.881 1.00 0.00 C ATOM 1939 C ILE A 120 -5.741 2.071 11.485 1.00 0.00 C ATOM 1940 O ILE A 120 -6.732 1.443 11.115 1.00 0.00 O ATOM 1941 CB ILE A 120 -5.628 3.007 13.807 1.00 0.00 C ATOM 1942 CG1 ILE A 120 -5.139 2.765 15.236 1.00 0.00 C ATOM 1943 CG2 ILE A 120 -7.145 3.140 13.782 1.00 0.00 C ATOM 1944 CD1 ILE A 120 -5.048 4.028 16.064 1.00 0.00 C ATOM 0 H ILE A 120 -3.226 2.476 13.405 1.00 0.00 H new ATOM 0 HA ILE A 120 -5.522 0.916 13.285 1.00 0.00 H new ATOM 0 HB ILE A 120 -5.198 3.940 13.441 1.00 0.00 H new ATOM 0 HG12 ILE A 120 -5.813 2.065 15.729 1.00 0.00 H new ATOM 0 HG13 ILE A 120 -4.158 2.292 15.201 1.00 0.00 H new ATOM 0 HG21 ILE A 120 -7.450 3.952 14.442 1.00 0.00 H new ATOM 0 HG22 ILE A 120 -7.475 3.355 12.765 1.00 0.00 H new ATOM 0 HG23 ILE A 120 -7.598 2.208 14.121 1.00 0.00 H new ATOM 0 HD11 ILE A 120 -4.695 3.782 17.065 1.00 0.00 H new ATOM 0 HD12 ILE A 120 -4.351 4.722 15.594 1.00 0.00 H new ATOM 0 HD13 ILE A 120 -6.032 4.491 16.130 1.00 0.00 H new ATOM 1956 N ALA A 121 -5.113 2.954 10.718 1.00 0.00 N ATOM 1957 CA ALA A 121 -5.562 3.244 9.362 1.00 0.00 C ATOM 1958 C ALA A 121 -5.535 1.987 8.500 1.00 0.00 C ATOM 1959 O ALA A 121 -6.470 1.717 7.748 1.00 0.00 O ATOM 1960 CB ALA A 121 -4.700 4.332 8.741 1.00 0.00 C ATOM 0 H ALA A 121 -4.291 3.482 11.012 1.00 0.00 H new ATOM 0 HA ALA A 121 -6.591 3.599 9.412 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -5.047 4.538 7.728 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -4.772 5.239 9.341 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -3.662 4.000 8.708 1.00 0.00 H new ATOM 1966 N GLY A 122 -4.454 1.221 8.616 1.00 0.00 N ATOM 1967 CA GLY A 122 -4.322 0.001 7.845 1.00 0.00 C ATOM 1968 C GLY A 122 -5.193 -1.124 8.374 1.00 0.00 C ATOM 1969 O GLY A 122 -5.469 -2.090 7.663 1.00 0.00 O ATOM 0 H GLY A 122 -3.667 1.425 9.232 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -4.586 0.202 6.807 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -3.280 -0.318 7.853 1.00 0.00 H new ATOM 1973 N HIS A 123 -5.628 -1.000 9.624 1.00 0.00 N ATOM 1974 CA HIS A 123 -6.472 -2.018 10.240 1.00 0.00 C ATOM 1975 C HIS A 123 -7.795 -2.154 9.495 1.00 0.00 C ATOM 1976 O HIS A 123 -8.284 -3.262 9.274 1.00 0.00 O ATOM 1977 CB HIS A 123 -6.727 -1.678 11.710 1.00 0.00 C ATOM 1978 CG HIS A 123 -6.363 -2.785 12.650 1.00 0.00 C ATOM 1979 ND1 HIS A 123 -6.326 -4.111 12.273 1.00 0.00 N ATOM 1980 CD2 HIS A 123 -6.014 -2.759 13.959 1.00 0.00 C ATOM 1981 CE1 HIS A 123 -5.973 -4.852 13.308 1.00 0.00 C ATOM 1982 NE2 HIS A 123 -5.778 -4.056 14.342 1.00 0.00 N ATOM 0 H HIS A 123 -5.411 -0.208 10.228 1.00 0.00 H new ATOM 0 HA HIS A 123 -5.948 -2.972 10.183 1.00 0.00 H new ATOM 0 HB2 HIS A 123 -6.157 -0.787 11.973 1.00 0.00 H new ATOM 0 HB3 HIS A 123 -7.781 -1.433 11.841 1.00 0.00 H new ATOM 0 HD2 HIS A 123 -5.936 -1.882 14.584 1.00 0.00 H new ATOM 0 HE1 HIS A 123 -5.863 -5.926 13.308 1.00 0.00 H new ATOM 0 HE2 HIS A 123 -5.497 -4.356 15.276 1.00 0.00 H new ATOM 1991 N LYS A 124 -8.372 -1.020 9.108 1.00 0.00 N ATOM 1992 CA LYS A 124 -9.639 -1.020 8.384 1.00 0.00 C ATOM 1993 C LYS A 124 -9.421 -1.186 6.880 1.00 0.00 C ATOM 1994 O LYS A 124 -10.376 -1.166 6.103 1.00 0.00 O ATOM 1995 CB LYS A 124 -10.413 0.272 8.659 1.00 0.00 C ATOM 1996 CG LYS A 124 -9.560 1.528 8.568 1.00 0.00 C ATOM 1997 CD LYS A 124 -9.126 2.007 9.943 1.00 0.00 C ATOM 1998 CE LYS A 124 -10.226 2.799 10.631 1.00 0.00 C ATOM 1999 NZ LYS A 124 -11.038 1.947 11.543 1.00 0.00 N ATOM 0 H LYS A 124 -7.984 -0.093 9.283 1.00 0.00 H new ATOM 0 HA LYS A 124 -10.223 -1.869 8.740 1.00 0.00 H new ATOM 0 HB2 LYS A 124 -11.236 0.350 7.948 1.00 0.00 H new ATOM 0 HB3 LYS A 124 -10.855 0.215 9.654 1.00 0.00 H new ATOM 0 HG2 LYS A 124 -8.680 1.328 7.957 1.00 0.00 H new ATOM 0 HG3 LYS A 124 -10.123 2.316 8.068 1.00 0.00 H new ATOM 0 HD2 LYS A 124 -8.854 1.150 10.559 1.00 0.00 H new ATOM 0 HD3 LYS A 124 -8.235 2.627 9.849 1.00 0.00 H new ATOM 0 HE2 LYS A 124 -9.783 3.618 11.198 1.00 0.00 H new ATOM 0 HE3 LYS A 124 -10.875 3.247 9.879 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 -11.398 2.525 12.329 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 -11.838 1.541 11.018 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 -10.446 1.180 11.920 1.00 0.00 H new ATOM 2013 N LEU A 125 -8.164 -1.355 6.473 1.00 0.00 N ATOM 2014 CA LEU A 125 -7.838 -1.528 5.062 1.00 0.00 C ATOM 2015 C LEU A 125 -7.995 -2.990 4.651 1.00 0.00 C ATOM 2016 O LEU A 125 -7.958 -3.887 5.492 1.00 0.00 O ATOM 2017 CB LEU A 125 -6.407 -1.063 4.781 1.00 0.00 C ATOM 2018 CG LEU A 125 -6.210 0.453 4.736 1.00 0.00 C ATOM 2019 CD1 LEU A 125 -4.761 0.792 4.421 1.00 0.00 C ATOM 2020 CD2 LEU A 125 -7.139 1.081 3.709 1.00 0.00 C ATOM 0 H LEU A 125 -7.359 -1.376 7.099 1.00 0.00 H new ATOM 0 HA LEU A 125 -8.529 -0.920 4.478 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -5.751 -1.476 5.548 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -6.086 -1.483 3.828 1.00 0.00 H new ATOM 0 HG LEU A 125 -6.455 0.861 5.717 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -4.638 1.875 4.393 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -4.114 0.374 5.192 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -4.491 0.371 3.452 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -6.985 2.160 3.691 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -6.925 0.667 2.724 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -8.174 0.867 3.975 1.00 0.00 H new ATOM 2032 N PRO A 126 -8.174 -3.249 3.344 1.00 0.00 N ATOM 2033 CA PRO A 126 -8.337 -4.599 2.823 1.00 0.00 C ATOM 2034 C PRO A 126 -7.004 -5.259 2.469 1.00 0.00 C ATOM 2035 O PRO A 126 -6.965 -6.228 1.710 1.00 0.00 O ATOM 2036 CB PRO A 126 -9.176 -4.370 1.568 1.00 0.00 C ATOM 2037 CG PRO A 126 -8.811 -2.998 1.093 1.00 0.00 C ATOM 2038 CD PRO A 126 -8.234 -2.244 2.271 1.00 0.00 C ATOM 0 HA PRO A 126 -8.791 -5.273 3.550 1.00 0.00 H new ATOM 0 HB2 PRO A 126 -8.959 -5.120 0.808 1.00 0.00 H new ATOM 0 HB3 PRO A 126 -10.241 -4.439 1.789 1.00 0.00 H new ATOM 0 HG2 PRO A 126 -8.085 -3.054 0.282 1.00 0.00 H new ATOM 0 HG3 PRO A 126 -9.688 -2.483 0.701 1.00 0.00 H new ATOM 0 HD2 PRO A 126 -7.246 -1.844 2.043 1.00 0.00 H new ATOM 0 HD3 PRO A 126 -8.863 -1.399 2.551 1.00 0.00 H new ATOM 2046 N ILE A 127 -5.916 -4.734 3.026 1.00 0.00 N ATOM 2047 CA ILE A 127 -4.586 -5.276 2.772 1.00 0.00 C ATOM 2048 C ILE A 127 -3.650 -5.003 3.944 1.00 0.00 C ATOM 2049 O ILE A 127 -3.958 -4.197 4.822 1.00 0.00 O ATOM 2050 CB ILE A 127 -3.970 -4.684 1.489 1.00 0.00 C ATOM 2051 CG1 ILE A 127 -4.077 -3.158 1.497 1.00 0.00 C ATOM 2052 CG2 ILE A 127 -4.654 -5.263 0.260 1.00 0.00 C ATOM 2053 CD1 ILE A 127 -3.099 -2.484 2.436 1.00 0.00 C ATOM 0 H ILE A 127 -5.930 -3.933 3.657 1.00 0.00 H new ATOM 0 HA ILE A 127 -4.703 -6.352 2.645 1.00 0.00 H new ATOM 0 HB ILE A 127 -2.914 -4.951 1.455 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -3.912 -2.786 0.486 1.00 0.00 H new ATOM 0 HG13 ILE A 127 -5.091 -2.875 1.779 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -4.209 -4.836 -0.639 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -4.527 -6.346 0.249 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -5.717 -5.023 0.288 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -3.234 -1.403 2.388 1.00 0.00 H new ATOM 0 HD12 ILE A 127 -3.278 -2.827 3.455 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -2.080 -2.736 2.142 1.00 0.00 H new ATOM 2065 N LYS A 128 -2.508 -5.681 3.953 1.00 0.00 N ATOM 2066 CA LYS A 128 -1.528 -5.516 5.017 1.00 0.00 C ATOM 2067 C LYS A 128 -0.751 -4.213 4.851 1.00 0.00 C ATOM 2068 O LYS A 128 -0.485 -3.775 3.732 1.00 0.00 O ATOM 2069 CB LYS A 128 -0.566 -6.703 5.025 1.00 0.00 C ATOM 2070 CG LYS A 128 -1.149 -7.952 5.665 1.00 0.00 C ATOM 2071 CD LYS A 128 -0.433 -8.302 6.958 1.00 0.00 C ATOM 2072 CE LYS A 128 -0.781 -9.706 7.426 1.00 0.00 C ATOM 2073 NZ LYS A 128 -0.615 -10.711 6.340 1.00 0.00 N ATOM 0 H LYS A 128 -2.239 -6.351 3.233 1.00 0.00 H new ATOM 0 HA LYS A 128 -2.059 -5.474 5.968 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -0.275 -6.932 4.000 1.00 0.00 H new ATOM 0 HB3 LYS A 128 0.342 -6.421 5.558 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -2.209 -7.798 5.865 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -1.074 -8.787 4.969 1.00 0.00 H new ATOM 0 HD2 LYS A 128 0.644 -8.223 6.811 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -0.703 -7.582 7.731 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -0.146 -9.975 8.270 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -1.811 -9.725 7.783 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -0.260 -11.602 6.743 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -1.532 -10.880 5.880 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 0.064 -10.354 5.637 1.00 0.00 H new ATOM 2087 N THR A 129 -0.391 -3.599 5.974 1.00 0.00 N ATOM 2088 CA THR A 129 0.358 -2.346 5.957 1.00 0.00 C ATOM 2089 C THR A 129 1.278 -2.250 7.170 1.00 0.00 C ATOM 2090 O THR A 129 0.968 -2.779 8.238 1.00 0.00 O ATOM 2091 CB THR A 129 -0.600 -1.154 5.939 1.00 0.00 C ATOM 2092 OG1 THR A 129 -1.169 -0.947 7.220 1.00 0.00 O ATOM 2093 CG2 THR A 129 -1.736 -1.309 4.951 1.00 0.00 C ATOM 0 H THR A 129 -0.606 -3.949 6.908 1.00 0.00 H new ATOM 0 HA THR A 129 0.968 -2.328 5.054 1.00 0.00 H new ATOM 0 HB THR A 129 0.009 -0.302 5.635 1.00 0.00 H new ATOM 0 HG1 THR A 129 -1.745 -1.706 7.449 1.00 0.00 H new ATOM 0 HG21 THR A 129 -2.376 -0.428 4.991 1.00 0.00 H new ATOM 0 HG22 THR A 129 -1.331 -1.418 3.945 1.00 0.00 H new ATOM 0 HG23 THR A 129 -2.320 -2.194 5.204 1.00 0.00 H new ATOM 2101 N LYS A 130 2.409 -1.570 7.005 1.00 0.00 N ATOM 2102 CA LYS A 130 3.366 -1.408 8.094 1.00 0.00 C ATOM 2103 C LYS A 130 3.817 0.044 8.214 1.00 0.00 C ATOM 2104 O LYS A 130 3.648 0.836 7.287 1.00 0.00 O ATOM 2105 CB LYS A 130 4.577 -2.320 7.884 1.00 0.00 C ATOM 2106 CG LYS A 130 5.201 -2.194 6.503 1.00 0.00 C ATOM 2107 CD LYS A 130 6.587 -1.572 6.568 1.00 0.00 C ATOM 2108 CE LYS A 130 7.226 -1.489 5.192 1.00 0.00 C ATOM 2109 NZ LYS A 130 8.670 -1.849 5.227 1.00 0.00 N ATOM 0 H LYS A 130 2.684 -1.124 6.130 1.00 0.00 H new ATOM 0 HA LYS A 130 2.869 -1.691 9.022 1.00 0.00 H new ATOM 0 HB2 LYS A 130 5.331 -2.089 8.637 1.00 0.00 H new ATOM 0 HB3 LYS A 130 4.274 -3.355 8.044 1.00 0.00 H new ATOM 0 HG2 LYS A 130 5.265 -3.179 6.041 1.00 0.00 H new ATOM 0 HG3 LYS A 130 4.558 -1.585 5.867 1.00 0.00 H new ATOM 0 HD2 LYS A 130 6.519 -0.573 6.999 1.00 0.00 H new ATOM 0 HD3 LYS A 130 7.221 -2.162 7.230 1.00 0.00 H new ATOM 0 HE2 LYS A 130 6.702 -2.156 4.508 1.00 0.00 H new ATOM 0 HE3 LYS A 130 7.113 -0.478 4.800 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 9.068 -1.780 4.269 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 9.175 -1.197 5.860 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 8.777 -2.823 5.577 1.00 0.00 H new ATOM 2123 N ILE A 131 4.391 0.388 9.363 1.00 0.00 N ATOM 2124 CA ILE A 131 4.866 1.747 9.604 1.00 0.00 C ATOM 2125 C ILE A 131 6.315 1.908 9.157 1.00 0.00 C ATOM 2126 O ILE A 131 7.127 0.996 9.312 1.00 0.00 O ATOM 2127 CB ILE A 131 4.763 2.141 11.095 1.00 0.00 C ATOM 2128 CG1 ILE A 131 3.586 1.429 11.772 1.00 0.00 C ATOM 2129 CG2 ILE A 131 4.626 3.650 11.235 1.00 0.00 C ATOM 2130 CD1 ILE A 131 2.247 1.737 11.142 1.00 0.00 C ATOM 0 H ILE A 131 4.538 -0.255 10.141 1.00 0.00 H new ATOM 0 HA ILE A 131 4.222 2.405 9.020 1.00 0.00 H new ATOM 0 HB ILE A 131 5.679 1.826 11.594 1.00 0.00 H new ATOM 0 HG12 ILE A 131 3.755 0.353 11.737 1.00 0.00 H new ATOM 0 HG13 ILE A 131 3.557 1.713 12.824 1.00 0.00 H new ATOM 0 HG21 ILE A 131 4.554 3.912 12.291 1.00 0.00 H new ATOM 0 HG22 ILE A 131 5.498 4.137 10.798 1.00 0.00 H new ATOM 0 HG23 ILE A 131 3.727 3.983 10.717 1.00 0.00 H new ATOM 0 HD11 ILE A 131 1.462 1.198 11.673 1.00 0.00 H new ATOM 0 HD12 ILE A 131 2.055 2.808 11.200 1.00 0.00 H new ATOM 0 HD13 ILE A 131 2.256 1.427 10.097 1.00 0.00 H new ATOM 2142 N VAL A 132 6.635 3.074 8.605 1.00 0.00 N ATOM 2143 CA VAL A 132 7.987 3.354 8.138 1.00 0.00 C ATOM 2144 C VAL A 132 8.344 4.825 8.332 1.00 0.00 C ATOM 2145 O VAL A 132 7.523 5.707 8.087 1.00 0.00 O ATOM 2146 CB VAL A 132 8.156 2.982 6.650 1.00 0.00 C ATOM 2147 CG1 VAL A 132 7.731 1.542 6.411 1.00 0.00 C ATOM 2148 CG2 VAL A 132 7.364 3.932 5.763 1.00 0.00 C ATOM 0 H VAL A 132 5.976 3.840 8.470 1.00 0.00 H new ATOM 0 HA VAL A 132 8.662 2.741 8.735 1.00 0.00 H new ATOM 0 HB VAL A 132 9.210 3.077 6.390 1.00 0.00 H new ATOM 0 HG11 VAL A 132 7.856 1.296 5.357 1.00 0.00 H new ATOM 0 HG12 VAL A 132 8.347 0.876 7.015 1.00 0.00 H new ATOM 0 HG13 VAL A 132 6.684 1.420 6.690 1.00 0.00 H new ATOM 0 HG21 VAL A 132 7.498 3.651 4.718 1.00 0.00 H new ATOM 0 HG22 VAL A 132 6.307 3.875 6.022 1.00 0.00 H new ATOM 0 HG23 VAL A 132 7.720 4.951 5.913 1.00 0.00 H new ATOM 2158 N ARG A 133 9.571 5.084 8.772 1.00 0.00 N ATOM 2159 CA ARG A 133 10.026 6.453 8.994 1.00 0.00 C ATOM 2160 C ARG A 133 10.816 6.970 7.800 1.00 0.00 C ATOM 2161 O ARG A 133 11.844 6.403 7.432 1.00 0.00 O ATOM 2162 CB ARG A 133 10.893 6.536 10.248 1.00 0.00 C ATOM 2163 CG ARG A 133 10.643 7.789 11.071 1.00 0.00 C ATOM 2164 CD ARG A 133 11.069 7.600 12.517 1.00 0.00 C ATOM 2165 NE ARG A 133 12.444 8.039 12.745 1.00 0.00 N ATOM 2166 CZ ARG A 133 12.940 8.330 13.946 1.00 0.00 C ATOM 2167 NH1 ARG A 133 12.179 8.231 15.028 1.00 0.00 N ATOM 2168 NH2 ARG A 133 14.202 8.721 14.063 1.00 0.00 N ATOM 0 H ARG A 133 10.266 4.368 8.981 1.00 0.00 H new ATOM 0 HA ARG A 133 9.140 7.075 9.126 1.00 0.00 H new ATOM 0 HB2 ARG A 133 10.707 5.659 10.868 1.00 0.00 H new ATOM 0 HB3 ARG A 133 11.943 6.504 9.958 1.00 0.00 H new ATOM 0 HG2 ARG A 133 11.189 8.626 10.636 1.00 0.00 H new ATOM 0 HG3 ARG A 133 9.584 8.045 11.033 1.00 0.00 H new ATOM 0 HD2 ARG A 133 10.397 8.159 13.169 1.00 0.00 H new ATOM 0 HD3 ARG A 133 10.975 6.549 12.788 1.00 0.00 H new ATOM 0 HE ARG A 133 13.060 8.128 11.937 1.00 0.00 H new ATOM 0 HH11 ARG A 133 11.208 7.931 14.943 1.00 0.00 H new ATOM 0 HH12 ARG A 133 12.565 8.455 15.945 1.00 0.00 H new ATOM 0 HH21 ARG A 133 14.791 8.798 13.234 1.00 0.00 H new ATOM 0 HH22 ARG A 133 14.584 8.944 14.982 1.00 0.00 H new