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 32 TYR OH : rot 165:sc= 0.18 USER MOD Set 1.2: A 115 MET CE :methyl -178:sc= -0.388 (180deg=-0.421) USER MOD Single : A 43 THR OG1 : rot 180:sc= -1.04 USER MOD Single : A 45 GLN : amide:sc= -1.21 K(o=-1.2,f=-2.3!) USER MOD Single : A 46 GLN : amide:sc= -1.83 X(o=-1.8,f=-2.2!) USER MOD Single : A 54 MET CE :methyl -119:sc= -7.29! (180deg=-11.5!) USER MOD Single : A 57 HIS : no HE2:sc= -1.67 K(o=-1.7,f=-4.3) USER MOD Single : A 63 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0338) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 MET CE :methyl -141:sc= -4.47! (180deg=-7.52!) USER MOD Single : A 110 THR OG1 : rot 180:sc= -1.08 USER MOD Single : A 113 GLN : amide:sc= 0.453 K(o=0.45,f=-5.3!) USER MOD Single : A 123 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 124 LYS NZ :NH3+ 172:sc= -0.84 (180deg=-1.06) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 THR OG1 : rot -50:sc= -0.63 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 507 N ASP A 31 7.348 12.479 9.078 1.00 0.00 N ATOM 508 CA ASP A 31 8.491 11.660 9.466 1.00 0.00 C ATOM 509 C ASP A 31 8.193 10.175 9.273 1.00 0.00 C ATOM 510 O ASP A 31 9.100 9.375 9.053 1.00 0.00 O ATOM 511 CB ASP A 31 8.868 11.930 10.923 1.00 0.00 C ATOM 512 CG ASP A 31 9.733 13.165 11.076 1.00 0.00 C ATOM 513 OD1 ASP A 31 9.249 14.272 10.758 1.00 0.00 O ATOM 514 OD2 ASP A 31 10.894 13.026 11.514 1.00 0.00 O ATOM 0 HA ASP A 31 9.330 11.929 8.824 1.00 0.00 H new ATOM 0 HB2 ASP A 31 7.960 12.050 11.514 1.00 0.00 H new ATOM 0 HB3 ASP A 31 9.398 11.066 11.324 1.00 0.00 H new ATOM 519 N TYR A 32 6.916 9.815 9.360 1.00 0.00 N ATOM 520 CA TYR A 32 6.500 8.427 9.195 1.00 0.00 C ATOM 521 C TYR A 32 5.620 8.267 7.961 1.00 0.00 C ATOM 522 O TYR A 32 5.214 9.252 7.344 1.00 0.00 O ATOM 523 CB TYR A 32 5.744 7.951 10.436 1.00 0.00 C ATOM 524 CG TYR A 32 6.646 7.467 11.548 1.00 0.00 C ATOM 525 CD1 TYR A 32 7.672 6.563 11.298 1.00 0.00 C ATOM 526 CD2 TYR A 32 6.465 7.910 12.852 1.00 0.00 C ATOM 527 CE1 TYR A 32 8.491 6.116 12.317 1.00 0.00 C ATOM 528 CE2 TYR A 32 7.281 7.469 13.875 1.00 0.00 C ATOM 529 CZ TYR A 32 8.293 6.571 13.603 1.00 0.00 C ATOM 530 OH TYR A 32 9.107 6.128 14.619 1.00 0.00 O ATOM 0 H TYR A 32 6.152 10.465 9.544 1.00 0.00 H new ATOM 0 HA TYR A 32 7.395 7.818 9.064 1.00 0.00 H new ATOM 0 HB2 TYR A 32 5.127 8.768 10.810 1.00 0.00 H new ATOM 0 HB3 TYR A 32 5.068 7.145 10.152 1.00 0.00 H new ATOM 0 HD1 TYR A 32 7.831 6.205 10.292 1.00 0.00 H new ATOM 0 HD2 TYR A 32 5.673 8.611 13.069 1.00 0.00 H new ATOM 0 HE1 TYR A 32 9.283 5.413 12.107 1.00 0.00 H new ATOM 0 HE2 TYR A 32 7.128 7.825 14.883 1.00 0.00 H new ATOM 0 HH TYR A 32 9.000 6.709 15.401 1.00 0.00 H new ATOM 540 N GLY A 33 5.329 7.020 7.604 1.00 0.00 N ATOM 541 CA GLY A 33 4.500 6.760 6.443 1.00 0.00 C ATOM 542 C GLY A 33 3.916 5.360 6.442 1.00 0.00 C ATOM 543 O GLY A 33 4.621 4.384 6.693 1.00 0.00 O ATOM 0 H GLY A 33 5.652 6.187 8.097 1.00 0.00 H new ATOM 0 HA2 GLY A 33 3.689 7.488 6.411 1.00 0.00 H new ATOM 0 HA3 GLY A 33 5.093 6.903 5.539 1.00 0.00 H new ATOM 547 N LEU A 34 2.623 5.265 6.151 1.00 0.00 N ATOM 548 CA LEU A 34 1.942 3.977 6.107 1.00 0.00 C ATOM 549 C LEU A 34 1.985 3.405 4.694 1.00 0.00 C ATOM 550 O LEU A 34 1.427 3.986 3.764 1.00 0.00 O ATOM 551 CB LEU A 34 0.488 4.130 6.565 1.00 0.00 C ATOM 552 CG LEU A 34 -0.210 2.841 7.010 1.00 0.00 C ATOM 553 CD1 LEU A 34 -0.731 2.077 5.804 1.00 0.00 C ATOM 554 CD2 LEU A 34 0.727 1.967 7.834 1.00 0.00 C ATOM 0 H LEU A 34 2.026 6.065 5.942 1.00 0.00 H new ATOM 0 HA LEU A 34 2.454 3.290 6.781 1.00 0.00 H new ATOM 0 HB2 LEU A 34 0.460 4.840 7.392 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -0.086 4.568 5.749 1.00 0.00 H new ATOM 0 HG LEU A 34 -1.056 3.114 7.641 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -1.224 1.164 6.137 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -1.444 2.697 5.261 1.00 0.00 H new ATOM 0 HD13 LEU A 34 0.101 1.821 5.148 1.00 0.00 H new ATOM 0 HD21 LEU A 34 0.205 1.059 8.137 1.00 0.00 H new ATOM 0 HD22 LEU A 34 1.599 1.703 7.235 1.00 0.00 H new ATOM 0 HD23 LEU A 34 1.048 2.513 8.721 1.00 0.00 H new ATOM 566 N VAL A 35 2.657 2.270 4.536 1.00 0.00 N ATOM 567 CA VAL A 35 2.775 1.637 3.229 1.00 0.00 C ATOM 568 C VAL A 35 1.879 0.413 3.115 1.00 0.00 C ATOM 569 O VAL A 35 1.720 -0.351 4.068 1.00 0.00 O ATOM 570 CB VAL A 35 4.228 1.214 2.929 1.00 0.00 C ATOM 571 CG1 VAL A 35 4.801 0.418 4.090 1.00 0.00 C ATOM 572 CG2 VAL A 35 4.301 0.407 1.638 1.00 0.00 C ATOM 0 H VAL A 35 3.126 1.772 5.293 1.00 0.00 H new ATOM 0 HA VAL A 35 2.460 2.384 2.501 1.00 0.00 H new ATOM 0 HB VAL A 35 4.826 2.116 2.800 1.00 0.00 H new ATOM 0 HG11 VAL A 35 5.826 0.128 3.861 1.00 0.00 H new ATOM 0 HG12 VAL A 35 4.790 1.030 4.992 1.00 0.00 H new ATOM 0 HG13 VAL A 35 4.198 -0.476 4.251 1.00 0.00 H new ATOM 0 HG21 VAL A 35 5.335 0.120 1.447 1.00 0.00 H new ATOM 0 HG22 VAL A 35 3.687 -0.489 1.734 1.00 0.00 H new ATOM 0 HG23 VAL A 35 3.933 1.012 0.809 1.00 0.00 H new ATOM 582 N ALA A 36 1.319 0.222 1.929 1.00 0.00 N ATOM 583 CA ALA A 36 0.464 -0.920 1.660 1.00 0.00 C ATOM 584 C ALA A 36 1.284 -2.037 1.028 1.00 0.00 C ATOM 585 O ALA A 36 1.712 -1.926 -0.120 1.00 0.00 O ATOM 586 CB ALA A 36 -0.688 -0.519 0.753 1.00 0.00 C ATOM 0 H ALA A 36 1.444 0.849 1.134 1.00 0.00 H new ATOM 0 HA ALA A 36 0.044 -1.280 2.599 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -1.319 -1.387 0.561 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -1.278 0.259 1.237 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -0.294 -0.142 -0.191 1.00 0.00 H new ATOM 592 N LEU A 37 1.512 -3.103 1.792 1.00 0.00 N ATOM 593 CA LEU A 37 2.297 -4.237 1.313 1.00 0.00 C ATOM 594 C LEU A 37 1.488 -5.129 0.371 1.00 0.00 C ATOM 595 O LEU A 37 1.996 -6.131 -0.132 1.00 0.00 O ATOM 596 CB LEU A 37 2.801 -5.066 2.497 1.00 0.00 C ATOM 597 CG LEU A 37 3.395 -4.254 3.649 1.00 0.00 C ATOM 598 CD1 LEU A 37 3.396 -5.071 4.932 1.00 0.00 C ATOM 599 CD2 LEU A 37 4.804 -3.796 3.304 1.00 0.00 C ATOM 0 H LEU A 37 1.164 -3.205 2.745 1.00 0.00 H new ATOM 0 HA LEU A 37 3.144 -3.837 0.756 1.00 0.00 H new ATOM 0 HB2 LEU A 37 1.974 -5.663 2.882 1.00 0.00 H new ATOM 0 HB3 LEU A 37 3.557 -5.764 2.137 1.00 0.00 H new ATOM 0 HG LEU A 37 2.775 -3.371 3.806 1.00 0.00 H new ATOM 0 HD11 LEU A 37 3.822 -4.478 5.741 1.00 0.00 H new ATOM 0 HD12 LEU A 37 2.374 -5.350 5.186 1.00 0.00 H new ATOM 0 HD13 LEU A 37 3.993 -5.972 4.789 1.00 0.00 H new ATOM 0 HD21 LEU A 37 5.213 -3.220 4.134 1.00 0.00 H new ATOM 0 HD22 LEU A 37 5.435 -4.666 3.121 1.00 0.00 H new ATOM 0 HD23 LEU A 37 4.776 -3.174 2.409 1.00 0.00 H new ATOM 611 N GLU A 38 0.231 -4.765 0.132 1.00 0.00 N ATOM 612 CA GLU A 38 -0.630 -5.543 -0.749 1.00 0.00 C ATOM 613 C GLU A 38 -1.546 -4.630 -1.558 1.00 0.00 C ATOM 614 O GLU A 38 -1.932 -3.555 -1.097 1.00 0.00 O ATOM 615 CB GLU A 38 -1.461 -6.536 0.066 1.00 0.00 C ATOM 616 CG GLU A 38 -1.059 -7.986 -0.149 1.00 0.00 C ATOM 617 CD GLU A 38 0.140 -8.387 0.690 1.00 0.00 C ATOM 618 OE1 GLU A 38 -0.007 -8.485 1.926 1.00 0.00 O ATOM 619 OE2 GLU A 38 1.224 -8.604 0.111 1.00 0.00 O ATOM 0 H GLU A 38 -0.211 -3.939 0.535 1.00 0.00 H new ATOM 0 HA GLU A 38 0.002 -6.096 -1.444 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -1.365 -6.294 1.125 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -2.513 -6.417 -0.194 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -1.902 -8.633 0.095 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -0.830 -8.144 -1.203 1.00 0.00 H new ATOM 626 N PRO A 39 -1.906 -5.045 -2.784 1.00 0.00 N ATOM 627 CA PRO A 39 -2.780 -4.258 -3.657 1.00 0.00 C ATOM 628 C PRO A 39 -4.230 -4.266 -3.190 1.00 0.00 C ATOM 629 O PRO A 39 -4.762 -5.307 -2.804 1.00 0.00 O ATOM 630 CB PRO A 39 -2.648 -4.959 -5.010 1.00 0.00 C ATOM 631 CG PRO A 39 -2.317 -6.371 -4.671 1.00 0.00 C ATOM 632 CD PRO A 39 -1.491 -6.314 -3.414 1.00 0.00 C ATOM 0 HA PRO A 39 -2.497 -3.205 -3.676 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -3.574 -4.895 -5.582 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -1.866 -4.504 -5.618 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -3.223 -6.958 -4.516 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -1.763 -6.847 -5.480 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -1.689 -7.167 -2.765 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -0.424 -6.322 -3.635 1.00 0.00 H new ATOM 640 N ALA A 40 -4.867 -3.100 -3.226 1.00 0.00 N ATOM 641 CA ALA A 40 -6.257 -2.978 -2.804 1.00 0.00 C ATOM 642 C ALA A 40 -6.871 -1.666 -3.282 1.00 0.00 C ATOM 643 O ALA A 40 -6.176 -0.795 -3.806 1.00 0.00 O ATOM 644 CB ALA A 40 -6.356 -3.088 -1.290 1.00 0.00 C ATOM 0 H ALA A 40 -4.443 -2.228 -3.543 1.00 0.00 H new ATOM 0 HA ALA A 40 -6.820 -3.793 -3.258 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -7.399 -2.995 -0.986 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -5.969 -4.055 -0.969 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -5.771 -2.292 -0.828 1.00 0.00 H new ATOM 650 N TRP A 41 -8.180 -1.533 -3.091 1.00 0.00 N ATOM 651 CA TRP A 41 -8.896 -0.328 -3.495 1.00 0.00 C ATOM 652 C TRP A 41 -9.314 0.482 -2.272 1.00 0.00 C ATOM 653 O TRP A 41 -10.243 0.108 -1.556 1.00 0.00 O ATOM 654 CB TRP A 41 -10.128 -0.696 -4.325 1.00 0.00 C ATOM 655 CG TRP A 41 -9.792 -1.299 -5.655 1.00 0.00 C ATOM 656 CD1 TRP A 41 -8.731 -0.981 -6.454 1.00 0.00 C ATOM 657 CD2 TRP A 41 -10.520 -2.322 -6.343 1.00 0.00 C ATOM 658 NE1 TRP A 41 -8.755 -1.745 -7.595 1.00 0.00 N ATOM 659 CE2 TRP A 41 -9.843 -2.575 -7.551 1.00 0.00 C ATOM 660 CE3 TRP A 41 -11.679 -3.049 -6.054 1.00 0.00 C ATOM 661 CZ2 TRP A 41 -10.288 -3.525 -8.468 1.00 0.00 C ATOM 662 CZ3 TRP A 41 -12.119 -3.990 -6.965 1.00 0.00 C ATOM 663 CH2 TRP A 41 -11.424 -4.222 -8.159 1.00 0.00 C ATOM 0 H TRP A 41 -8.767 -2.246 -2.658 1.00 0.00 H new ATOM 0 HA TRP A 41 -8.228 0.280 -4.104 1.00 0.00 H new ATOM 0 HB2 TRP A 41 -10.741 -1.399 -3.760 1.00 0.00 H new ATOM 0 HB3 TRP A 41 -10.731 0.198 -4.482 1.00 0.00 H new ATOM 0 HD1 TRP A 41 -7.983 -0.238 -6.222 1.00 0.00 H new ATOM 0 HE1 TRP A 41 -8.073 -1.701 -8.352 1.00 0.00 H new ATOM 0 HE3 TRP A 41 -12.220 -2.878 -5.135 1.00 0.00 H new ATOM 0 HZ2 TRP A 41 -9.755 -3.705 -9.390 1.00 0.00 H new ATOM 0 HZ3 TRP A 41 -13.014 -4.556 -6.753 1.00 0.00 H new ATOM 0 HH2 TRP A 41 -11.792 -4.966 -8.850 1.00 0.00 H new ATOM 674 N ILE A 42 -8.618 1.589 -2.034 1.00 0.00 N ATOM 675 CA ILE A 42 -8.915 2.445 -0.891 1.00 0.00 C ATOM 676 C ILE A 42 -10.053 3.412 -1.202 1.00 0.00 C ATOM 677 O ILE A 42 -9.942 4.252 -2.095 1.00 0.00 O ATOM 678 CB ILE A 42 -7.675 3.252 -0.457 1.00 0.00 C ATOM 679 CG1 ILE A 42 -6.443 2.347 -0.399 1.00 0.00 C ATOM 680 CG2 ILE A 42 -7.919 3.905 0.895 1.00 0.00 C ATOM 681 CD1 ILE A 42 -6.532 1.277 0.666 1.00 0.00 C ATOM 0 H ILE A 42 -7.846 1.914 -2.616 1.00 0.00 H new ATOM 0 HA ILE A 42 -9.217 1.787 -0.076 1.00 0.00 H new ATOM 0 HB ILE A 42 -7.493 4.035 -1.193 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -6.305 1.872 -1.370 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -5.560 2.959 -0.215 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -7.036 4.472 1.190 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -8.775 4.577 0.826 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -8.121 3.135 1.640 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -5.625 0.672 0.651 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -6.639 1.745 1.644 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -7.396 0.641 0.471 1.00 0.00 H new ATOM 693 N THR A 43 -11.147 3.285 -0.457 1.00 0.00 N ATOM 694 CA THR A 43 -12.310 4.144 -0.648 1.00 0.00 C ATOM 695 C THR A 43 -12.107 5.501 0.015 1.00 0.00 C ATOM 696 O THR A 43 -11.174 5.690 0.797 1.00 0.00 O ATOM 697 CB THR A 43 -13.562 3.476 -0.079 1.00 0.00 C ATOM 698 OG1 THR A 43 -13.232 2.657 1.028 1.00 0.00 O ATOM 699 CG2 THR A 43 -14.291 2.613 -1.085 1.00 0.00 C ATOM 0 H THR A 43 -11.252 2.594 0.286 1.00 0.00 H new ATOM 0 HA THR A 43 -12.438 4.299 -1.719 1.00 0.00 H new ATOM 0 HB THR A 43 -14.218 4.295 0.215 1.00 0.00 H new ATOM 0 HG1 THR A 43 -14.046 2.239 1.380 1.00 0.00 H new ATOM 0 HG21 THR A 43 -15.169 2.170 -0.615 1.00 0.00 H new ATOM 0 HG22 THR A 43 -14.602 3.225 -1.931 1.00 0.00 H new ATOM 0 HG23 THR A 43 -13.628 1.822 -1.434 1.00 0.00 H new ATOM 707 N ALA A 44 -12.993 6.441 -0.298 1.00 0.00 N ATOM 708 CA ALA A 44 -12.918 7.779 0.271 1.00 0.00 C ATOM 709 C ALA A 44 -12.958 7.720 1.793 1.00 0.00 C ATOM 710 O ALA A 44 -12.203 8.416 2.471 1.00 0.00 O ATOM 711 CB ALA A 44 -14.053 8.642 -0.259 1.00 0.00 C ATOM 0 H ALA A 44 -13.771 6.299 -0.943 1.00 0.00 H new ATOM 0 HA ALA A 44 -11.971 8.228 -0.028 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -13.985 9.640 0.175 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -13.980 8.712 -1.344 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -15.009 8.193 0.012 1.00 0.00 H new ATOM 717 N GLN A 45 -13.847 6.885 2.324 1.00 0.00 N ATOM 718 CA GLN A 45 -13.998 6.723 3.740 1.00 0.00 C ATOM 719 C GLN A 45 -12.697 6.294 4.404 1.00 0.00 C ATOM 720 O GLN A 45 -12.378 6.742 5.496 1.00 0.00 O ATOM 721 CB GLN A 45 -15.075 5.683 3.967 1.00 0.00 C ATOM 722 CG GLN A 45 -16.283 6.228 4.681 1.00 0.00 C ATOM 723 CD GLN A 45 -16.434 5.683 6.089 1.00 0.00 C ATOM 724 OE1 GLN A 45 -16.258 6.406 7.069 1.00 0.00 O ATOM 725 NE2 GLN A 45 -16.760 4.400 6.195 1.00 0.00 N ATOM 0 H GLN A 45 -14.478 6.306 1.770 1.00 0.00 H new ATOM 0 HA GLN A 45 -14.275 7.677 4.188 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -15.383 5.273 3.005 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -14.659 4.859 4.547 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -16.214 7.315 4.723 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -17.177 5.988 4.106 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -16.896 3.837 5.355 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -16.874 3.977 7.116 1.00 0.00 H new ATOM 734 N GLN A 46 -11.947 5.424 3.748 1.00 0.00 N ATOM 735 CA GLN A 46 -10.694 4.944 4.301 1.00 0.00 C ATOM 736 C GLN A 46 -9.737 6.104 4.561 1.00 0.00 C ATOM 737 O GLN A 46 -8.973 6.085 5.525 1.00 0.00 O ATOM 738 CB GLN A 46 -10.058 3.934 3.350 1.00 0.00 C ATOM 739 CG GLN A 46 -10.956 2.749 3.033 1.00 0.00 C ATOM 740 CD GLN A 46 -11.073 1.778 4.193 1.00 0.00 C ATOM 741 OE1 GLN A 46 -10.478 0.702 4.179 1.00 0.00 O ATOM 742 NE2 GLN A 46 -11.845 2.156 5.206 1.00 0.00 N ATOM 0 H GLN A 46 -12.184 5.037 2.834 1.00 0.00 H new ATOM 0 HA GLN A 46 -10.900 4.454 5.253 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -9.794 4.439 2.420 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -9.130 3.569 3.789 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -11.949 3.111 2.766 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -10.564 2.223 2.162 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -12.320 3.058 5.176 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -11.962 1.544 6.014 1.00 0.00 H new ATOM 751 N ILE A 47 -9.787 7.111 3.698 1.00 0.00 N ATOM 752 CA ILE A 47 -8.925 8.278 3.840 1.00 0.00 C ATOM 753 C ILE A 47 -9.350 9.149 5.021 1.00 0.00 C ATOM 754 O ILE A 47 -8.521 9.534 5.846 1.00 0.00 O ATOM 755 CB ILE A 47 -8.922 9.135 2.559 1.00 0.00 C ATOM 756 CG1 ILE A 47 -8.602 8.267 1.341 1.00 0.00 C ATOM 757 CG2 ILE A 47 -7.924 10.278 2.681 1.00 0.00 C ATOM 758 CD1 ILE A 47 -9.016 8.893 0.028 1.00 0.00 C ATOM 0 H ILE A 47 -10.414 7.143 2.894 1.00 0.00 H new ATOM 0 HA ILE A 47 -7.919 7.900 4.020 1.00 0.00 H new ATOM 0 HB ILE A 47 -9.915 9.564 2.427 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -7.530 8.068 1.318 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -9.102 7.305 1.449 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -7.937 10.871 1.767 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -8.195 10.909 3.527 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -6.924 9.873 2.837 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -8.759 8.222 -0.792 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -10.092 9.066 0.031 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -8.496 9.842 -0.103 1.00 0.00 H new ATOM 770 N GLU A 48 -10.639 9.466 5.092 1.00 0.00 N ATOM 771 CA GLU A 48 -11.164 10.303 6.169 1.00 0.00 C ATOM 772 C GLU A 48 -11.446 9.484 7.426 1.00 0.00 C ATOM 773 O GLU A 48 -11.071 9.876 8.531 1.00 0.00 O ATOM 774 CB GLU A 48 -12.442 11.010 5.713 1.00 0.00 C ATOM 775 CG GLU A 48 -12.663 12.357 6.381 1.00 0.00 C ATOM 776 CD GLU A 48 -13.306 13.369 5.453 1.00 0.00 C ATOM 777 OE1 GLU A 48 -14.366 13.052 4.873 1.00 0.00 O ATOM 778 OE2 GLU A 48 -12.750 14.478 5.307 1.00 0.00 O ATOM 0 H GLU A 48 -11.340 9.157 4.418 1.00 0.00 H new ATOM 0 HA GLU A 48 -10.405 11.046 6.412 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -12.404 11.151 4.633 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -13.297 10.366 5.920 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -13.294 12.223 7.260 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -11.707 12.746 6.731 1.00 0.00 H new ATOM 785 N ALA A 49 -12.111 8.347 7.250 1.00 0.00 N ATOM 786 CA ALA A 49 -12.450 7.471 8.369 1.00 0.00 C ATOM 787 C ALA A 49 -11.205 7.089 9.164 1.00 0.00 C ATOM 788 O ALA A 49 -11.194 7.163 10.392 1.00 0.00 O ATOM 789 CB ALA A 49 -13.166 6.219 7.871 1.00 0.00 C ATOM 0 H ALA A 49 -12.427 8.009 6.341 1.00 0.00 H new ATOM 0 HA ALA A 49 -13.121 8.018 9.031 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -13.411 5.578 8.718 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -14.083 6.505 7.356 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -12.517 5.678 7.183 1.00 0.00 H new ATOM 795 N ALA A 50 -10.156 6.686 8.455 1.00 0.00 N ATOM 796 CA ALA A 50 -8.906 6.299 9.095 1.00 0.00 C ATOM 797 C ALA A 50 -8.228 7.505 9.735 1.00 0.00 C ATOM 798 O ALA A 50 -7.613 7.395 10.796 1.00 0.00 O ATOM 799 CB ALA A 50 -7.976 5.640 8.087 1.00 0.00 C ATOM 0 H ALA A 50 -10.147 6.619 7.437 1.00 0.00 H new ATOM 0 HA ALA A 50 -9.134 5.580 9.882 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -7.046 5.357 8.581 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -8.455 4.751 7.677 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -7.759 6.340 7.280 1.00 0.00 H new ATOM 805 N ARG A 51 -8.348 8.659 9.084 1.00 0.00 N ATOM 806 CA ARG A 51 -7.749 9.887 9.593 1.00 0.00 C ATOM 807 C ARG A 51 -8.382 10.282 10.923 1.00 0.00 C ATOM 808 O ARG A 51 -7.687 10.677 11.858 1.00 0.00 O ATOM 809 CB ARG A 51 -7.911 11.019 8.573 1.00 0.00 C ATOM 810 CG ARG A 51 -6.592 11.516 8.003 1.00 0.00 C ATOM 811 CD ARG A 51 -6.293 12.943 8.439 1.00 0.00 C ATOM 812 NE ARG A 51 -7.026 13.924 7.641 1.00 0.00 N ATOM 813 CZ ARG A 51 -8.133 14.545 8.049 1.00 0.00 C ATOM 814 NH1 ARG A 51 -8.651 14.293 9.245 1.00 0.00 N ATOM 815 NH2 ARG A 51 -8.726 15.425 7.253 1.00 0.00 N ATOM 0 H ARG A 51 -8.854 8.768 8.205 1.00 0.00 H new ATOM 0 HA ARG A 51 -6.686 9.710 9.756 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -8.543 10.673 7.755 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -8.430 11.852 9.047 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -5.785 10.859 8.328 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -6.624 11.467 6.915 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -6.554 13.063 9.490 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -5.223 13.132 8.353 1.00 0.00 H new ATOM 0 HE ARG A 51 -6.668 14.148 6.713 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -8.202 13.618 9.863 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -9.498 14.775 9.546 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -8.335 15.625 6.332 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -9.573 15.902 7.562 1.00 0.00 H new ATOM 829 N VAL A 52 -9.705 10.169 11.001 1.00 0.00 N ATOM 830 CA VAL A 52 -10.430 10.512 12.219 1.00 0.00 C ATOM 831 C VAL A 52 -9.928 9.688 13.400 1.00 0.00 C ATOM 832 O VAL A 52 -9.729 10.211 14.496 1.00 0.00 O ATOM 833 CB VAL A 52 -11.946 10.286 12.052 1.00 0.00 C ATOM 834 CG1 VAL A 52 -12.697 10.738 13.296 1.00 0.00 C ATOM 835 CG2 VAL A 52 -12.461 11.010 10.816 1.00 0.00 C ATOM 0 H VAL A 52 -10.296 9.843 10.236 1.00 0.00 H new ATOM 0 HA VAL A 52 -10.250 11.569 12.413 1.00 0.00 H new ATOM 0 HB VAL A 52 -12.122 9.218 11.920 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -13.765 10.570 13.157 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -12.349 10.169 14.158 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -12.516 11.799 13.465 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -13.533 10.839 10.714 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -12.272 12.079 10.915 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -11.948 10.631 9.932 1.00 0.00 H new ATOM 845 N ALA A 53 -9.720 8.397 13.164 1.00 0.00 N ATOM 846 CA ALA A 53 -9.235 7.498 14.204 1.00 0.00 C ATOM 847 C ALA A 53 -7.815 7.865 14.621 1.00 0.00 C ATOM 848 O ALA A 53 -7.472 7.824 15.802 1.00 0.00 O ATOM 849 CB ALA A 53 -9.289 6.057 13.719 1.00 0.00 C ATOM 0 H ALA A 53 -9.880 7.950 12.261 1.00 0.00 H new ATOM 0 HA ALA A 53 -9.882 7.601 15.075 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -8.924 5.395 14.504 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -10.318 5.795 13.472 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -8.664 5.948 12.833 1.00 0.00 H new ATOM 855 N MET A 54 -6.994 8.219 13.639 1.00 0.00 N ATOM 856 CA MET A 54 -5.608 8.591 13.893 1.00 0.00 C ATOM 857 C MET A 54 -5.514 9.947 14.588 1.00 0.00 C ATOM 858 O MET A 54 -4.801 10.096 15.580 1.00 0.00 O ATOM 859 CB MET A 54 -4.825 8.622 12.580 1.00 0.00 C ATOM 860 CG MET A 54 -4.609 7.246 11.977 1.00 0.00 C ATOM 861 SD MET A 54 -3.399 7.254 10.643 1.00 0.00 S ATOM 862 CE MET A 54 -4.432 7.725 9.258 1.00 0.00 C ATOM 0 H MET A 54 -7.266 8.256 12.657 1.00 0.00 H new ATOM 0 HA MET A 54 -5.175 7.842 14.556 1.00 0.00 H new ATOM 0 HB2 MET A 54 -5.357 9.246 11.862 1.00 0.00 H new ATOM 0 HB3 MET A 54 -3.857 9.091 12.754 1.00 0.00 H new ATOM 0 HG2 MET A 54 -4.279 6.560 12.757 1.00 0.00 H new ATOM 0 HG3 MET A 54 -5.558 6.866 11.599 1.00 0.00 H new ATOM 0 HE1 MET A 54 -4.422 6.932 8.510 1.00 0.00 H new ATOM 0 HE2 MET A 54 -5.453 7.885 9.604 1.00 0.00 H new ATOM 0 HE3 MET A 54 -4.050 8.645 8.816 1.00 0.00 H new ATOM 872 N VAL A 55 -6.236 10.932 14.063 1.00 0.00 N ATOM 873 CA VAL A 55 -6.227 12.275 14.637 1.00 0.00 C ATOM 874 C VAL A 55 -6.638 12.246 16.105 1.00 0.00 C ATOM 875 O VAL A 55 -6.105 12.994 16.925 1.00 0.00 O ATOM 876 CB VAL A 55 -7.167 13.223 13.866 1.00 0.00 C ATOM 877 CG1 VAL A 55 -7.092 14.634 14.432 1.00 0.00 C ATOM 878 CG2 VAL A 55 -6.829 13.221 12.382 1.00 0.00 C ATOM 0 H VAL A 55 -6.834 10.827 13.243 1.00 0.00 H new ATOM 0 HA VAL A 55 -5.206 12.648 14.557 1.00 0.00 H new ATOM 0 HB VAL A 55 -8.189 12.863 13.986 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -7.763 15.286 13.873 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -7.388 14.621 15.481 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -6.071 15.006 14.348 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -7.503 13.896 11.854 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -5.800 13.553 12.243 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -6.941 12.212 11.985 1.00 0.00 H new ATOM 888 N ARG A 56 -7.588 11.376 16.431 1.00 0.00 N ATOM 889 CA ARG A 56 -8.068 11.248 17.800 1.00 0.00 C ATOM 890 C ARG A 56 -7.053 10.505 18.665 1.00 0.00 C ATOM 891 O ARG A 56 -6.969 10.732 19.873 1.00 0.00 O ATOM 892 CB ARG A 56 -9.411 10.515 17.822 1.00 0.00 C ATOM 893 CG ARG A 56 -10.605 11.426 17.589 1.00 0.00 C ATOM 894 CD ARG A 56 -11.879 10.628 17.362 1.00 0.00 C ATOM 895 NE ARG A 56 -12.458 10.153 18.617 1.00 0.00 N ATOM 896 CZ ARG A 56 -13.721 9.754 18.746 1.00 0.00 C ATOM 897 NH1 ARG A 56 -14.540 9.769 17.701 1.00 0.00 N ATOM 898 NH2 ARG A 56 -14.167 9.338 19.923 1.00 0.00 N ATOM 0 H ARG A 56 -8.040 10.750 15.765 1.00 0.00 H new ATOM 0 HA ARG A 56 -8.201 12.249 18.210 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -9.404 9.737 17.058 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -9.527 10.016 18.784 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -10.735 12.084 18.448 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -10.415 12.063 16.725 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -12.607 11.248 16.839 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -11.663 9.776 16.717 1.00 0.00 H new ATOM 0 HE ARG A 56 -11.859 10.126 19.442 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -14.202 10.088 16.793 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -15.507 9.462 17.806 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -13.542 9.324 20.729 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -15.135 9.032 20.022 1.00 0.00 H new ATOM 912 N HIS A 57 -6.288 9.615 18.041 1.00 0.00 N ATOM 913 CA HIS A 57 -5.282 8.836 18.755 1.00 0.00 C ATOM 914 C HIS A 57 -4.175 9.734 19.299 1.00 0.00 C ATOM 915 O HIS A 57 -3.871 9.704 20.492 1.00 0.00 O ATOM 916 CB HIS A 57 -4.683 7.771 17.833 1.00 0.00 C ATOM 917 CG HIS A 57 -4.118 6.595 18.567 1.00 0.00 C ATOM 918 ND1 HIS A 57 -4.720 6.041 19.677 1.00 0.00 N ATOM 919 CD2 HIS A 57 -2.998 5.867 18.346 1.00 0.00 C ATOM 920 CE1 HIS A 57 -3.995 5.023 20.106 1.00 0.00 C ATOM 921 NE2 HIS A 57 -2.945 4.896 19.315 1.00 0.00 N ATOM 0 H HIS A 57 -6.345 9.415 17.042 1.00 0.00 H new ATOM 0 HA HIS A 57 -5.772 8.347 19.597 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -5.453 7.424 17.144 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -3.897 8.225 17.230 1.00 0.00 H new ATOM 0 HD1 HIS A 57 -5.589 6.366 20.101 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -2.280 6.022 17.554 1.00 0.00 H new ATOM 0 HE1 HIS A 57 -4.222 4.400 20.959 1.00 0.00 H new ATOM 930 N PHE A 58 -3.571 10.530 18.420 1.00 0.00 N ATOM 931 CA PHE A 58 -2.495 11.432 18.819 1.00 0.00 C ATOM 932 C PHE A 58 -2.944 12.348 19.954 1.00 0.00 C ATOM 933 O PHE A 58 -3.503 13.419 19.717 1.00 0.00 O ATOM 934 CB PHE A 58 -2.031 12.272 17.628 1.00 0.00 C ATOM 935 CG PHE A 58 -1.851 11.482 16.363 1.00 0.00 C ATOM 936 CD1 PHE A 58 -0.895 10.482 16.281 1.00 0.00 C ATOM 937 CD2 PHE A 58 -2.640 11.743 15.253 1.00 0.00 C ATOM 938 CE1 PHE A 58 -0.730 9.756 15.118 1.00 0.00 C ATOM 939 CE2 PHE A 58 -2.478 11.020 14.086 1.00 0.00 C ATOM 940 CZ PHE A 58 -1.522 10.024 14.019 1.00 0.00 C ATOM 0 H PHE A 58 -3.808 10.568 17.429 1.00 0.00 H new ATOM 0 HA PHE A 58 -1.662 10.824 19.172 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -2.757 13.065 17.450 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -1.087 12.755 17.881 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -0.272 10.268 17.137 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -3.389 12.519 15.301 1.00 0.00 H new ATOM 0 HE1 PHE A 58 0.018 8.979 15.068 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -3.098 11.233 13.228 1.00 0.00 H new ATOM 0 HZ PHE A 58 -1.395 9.457 13.109 1.00 0.00 H new ATOM 950 N ARG A 59 -2.693 11.919 21.187 1.00 0.00 N ATOM 951 CA ARG A 59 -3.071 12.700 22.360 1.00 0.00 C ATOM 952 C ARG A 59 -2.283 14.005 22.426 1.00 0.00 C ATOM 953 O ARG A 59 -2.760 15.003 22.966 1.00 0.00 O ATOM 954 CB ARG A 59 -2.841 11.887 23.635 1.00 0.00 C ATOM 955 CG ARG A 59 -3.626 10.586 23.677 1.00 0.00 C ATOM 956 CD ARG A 59 -3.975 10.193 25.103 1.00 0.00 C ATOM 957 NE ARG A 59 -5.218 9.429 25.170 1.00 0.00 N ATOM 958 CZ ARG A 59 -5.353 8.189 24.707 1.00 0.00 C ATOM 959 NH1 ARG A 59 -4.323 7.569 24.142 1.00 0.00 N ATOM 960 NH2 ARG A 59 -6.519 7.566 24.808 1.00 0.00 N ATOM 0 H ARG A 59 -2.230 11.035 21.400 1.00 0.00 H new ATOM 0 HA ARG A 59 -4.130 12.942 22.277 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -1.778 11.663 23.727 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -3.114 12.495 24.498 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -4.540 10.692 23.093 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -3.042 9.792 23.212 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -3.163 9.602 25.526 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -4.067 11.091 25.714 1.00 0.00 H new ATOM 0 HE ARG A 59 -6.031 9.873 25.597 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -3.424 8.044 24.062 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -4.431 6.618 23.789 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -7.313 8.037 25.241 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -6.622 6.615 24.453 1.00 0.00 H new ATOM 974 N ARG A 60 -1.073 13.991 21.875 1.00 0.00 N ATOM 975 CA ARG A 60 -0.221 15.174 21.873 1.00 0.00 C ATOM 976 C ARG A 60 -0.328 15.924 20.549 1.00 0.00 C ATOM 977 O ARG A 60 0.640 16.523 20.083 1.00 0.00 O ATOM 978 CB ARG A 60 1.235 14.780 22.132 1.00 0.00 C ATOM 979 CG ARG A 60 1.433 13.997 23.420 1.00 0.00 C ATOM 980 CD ARG A 60 2.785 14.293 24.049 1.00 0.00 C ATOM 981 NE ARG A 60 2.804 15.591 24.722 1.00 0.00 N ATOM 982 CZ ARG A 60 3.711 15.942 25.630 1.00 0.00 C ATOM 983 NH1 ARG A 60 4.673 15.096 25.978 1.00 0.00 N ATOM 984 NH2 ARG A 60 3.655 17.140 26.195 1.00 0.00 N ATOM 0 H ARG A 60 -0.661 13.174 21.425 1.00 0.00 H new ATOM 0 HA ARG A 60 -0.561 15.834 22.671 1.00 0.00 H new ATOM 0 HB2 ARG A 60 1.596 14.183 21.294 1.00 0.00 H new ATOM 0 HB3 ARG A 60 1.846 15.682 22.167 1.00 0.00 H new ATOM 0 HG2 ARG A 60 0.640 14.247 24.125 1.00 0.00 H new ATOM 0 HG3 ARG A 60 1.352 12.930 23.214 1.00 0.00 H new ATOM 0 HD2 ARG A 60 3.031 13.509 24.766 1.00 0.00 H new ATOM 0 HD3 ARG A 60 3.556 14.273 23.278 1.00 0.00 H new ATOM 0 HE ARG A 60 2.079 16.267 24.481 1.00 0.00 H new ATOM 0 HH11 ARG A 60 4.719 14.172 25.549 1.00 0.00 H new ATOM 0 HH12 ARG A 60 5.366 15.370 26.675 1.00 0.00 H new ATOM 0 HH21 ARG A 60 2.916 17.793 25.934 1.00 0.00 H new ATOM 0 HH22 ARG A 60 4.351 17.409 26.891 1.00 0.00 H new ATOM 998 N GLY A 61 -1.512 15.885 19.946 1.00 0.00 N ATOM 999 CA GLY A 61 -1.723 16.564 18.682 1.00 0.00 C ATOM 1000 C GLY A 61 -0.918 15.950 17.553 1.00 0.00 C ATOM 1001 O GLY A 61 0.000 15.166 17.792 1.00 0.00 O ATOM 0 H GLY A 61 -2.329 15.395 20.311 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -2.783 16.532 18.428 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -1.452 17.615 18.788 1.00 0.00 H new ATOM 1005 N GLY A 62 -1.264 16.305 16.321 1.00 0.00 N ATOM 1006 CA GLY A 62 -0.558 15.774 15.170 1.00 0.00 C ATOM 1007 C GLY A 62 -1.320 15.981 13.876 1.00 0.00 C ATOM 1008 O GLY A 62 -2.494 16.350 13.890 1.00 0.00 O ATOM 0 H GLY A 62 -2.021 16.951 16.099 1.00 0.00 H new ATOM 0 HA2 GLY A 62 0.418 16.253 15.094 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -0.380 14.709 15.317 1.00 0.00 H new ATOM 1012 N LYS A 63 -0.648 15.745 12.753 1.00 0.00 N ATOM 1013 CA LYS A 63 -1.268 15.908 11.444 1.00 0.00 C ATOM 1014 C LYS A 63 -0.865 14.773 10.507 1.00 0.00 C ATOM 1015 O LYS A 63 0.275 14.305 10.537 1.00 0.00 O ATOM 1016 CB LYS A 63 -0.874 17.254 10.834 1.00 0.00 C ATOM 1017 CG LYS A 63 0.628 17.479 10.773 1.00 0.00 C ATOM 1018 CD LYS A 63 0.974 18.957 10.840 1.00 0.00 C ATOM 1019 CE LYS A 63 2.477 19.176 10.884 1.00 0.00 C ATOM 1020 NZ LYS A 63 3.055 18.804 12.204 1.00 0.00 N ATOM 0 H LYS A 63 0.325 15.441 12.724 1.00 0.00 H new ATOM 0 HA LYS A 63 -2.350 15.880 11.575 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -1.284 17.320 9.826 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -1.329 18.055 11.417 1.00 0.00 H new ATOM 0 HG2 LYS A 63 1.109 16.954 11.598 1.00 0.00 H new ATOM 0 HG3 LYS A 63 1.023 17.053 9.851 1.00 0.00 H new ATOM 0 HD2 LYS A 63 0.556 19.469 9.973 1.00 0.00 H new ATOM 0 HD3 LYS A 63 0.515 19.399 11.724 1.00 0.00 H new ATOM 0 HE2 LYS A 63 2.953 18.586 10.100 1.00 0.00 H new ATOM 0 HE3 LYS A 63 2.697 20.222 10.673 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 4.062 19.063 12.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 2.550 19.310 12.959 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 2.958 17.779 12.349 1.00 0.00 H new ATOM 1034 N ILE A 64 -1.805 14.334 9.677 1.00 0.00 N ATOM 1035 CA ILE A 64 -1.546 13.253 8.732 1.00 0.00 C ATOM 1036 C ILE A 64 -1.619 13.749 7.293 1.00 0.00 C ATOM 1037 O ILE A 64 -2.550 14.461 6.917 1.00 0.00 O ATOM 1038 CB ILE A 64 -2.543 12.088 8.901 1.00 0.00 C ATOM 1039 CG1 ILE A 64 -2.941 11.919 10.369 1.00 0.00 C ATOM 1040 CG2 ILE A 64 -1.941 10.799 8.361 1.00 0.00 C ATOM 1041 CD1 ILE A 64 -3.909 10.780 10.602 1.00 0.00 C ATOM 0 H ILE A 64 -2.753 14.710 9.639 1.00 0.00 H new ATOM 0 HA ILE A 64 -0.540 12.894 8.948 1.00 0.00 H new ATOM 0 HB ILE A 64 -3.443 12.321 8.332 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -2.043 11.751 10.964 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -3.390 12.846 10.725 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -2.654 9.984 8.486 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -1.711 10.920 7.303 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -1.026 10.568 8.907 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -4.148 10.717 11.664 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -4.822 10.957 10.034 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -3.455 9.844 10.277 1.00 0.00 H new ATOM 1053 N PHE A 65 -0.635 13.359 6.491 1.00 0.00 N ATOM 1054 CA PHE A 65 -0.591 13.754 5.089 1.00 0.00 C ATOM 1055 C PHE A 65 -0.934 12.570 4.192 1.00 0.00 C ATOM 1056 O PHE A 65 -0.153 11.626 4.070 1.00 0.00 O ATOM 1057 CB PHE A 65 0.792 14.299 4.732 1.00 0.00 C ATOM 1058 CG PHE A 65 1.271 15.376 5.665 1.00 0.00 C ATOM 1059 CD1 PHE A 65 0.898 16.696 5.470 1.00 0.00 C ATOM 1060 CD2 PHE A 65 2.093 15.066 6.736 1.00 0.00 C ATOM 1061 CE1 PHE A 65 1.337 17.688 6.326 1.00 0.00 C ATOM 1062 CE2 PHE A 65 2.535 16.054 7.596 1.00 0.00 C ATOM 1063 CZ PHE A 65 2.157 17.366 7.390 1.00 0.00 C ATOM 0 H PHE A 65 0.143 12.770 6.788 1.00 0.00 H new ATOM 0 HA PHE A 65 -1.329 14.540 4.930 1.00 0.00 H new ATOM 0 HB2 PHE A 65 1.510 13.479 4.738 1.00 0.00 H new ATOM 0 HB3 PHE A 65 0.767 14.694 3.716 1.00 0.00 H new ATOM 0 HD1 PHE A 65 0.257 16.953 4.640 1.00 0.00 H new ATOM 0 HD2 PHE A 65 2.392 14.041 6.901 1.00 0.00 H new ATOM 0 HE1 PHE A 65 1.039 18.713 6.163 1.00 0.00 H new ATOM 0 HE2 PHE A 65 3.175 15.800 8.428 1.00 0.00 H new ATOM 0 HZ PHE A 65 2.502 18.140 8.060 1.00 0.00 H new ATOM 1073 N ILE A 66 -2.108 12.622 3.573 1.00 0.00 N ATOM 1074 CA ILE A 66 -2.553 11.549 2.694 1.00 0.00 C ATOM 1075 C ILE A 66 -2.061 11.767 1.268 1.00 0.00 C ATOM 1076 O ILE A 66 -2.118 12.879 0.744 1.00 0.00 O ATOM 1077 CB ILE A 66 -4.091 11.420 2.677 1.00 0.00 C ATOM 1078 CG1 ILE A 66 -4.690 11.812 4.033 1.00 0.00 C ATOM 1079 CG2 ILE A 66 -4.496 10.002 2.305 1.00 0.00 C ATOM 1080 CD1 ILE A 66 -4.081 11.073 5.207 1.00 0.00 C ATOM 0 H ILE A 66 -2.767 13.395 3.664 1.00 0.00 H new ATOM 0 HA ILE A 66 -2.127 10.628 3.091 1.00 0.00 H new ATOM 0 HB ILE A 66 -4.483 12.105 1.925 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -4.558 12.884 4.182 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -5.763 11.623 4.014 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -5.583 9.924 2.297 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -4.107 9.760 1.316 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -4.088 9.304 3.036 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -4.556 11.404 6.131 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -4.236 10.001 5.083 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -3.012 11.282 5.253 1.00 0.00 H new ATOM 1092 N ARG A 67 -1.576 10.697 0.645 1.00 0.00 N ATOM 1093 CA ARG A 67 -1.072 10.770 -0.721 1.00 0.00 C ATOM 1094 C ARG A 67 -2.033 10.096 -1.695 1.00 0.00 C ATOM 1095 O ARG A 67 -2.081 10.444 -2.875 1.00 0.00 O ATOM 1096 CB ARG A 67 0.307 10.114 -0.811 1.00 0.00 C ATOM 1097 CG ARG A 67 1.002 10.341 -2.144 1.00 0.00 C ATOM 1098 CD ARG A 67 1.459 11.783 -2.297 1.00 0.00 C ATOM 1099 NE ARG A 67 1.596 12.167 -3.699 1.00 0.00 N ATOM 1100 CZ ARG A 67 1.875 13.405 -4.105 1.00 0.00 C ATOM 1101 NH1 ARG A 67 2.046 14.379 -3.220 1.00 0.00 N ATOM 1102 NH2 ARG A 67 1.983 13.668 -5.400 1.00 0.00 N ATOM 0 H ARG A 67 -1.522 9.769 1.065 1.00 0.00 H new ATOM 0 HA ARG A 67 -0.987 11.822 -0.995 1.00 0.00 H new ATOM 0 HB2 ARG A 67 0.938 10.502 -0.011 1.00 0.00 H new ATOM 0 HB3 ARG A 67 0.202 9.042 -0.643 1.00 0.00 H new ATOM 0 HG2 ARG A 67 1.861 9.676 -2.225 1.00 0.00 H new ATOM 0 HG3 ARG A 67 0.323 10.085 -2.957 1.00 0.00 H new ATOM 0 HD2 ARG A 67 0.743 12.444 -1.808 1.00 0.00 H new ATOM 0 HD3 ARG A 67 2.414 11.916 -1.789 1.00 0.00 H new ATOM 0 HE ARG A 67 1.471 11.445 -4.409 1.00 0.00 H new ATOM 0 HH11 ARG A 67 1.964 14.182 -2.223 1.00 0.00 H new ATOM 0 HH12 ARG A 67 2.259 15.325 -3.537 1.00 0.00 H new ATOM 0 HH21 ARG A 67 1.853 12.923 -6.084 1.00 0.00 H new ATOM 0 HH22 ARG A 67 2.197 14.615 -5.712 1.00 0.00 H new ATOM 1116 N ILE A 68 -2.797 9.130 -1.197 1.00 0.00 N ATOM 1117 CA ILE A 68 -3.755 8.409 -2.025 1.00 0.00 C ATOM 1118 C ILE A 68 -4.962 9.281 -2.354 1.00 0.00 C ATOM 1119 O ILE A 68 -5.240 10.261 -1.663 1.00 0.00 O ATOM 1120 CB ILE A 68 -4.240 7.120 -1.336 1.00 0.00 C ATOM 1121 CG1 ILE A 68 -4.956 7.452 -0.024 1.00 0.00 C ATOM 1122 CG2 ILE A 68 -3.068 6.183 -1.084 1.00 0.00 C ATOM 1123 CD1 ILE A 68 -5.430 6.232 0.732 1.00 0.00 C ATOM 0 H ILE A 68 -2.771 8.828 -0.223 1.00 0.00 H new ATOM 0 HA ILE A 68 -3.237 8.144 -2.947 1.00 0.00 H new ATOM 0 HB ILE A 68 -4.948 6.618 -1.995 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -4.282 8.025 0.613 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -5.812 8.091 -0.239 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -3.426 5.276 -0.597 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -2.599 5.924 -2.033 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -2.339 6.677 -0.442 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -5.928 6.544 1.650 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -6.129 5.669 0.113 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -4.575 5.602 0.978 1.00 0.00 H new ATOM 1135 N PHE A 69 -5.679 8.916 -3.412 1.00 0.00 N ATOM 1136 CA PHE A 69 -6.858 9.664 -3.830 1.00 0.00 C ATOM 1137 C PHE A 69 -7.847 8.756 -4.561 1.00 0.00 C ATOM 1138 O PHE A 69 -7.449 7.927 -5.381 1.00 0.00 O ATOM 1139 CB PHE A 69 -6.454 10.832 -4.731 1.00 0.00 C ATOM 1140 CG PHE A 69 -7.124 12.128 -4.372 1.00 0.00 C ATOM 1141 CD1 PHE A 69 -6.598 12.944 -3.384 1.00 0.00 C ATOM 1142 CD2 PHE A 69 -8.281 12.529 -5.022 1.00 0.00 C ATOM 1143 CE1 PHE A 69 -7.213 14.137 -3.051 1.00 0.00 C ATOM 1144 CE2 PHE A 69 -8.900 13.719 -4.693 1.00 0.00 C ATOM 1145 CZ PHE A 69 -8.365 14.525 -3.706 1.00 0.00 C ATOM 0 H PHE A 69 -5.464 8.107 -3.995 1.00 0.00 H new ATOM 0 HA PHE A 69 -7.345 10.057 -2.938 1.00 0.00 H new ATOM 0 HB2 PHE A 69 -5.373 10.964 -4.678 1.00 0.00 H new ATOM 0 HB3 PHE A 69 -6.694 10.583 -5.765 1.00 0.00 H new ATOM 0 HD1 PHE A 69 -5.698 12.645 -2.868 1.00 0.00 H new ATOM 0 HD2 PHE A 69 -8.703 11.904 -5.795 1.00 0.00 H new ATOM 0 HE1 PHE A 69 -6.793 14.765 -2.279 1.00 0.00 H new ATOM 0 HE2 PHE A 69 -9.801 14.019 -5.207 1.00 0.00 H new ATOM 0 HZ PHE A 69 -8.847 15.456 -3.448 1.00 0.00 H new ATOM 1155 N PRO A 70 -9.152 8.897 -4.273 1.00 0.00 N ATOM 1156 CA PRO A 70 -10.191 8.084 -4.905 1.00 0.00 C ATOM 1157 C PRO A 70 -10.544 8.581 -6.304 1.00 0.00 C ATOM 1158 O PRO A 70 -11.219 9.598 -6.459 1.00 0.00 O ATOM 1159 CB PRO A 70 -11.378 8.252 -3.962 1.00 0.00 C ATOM 1160 CG PRO A 70 -11.206 9.616 -3.387 1.00 0.00 C ATOM 1161 CD PRO A 70 -9.720 9.858 -3.306 1.00 0.00 C ATOM 0 HA PRO A 70 -9.879 7.049 -5.044 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -12.325 8.162 -4.495 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -11.377 7.490 -3.183 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -11.688 10.366 -4.014 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -11.665 9.683 -2.401 1.00 0.00 H new ATOM 0 HD2 PRO A 70 -9.467 10.885 -3.568 1.00 0.00 H new ATOM 0 HD3 PRO A 70 -9.341 9.683 -2.299 1.00 0.00 H new ATOM 1539 N VAL A 94 -12.558 4.652 -5.442 1.00 0.00 N ATOM 1540 CA VAL A 94 -11.455 4.086 -4.673 1.00 0.00 C ATOM 1541 C VAL A 94 -10.109 4.454 -5.286 1.00 0.00 C ATOM 1542 O VAL A 94 -10.044 5.055 -6.358 1.00 0.00 O ATOM 1543 CB VAL A 94 -11.552 2.550 -4.582 1.00 0.00 C ATOM 1544 CG1 VAL A 94 -12.494 2.137 -3.463 1.00 0.00 C ATOM 1545 CG2 VAL A 94 -11.996 1.959 -5.911 1.00 0.00 C ATOM 0 HA VAL A 94 -11.529 4.508 -3.671 1.00 0.00 H new ATOM 0 HB VAL A 94 -10.561 2.158 -4.352 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -12.548 1.049 -3.416 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -12.123 2.523 -2.514 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -13.488 2.542 -3.656 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -12.058 0.874 -5.824 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -12.975 2.358 -6.178 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -11.274 2.221 -6.685 1.00 0.00 H new ATOM 1555 N ALA A 95 -9.034 4.082 -4.598 1.00 0.00 N ATOM 1556 CA ALA A 95 -7.685 4.364 -5.070 1.00 0.00 C ATOM 1557 C ALA A 95 -6.858 3.085 -5.136 1.00 0.00 C ATOM 1558 O ALA A 95 -6.511 2.506 -4.108 1.00 0.00 O ATOM 1559 CB ALA A 95 -7.012 5.387 -4.167 1.00 0.00 C ATOM 0 H ALA A 95 -9.073 3.583 -3.709 1.00 0.00 H new ATOM 0 HA ALA A 95 -7.753 4.778 -6.076 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -6.005 5.588 -4.532 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -7.590 6.311 -4.170 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -6.958 4.996 -3.151 1.00 0.00 H new ATOM 1565 N VAL A 96 -6.550 2.645 -6.353 1.00 0.00 N ATOM 1566 CA VAL A 96 -5.769 1.428 -6.550 1.00 0.00 C ATOM 1567 C VAL A 96 -4.351 1.588 -6.014 1.00 0.00 C ATOM 1568 O VAL A 96 -3.656 2.552 -6.338 1.00 0.00 O ATOM 1569 CB VAL A 96 -5.703 1.030 -8.037 1.00 0.00 C ATOM 1570 CG1 VAL A 96 -5.219 -0.404 -8.182 1.00 0.00 C ATOM 1571 CG2 VAL A 96 -7.059 1.210 -8.701 1.00 0.00 C ATOM 0 H VAL A 96 -6.829 3.112 -7.216 1.00 0.00 H new ATOM 0 HA VAL A 96 -6.277 0.639 -5.995 1.00 0.00 H new ATOM 0 HB VAL A 96 -4.990 1.685 -8.538 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -5.178 -0.669 -9.238 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -4.225 -0.498 -7.745 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -5.907 -1.074 -7.666 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -6.991 0.924 -9.751 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -7.796 0.582 -8.200 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -7.364 2.254 -8.629 1.00 0.00 H new ATOM 1581 N VAL A 97 -3.930 0.635 -5.189 1.00 0.00 N ATOM 1582 CA VAL A 97 -2.596 0.664 -4.601 1.00 0.00 C ATOM 1583 C VAL A 97 -1.850 -0.642 -4.857 1.00 0.00 C ATOM 1584 O VAL A 97 -2.459 -1.665 -5.165 1.00 0.00 O ATOM 1585 CB VAL A 97 -2.662 0.905 -3.080 1.00 0.00 C ATOM 1586 CG1 VAL A 97 -1.273 1.154 -2.516 1.00 0.00 C ATOM 1587 CG2 VAL A 97 -3.591 2.065 -2.760 1.00 0.00 C ATOM 0 H VAL A 97 -4.495 -0.168 -4.912 1.00 0.00 H new ATOM 0 HA VAL A 97 -2.061 1.486 -5.076 1.00 0.00 H new ATOM 0 HB VAL A 97 -3.064 0.008 -2.609 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -1.341 1.322 -1.441 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -0.641 0.287 -2.708 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -0.839 2.032 -2.993 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -3.623 2.218 -1.681 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -3.224 2.970 -3.244 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -4.593 1.840 -3.125 1.00 0.00 H new ATOM 1597 N LYS A 98 -0.528 -0.598 -4.719 1.00 0.00 N ATOM 1598 CA LYS A 98 0.306 -1.778 -4.922 1.00 0.00 C ATOM 1599 C LYS A 98 1.276 -1.954 -3.754 1.00 0.00 C ATOM 1600 O LYS A 98 1.571 -1.000 -3.036 1.00 0.00 O ATOM 1601 CB LYS A 98 1.083 -1.666 -6.237 1.00 0.00 C ATOM 1602 CG LYS A 98 1.814 -0.343 -6.402 1.00 0.00 C ATOM 1603 CD LYS A 98 1.518 0.295 -7.751 1.00 0.00 C ATOM 1604 CE LYS A 98 0.506 1.422 -7.625 1.00 0.00 C ATOM 1605 NZ LYS A 98 0.743 2.498 -8.627 1.00 0.00 N ATOM 0 H LYS A 98 -0.011 0.244 -4.467 1.00 0.00 H new ATOM 0 HA LYS A 98 -0.344 -2.652 -4.973 1.00 0.00 H new ATOM 0 HB2 LYS A 98 1.806 -2.480 -6.293 1.00 0.00 H new ATOM 0 HB3 LYS A 98 0.392 -1.796 -7.070 1.00 0.00 H new ATOM 0 HG2 LYS A 98 1.519 0.338 -5.604 1.00 0.00 H new ATOM 0 HG3 LYS A 98 2.887 -0.505 -6.303 1.00 0.00 H new ATOM 0 HD2 LYS A 98 2.442 0.681 -8.183 1.00 0.00 H new ATOM 0 HD3 LYS A 98 1.137 -0.462 -8.437 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -0.500 1.022 -7.753 1.00 0.00 H new ATOM 0 HE3 LYS A 98 0.556 1.844 -6.621 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 0.032 3.247 -8.507 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 1.693 2.898 -8.489 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 0.670 2.102 -9.586 1.00 0.00 H new ATOM 1619 N PRO A 99 1.788 -3.180 -3.545 1.00 0.00 N ATOM 1620 CA PRO A 99 2.730 -3.466 -2.456 1.00 0.00 C ATOM 1621 C PRO A 99 3.903 -2.495 -2.438 1.00 0.00 C ATOM 1622 O PRO A 99 4.710 -2.462 -3.367 1.00 0.00 O ATOM 1623 CB PRO A 99 3.210 -4.885 -2.765 1.00 0.00 C ATOM 1624 CG PRO A 99 2.104 -5.496 -3.552 1.00 0.00 C ATOM 1625 CD PRO A 99 1.495 -4.378 -4.353 1.00 0.00 C ATOM 0 HA PRO A 99 2.265 -3.366 -1.475 1.00 0.00 H new ATOM 0 HB2 PRO A 99 4.140 -4.873 -3.333 1.00 0.00 H new ATOM 0 HB3 PRO A 99 3.402 -5.446 -1.850 1.00 0.00 H new ATOM 0 HG2 PRO A 99 2.479 -6.284 -4.205 1.00 0.00 H new ATOM 0 HG3 PRO A 99 1.364 -5.953 -2.895 1.00 0.00 H new ATOM 0 HD2 PRO A 99 1.936 -4.310 -5.347 1.00 0.00 H new ATOM 0 HD3 PRO A 99 0.423 -4.519 -4.489 1.00 0.00 H new ATOM 1633 N GLY A 100 3.988 -1.705 -1.375 1.00 0.00 N ATOM 1634 CA GLY A 100 5.060 -0.740 -1.253 1.00 0.00 C ATOM 1635 C GLY A 100 4.616 0.663 -1.612 1.00 0.00 C ATOM 1636 O GLY A 100 5.372 1.426 -2.213 1.00 0.00 O ATOM 0 H GLY A 100 3.331 -1.717 -0.594 1.00 0.00 H new ATOM 0 HA2 GLY A 100 5.438 -0.748 -0.231 1.00 0.00 H new ATOM 0 HA3 GLY A 100 5.886 -1.034 -1.901 1.00 0.00 H new ATOM 1640 N ARG A 101 3.383 1.003 -1.248 1.00 0.00 N ATOM 1641 CA ARG A 101 2.842 2.327 -1.544 1.00 0.00 C ATOM 1642 C ARG A 101 2.491 3.087 -0.268 1.00 0.00 C ATOM 1643 O ARG A 101 1.607 2.678 0.484 1.00 0.00 O ATOM 1644 CB ARG A 101 1.598 2.209 -2.425 1.00 0.00 C ATOM 1645 CG ARG A 101 1.588 3.176 -3.597 1.00 0.00 C ATOM 1646 CD ARG A 101 2.702 2.865 -4.581 1.00 0.00 C ATOM 1647 NE ARG A 101 2.822 3.890 -5.617 1.00 0.00 N ATOM 1648 CZ ARG A 101 3.435 5.057 -5.437 1.00 0.00 C ATOM 1649 NH1 ARG A 101 3.981 5.355 -4.265 1.00 0.00 N ATOM 1650 NH2 ARG A 101 3.502 5.931 -6.433 1.00 0.00 N ATOM 0 H ARG A 101 2.742 0.385 -0.750 1.00 0.00 H new ATOM 0 HA ARG A 101 3.614 2.884 -2.075 1.00 0.00 H new ATOM 0 HB2 ARG A 101 1.528 1.190 -2.805 1.00 0.00 H new ATOM 0 HB3 ARG A 101 0.712 2.383 -1.814 1.00 0.00 H new ATOM 0 HG2 ARG A 101 0.626 3.123 -4.106 1.00 0.00 H new ATOM 0 HG3 ARG A 101 1.699 4.196 -3.230 1.00 0.00 H new ATOM 0 HD2 ARG A 101 3.647 2.781 -4.044 1.00 0.00 H new ATOM 0 HD3 ARG A 101 2.513 1.898 -5.048 1.00 0.00 H new ATOM 0 HE ARG A 101 2.412 3.699 -6.531 1.00 0.00 H new ATOM 0 HH11 ARG A 101 3.932 4.688 -3.495 1.00 0.00 H new ATOM 0 HH12 ARG A 101 4.449 6.252 -4.134 1.00 0.00 H new ATOM 0 HH21 ARG A 101 3.084 5.708 -7.336 1.00 0.00 H new ATOM 0 HH22 ARG A 101 3.972 6.826 -6.296 1.00 0.00 H new ATOM 1664 N VAL A 102 3.174 4.205 -0.041 1.00 0.00 N ATOM 1665 CA VAL A 102 2.916 5.031 1.133 1.00 0.00 C ATOM 1666 C VAL A 102 1.579 5.753 0.984 1.00 0.00 C ATOM 1667 O VAL A 102 1.466 6.714 0.225 1.00 0.00 O ATOM 1668 CB VAL A 102 4.034 6.072 1.353 1.00 0.00 C ATOM 1669 CG1 VAL A 102 3.929 6.682 2.742 1.00 0.00 C ATOM 1670 CG2 VAL A 102 5.406 5.443 1.142 1.00 0.00 C ATOM 0 H VAL A 102 3.909 4.559 -0.653 1.00 0.00 H new ATOM 0 HA VAL A 102 2.887 4.369 1.999 1.00 0.00 H new ATOM 0 HB VAL A 102 3.910 6.868 0.619 1.00 0.00 H new ATOM 0 HG11 VAL A 102 4.725 7.414 2.879 1.00 0.00 H new ATOM 0 HG12 VAL A 102 2.962 7.173 2.852 1.00 0.00 H new ATOM 0 HG13 VAL A 102 4.024 5.897 3.492 1.00 0.00 H new ATOM 0 HG21 VAL A 102 6.179 6.194 1.302 1.00 0.00 H new ATOM 0 HG22 VAL A 102 5.544 4.625 1.849 1.00 0.00 H new ATOM 0 HG23 VAL A 102 5.478 5.060 0.124 1.00 0.00 H new ATOM 1680 N MET A 103 0.564 5.270 1.695 1.00 0.00 N ATOM 1681 CA MET A 103 -0.769 5.858 1.621 1.00 0.00 C ATOM 1682 C MET A 103 -0.966 6.955 2.663 1.00 0.00 C ATOM 1683 O MET A 103 -1.645 7.949 2.408 1.00 0.00 O ATOM 1684 CB MET A 103 -1.831 4.772 1.809 1.00 0.00 C ATOM 1685 CG MET A 103 -1.597 3.538 0.953 1.00 0.00 C ATOM 1686 SD MET A 103 -2.691 2.172 1.387 1.00 0.00 S ATOM 1687 CE MET A 103 -2.000 1.669 2.962 1.00 0.00 C ATOM 0 H MET A 103 0.639 4.474 2.328 1.00 0.00 H new ATOM 0 HA MET A 103 -0.873 6.311 0.635 1.00 0.00 H new ATOM 0 HB2 MET A 103 -1.855 4.477 2.858 1.00 0.00 H new ATOM 0 HB3 MET A 103 -2.810 5.188 1.572 1.00 0.00 H new ATOM 0 HG2 MET A 103 -1.743 3.796 -0.096 1.00 0.00 H new ATOM 0 HG3 MET A 103 -0.561 3.217 1.061 1.00 0.00 H new ATOM 0 HE1 MET A 103 -2.019 0.582 3.037 1.00 0.00 H new ATOM 0 HE2 MET A 103 -0.971 2.020 3.037 1.00 0.00 H new ATOM 0 HE3 MET A 103 -2.590 2.099 3.772 1.00 0.00 H new ATOM 1697 N PHE A 104 -0.381 6.766 3.841 1.00 0.00 N ATOM 1698 CA PHE A 104 -0.512 7.742 4.917 1.00 0.00 C ATOM 1699 C PHE A 104 0.853 8.209 5.413 1.00 0.00 C ATOM 1700 O PHE A 104 1.864 7.543 5.196 1.00 0.00 O ATOM 1701 CB PHE A 104 -1.305 7.137 6.074 1.00 0.00 C ATOM 1702 CG PHE A 104 -2.777 7.030 5.802 1.00 0.00 C ATOM 1703 CD1 PHE A 104 -3.272 6.023 4.988 1.00 0.00 C ATOM 1704 CD2 PHE A 104 -3.666 7.933 6.360 1.00 0.00 C ATOM 1705 CE1 PHE A 104 -4.628 5.919 4.737 1.00 0.00 C ATOM 1706 CE2 PHE A 104 -5.022 7.836 6.113 1.00 0.00 C ATOM 1707 CZ PHE A 104 -5.503 6.828 5.300 1.00 0.00 C ATOM 0 H PHE A 104 0.186 5.951 4.074 1.00 0.00 H new ATOM 0 HA PHE A 104 -1.043 8.609 4.523 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -0.911 6.145 6.294 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -1.152 7.745 6.966 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -2.591 5.312 4.545 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -3.295 8.723 6.996 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -5.002 5.129 4.102 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -5.705 8.547 6.555 1.00 0.00 H new ATOM 0 HZ PHE A 104 -6.562 6.751 5.105 1.00 0.00 H new ATOM 1717 N GLU A 105 0.867 9.358 6.083 1.00 0.00 N ATOM 1718 CA GLU A 105 2.103 9.922 6.617 1.00 0.00 C ATOM 1719 C GLU A 105 1.811 10.836 7.804 1.00 0.00 C ATOM 1720 O GLU A 105 0.929 11.690 7.737 1.00 0.00 O ATOM 1721 CB GLU A 105 2.843 10.706 5.532 1.00 0.00 C ATOM 1722 CG GLU A 105 3.401 9.836 4.418 1.00 0.00 C ATOM 1723 CD GLU A 105 2.456 9.725 3.237 1.00 0.00 C ATOM 1724 OE1 GLU A 105 2.182 10.762 2.597 1.00 0.00 O ATOM 1725 OE2 GLU A 105 1.990 8.601 2.952 1.00 0.00 O ATOM 0 H GLU A 105 0.035 9.918 6.269 1.00 0.00 H new ATOM 0 HA GLU A 105 2.732 9.099 6.955 1.00 0.00 H new ATOM 0 HB2 GLU A 105 2.163 11.441 5.100 1.00 0.00 H new ATOM 0 HB3 GLU A 105 3.661 11.260 5.992 1.00 0.00 H new ATOM 0 HG2 GLU A 105 4.352 10.249 4.081 1.00 0.00 H new ATOM 0 HG3 GLU A 105 3.607 8.840 4.809 1.00 0.00 H new ATOM 1732 N VAL A 106 2.559 10.654 8.889 1.00 0.00 N ATOM 1733 CA VAL A 106 2.378 11.470 10.084 1.00 0.00 C ATOM 1734 C VAL A 106 3.686 12.128 10.508 1.00 0.00 C ATOM 1735 O VAL A 106 4.768 11.594 10.265 1.00 0.00 O ATOM 1736 CB VAL A 106 1.828 10.642 11.262 1.00 0.00 C ATOM 1737 CG1 VAL A 106 0.459 10.074 10.922 1.00 0.00 C ATOM 1738 CG2 VAL A 106 2.799 9.531 11.639 1.00 0.00 C ATOM 0 H VAL A 106 3.294 9.951 8.965 1.00 0.00 H new ATOM 0 HA VAL A 106 1.653 12.241 9.825 1.00 0.00 H new ATOM 0 HB VAL A 106 1.718 11.301 12.124 1.00 0.00 H new ATOM 0 HG11 VAL A 106 0.087 9.492 11.765 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -0.232 10.891 10.711 1.00 0.00 H new ATOM 0 HG13 VAL A 106 0.539 9.431 10.045 1.00 0.00 H new ATOM 0 HG21 VAL A 106 2.391 8.959 12.472 1.00 0.00 H new ATOM 0 HG22 VAL A 106 2.947 8.871 10.784 1.00 0.00 H new ATOM 0 HG23 VAL A 106 3.755 9.967 11.931 1.00 0.00 H new ATOM 1748 N ALA A 107 3.579 13.290 11.144 1.00 0.00 N ATOM 1749 CA ALA A 107 4.755 14.020 11.603 1.00 0.00 C ATOM 1750 C ALA A 107 4.455 14.794 12.882 1.00 0.00 C ATOM 1751 O ALA A 107 3.364 15.338 13.049 1.00 0.00 O ATOM 1752 CB ALA A 107 5.251 14.961 10.515 1.00 0.00 C ATOM 0 H ALA A 107 2.691 13.746 11.353 1.00 0.00 H new ATOM 0 HA ALA A 107 5.539 13.296 11.824 1.00 0.00 H new ATOM 0 HB1 ALA A 107 6.129 15.499 10.872 1.00 0.00 H new ATOM 0 HB2 ALA A 107 5.514 14.385 9.628 1.00 0.00 H new ATOM 0 HB3 ALA A 107 4.465 15.674 10.265 1.00 0.00 H new ATOM 1758 N GLY A 108 5.434 14.843 13.779 1.00 0.00 N ATOM 1759 CA GLY A 108 5.257 15.557 15.029 1.00 0.00 C ATOM 1760 C GLY A 108 4.785 14.658 16.158 1.00 0.00 C ATOM 1761 O GLY A 108 4.992 14.968 17.331 1.00 0.00 O ATOM 0 H GLY A 108 6.346 14.401 13.663 1.00 0.00 H new ATOM 0 HA2 GLY A 108 6.200 16.024 15.312 1.00 0.00 H new ATOM 0 HA3 GLY A 108 4.535 16.360 14.884 1.00 0.00 H new ATOM 1765 N VAL A 109 4.144 13.547 15.807 1.00 0.00 N ATOM 1766 CA VAL A 109 3.641 12.612 16.805 1.00 0.00 C ATOM 1767 C VAL A 109 4.711 11.601 17.206 1.00 0.00 C ATOM 1768 O VAL A 109 5.623 11.307 16.433 1.00 0.00 O ATOM 1769 CB VAL A 109 2.397 11.859 16.298 1.00 0.00 C ATOM 1770 CG1 VAL A 109 1.277 12.843 15.988 1.00 0.00 C ATOM 1771 CG2 VAL A 109 2.733 11.013 15.076 1.00 0.00 C ATOM 0 H VAL A 109 3.962 13.274 14.841 1.00 0.00 H new ATOM 0 HA VAL A 109 3.364 13.204 17.677 1.00 0.00 H new ATOM 0 HB VAL A 109 2.057 11.185 17.084 1.00 0.00 H new ATOM 0 HG11 VAL A 109 0.403 12.299 15.630 1.00 0.00 H new ATOM 0 HG12 VAL A 109 1.017 13.394 16.892 1.00 0.00 H new ATOM 0 HG13 VAL A 109 1.609 13.542 15.220 1.00 0.00 H new ATOM 0 HG21 VAL A 109 1.838 10.491 14.737 1.00 0.00 H new ATOM 0 HG22 VAL A 109 3.102 11.657 14.278 1.00 0.00 H new ATOM 0 HG23 VAL A 109 3.500 10.284 15.338 1.00 0.00 H new ATOM 1781 N THR A 110 4.593 11.074 18.421 1.00 0.00 N ATOM 1782 CA THR A 110 5.550 10.095 18.926 1.00 0.00 C ATOM 1783 C THR A 110 5.459 8.790 18.142 1.00 0.00 C ATOM 1784 O THR A 110 4.492 8.555 17.420 1.00 0.00 O ATOM 1785 CB THR A 110 5.303 9.831 20.411 1.00 0.00 C ATOM 1786 OG1 THR A 110 4.039 9.224 20.609 1.00 0.00 O ATOM 1787 CG2 THR A 110 5.348 11.085 21.259 1.00 0.00 C ATOM 0 H THR A 110 3.845 11.308 19.074 1.00 0.00 H new ATOM 0 HA THR A 110 6.552 10.504 18.799 1.00 0.00 H new ATOM 0 HB THR A 110 6.112 9.171 20.725 1.00 0.00 H new ATOM 0 HG1 THR A 110 3.900 9.062 21.565 1.00 0.00 H new ATOM 0 HG21 THR A 110 5.165 10.826 22.302 1.00 0.00 H new ATOM 0 HG22 THR A 110 6.329 11.551 21.168 1.00 0.00 H new ATOM 0 HG23 THR A 110 4.582 11.782 20.919 1.00 0.00 H new ATOM 1795 N GLU A 111 6.473 7.945 18.291 1.00 0.00 N ATOM 1796 CA GLU A 111 6.509 6.663 17.596 1.00 0.00 C ATOM 1797 C GLU A 111 5.316 5.796 17.988 1.00 0.00 C ATOM 1798 O GLU A 111 4.728 5.116 17.147 1.00 0.00 O ATOM 1799 CB GLU A 111 7.813 5.928 17.908 1.00 0.00 C ATOM 1800 CG GLU A 111 7.931 4.577 17.221 1.00 0.00 C ATOM 1801 CD GLU A 111 9.306 3.959 17.380 1.00 0.00 C ATOM 1802 OE1 GLU A 111 9.785 3.864 18.530 1.00 0.00 O ATOM 1803 OE2 GLU A 111 9.906 3.572 16.355 1.00 0.00 O ATOM 0 H GLU A 111 7.281 8.124 18.887 1.00 0.00 H new ATOM 0 HA GLU A 111 6.456 6.857 16.525 1.00 0.00 H new ATOM 0 HB2 GLU A 111 8.653 6.554 17.607 1.00 0.00 H new ATOM 0 HB3 GLU A 111 7.891 5.786 18.986 1.00 0.00 H new ATOM 0 HG2 GLU A 111 7.183 3.899 17.631 1.00 0.00 H new ATOM 0 HG3 GLU A 111 7.709 4.693 16.160 1.00 0.00 H new ATOM 1810 N GLU A 112 4.966 5.823 19.270 1.00 0.00 N ATOM 1811 CA GLU A 112 3.845 5.035 19.772 1.00 0.00 C ATOM 1812 C GLU A 112 2.531 5.498 19.151 1.00 0.00 C ATOM 1813 O GLU A 112 1.721 4.683 18.711 1.00 0.00 O ATOM 1814 CB GLU A 112 3.769 5.134 21.298 1.00 0.00 C ATOM 1815 CG GLU A 112 4.071 3.823 22.007 1.00 0.00 C ATOM 1816 CD GLU A 112 3.101 2.720 21.631 1.00 0.00 C ATOM 1817 OE1 GLU A 112 3.367 2.008 20.640 1.00 0.00 O ATOM 1818 OE2 GLU A 112 2.074 2.569 22.327 1.00 0.00 O ATOM 0 H GLU A 112 5.441 6.381 19.979 1.00 0.00 H new ATOM 0 HA GLU A 112 4.009 3.995 19.491 1.00 0.00 H new ATOM 0 HB2 GLU A 112 4.472 5.893 21.640 1.00 0.00 H new ATOM 0 HB3 GLU A 112 2.772 5.471 21.583 1.00 0.00 H new ATOM 0 HG2 GLU A 112 5.086 3.508 21.764 1.00 0.00 H new ATOM 0 HG3 GLU A 112 4.036 3.981 23.085 1.00 0.00 H new ATOM 1825 N GLN A 113 2.324 6.811 19.118 1.00 0.00 N ATOM 1826 CA GLN A 113 1.107 7.378 18.550 1.00 0.00 C ATOM 1827 C GLN A 113 1.137 7.318 17.028 1.00 0.00 C ATOM 1828 O GLN A 113 0.112 7.090 16.384 1.00 0.00 O ATOM 1829 CB GLN A 113 0.930 8.826 19.012 1.00 0.00 C ATOM 1830 CG GLN A 113 1.159 9.023 20.503 1.00 0.00 C ATOM 1831 CD GLN A 113 -0.122 9.322 21.256 1.00 0.00 C ATOM 1832 OE1 GLN A 113 -0.456 10.482 21.501 1.00 0.00 O ATOM 1833 NE2 GLN A 113 -0.848 8.275 21.631 1.00 0.00 N ATOM 0 H GLN A 113 2.983 7.501 19.478 1.00 0.00 H new ATOM 0 HA GLN A 113 0.262 6.786 18.902 1.00 0.00 H new ATOM 0 HB2 GLN A 113 1.622 9.462 18.460 1.00 0.00 H new ATOM 0 HB3 GLN A 113 -0.077 9.158 18.761 1.00 0.00 H new ATOM 0 HG2 GLN A 113 1.619 8.126 20.918 1.00 0.00 H new ATOM 0 HG3 GLN A 113 1.864 9.841 20.653 1.00 0.00 H new ATOM 0 HE21 GLN A 113 -0.534 7.331 21.407 1.00 0.00 H new ATOM 0 HE22 GLN A 113 -1.719 8.415 22.143 1.00 0.00 H new ATOM 1842 N ALA A 114 2.317 7.527 16.456 1.00 0.00 N ATOM 1843 CA ALA A 114 2.483 7.501 15.009 1.00 0.00 C ATOM 1844 C ALA A 114 2.351 6.083 14.460 1.00 0.00 C ATOM 1845 O ALA A 114 1.632 5.849 13.488 1.00 0.00 O ATOM 1846 CB ALA A 114 3.830 8.090 14.629 1.00 0.00 C ATOM 0 H ALA A 114 3.175 7.717 16.974 1.00 0.00 H new ATOM 0 HA ALA A 114 1.691 8.105 14.567 1.00 0.00 H new ATOM 0 HB1 ALA A 114 3.945 8.066 13.545 1.00 0.00 H new ATOM 0 HB2 ALA A 114 3.888 9.121 14.977 1.00 0.00 H new ATOM 0 HB3 ALA A 114 4.626 7.506 15.091 1.00 0.00 H new ATOM 1852 N MET A 115 3.048 5.143 15.087 1.00 0.00 N ATOM 1853 CA MET A 115 3.007 3.750 14.659 1.00 0.00 C ATOM 1854 C MET A 115 1.604 3.176 14.813 1.00 0.00 C ATOM 1855 O MET A 115 1.070 2.560 13.890 1.00 0.00 O ATOM 1856 CB MET A 115 4.006 2.917 15.464 1.00 0.00 C ATOM 1857 CG MET A 115 5.456 3.305 15.219 1.00 0.00 C ATOM 1858 SD MET A 115 6.362 2.061 14.277 1.00 0.00 S ATOM 1859 CE MET A 115 7.502 3.094 13.361 1.00 0.00 C ATOM 0 H MET A 115 3.648 5.320 15.893 1.00 0.00 H new ATOM 0 HA MET A 115 3.281 3.711 13.605 1.00 0.00 H new ATOM 0 HB2 MET A 115 3.784 3.024 16.526 1.00 0.00 H new ATOM 0 HB3 MET A 115 3.873 1.864 15.215 1.00 0.00 H new ATOM 0 HG2 MET A 115 5.488 4.254 14.684 1.00 0.00 H new ATOM 0 HG3 MET A 115 5.952 3.462 16.177 1.00 0.00 H new ATOM 0 HE1 MET A 115 8.109 2.472 12.703 1.00 0.00 H new ATOM 0 HE2 MET A 115 6.942 3.814 12.764 1.00 0.00 H new ATOM 0 HE3 MET A 115 8.150 3.626 14.057 1.00 0.00 H new ATOM 1869 N GLU A 116 1.009 3.384 15.982 1.00 0.00 N ATOM 1870 CA GLU A 116 -0.335 2.889 16.253 1.00 0.00 C ATOM 1871 C GLU A 116 -1.347 3.535 15.313 1.00 0.00 C ATOM 1872 O GLU A 116 -2.168 2.849 14.704 1.00 0.00 O ATOM 1873 CB GLU A 116 -0.721 3.165 17.707 1.00 0.00 C ATOM 1874 CG GLU A 116 -1.712 2.162 18.273 1.00 0.00 C ATOM 1875 CD GLU A 116 -1.385 1.762 19.700 1.00 0.00 C ATOM 1876 OE1 GLU A 116 -0.257 1.285 19.939 1.00 0.00 O ATOM 1877 OE2 GLU A 116 -2.260 1.928 20.577 1.00 0.00 O ATOM 0 H GLU A 116 1.436 3.892 16.757 1.00 0.00 H new ATOM 0 HA GLU A 116 -0.342 1.812 16.084 1.00 0.00 H new ATOM 0 HB2 GLU A 116 0.180 3.159 18.321 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -1.149 4.165 17.777 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -2.715 2.589 18.240 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -1.723 1.272 17.643 1.00 0.00 H new ATOM 1884 N ALA A 117 -1.280 4.858 15.199 1.00 0.00 N ATOM 1885 CA ALA A 117 -2.191 5.596 14.331 1.00 0.00 C ATOM 1886 C ALA A 117 -2.114 5.086 12.897 1.00 0.00 C ATOM 1887 O ALA A 117 -3.135 4.805 12.269 1.00 0.00 O ATOM 1888 CB ALA A 117 -1.871 7.082 14.376 1.00 0.00 C ATOM 0 H ALA A 117 -0.606 5.440 15.696 1.00 0.00 H new ATOM 0 HA ALA A 117 -3.207 5.439 14.694 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -2.558 7.622 13.724 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -1.978 7.447 15.398 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -0.847 7.244 14.039 1.00 0.00 H new ATOM 1894 N LEU A 118 -0.896 4.960 12.387 1.00 0.00 N ATOM 1895 CA LEU A 118 -0.686 4.477 11.030 1.00 0.00 C ATOM 1896 C LEU A 118 -1.186 3.043 10.894 1.00 0.00 C ATOM 1897 O LEU A 118 -1.657 2.636 9.832 1.00 0.00 O ATOM 1898 CB LEU A 118 0.801 4.563 10.666 1.00 0.00 C ATOM 1899 CG LEU A 118 1.261 5.871 9.996 1.00 0.00 C ATOM 1900 CD1 LEU A 118 0.449 7.073 10.471 1.00 0.00 C ATOM 1901 CD2 LEU A 118 2.739 6.103 10.264 1.00 0.00 C ATOM 0 H LEU A 118 -0.039 5.186 12.893 1.00 0.00 H new ATOM 0 HA LEU A 118 -1.252 5.105 10.342 1.00 0.00 H new ATOM 0 HB2 LEU A 118 1.385 4.419 11.575 1.00 0.00 H new ATOM 0 HB3 LEU A 118 1.039 3.734 10.000 1.00 0.00 H new ATOM 0 HG LEU A 118 1.096 5.766 8.924 1.00 0.00 H new ATOM 0 HD11 LEU A 118 0.807 7.974 9.973 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -0.603 6.919 10.231 1.00 0.00 H new ATOM 0 HD13 LEU A 118 0.562 7.185 11.549 1.00 0.00 H new ATOM 0 HD21 LEU A 118 3.054 7.030 9.786 1.00 0.00 H new ATOM 0 HD22 LEU A 118 2.907 6.173 11.339 1.00 0.00 H new ATOM 0 HD23 LEU A 118 3.317 5.272 9.860 1.00 0.00 H new ATOM 1913 N ARG A 119 -1.091 2.287 11.983 1.00 0.00 N ATOM 1914 CA ARG A 119 -1.547 0.903 11.996 1.00 0.00 C ATOM 1915 C ARG A 119 -3.070 0.842 12.036 1.00 0.00 C ATOM 1916 O ARG A 119 -3.687 0.002 11.380 1.00 0.00 O ATOM 1917 CB ARG A 119 -0.956 0.160 13.197 1.00 0.00 C ATOM 1918 CG ARG A 119 0.257 -0.689 12.851 1.00 0.00 C ATOM 1919 CD ARG A 119 1.308 -0.634 13.947 1.00 0.00 C ATOM 1920 NE ARG A 119 2.475 -1.453 13.628 1.00 0.00 N ATOM 1921 CZ ARG A 119 3.447 -1.729 14.494 1.00 0.00 C ATOM 1922 NH1 ARG A 119 3.397 -1.255 15.733 1.00 0.00 N ATOM 1923 NH2 ARG A 119 4.471 -2.484 14.121 1.00 0.00 N ATOM 0 H ARG A 119 -0.702 2.611 12.869 1.00 0.00 H new ATOM 0 HA ARG A 119 -1.205 0.419 11.081 1.00 0.00 H new ATOM 0 HB2 ARG A 119 -0.675 0.886 13.960 1.00 0.00 H new ATOM 0 HB3 ARG A 119 -1.724 -0.479 13.632 1.00 0.00 H new ATOM 0 HG2 ARG A 119 -0.054 -1.722 12.695 1.00 0.00 H new ATOM 0 HG3 ARG A 119 0.690 -0.341 11.913 1.00 0.00 H new ATOM 0 HD2 ARG A 119 1.621 0.399 14.098 1.00 0.00 H new ATOM 0 HD3 ARG A 119 0.871 -0.975 14.886 1.00 0.00 H new ATOM 0 HE ARG A 119 2.549 -1.836 12.686 1.00 0.00 H new ATOM 0 HH11 ARG A 119 2.610 -0.676 16.026 1.00 0.00 H new ATOM 0 HH12 ARG A 119 4.145 -1.470 16.392 1.00 0.00 H new ATOM 0 HH21 ARG A 119 4.513 -2.853 13.171 1.00 0.00 H new ATOM 0 HH22 ARG A 119 5.216 -2.696 14.784 1.00 0.00 H new ATOM 1937 N ILE A 120 -3.672 1.744 12.808 1.00 0.00 N ATOM 1938 CA ILE A 120 -5.125 1.804 12.931 1.00 0.00 C ATOM 1939 C ILE A 120 -5.774 1.987 11.561 1.00 0.00 C ATOM 1940 O ILE A 120 -6.854 1.459 11.299 1.00 0.00 O ATOM 1941 CB ILE A 120 -5.562 2.953 13.867 1.00 0.00 C ATOM 1942 CG1 ILE A 120 -5.088 2.682 15.296 1.00 0.00 C ATOM 1943 CG2 ILE A 120 -7.075 3.138 13.839 1.00 0.00 C ATOM 1944 CD1 ILE A 120 -4.824 3.940 16.093 1.00 0.00 C ATOM 0 H ILE A 120 -3.174 2.444 13.358 1.00 0.00 H new ATOM 0 HA ILE A 120 -5.456 0.859 13.363 1.00 0.00 H new ATOM 0 HB ILE A 120 -5.101 3.874 13.510 1.00 0.00 H new ATOM 0 HG12 ILE A 120 -5.840 2.085 15.813 1.00 0.00 H new ATOM 0 HG13 ILE A 120 -4.176 2.086 15.261 1.00 0.00 H new ATOM 0 HG21 ILE A 120 -7.354 3.953 14.507 1.00 0.00 H new ATOM 0 HG22 ILE A 120 -7.394 3.375 12.824 1.00 0.00 H new ATOM 0 HG23 ILE A 120 -7.560 2.218 14.166 1.00 0.00 H new ATOM 0 HD11 ILE A 120 -4.491 3.672 17.096 1.00 0.00 H new ATOM 0 HD12 ILE A 120 -4.051 4.528 15.599 1.00 0.00 H new ATOM 0 HD13 ILE A 120 -5.740 4.528 16.159 1.00 0.00 H new ATOM 1956 N ALA A 121 -5.103 2.736 10.693 1.00 0.00 N ATOM 1957 CA ALA A 121 -5.610 2.984 9.350 1.00 0.00 C ATOM 1958 C ALA A 121 -5.586 1.709 8.517 1.00 0.00 C ATOM 1959 O ALA A 121 -6.534 1.412 7.791 1.00 0.00 O ATOM 1960 CB ALA A 121 -4.794 4.076 8.672 1.00 0.00 C ATOM 0 H ALA A 121 -4.208 3.181 10.896 1.00 0.00 H new ATOM 0 HA ALA A 121 -6.645 3.318 9.431 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -5.183 4.252 7.669 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -4.862 4.995 9.254 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -3.752 3.764 8.607 1.00 0.00 H new ATOM 1966 N GLY A 122 -4.495 0.958 8.629 1.00 0.00 N ATOM 1967 CA GLY A 122 -4.365 -0.280 7.883 1.00 0.00 C ATOM 1968 C GLY A 122 -5.255 -1.383 8.421 1.00 0.00 C ATOM 1969 O GLY A 122 -5.584 -2.329 7.705 1.00 0.00 O ATOM 0 H GLY A 122 -3.698 1.185 9.224 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -4.612 -0.097 6.837 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -3.327 -0.610 7.912 1.00 0.00 H new ATOM 1973 N HIS A 123 -5.647 -1.266 9.688 1.00 0.00 N ATOM 1974 CA HIS A 123 -6.504 -2.264 10.319 1.00 0.00 C ATOM 1975 C HIS A 123 -7.818 -2.414 9.559 1.00 0.00 C ATOM 1976 O HIS A 123 -8.275 -3.528 9.304 1.00 0.00 O ATOM 1977 CB HIS A 123 -6.781 -1.881 11.773 1.00 0.00 C ATOM 1978 CG HIS A 123 -6.794 -3.052 12.706 1.00 0.00 C ATOM 1979 ND1 HIS A 123 -7.937 -3.759 13.012 1.00 0.00 N ATOM 1980 CD2 HIS A 123 -5.792 -3.643 13.402 1.00 0.00 C ATOM 1981 CE1 HIS A 123 -7.640 -4.732 13.856 1.00 0.00 C ATOM 1982 NE2 HIS A 123 -6.345 -4.683 14.108 1.00 0.00 N ATOM 0 H HIS A 123 -5.384 -0.490 10.296 1.00 0.00 H new ATOM 0 HA HIS A 123 -5.983 -3.221 10.296 1.00 0.00 H new ATOM 0 HB2 HIS A 123 -6.023 -1.171 12.104 1.00 0.00 H new ATOM 0 HB3 HIS A 123 -7.743 -1.371 11.829 1.00 0.00 H new ATOM 0 HD2 HIS A 123 -4.752 -3.350 13.401 1.00 0.00 H new ATOM 0 HE1 HIS A 123 -8.338 -5.445 14.269 1.00 0.00 H new ATOM 0 HE2 HIS A 123 -5.837 -5.315 14.727 1.00 0.00 H new ATOM 1991 N LYS A 124 -8.421 -1.286 9.199 1.00 0.00 N ATOM 1992 CA LYS A 124 -9.683 -1.295 8.468 1.00 0.00 C ATOM 1993 C LYS A 124 -9.455 -1.462 6.965 1.00 0.00 C ATOM 1994 O LYS A 124 -10.410 -1.518 6.190 1.00 0.00 O ATOM 1995 CB LYS A 124 -10.463 -0.006 8.735 1.00 0.00 C ATOM 1996 CG LYS A 124 -9.631 1.256 8.568 1.00 0.00 C ATOM 1997 CD LYS A 124 -9.298 1.887 9.910 1.00 0.00 C ATOM 1998 CE LYS A 124 -10.386 2.850 10.358 1.00 0.00 C ATOM 1999 NZ LYS A 124 -11.713 2.181 10.456 1.00 0.00 N ATOM 0 H LYS A 124 -8.057 -0.355 9.401 1.00 0.00 H new ATOM 0 HA LYS A 124 -10.264 -2.147 8.822 1.00 0.00 H new ATOM 0 HB2 LYS A 124 -11.316 0.039 8.058 1.00 0.00 H new ATOM 0 HB3 LYS A 124 -10.862 -0.036 9.749 1.00 0.00 H new ATOM 0 HG2 LYS A 124 -8.709 1.017 8.038 1.00 0.00 H new ATOM 0 HG3 LYS A 124 -10.175 1.973 7.953 1.00 0.00 H new ATOM 0 HD2 LYS A 124 -9.171 1.106 10.659 1.00 0.00 H new ATOM 0 HD3 LYS A 124 -8.348 2.417 9.838 1.00 0.00 H new ATOM 0 HE2 LYS A 124 -10.120 3.273 11.327 1.00 0.00 H new ATOM 0 HE3 LYS A 124 -10.449 3.680 9.654 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 -12.398 2.831 10.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 -12.041 1.919 9.504 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 -11.628 1.325 11.041 1.00 0.00 H new ATOM 2013 N LEU A 125 -8.191 -1.545 6.557 1.00 0.00 N ATOM 2014 CA LEU A 125 -7.853 -1.708 5.148 1.00 0.00 C ATOM 2015 C LEU A 125 -7.904 -3.179 4.747 1.00 0.00 C ATOM 2016 O LEU A 125 -7.714 -4.066 5.580 1.00 0.00 O ATOM 2017 CB LEU A 125 -6.462 -1.137 4.863 1.00 0.00 C ATOM 2018 CG LEU A 125 -6.392 0.388 4.767 1.00 0.00 C ATOM 2019 CD1 LEU A 125 -4.956 0.848 4.577 1.00 0.00 C ATOM 2020 CD2 LEU A 125 -7.264 0.892 3.630 1.00 0.00 C ATOM 0 H LEU A 125 -7.386 -1.502 7.182 1.00 0.00 H new ATOM 0 HA LEU A 125 -8.588 -1.161 4.558 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -5.783 -1.467 5.649 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -6.097 -1.561 3.928 1.00 0.00 H new ATOM 0 HG LEU A 125 -6.767 0.806 5.701 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -4.928 1.936 4.511 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -4.354 0.520 5.424 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -4.555 0.418 3.659 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -7.201 1.979 3.578 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -6.919 0.463 2.689 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -8.298 0.596 3.806 1.00 0.00 H new ATOM 2032 N PRO A 126 -8.170 -3.461 3.459 1.00 0.00 N ATOM 2033 CA PRO A 126 -8.253 -4.826 2.947 1.00 0.00 C ATOM 2034 C PRO A 126 -6.897 -5.382 2.513 1.00 0.00 C ATOM 2035 O PRO A 126 -6.828 -6.286 1.680 1.00 0.00 O ATOM 2036 CB PRO A 126 -9.173 -4.665 1.741 1.00 0.00 C ATOM 2037 CG PRO A 126 -8.869 -3.299 1.217 1.00 0.00 C ATOM 2038 CD PRO A 126 -8.421 -2.467 2.397 1.00 0.00 C ATOM 0 HA PRO A 126 -8.608 -5.530 3.700 1.00 0.00 H new ATOM 0 HB2 PRO A 126 -8.979 -5.430 0.989 1.00 0.00 H new ATOM 0 HB3 PRO A 126 -10.221 -4.756 2.026 1.00 0.00 H new ATOM 0 HG2 PRO A 126 -8.090 -3.342 0.456 1.00 0.00 H new ATOM 0 HG3 PRO A 126 -9.749 -2.861 0.747 1.00 0.00 H new ATOM 0 HD2 PRO A 126 -7.522 -1.896 2.164 1.00 0.00 H new ATOM 0 HD3 PRO A 126 -9.187 -1.750 2.694 1.00 0.00 H new ATOM 2046 N ILE A 127 -5.823 -4.839 3.079 1.00 0.00 N ATOM 2047 CA ILE A 127 -4.478 -5.289 2.746 1.00 0.00 C ATOM 2048 C ILE A 127 -3.515 -5.058 3.905 1.00 0.00 C ATOM 2049 O ILE A 127 -3.828 -4.333 4.850 1.00 0.00 O ATOM 2050 CB ILE A 127 -3.939 -4.572 1.492 1.00 0.00 C ATOM 2051 CG1 ILE A 127 -4.191 -3.066 1.588 1.00 0.00 C ATOM 2052 CG2 ILE A 127 -4.585 -5.143 0.239 1.00 0.00 C ATOM 2053 CD1 ILE A 127 -3.277 -2.361 2.567 1.00 0.00 C ATOM 0 H ILE A 127 -5.859 -4.088 3.769 1.00 0.00 H new ATOM 0 HA ILE A 127 -4.545 -6.358 2.543 1.00 0.00 H new ATOM 0 HB ILE A 127 -2.863 -4.737 1.432 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -4.065 -2.621 0.601 1.00 0.00 H new ATOM 0 HG13 ILE A 127 -5.226 -2.897 1.884 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -4.195 -4.627 -0.639 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -4.359 -6.207 0.165 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -5.665 -5.005 0.291 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -3.512 -1.297 2.583 1.00 0.00 H new ATOM 0 HD12 ILE A 127 -3.419 -2.779 3.564 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -2.240 -2.499 2.261 1.00 0.00 H new ATOM 2065 N LYS A 128 -2.344 -5.681 3.827 1.00 0.00 N ATOM 2066 CA LYS A 128 -1.334 -5.547 4.870 1.00 0.00 C ATOM 2067 C LYS A 128 -0.556 -4.243 4.718 1.00 0.00 C ATOM 2068 O LYS A 128 -0.177 -3.860 3.613 1.00 0.00 O ATOM 2069 CB LYS A 128 -0.373 -6.739 4.827 1.00 0.00 C ATOM 2070 CG LYS A 128 -0.626 -7.762 5.923 1.00 0.00 C ATOM 2071 CD LYS A 128 -0.135 -7.264 7.271 1.00 0.00 C ATOM 2072 CE LYS A 128 0.228 -8.416 8.192 1.00 0.00 C ATOM 2073 NZ LYS A 128 0.973 -7.953 9.395 1.00 0.00 N ATOM 0 H LYS A 128 -2.071 -6.284 3.051 1.00 0.00 H new ATOM 0 HA LYS A 128 -1.842 -5.529 5.834 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -0.458 -7.229 3.857 1.00 0.00 H new ATOM 0 HB3 LYS A 128 0.650 -6.374 4.911 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -1.693 -7.979 5.980 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -0.123 -8.696 5.674 1.00 0.00 H new ATOM 0 HD2 LYS A 128 0.735 -6.623 7.128 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -0.908 -6.653 7.738 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -0.680 -8.931 8.504 1.00 0.00 H new ATOM 0 HE3 LYS A 128 0.834 -9.140 7.646 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 1.202 -8.769 9.997 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 1.853 -7.484 9.099 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 0.386 -7.282 9.930 1.00 0.00 H new ATOM 2087 N THR A 129 -0.319 -3.569 5.840 1.00 0.00 N ATOM 2088 CA THR A 129 0.417 -2.309 5.837 1.00 0.00 C ATOM 2089 C THR A 129 1.339 -2.221 7.049 1.00 0.00 C ATOM 2090 O THR A 129 1.042 -2.778 8.106 1.00 0.00 O ATOM 2091 CB THR A 129 -0.548 -1.123 5.832 1.00 0.00 C ATOM 2092 OG1 THR A 129 -1.062 -0.890 7.131 1.00 0.00 O ATOM 2093 CG2 THR A 129 -1.727 -1.304 4.898 1.00 0.00 C ATOM 0 H THR A 129 -0.626 -3.875 6.763 1.00 0.00 H new ATOM 0 HA THR A 129 1.023 -2.275 4.932 1.00 0.00 H new ATOM 0 HB THR A 129 0.042 -0.277 5.480 1.00 0.00 H new ATOM 0 HG1 THR A 129 -1.402 -1.730 7.504 1.00 0.00 H new ATOM 0 HG21 THR A 129 -2.368 -0.424 4.947 1.00 0.00 H new ATOM 0 HG22 THR A 129 -1.366 -1.434 3.878 1.00 0.00 H new ATOM 0 HG23 THR A 129 -2.296 -2.185 5.197 1.00 0.00 H new ATOM 2101 N LYS A 130 2.456 -1.516 6.893 1.00 0.00 N ATOM 2102 CA LYS A 130 3.414 -1.360 7.984 1.00 0.00 C ATOM 2103 C LYS A 130 3.863 0.093 8.116 1.00 0.00 C ATOM 2104 O LYS A 130 3.721 0.884 7.183 1.00 0.00 O ATOM 2105 CB LYS A 130 4.628 -2.263 7.758 1.00 0.00 C ATOM 2106 CG LYS A 130 5.223 -2.145 6.364 1.00 0.00 C ATOM 2107 CD LYS A 130 6.729 -2.351 6.381 1.00 0.00 C ATOM 2108 CE LYS A 130 7.380 -1.797 5.125 1.00 0.00 C ATOM 2109 NZ LYS A 130 8.758 -2.329 4.933 1.00 0.00 N ATOM 0 H LYS A 130 2.719 -1.046 6.027 1.00 0.00 H new ATOM 0 HA LYS A 130 2.919 -1.652 8.910 1.00 0.00 H new ATOM 0 HB2 LYS A 130 5.395 -2.018 8.493 1.00 0.00 H new ATOM 0 HB3 LYS A 130 4.338 -3.299 7.934 1.00 0.00 H new ATOM 0 HG2 LYS A 130 4.761 -2.882 5.707 1.00 0.00 H new ATOM 0 HG3 LYS A 130 4.994 -1.162 5.952 1.00 0.00 H new ATOM 0 HD2 LYS A 130 7.154 -1.863 7.258 1.00 0.00 H new ATOM 0 HD3 LYS A 130 6.951 -3.415 6.469 1.00 0.00 H new ATOM 0 HE2 LYS A 130 6.769 -2.049 4.258 1.00 0.00 H new ATOM 0 HE3 LYS A 130 7.416 -0.709 5.184 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 9.168 -1.927 4.066 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 9.348 -2.067 5.748 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 8.722 -3.365 4.851 1.00 0.00 H new ATOM 2123 N ILE A 131 4.404 0.436 9.281 1.00 0.00 N ATOM 2124 CA ILE A 131 4.876 1.793 9.538 1.00 0.00 C ATOM 2125 C ILE A 131 6.329 1.956 9.107 1.00 0.00 C ATOM 2126 O ILE A 131 7.139 1.044 9.277 1.00 0.00 O ATOM 2127 CB ILE A 131 4.765 2.168 11.032 1.00 0.00 C ATOM 2128 CG1 ILE A 131 3.545 1.502 11.676 1.00 0.00 C ATOM 2129 CG2 ILE A 131 4.696 3.681 11.194 1.00 0.00 C ATOM 2130 CD1 ILE A 131 2.239 1.836 10.991 1.00 0.00 C ATOM 0 H ILE A 131 4.527 -0.207 10.063 1.00 0.00 H new ATOM 0 HA ILE A 131 4.237 2.457 8.956 1.00 0.00 H new ATOM 0 HB ILE A 131 5.656 1.802 11.542 1.00 0.00 H new ATOM 0 HG12 ILE A 131 3.684 0.421 11.666 1.00 0.00 H new ATOM 0 HG13 ILE A 131 3.485 1.806 12.721 1.00 0.00 H new ATOM 0 HG21 ILE A 131 4.618 3.930 12.252 1.00 0.00 H new ATOM 0 HG22 ILE A 131 5.598 4.133 10.780 1.00 0.00 H new ATOM 0 HG23 ILE A 131 3.823 4.064 10.666 1.00 0.00 H new ATOM 0 HD11 ILE A 131 1.420 1.329 11.502 1.00 0.00 H new ATOM 0 HD12 ILE A 131 2.076 2.913 11.024 1.00 0.00 H new ATOM 0 HD13 ILE A 131 2.278 1.507 9.953 1.00 0.00 H new ATOM 2142 N VAL A 132 6.659 3.122 8.560 1.00 0.00 N ATOM 2143 CA VAL A 132 8.020 3.392 8.121 1.00 0.00 C ATOM 2144 C VAL A 132 8.362 4.875 8.249 1.00 0.00 C ATOM 2145 O VAL A 132 7.506 5.741 8.080 1.00 0.00 O ATOM 2146 CB VAL A 132 8.250 2.931 6.667 1.00 0.00 C ATOM 2147 CG1 VAL A 132 7.770 1.500 6.480 1.00 0.00 C ATOM 2148 CG2 VAL A 132 7.557 3.864 5.684 1.00 0.00 C ATOM 0 H VAL A 132 6.005 3.890 8.412 1.00 0.00 H new ATOM 0 HA VAL A 132 8.680 2.821 8.775 1.00 0.00 H new ATOM 0 HB VAL A 132 9.321 2.965 6.465 1.00 0.00 H new ATOM 0 HG11 VAL A 132 7.940 1.191 5.449 1.00 0.00 H new ATOM 0 HG12 VAL A 132 8.320 0.841 7.151 1.00 0.00 H new ATOM 0 HG13 VAL A 132 6.705 1.441 6.706 1.00 0.00 H new ATOM 0 HG21 VAL A 132 7.735 3.517 4.666 1.00 0.00 H new ATOM 0 HG22 VAL A 132 6.485 3.871 5.883 1.00 0.00 H new ATOM 0 HG23 VAL A 132 7.954 4.873 5.798 1.00 0.00 H new ATOM 2158 N ARG A 133 9.624 5.150 8.550 1.00 0.00 N ATOM 2159 CA ARG A 133 10.108 6.516 8.710 1.00 0.00 C ATOM 2160 C ARG A 133 10.596 7.089 7.390 1.00 0.00 C ATOM 2161 O ARG A 133 10.822 6.354 6.431 1.00 0.00 O ATOM 2162 CB ARG A 133 11.256 6.565 9.707 1.00 0.00 C ATOM 2163 CG ARG A 133 11.017 7.506 10.877 1.00 0.00 C ATOM 2164 CD ARG A 133 11.603 6.954 12.166 1.00 0.00 C ATOM 2165 NE ARG A 133 11.310 7.811 13.312 1.00 0.00 N ATOM 2166 CZ ARG A 133 11.966 8.936 13.585 1.00 0.00 C ATOM 2167 NH1 ARG A 133 12.953 9.344 12.796 1.00 0.00 N ATOM 2168 NH2 ARG A 133 11.634 9.657 14.647 1.00 0.00 N ATOM 0 H ARG A 133 10.339 4.436 8.690 1.00 0.00 H new ATOM 0 HA ARG A 133 9.270 7.110 9.074 1.00 0.00 H new ATOM 0 HB2 ARG A 133 11.433 5.561 10.092 1.00 0.00 H new ATOM 0 HB3 ARG A 133 12.163 6.872 9.187 1.00 0.00 H new ATOM 0 HG2 ARG A 133 11.462 8.477 10.661 1.00 0.00 H new ATOM 0 HG3 ARG A 133 9.946 7.667 11.003 1.00 0.00 H new ATOM 0 HD2 ARG A 133 11.203 5.956 12.348 1.00 0.00 H new ATOM 0 HD3 ARG A 133 12.683 6.850 12.058 1.00 0.00 H new ATOM 0 HE ARG A 133 10.557 7.530 13.941 1.00 0.00 H new ATOM 0 HH11 ARG A 133 13.211 8.794 11.976 1.00 0.00 H new ATOM 0 HH12 ARG A 133 13.453 10.207 13.009 1.00 0.00 H new ATOM 0 HH21 ARG A 133 10.875 9.349 15.255 1.00 0.00 H new ATOM 0 HH22 ARG A 133 12.137 10.519 14.856 1.00 0.00 H new