USER MOD reduce.3.24.130724 H: found=0, std=0, add=673, rem=0, adj=11 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 110 THR OG1 : rot 174:sc= -0.511 USER MOD Set 1.2: A 113 GLN : amide:sc= 0.479 K(o=-0.032,f=-6.3!) USER MOD Single : A 32 TYR OH : rot 130:sc= -1.24 USER MOD Single : A 43 THR OG1 : rot 180:sc= -1.12 USER MOD Single : A 45 GLN :FLIP amide:sc= -0.338 F(o=-0.98,f=-0.34) USER MOD Single : A 46 GLN : amide:sc= -3.04! C(o=-3!,f=-4.7!) USER MOD Single : A 54 MET CE :methyl 147:sc= -13.8! (180deg=-16.9!) USER MOD Single : A 57 HIS : no HE2:sc= -2.41 K(o=-2.4,f=-7.8!) USER MOD Single : A 63 LYS NZ :NH3+ -164:sc=-0.00677 (180deg=-0.131) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 MET CE :methyl -132:sc= -5.28! (180deg=-9.04!) USER MOD Single : A 115 MET CE :methyl -175:sc= -0.0324 (180deg=-0.0632) USER MOD Single : A 123 HIS : no HD1:sc= -0.102 X(o=-0.1,f=-0.34) USER MOD Single : A 124 LYS NZ :NH3+ -169:sc= -0.164 (180deg=-0.314) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 THR OG1 : rot -60:sc= -0.581 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 507 N ASP A 31 7.165 12.331 9.004 1.00 0.00 N ATOM 508 CA ASP A 31 8.276 11.580 9.582 1.00 0.00 C ATOM 509 C ASP A 31 8.095 10.082 9.361 1.00 0.00 C ATOM 510 O ASP A 31 9.061 9.358 9.121 1.00 0.00 O ATOM 511 CB ASP A 31 8.393 11.875 11.078 1.00 0.00 C ATOM 512 CG ASP A 31 9.110 13.182 11.356 1.00 0.00 C ATOM 513 OD1 ASP A 31 10.357 13.204 11.271 1.00 0.00 O ATOM 514 OD2 ASP A 31 8.426 14.182 11.657 1.00 0.00 O ATOM 0 HA ASP A 31 9.193 11.894 9.083 1.00 0.00 H new ATOM 0 HB2 ASP A 31 7.396 11.910 11.517 1.00 0.00 H new ATOM 0 HB3 ASP A 31 8.928 11.060 11.565 1.00 0.00 H new ATOM 519 N TYR A 32 6.849 9.627 9.440 1.00 0.00 N ATOM 520 CA TYR A 32 6.536 8.217 9.245 1.00 0.00 C ATOM 521 C TYR A 32 5.733 8.017 7.965 1.00 0.00 C ATOM 522 O TYR A 32 5.295 8.983 7.339 1.00 0.00 O ATOM 523 CB TYR A 32 5.753 7.675 10.439 1.00 0.00 C ATOM 524 CG TYR A 32 6.619 7.329 11.628 1.00 0.00 C ATOM 525 CD1 TYR A 32 7.635 6.386 11.524 1.00 0.00 C ATOM 526 CD2 TYR A 32 6.417 7.941 12.859 1.00 0.00 C ATOM 527 CE1 TYR A 32 8.422 6.063 12.612 1.00 0.00 C ATOM 528 CE2 TYR A 32 7.201 7.624 13.951 1.00 0.00 C ATOM 529 CZ TYR A 32 8.201 6.685 13.823 1.00 0.00 C ATOM 530 OH TYR A 32 8.985 6.367 14.909 1.00 0.00 O ATOM 0 H TYR A 32 6.039 10.215 9.638 1.00 0.00 H new ATOM 0 HA TYR A 32 7.474 7.669 9.159 1.00 0.00 H new ATOM 0 HB2 TYR A 32 5.013 8.415 10.743 1.00 0.00 H new ATOM 0 HB3 TYR A 32 5.205 6.785 10.129 1.00 0.00 H new ATOM 0 HD1 TYR A 32 7.812 5.898 10.577 1.00 0.00 H new ATOM 0 HD2 TYR A 32 5.634 8.677 12.964 1.00 0.00 H new ATOM 0 HE1 TYR A 32 9.206 5.327 12.515 1.00 0.00 H new ATOM 0 HE2 TYR A 32 7.031 8.110 14.900 1.00 0.00 H new ATOM 0 HH TYR A 32 9.324 7.190 15.320 1.00 0.00 H new ATOM 540 N GLY A 33 5.544 6.760 7.580 1.00 0.00 N ATOM 541 CA GLY A 33 4.797 6.463 6.375 1.00 0.00 C ATOM 542 C GLY A 33 4.146 5.094 6.409 1.00 0.00 C ATOM 543 O GLY A 33 4.810 4.088 6.664 1.00 0.00 O ATOM 0 H GLY A 33 5.895 5.943 8.081 1.00 0.00 H new ATOM 0 HA2 GLY A 33 4.028 7.222 6.233 1.00 0.00 H new ATOM 0 HA3 GLY A 33 5.465 6.521 5.515 1.00 0.00 H new ATOM 547 N LEU A 34 2.845 5.055 6.140 1.00 0.00 N ATOM 548 CA LEU A 34 2.102 3.802 6.126 1.00 0.00 C ATOM 549 C LEU A 34 2.105 3.213 4.723 1.00 0.00 C ATOM 550 O LEU A 34 1.520 3.780 3.800 1.00 0.00 O ATOM 551 CB LEU A 34 0.663 4.030 6.597 1.00 0.00 C ATOM 552 CG LEU A 34 -0.101 2.776 7.033 1.00 0.00 C ATOM 553 CD1 LEU A 34 -0.655 2.044 5.821 1.00 0.00 C ATOM 554 CD2 LEU A 34 0.790 1.852 7.855 1.00 0.00 C ATOM 0 H LEU A 34 2.283 5.880 5.928 1.00 0.00 H new ATOM 0 HA LEU A 34 2.584 3.101 6.808 1.00 0.00 H new ATOM 0 HB2 LEU A 34 0.680 4.731 7.432 1.00 0.00 H new ATOM 0 HB3 LEU A 34 0.108 4.509 5.790 1.00 0.00 H new ATOM 0 HG LEU A 34 -0.935 3.088 7.662 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -1.195 1.155 6.148 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -1.334 2.702 5.278 1.00 0.00 H new ATOM 0 HD13 LEU A 34 0.166 1.750 5.167 1.00 0.00 H new ATOM 0 HD21 LEU A 34 0.223 0.969 8.152 1.00 0.00 H new ATOM 0 HD22 LEU A 34 1.649 1.548 7.257 1.00 0.00 H new ATOM 0 HD23 LEU A 34 1.136 2.377 8.745 1.00 0.00 H new ATOM 566 N VAL A 35 2.784 2.085 4.563 1.00 0.00 N ATOM 567 CA VAL A 35 2.882 1.436 3.264 1.00 0.00 C ATOM 568 C VAL A 35 1.940 0.247 3.145 1.00 0.00 C ATOM 569 O VAL A 35 1.714 -0.485 4.107 1.00 0.00 O ATOM 570 CB VAL A 35 4.316 0.944 2.995 1.00 0.00 C ATOM 571 CG1 VAL A 35 4.784 0.037 4.120 1.00 0.00 C ATOM 572 CG2 VAL A 35 4.394 0.217 1.660 1.00 0.00 C ATOM 0 H VAL A 35 3.274 1.602 5.316 1.00 0.00 H new ATOM 0 HA VAL A 35 2.600 2.189 2.528 1.00 0.00 H new ATOM 0 HB VAL A 35 4.974 1.812 2.951 1.00 0.00 H new ATOM 0 HG11 VAL A 35 5.799 -0.303 3.915 1.00 0.00 H new ATOM 0 HG12 VAL A 35 4.768 0.587 5.061 1.00 0.00 H new ATOM 0 HG13 VAL A 35 4.121 -0.825 4.192 1.00 0.00 H new ATOM 0 HG21 VAL A 35 5.416 -0.122 1.490 1.00 0.00 H new ATOM 0 HG22 VAL A 35 3.724 -0.643 1.674 1.00 0.00 H new ATOM 0 HG23 VAL A 35 4.098 0.894 0.859 1.00 0.00 H new ATOM 582 N ALA A 36 1.424 0.047 1.939 1.00 0.00 N ATOM 583 CA ALA A 36 0.540 -1.068 1.658 1.00 0.00 C ATOM 584 C ALA A 36 1.341 -2.207 1.040 1.00 0.00 C ATOM 585 O ALA A 36 1.901 -2.057 -0.045 1.00 0.00 O ATOM 586 CB ALA A 36 -0.583 -0.636 0.726 1.00 0.00 C ATOM 0 H ALA A 36 1.607 0.650 1.137 1.00 0.00 H new ATOM 0 HA ALA A 36 0.091 -1.413 2.589 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -1.237 -1.485 0.526 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -1.158 0.162 1.195 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -0.159 -0.275 -0.211 1.00 0.00 H new ATOM 592 N LEU A 37 1.414 -3.330 1.748 1.00 0.00 N ATOM 593 CA LEU A 37 2.171 -4.488 1.278 1.00 0.00 C ATOM 594 C LEU A 37 1.310 -5.431 0.440 1.00 0.00 C ATOM 595 O LEU A 37 1.650 -6.602 0.268 1.00 0.00 O ATOM 596 CB LEU A 37 2.756 -5.246 2.472 1.00 0.00 C ATOM 597 CG LEU A 37 3.311 -4.362 3.587 1.00 0.00 C ATOM 598 CD1 LEU A 37 3.413 -5.141 4.889 1.00 0.00 C ATOM 599 CD2 LEU A 37 4.666 -3.799 3.191 1.00 0.00 C ATOM 0 H LEU A 37 0.958 -3.464 2.650 1.00 0.00 H new ATOM 0 HA LEU A 37 2.976 -4.120 0.642 1.00 0.00 H new ATOM 0 HB2 LEU A 37 1.982 -5.889 2.890 1.00 0.00 H new ATOM 0 HB3 LEU A 37 3.553 -5.898 2.114 1.00 0.00 H new ATOM 0 HG LEU A 37 2.624 -3.530 3.742 1.00 0.00 H new ATOM 0 HD11 LEU A 37 3.810 -4.493 5.670 1.00 0.00 H new ATOM 0 HD12 LEU A 37 2.424 -5.495 5.180 1.00 0.00 H new ATOM 0 HD13 LEU A 37 4.078 -5.994 4.752 1.00 0.00 H new ATOM 0 HD21 LEU A 37 5.048 -3.171 3.996 1.00 0.00 H new ATOM 0 HD22 LEU A 37 5.361 -4.618 3.008 1.00 0.00 H new ATOM 0 HD23 LEU A 37 4.562 -3.203 2.284 1.00 0.00 H new ATOM 611 N GLU A 38 0.201 -4.924 -0.085 1.00 0.00 N ATOM 612 CA GLU A 38 -0.691 -5.734 -0.907 1.00 0.00 C ATOM 613 C GLU A 38 -1.653 -4.847 -1.695 1.00 0.00 C ATOM 614 O GLU A 38 -2.163 -3.857 -1.172 1.00 0.00 O ATOM 615 CB GLU A 38 -1.473 -6.715 -0.031 1.00 0.00 C ATOM 616 CG GLU A 38 -2.162 -7.819 -0.816 1.00 0.00 C ATOM 617 CD GLU A 38 -3.039 -8.695 0.057 1.00 0.00 C ATOM 618 OE1 GLU A 38 -2.731 -8.831 1.260 1.00 0.00 O ATOM 619 OE2 GLU A 38 -4.034 -9.243 -0.462 1.00 0.00 O ATOM 0 H GLU A 38 -0.102 -3.958 0.043 1.00 0.00 H new ATOM 0 HA GLU A 38 -0.086 -6.300 -1.616 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -0.792 -7.165 0.692 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -2.222 -6.164 0.537 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -2.769 -7.374 -1.605 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -1.409 -8.437 -1.304 1.00 0.00 H new ATOM 626 N PRO A 39 -1.913 -5.187 -2.972 1.00 0.00 N ATOM 627 CA PRO A 39 -2.816 -4.408 -3.826 1.00 0.00 C ATOM 628 C PRO A 39 -4.249 -4.398 -3.306 1.00 0.00 C ATOM 629 O PRO A 39 -4.808 -5.443 -2.974 1.00 0.00 O ATOM 630 CB PRO A 39 -2.743 -5.121 -5.180 1.00 0.00 C ATOM 631 CG PRO A 39 -2.258 -6.494 -4.867 1.00 0.00 C ATOM 632 CD PRO A 39 -1.347 -6.346 -3.683 1.00 0.00 C ATOM 0 HA PRO A 39 -2.523 -3.359 -3.868 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -3.719 -5.148 -5.665 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -2.063 -4.608 -5.860 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -3.090 -7.160 -4.639 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -1.728 -6.925 -5.717 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -1.346 -7.241 -3.060 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -0.315 -6.168 -3.987 1.00 0.00 H new ATOM 640 N ALA A 40 -4.840 -3.208 -3.241 1.00 0.00 N ATOM 641 CA ALA A 40 -6.209 -3.058 -2.764 1.00 0.00 C ATOM 642 C ALA A 40 -6.806 -1.729 -3.215 1.00 0.00 C ATOM 643 O ALA A 40 -6.105 -0.870 -3.748 1.00 0.00 O ATOM 644 CB ALA A 40 -6.256 -3.173 -1.248 1.00 0.00 C ATOM 0 H ALA A 40 -4.391 -2.334 -3.513 1.00 0.00 H new ATOM 0 HA ALA A 40 -6.807 -3.860 -3.196 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -7.285 -3.059 -0.906 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -5.879 -4.150 -0.945 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -5.638 -2.393 -0.805 1.00 0.00 H new ATOM 650 N TRP A 41 -8.107 -1.568 -2.993 1.00 0.00 N ATOM 651 CA TRP A 41 -8.803 -0.343 -3.371 1.00 0.00 C ATOM 652 C TRP A 41 -9.199 0.457 -2.134 1.00 0.00 C ATOM 653 O TRP A 41 -9.916 -0.040 -1.266 1.00 0.00 O ATOM 654 CB TRP A 41 -10.045 -0.675 -4.200 1.00 0.00 C ATOM 655 CG TRP A 41 -9.726 -1.186 -5.571 1.00 0.00 C ATOM 656 CD1 TRP A 41 -8.712 -0.768 -6.385 1.00 0.00 C ATOM 657 CD2 TRP A 41 -10.422 -2.210 -6.289 1.00 0.00 C ATOM 658 NE1 TRP A 41 -8.735 -1.470 -7.565 1.00 0.00 N ATOM 659 CE2 TRP A 41 -9.777 -2.360 -7.531 1.00 0.00 C ATOM 660 CE3 TRP A 41 -11.529 -3.013 -6.003 1.00 0.00 C ATOM 661 CZ2 TRP A 41 -10.201 -3.283 -8.484 1.00 0.00 C ATOM 662 CZ3 TRP A 41 -11.950 -3.928 -6.950 1.00 0.00 C ATOM 663 CH2 TRP A 41 -11.287 -4.057 -8.176 1.00 0.00 C ATOM 0 H TRP A 41 -8.701 -2.271 -2.553 1.00 0.00 H new ATOM 0 HA TRP A 41 -8.126 0.263 -3.973 1.00 0.00 H new ATOM 0 HB2 TRP A 41 -10.637 -1.422 -3.671 1.00 0.00 H new ATOM 0 HB3 TRP A 41 -10.663 0.218 -4.288 1.00 0.00 H new ATOM 0 HD1 TRP A 41 -7.997 0.002 -6.137 1.00 0.00 H new ATOM 0 HE1 TRP A 41 -8.083 -1.349 -8.340 1.00 0.00 H new ATOM 0 HE3 TRP A 41 -12.046 -2.921 -5.059 1.00 0.00 H new ATOM 0 HZ2 TRP A 41 -9.692 -3.384 -9.431 1.00 0.00 H new ATOM 0 HZ3 TRP A 41 -12.805 -4.554 -6.740 1.00 0.00 H new ATOM 0 HH2 TRP A 41 -11.640 -4.783 -8.894 1.00 0.00 H new ATOM 674 N ILE A 42 -8.727 1.697 -2.058 1.00 0.00 N ATOM 675 CA ILE A 42 -9.032 2.562 -0.924 1.00 0.00 C ATOM 676 C ILE A 42 -10.137 3.556 -1.264 1.00 0.00 C ATOM 677 O ILE A 42 -9.965 4.422 -2.122 1.00 0.00 O ATOM 678 CB ILE A 42 -7.786 3.338 -0.458 1.00 0.00 C ATOM 679 CG1 ILE A 42 -6.590 2.393 -0.314 1.00 0.00 C ATOM 680 CG2 ILE A 42 -8.066 4.052 0.857 1.00 0.00 C ATOM 681 CD1 ILE A 42 -6.748 1.379 0.798 1.00 0.00 C ATOM 0 H ILE A 42 -8.132 2.125 -2.768 1.00 0.00 H new ATOM 0 HA ILE A 42 -9.371 1.912 -0.118 1.00 0.00 H new ATOM 0 HB ILE A 42 -7.543 4.087 -1.211 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -6.439 1.866 -1.256 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -5.692 2.983 -0.131 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -7.176 4.596 1.173 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -8.890 4.753 0.722 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -8.333 3.320 1.619 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -5.863 0.744 0.840 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -6.868 1.898 1.749 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -7.627 0.763 0.607 1.00 0.00 H new ATOM 693 N THR A 43 -11.273 3.428 -0.585 1.00 0.00 N ATOM 694 CA THR A 43 -12.408 4.315 -0.811 1.00 0.00 C ATOM 695 C THR A 43 -12.202 5.652 -0.111 1.00 0.00 C ATOM 696 O THR A 43 -11.206 5.857 0.584 1.00 0.00 O ATOM 697 CB THR A 43 -13.696 3.667 -0.306 1.00 0.00 C ATOM 698 OG1 THR A 43 -13.431 2.802 0.784 1.00 0.00 O ATOM 699 CG2 THR A 43 -14.414 2.862 -1.364 1.00 0.00 C ATOM 0 H THR A 43 -11.432 2.716 0.128 1.00 0.00 H new ATOM 0 HA THR A 43 -12.488 4.491 -1.884 1.00 0.00 H new ATOM 0 HB THR A 43 -14.336 4.496 -0.005 1.00 0.00 H new ATOM 0 HG1 THR A 43 -14.269 2.399 1.093 1.00 0.00 H new ATOM 0 HG21 THR A 43 -15.320 2.429 -0.940 1.00 0.00 H new ATOM 0 HG22 THR A 43 -14.679 3.512 -2.198 1.00 0.00 H new ATOM 0 HG23 THR A 43 -13.762 2.064 -1.719 1.00 0.00 H new ATOM 707 N ALA A 44 -13.154 6.558 -0.299 1.00 0.00 N ATOM 708 CA ALA A 44 -13.085 7.875 0.315 1.00 0.00 C ATOM 709 C ALA A 44 -13.113 7.771 1.834 1.00 0.00 C ATOM 710 O ALA A 44 -12.372 8.467 2.528 1.00 0.00 O ATOM 711 CB ALA A 44 -14.229 8.748 -0.179 1.00 0.00 C ATOM 0 H ALA A 44 -13.983 6.403 -0.873 1.00 0.00 H new ATOM 0 HA ALA A 44 -12.141 8.337 0.026 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -14.165 9.731 0.289 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -14.163 8.856 -1.262 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -15.180 8.283 0.082 1.00 0.00 H new ATOM 717 N GLN A 45 -13.977 6.900 2.349 1.00 0.00 N ATOM 718 CA GLN A 45 -14.115 6.698 3.760 1.00 0.00 C ATOM 719 C GLN A 45 -12.806 6.265 4.408 1.00 0.00 C ATOM 720 O GLN A 45 -12.452 6.742 5.475 1.00 0.00 O ATOM 721 CB GLN A 45 -15.182 5.645 3.969 1.00 0.00 C ATOM 722 CG GLN A 45 -16.387 6.163 4.706 1.00 0.00 C ATOM 723 CD GLN A 45 -16.534 5.572 6.095 1.00 0.00 C ATOM 724 OE1 GLN A 45 -16.522 6.431 7.108 1.00 0.00 O flip ATOM 725 NE2 GLN A 45 -16.653 4.358 6.257 1.00 0.00 N flip ATOM 0 H GLN A 45 -14.597 6.320 1.784 1.00 0.00 H new ATOM 0 HA GLN A 45 -14.396 7.639 4.233 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -15.496 5.257 3.000 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -14.756 4.810 4.524 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -16.319 7.248 4.785 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -17.283 5.941 4.126 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -16.657 3.734 5.450 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -16.747 3.976 7.198 1.00 0.00 H new ATOM 734 N GLN A 46 -12.090 5.357 3.765 1.00 0.00 N ATOM 735 CA GLN A 46 -10.836 4.868 4.309 1.00 0.00 C ATOM 736 C GLN A 46 -9.846 6.010 4.515 1.00 0.00 C ATOM 737 O GLN A 46 -9.062 5.999 5.463 1.00 0.00 O ATOM 738 CB GLN A 46 -10.244 3.812 3.377 1.00 0.00 C ATOM 739 CG GLN A 46 -11.229 2.711 3.015 1.00 0.00 C ATOM 740 CD GLN A 46 -10.613 1.328 3.085 1.00 0.00 C ATOM 741 OE1 GLN A 46 -10.293 0.832 4.165 1.00 0.00 O ATOM 742 NE2 GLN A 46 -10.447 0.695 1.929 1.00 0.00 N ATOM 0 H GLN A 46 -12.355 4.946 2.870 1.00 0.00 H new ATOM 0 HA GLN A 46 -11.034 4.417 5.281 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -9.898 4.296 2.464 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -9.370 3.367 3.852 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -12.084 2.758 3.690 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -11.608 2.885 2.008 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -10.727 1.144 1.057 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -10.040 -0.240 1.913 1.00 0.00 H new ATOM 751 N ILE A 47 -9.890 6.996 3.627 1.00 0.00 N ATOM 752 CA ILE A 47 -8.997 8.144 3.723 1.00 0.00 C ATOM 753 C ILE A 47 -9.376 9.055 4.889 1.00 0.00 C ATOM 754 O ILE A 47 -8.525 9.428 5.697 1.00 0.00 O ATOM 755 CB ILE A 47 -8.997 8.966 2.419 1.00 0.00 C ATOM 756 CG1 ILE A 47 -8.755 8.054 1.214 1.00 0.00 C ATOM 757 CG2 ILE A 47 -7.942 10.061 2.481 1.00 0.00 C ATOM 758 CD1 ILE A 47 -9.259 8.631 -0.092 1.00 0.00 C ATOM 0 H ILE A 47 -10.532 7.024 2.835 1.00 0.00 H new ATOM 0 HA ILE A 47 -7.997 7.747 3.895 1.00 0.00 H new ATOM 0 HB ILE A 47 -9.974 9.436 2.305 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -7.687 7.857 1.126 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -9.243 7.095 1.390 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -7.955 10.632 1.553 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -8.156 10.725 3.319 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -6.958 9.611 2.616 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -9.054 7.931 -0.902 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -10.333 8.802 -0.024 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -8.753 9.576 -0.292 1.00 0.00 H new ATOM 770 N GLU A 48 -10.653 9.418 4.970 1.00 0.00 N ATOM 771 CA GLU A 48 -11.135 10.294 6.036 1.00 0.00 C ATOM 772 C GLU A 48 -11.432 9.512 7.313 1.00 0.00 C ATOM 773 O GLU A 48 -11.037 9.918 8.406 1.00 0.00 O ATOM 774 CB GLU A 48 -12.390 11.039 5.581 1.00 0.00 C ATOM 775 CG GLU A 48 -12.494 12.452 6.135 1.00 0.00 C ATOM 776 CD GLU A 48 -12.571 13.503 5.045 1.00 0.00 C ATOM 777 OE1 GLU A 48 -11.752 13.444 4.103 1.00 0.00 O ATOM 778 OE2 GLU A 48 -13.452 14.384 5.132 1.00 0.00 O ATOM 0 H GLU A 48 -11.373 9.120 4.312 1.00 0.00 H new ATOM 0 HA GLU A 48 -10.346 11.013 6.255 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -12.401 11.083 4.492 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -13.270 10.472 5.886 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -13.378 12.526 6.768 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -11.630 12.654 6.769 1.00 0.00 H new ATOM 785 N ALA A 49 -12.135 8.393 7.169 1.00 0.00 N ATOM 786 CA ALA A 49 -12.492 7.554 8.310 1.00 0.00 C ATOM 787 C ALA A 49 -11.256 7.162 9.114 1.00 0.00 C ATOM 788 O ALA A 49 -11.243 7.264 10.340 1.00 0.00 O ATOM 789 CB ALA A 49 -13.240 6.308 7.845 1.00 0.00 C ATOM 0 H ALA A 49 -12.470 8.045 6.271 1.00 0.00 H new ATOM 0 HA ALA A 49 -13.148 8.134 8.960 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -13.498 5.695 8.709 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -14.151 6.604 7.325 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -12.606 5.734 7.169 1.00 0.00 H new ATOM 795 N ALA A 50 -10.219 6.716 8.414 1.00 0.00 N ATOM 796 CA ALA A 50 -8.978 6.313 9.061 1.00 0.00 C ATOM 797 C ALA A 50 -8.290 7.507 9.715 1.00 0.00 C ATOM 798 O ALA A 50 -7.766 7.403 10.824 1.00 0.00 O ATOM 799 CB ALA A 50 -8.048 5.651 8.057 1.00 0.00 C ATOM 0 H ALA A 50 -10.214 6.625 7.398 1.00 0.00 H new ATOM 0 HA ALA A 50 -9.221 5.592 9.842 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -7.125 5.356 8.556 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -8.533 4.769 7.639 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -7.819 6.353 7.256 1.00 0.00 H new ATOM 805 N ARG A 51 -8.301 8.643 9.023 1.00 0.00 N ATOM 806 CA ARG A 51 -7.681 9.857 9.539 1.00 0.00 C ATOM 807 C ARG A 51 -8.317 10.267 10.863 1.00 0.00 C ATOM 808 O ARG A 51 -7.624 10.674 11.796 1.00 0.00 O ATOM 809 CB ARG A 51 -7.811 10.994 8.523 1.00 0.00 C ATOM 810 CG ARG A 51 -6.600 11.913 8.483 1.00 0.00 C ATOM 811 CD ARG A 51 -6.742 12.973 7.403 1.00 0.00 C ATOM 812 NE ARG A 51 -7.921 13.812 7.611 1.00 0.00 N ATOM 813 CZ ARG A 51 -7.972 14.815 8.483 1.00 0.00 C ATOM 814 NH1 ARG A 51 -6.916 15.109 9.232 1.00 0.00 N ATOM 815 NH2 ARG A 51 -9.083 15.528 8.609 1.00 0.00 N ATOM 0 H ARG A 51 -8.732 8.747 8.105 1.00 0.00 H new ATOM 0 HA ARG A 51 -6.624 9.653 9.710 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -7.967 10.569 7.532 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -8.697 11.583 8.760 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -6.475 12.394 9.453 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -5.701 11.324 8.301 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -5.850 13.599 7.390 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -6.808 12.491 6.428 1.00 0.00 H new ATOM 0 HE ARG A 51 -8.753 13.617 7.055 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -6.058 14.564 9.141 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -6.962 15.880 9.899 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -9.898 15.307 8.037 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -9.122 16.297 9.278 1.00 0.00 H new ATOM 829 N VAL A 52 -9.639 10.153 10.939 1.00 0.00 N ATOM 830 CA VAL A 52 -10.369 10.506 12.150 1.00 0.00 C ATOM 831 C VAL A 52 -9.880 9.685 13.339 1.00 0.00 C ATOM 832 O VAL A 52 -9.718 10.207 14.443 1.00 0.00 O ATOM 833 CB VAL A 52 -11.884 10.286 11.975 1.00 0.00 C ATOM 834 CG1 VAL A 52 -12.641 10.764 13.206 1.00 0.00 C ATOM 835 CG2 VAL A 52 -12.386 10.994 10.724 1.00 0.00 C ATOM 0 H VAL A 52 -10.227 9.819 10.175 1.00 0.00 H new ATOM 0 HA VAL A 52 -10.184 11.563 12.339 1.00 0.00 H new ATOM 0 HB VAL A 52 -12.065 9.217 11.858 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -13.709 10.600 13.063 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -12.302 10.208 14.080 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -12.454 11.827 13.358 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -13.458 10.827 10.617 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -12.192 12.063 10.808 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -11.868 10.599 9.850 1.00 0.00 H new ATOM 845 N ALA A 53 -9.643 8.400 13.103 1.00 0.00 N ATOM 846 CA ALA A 53 -9.169 7.505 14.150 1.00 0.00 C ATOM 847 C ALA A 53 -7.732 7.836 14.540 1.00 0.00 C ATOM 848 O ALA A 53 -7.366 7.777 15.714 1.00 0.00 O ATOM 849 CB ALA A 53 -9.274 6.057 13.692 1.00 0.00 C ATOM 0 H ALA A 53 -9.772 7.955 12.194 1.00 0.00 H new ATOM 0 HA ALA A 53 -9.799 7.643 15.029 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -8.917 5.398 14.483 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -10.314 5.821 13.466 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -8.667 5.913 12.798 1.00 0.00 H new ATOM 855 N MET A 54 -6.924 8.184 13.545 1.00 0.00 N ATOM 856 CA MET A 54 -5.524 8.526 13.776 1.00 0.00 C ATOM 857 C MET A 54 -5.397 9.870 14.486 1.00 0.00 C ATOM 858 O MET A 54 -4.694 9.989 15.489 1.00 0.00 O ATOM 859 CB MET A 54 -4.765 8.561 12.450 1.00 0.00 C ATOM 860 CG MET A 54 -4.680 7.208 11.765 1.00 0.00 C ATOM 861 SD MET A 54 -3.362 7.133 10.538 1.00 0.00 S ATOM 862 CE MET A 54 -4.080 8.105 9.217 1.00 0.00 C ATOM 0 H MET A 54 -7.214 8.237 12.569 1.00 0.00 H new ATOM 0 HA MET A 54 -5.090 7.759 14.418 1.00 0.00 H new ATOM 0 HB2 MET A 54 -5.253 9.269 11.780 1.00 0.00 H new ATOM 0 HB3 MET A 54 -3.756 8.934 12.628 1.00 0.00 H new ATOM 0 HG2 MET A 54 -4.517 6.435 12.516 1.00 0.00 H new ATOM 0 HG3 MET A 54 -5.633 6.989 11.283 1.00 0.00 H new ATOM 0 HE1 MET A 54 -3.291 8.640 8.689 1.00 0.00 H new ATOM 0 HE2 MET A 54 -4.600 7.446 8.522 1.00 0.00 H new ATOM 0 HE3 MET A 54 -4.787 8.821 9.635 1.00 0.00 H new ATOM 872 N VAL A 55 -6.079 10.882 13.957 1.00 0.00 N ATOM 873 CA VAL A 55 -6.037 12.220 14.539 1.00 0.00 C ATOM 874 C VAL A 55 -6.477 12.199 15.999 1.00 0.00 C ATOM 875 O VAL A 55 -5.931 12.923 16.832 1.00 0.00 O ATOM 876 CB VAL A 55 -6.937 13.200 13.758 1.00 0.00 C ATOM 877 CG1 VAL A 55 -6.802 14.610 14.313 1.00 0.00 C ATOM 878 CG2 VAL A 55 -6.600 13.171 12.275 1.00 0.00 C ATOM 0 H VAL A 55 -6.667 10.801 13.127 1.00 0.00 H new ATOM 0 HA VAL A 55 -5.003 12.559 14.479 1.00 0.00 H new ATOM 0 HB VAL A 55 -7.973 12.884 13.879 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -7.444 15.286 13.749 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -7.099 14.618 15.362 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -5.766 14.937 14.227 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -7.245 13.869 11.741 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -5.558 13.459 12.133 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -6.754 12.164 11.886 1.00 0.00 H new ATOM 888 N ARG A 56 -7.466 11.367 16.303 1.00 0.00 N ATOM 889 CA ARG A 56 -7.980 11.252 17.661 1.00 0.00 C ATOM 890 C ARG A 56 -7.019 10.469 18.551 1.00 0.00 C ATOM 891 O ARG A 56 -6.956 10.691 19.760 1.00 0.00 O ATOM 892 CB ARG A 56 -9.350 10.573 17.649 1.00 0.00 C ATOM 893 CG ARG A 56 -10.501 11.528 17.375 1.00 0.00 C ATOM 894 CD ARG A 56 -11.792 10.777 17.092 1.00 0.00 C ATOM 895 NE ARG A 56 -12.555 10.523 18.311 1.00 0.00 N ATOM 896 CZ ARG A 56 -13.725 9.888 18.335 1.00 0.00 C ATOM 897 NH1 ARG A 56 -14.267 9.440 17.210 1.00 0.00 N ATOM 898 NH2 ARG A 56 -14.353 9.699 19.487 1.00 0.00 N ATOM 0 H ARG A 56 -7.928 10.761 15.625 1.00 0.00 H new ATOM 0 HA ARG A 56 -8.079 12.258 18.070 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -9.351 9.789 16.891 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -9.514 10.087 18.611 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -10.642 12.186 18.233 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -10.254 12.163 16.524 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -12.402 11.353 16.396 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -11.561 9.830 16.605 1.00 0.00 H new ATOM 0 HE ARG A 56 -12.169 10.851 19.196 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -13.787 9.581 16.321 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -15.164 8.954 17.234 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -13.940 10.040 20.355 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -15.249 9.213 19.505 1.00 0.00 H new ATOM 912 N HIS A 57 -6.274 9.549 17.945 1.00 0.00 N ATOM 913 CA HIS A 57 -5.319 8.731 18.686 1.00 0.00 C ATOM 914 C HIS A 57 -4.239 9.593 19.334 1.00 0.00 C ATOM 915 O HIS A 57 -3.992 9.491 20.536 1.00 0.00 O ATOM 916 CB HIS A 57 -4.675 7.697 17.763 1.00 0.00 C ATOM 917 CG HIS A 57 -4.081 6.533 18.494 1.00 0.00 C ATOM 918 ND1 HIS A 57 -4.784 5.782 19.412 1.00 0.00 N ATOM 919 CD2 HIS A 57 -2.840 5.991 18.439 1.00 0.00 C ATOM 920 CE1 HIS A 57 -4.002 4.832 19.892 1.00 0.00 C ATOM 921 NE2 HIS A 57 -2.818 4.936 19.317 1.00 0.00 N ATOM 0 H HIS A 57 -6.313 9.351 16.945 1.00 0.00 H new ATOM 0 HA HIS A 57 -5.865 8.215 19.476 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -5.424 7.331 17.061 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -3.896 8.182 17.174 1.00 0.00 H new ATOM 0 HD1 HIS A 57 -5.756 5.936 19.679 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -2.021 6.327 17.820 1.00 0.00 H new ATOM 0 HE1 HIS A 57 -4.283 4.095 20.630 1.00 0.00 H new ATOM 930 N PHE A 58 -3.598 10.439 18.533 1.00 0.00 N ATOM 931 CA PHE A 58 -2.542 11.314 19.035 1.00 0.00 C ATOM 932 C PHE A 58 -3.054 12.180 20.183 1.00 0.00 C ATOM 933 O PHE A 58 -3.858 13.089 19.977 1.00 0.00 O ATOM 934 CB PHE A 58 -2.001 12.205 17.913 1.00 0.00 C ATOM 935 CG PHE A 58 -1.815 11.489 16.604 1.00 0.00 C ATOM 936 CD1 PHE A 58 -0.828 10.526 16.456 1.00 0.00 C ATOM 937 CD2 PHE A 58 -2.630 11.780 15.522 1.00 0.00 C ATOM 938 CE1 PHE A 58 -0.659 9.868 15.252 1.00 0.00 C ATOM 939 CE2 PHE A 58 -2.464 11.124 14.317 1.00 0.00 C ATOM 940 CZ PHE A 58 -1.478 10.168 14.182 1.00 0.00 C ATOM 0 H PHE A 58 -3.790 10.538 17.536 1.00 0.00 H new ATOM 0 HA PHE A 58 -1.734 10.684 19.407 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -2.684 13.041 17.765 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -1.045 12.626 18.225 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -0.185 10.288 17.290 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -3.403 12.527 15.621 1.00 0.00 H new ATOM 0 HE1 PHE A 58 0.113 9.120 15.149 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -3.106 11.360 13.481 1.00 0.00 H new ATOM 0 HZ PHE A 58 -1.347 9.655 13.241 1.00 0.00 H new ATOM 950 N ARG A 59 -2.582 11.892 21.392 1.00 0.00 N ATOM 951 CA ARG A 59 -2.992 12.645 22.572 1.00 0.00 C ATOM 952 C ARG A 59 -2.428 14.060 22.540 1.00 0.00 C ATOM 953 O ARG A 59 -3.057 15.002 23.026 1.00 0.00 O ATOM 954 CB ARG A 59 -2.532 11.930 23.845 1.00 0.00 C ATOM 955 CG ARG A 59 -3.242 10.610 24.092 1.00 0.00 C ATOM 956 CD ARG A 59 -2.849 10.008 25.433 1.00 0.00 C ATOM 957 NE ARG A 59 -3.280 10.839 26.556 1.00 0.00 N ATOM 958 CZ ARG A 59 -2.559 11.835 27.067 1.00 0.00 C ATOM 959 NH1 ARG A 59 -1.370 12.136 26.558 1.00 0.00 N ATOM 960 NH2 ARG A 59 -3.030 12.535 28.090 1.00 0.00 N ATOM 0 H ARG A 59 -1.916 11.143 21.580 1.00 0.00 H new ATOM 0 HA ARG A 59 -4.080 12.707 22.570 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -1.459 11.750 23.783 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -2.696 12.586 24.700 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -4.321 10.765 24.064 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -2.999 9.910 23.293 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -3.289 9.015 25.527 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -1.767 9.882 25.470 1.00 0.00 H new ATOM 0 HE ARG A 59 -4.190 10.644 26.974 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -1.003 11.603 25.770 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -0.824 12.900 26.955 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -3.943 12.310 28.484 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -2.479 13.298 28.483 1.00 0.00 H new ATOM 974 N ARG A 60 -1.239 14.206 21.965 1.00 0.00 N ATOM 975 CA ARG A 60 -0.590 15.509 21.872 1.00 0.00 C ATOM 976 C ARG A 60 -0.819 16.134 20.500 1.00 0.00 C ATOM 977 O ARG A 60 0.039 16.848 19.981 1.00 0.00 O ATOM 978 CB ARG A 60 0.911 15.374 22.139 1.00 0.00 C ATOM 979 CG ARG A 60 1.238 14.928 23.556 1.00 0.00 C ATOM 980 CD ARG A 60 2.210 13.760 23.565 1.00 0.00 C ATOM 981 NE ARG A 60 2.934 13.658 24.829 1.00 0.00 N ATOM 982 CZ ARG A 60 3.981 14.415 25.147 1.00 0.00 C ATOM 983 NH1 ARG A 60 4.430 15.331 24.296 1.00 0.00 N ATOM 984 NH2 ARG A 60 4.582 14.258 26.318 1.00 0.00 N ATOM 0 H ARG A 60 -0.705 13.439 21.557 1.00 0.00 H new ATOM 0 HA ARG A 60 -1.030 16.161 22.627 1.00 0.00 H new ATOM 0 HB2 ARG A 60 1.334 14.658 21.435 1.00 0.00 H new ATOM 0 HB3 ARG A 60 1.394 16.332 21.948 1.00 0.00 H new ATOM 0 HG2 ARG A 60 1.666 15.763 24.111 1.00 0.00 H new ATOM 0 HG3 ARG A 60 0.320 14.642 24.069 1.00 0.00 H new ATOM 0 HD2 ARG A 60 1.665 12.834 23.384 1.00 0.00 H new ATOM 0 HD3 ARG A 60 2.922 13.875 22.748 1.00 0.00 H new ATOM 0 HE ARG A 60 2.618 12.966 25.508 1.00 0.00 H new ATOM 0 HH11 ARG A 60 3.972 15.457 23.393 1.00 0.00 H new ATOM 0 HH12 ARG A 60 5.233 15.908 24.545 1.00 0.00 H new ATOM 0 HH21 ARG A 60 4.242 13.557 26.976 1.00 0.00 H new ATOM 0 HH22 ARG A 60 5.385 14.839 26.561 1.00 0.00 H new ATOM 998 N GLY A 61 -1.983 15.862 19.919 1.00 0.00 N ATOM 999 CA GLY A 61 -2.304 16.405 18.612 1.00 0.00 C ATOM 1000 C GLY A 61 -1.337 15.944 17.539 1.00 0.00 C ATOM 1001 O GLY A 61 -0.194 15.596 17.832 1.00 0.00 O ATOM 0 H GLY A 61 -2.709 15.275 20.330 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -3.316 16.107 18.337 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -2.294 17.494 18.662 1.00 0.00 H new ATOM 1005 N GLY A 62 -1.798 15.943 16.292 1.00 0.00 N ATOM 1006 CA GLY A 62 -0.954 15.519 15.191 1.00 0.00 C ATOM 1007 C GLY A 62 -1.611 15.731 13.843 1.00 0.00 C ATOM 1008 O GLY A 62 -2.835 15.812 13.747 1.00 0.00 O ATOM 0 H GLY A 62 -2.740 16.228 16.025 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -0.014 16.070 15.224 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -0.709 14.464 15.310 1.00 0.00 H new ATOM 1012 N LYS A 63 -0.795 15.823 12.797 1.00 0.00 N ATOM 1013 CA LYS A 63 -1.304 16.026 11.446 1.00 0.00 C ATOM 1014 C LYS A 63 -0.855 14.901 10.522 1.00 0.00 C ATOM 1015 O LYS A 63 0.299 14.471 10.565 1.00 0.00 O ATOM 1016 CB LYS A 63 -0.832 17.374 10.897 1.00 0.00 C ATOM 1017 CG LYS A 63 0.681 17.521 10.863 1.00 0.00 C ATOM 1018 CD LYS A 63 1.098 18.982 10.854 1.00 0.00 C ATOM 1019 CE LYS A 63 2.559 19.147 11.237 1.00 0.00 C ATOM 1020 NZ LYS A 63 2.786 18.894 12.687 1.00 0.00 N ATOM 0 H LYS A 63 0.221 15.760 12.860 1.00 0.00 H new ATOM 0 HA LYS A 63 -2.393 16.022 11.490 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -1.224 17.503 9.888 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -1.253 18.173 11.507 1.00 0.00 H new ATOM 0 HG2 LYS A 63 1.116 17.023 11.730 1.00 0.00 H new ATOM 0 HG3 LYS A 63 1.076 17.023 9.978 1.00 0.00 H new ATOM 0 HD2 LYS A 63 0.931 19.403 9.862 1.00 0.00 H new ATOM 0 HD3 LYS A 63 0.473 19.544 11.548 1.00 0.00 H new ATOM 0 HE2 LYS A 63 3.168 18.460 10.649 1.00 0.00 H new ATOM 0 HE3 LYS A 63 2.887 20.156 10.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 3.715 19.271 12.964 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 2.042 19.363 13.242 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 2.760 17.870 12.869 1.00 0.00 H new ATOM 1034 N ILE A 64 -1.773 14.427 9.685 1.00 0.00 N ATOM 1035 CA ILE A 64 -1.469 13.350 8.749 1.00 0.00 C ATOM 1036 C ILE A 64 -1.477 13.855 7.311 1.00 0.00 C ATOM 1037 O ILE A 64 -2.277 14.719 6.950 1.00 0.00 O ATOM 1038 CB ILE A 64 -2.474 12.186 8.868 1.00 0.00 C ATOM 1039 CG1 ILE A 64 -2.901 11.978 10.322 1.00 0.00 C ATOM 1040 CG2 ILE A 64 -1.871 10.909 8.306 1.00 0.00 C ATOM 1041 CD1 ILE A 64 -3.897 10.852 10.499 1.00 0.00 C ATOM 0 H ILE A 64 -2.732 14.771 9.636 1.00 0.00 H new ATOM 0 HA ILE A 64 -0.474 12.988 9.008 1.00 0.00 H new ATOM 0 HB ILE A 64 -3.361 12.441 8.287 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -2.018 11.771 10.926 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -3.337 12.902 10.701 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -2.591 10.096 8.397 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -1.621 11.057 7.255 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -0.968 10.657 8.862 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -4.157 10.759 11.553 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -4.796 11.067 9.921 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -3.456 9.918 10.150 1.00 0.00 H new ATOM 1053 N PHE A 65 -0.588 13.304 6.493 1.00 0.00 N ATOM 1054 CA PHE A 65 -0.497 13.691 5.091 1.00 0.00 C ATOM 1055 C PHE A 65 -0.985 12.560 4.191 1.00 0.00 C ATOM 1056 O PHE A 65 -0.329 11.527 4.068 1.00 0.00 O ATOM 1057 CB PHE A 65 0.944 14.059 4.732 1.00 0.00 C ATOM 1058 CG PHE A 65 1.529 15.123 5.618 1.00 0.00 C ATOM 1059 CD1 PHE A 65 1.285 16.463 5.365 1.00 0.00 C ATOM 1060 CD2 PHE A 65 2.324 14.782 6.700 1.00 0.00 C ATOM 1061 CE1 PHE A 65 1.821 17.444 6.178 1.00 0.00 C ATOM 1062 CE2 PHE A 65 2.863 15.758 7.516 1.00 0.00 C ATOM 1063 CZ PHE A 65 2.612 17.091 7.254 1.00 0.00 C ATOM 0 H PHE A 65 0.080 12.588 6.777 1.00 0.00 H new ATOM 0 HA PHE A 65 -1.133 14.562 4.935 1.00 0.00 H new ATOM 0 HB2 PHE A 65 1.565 13.165 4.792 1.00 0.00 H new ATOM 0 HB3 PHE A 65 0.977 14.400 3.697 1.00 0.00 H new ATOM 0 HD1 PHE A 65 0.669 16.744 4.523 1.00 0.00 H new ATOM 0 HD2 PHE A 65 2.525 13.741 6.908 1.00 0.00 H new ATOM 0 HE1 PHE A 65 1.622 18.485 5.972 1.00 0.00 H new ATOM 0 HE2 PHE A 65 3.480 15.479 8.358 1.00 0.00 H new ATOM 0 HZ PHE A 65 3.034 17.856 7.889 1.00 0.00 H new ATOM 1073 N ILE A 66 -2.143 12.760 3.572 1.00 0.00 N ATOM 1074 CA ILE A 66 -2.719 11.751 2.690 1.00 0.00 C ATOM 1075 C ILE A 66 -2.383 12.042 1.232 1.00 0.00 C ATOM 1076 O ILE A 66 -2.585 13.156 0.748 1.00 0.00 O ATOM 1077 CB ILE A 66 -4.253 11.663 2.844 1.00 0.00 C ATOM 1078 CG1 ILE A 66 -4.672 11.985 4.282 1.00 0.00 C ATOM 1079 CG2 ILE A 66 -4.745 10.279 2.443 1.00 0.00 C ATOM 1080 CD1 ILE A 66 -4.016 11.098 5.316 1.00 0.00 C ATOM 0 H ILE A 66 -2.700 13.609 3.664 1.00 0.00 H new ATOM 0 HA ILE A 66 -2.282 10.796 2.982 1.00 0.00 H new ATOM 0 HB ILE A 66 -4.709 12.400 2.183 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -4.427 13.025 4.499 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -5.754 11.888 4.367 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -5.828 10.231 2.556 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -4.480 10.086 1.404 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -4.280 9.528 3.082 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -4.359 11.383 6.310 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -4.282 10.058 5.125 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -2.933 11.212 5.259 1.00 0.00 H new ATOM 1092 N ARG A 67 -1.870 11.033 0.535 1.00 0.00 N ATOM 1093 CA ARG A 67 -1.505 11.180 -0.868 1.00 0.00 C ATOM 1094 C ARG A 67 -2.299 10.216 -1.745 1.00 0.00 C ATOM 1095 O ARG A 67 -1.829 9.791 -2.800 1.00 0.00 O ATOM 1096 CB ARG A 67 -0.006 10.938 -1.054 1.00 0.00 C ATOM 1097 CG ARG A 67 0.859 12.104 -0.602 1.00 0.00 C ATOM 1098 CD ARG A 67 1.624 12.718 -1.763 1.00 0.00 C ATOM 1099 NE ARG A 67 0.744 13.067 -2.876 1.00 0.00 N ATOM 1100 CZ ARG A 67 1.178 13.413 -4.086 1.00 0.00 C ATOM 1101 NH1 ARG A 67 2.480 13.457 -4.343 1.00 0.00 N ATOM 1102 NH2 ARG A 67 0.310 13.714 -5.041 1.00 0.00 N ATOM 0 H ARG A 67 -1.698 10.104 0.920 1.00 0.00 H new ATOM 0 HA ARG A 67 -1.744 12.199 -1.173 1.00 0.00 H new ATOM 0 HB2 ARG A 67 0.281 10.046 -0.497 1.00 0.00 H new ATOM 0 HB3 ARG A 67 0.193 10.735 -2.106 1.00 0.00 H new ATOM 0 HG2 ARG A 67 0.231 12.864 -0.137 1.00 0.00 H new ATOM 0 HG3 ARG A 67 1.562 11.763 0.158 1.00 0.00 H new ATOM 0 HD2 ARG A 67 2.147 13.611 -1.421 1.00 0.00 H new ATOM 0 HD3 ARG A 67 2.384 12.016 -2.108 1.00 0.00 H new ATOM 0 HE ARG A 67 -0.263 13.044 -2.716 1.00 0.00 H new ATOM 0 HH11 ARG A 67 3.152 13.225 -3.612 1.00 0.00 H new ATOM 0 HH12 ARG A 67 2.808 13.723 -5.272 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -0.691 13.681 -4.849 1.00 0.00 H new ATOM 0 HH22 ARG A 67 0.643 13.979 -5.968 1.00 0.00 H new ATOM 1116 N ILE A 68 -3.506 9.873 -1.302 1.00 0.00 N ATOM 1117 CA ILE A 68 -4.362 8.961 -2.050 1.00 0.00 C ATOM 1118 C ILE A 68 -5.748 9.561 -2.268 1.00 0.00 C ATOM 1119 O ILE A 68 -6.379 10.047 -1.329 1.00 0.00 O ATOM 1120 CB ILE A 68 -4.505 7.602 -1.335 1.00 0.00 C ATOM 1121 CG1 ILE A 68 -5.142 7.785 0.044 1.00 0.00 C ATOM 1122 CG2 ILE A 68 -3.148 6.925 -1.212 1.00 0.00 C ATOM 1123 CD1 ILE A 68 -5.321 6.488 0.804 1.00 0.00 C ATOM 0 H ILE A 68 -3.911 10.213 -0.430 1.00 0.00 H new ATOM 0 HA ILE A 68 -3.883 8.801 -3.016 1.00 0.00 H new ATOM 0 HB ILE A 68 -5.158 6.964 -1.931 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -4.523 8.460 0.635 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -6.114 8.265 -0.074 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -3.264 5.967 -0.705 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -2.731 6.762 -2.206 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -2.475 7.561 -0.636 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -5.778 6.694 1.772 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -5.965 5.818 0.234 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -4.349 6.017 0.954 1.00 0.00 H new ATOM 1135 N PHE A 69 -6.214 9.523 -3.511 1.00 0.00 N ATOM 1136 CA PHE A 69 -7.524 10.063 -3.854 1.00 0.00 C ATOM 1137 C PHE A 69 -8.320 9.061 -4.689 1.00 0.00 C ATOM 1138 O PHE A 69 -7.777 8.432 -5.597 1.00 0.00 O ATOM 1139 CB PHE A 69 -7.370 11.379 -4.618 1.00 0.00 C ATOM 1140 CG PHE A 69 -7.885 12.572 -3.865 1.00 0.00 C ATOM 1141 CD1 PHE A 69 -9.229 12.906 -3.909 1.00 0.00 C ATOM 1142 CD2 PHE A 69 -7.026 13.358 -3.116 1.00 0.00 C ATOM 1143 CE1 PHE A 69 -9.707 14.003 -3.217 1.00 0.00 C ATOM 1144 CE2 PHE A 69 -7.498 14.456 -2.422 1.00 0.00 C ATOM 1145 CZ PHE A 69 -8.839 14.780 -2.473 1.00 0.00 C ATOM 0 H PHE A 69 -5.704 9.124 -4.299 1.00 0.00 H new ATOM 0 HA PHE A 69 -8.070 10.252 -2.929 1.00 0.00 H new ATOM 0 HB2 PHE A 69 -6.317 11.533 -4.851 1.00 0.00 H new ATOM 0 HB3 PHE A 69 -7.899 11.303 -5.568 1.00 0.00 H new ATOM 0 HD1 PHE A 69 -9.911 12.303 -4.490 1.00 0.00 H new ATOM 0 HD2 PHE A 69 -5.976 13.110 -3.074 1.00 0.00 H new ATOM 0 HE1 PHE A 69 -10.757 14.253 -3.258 1.00 0.00 H new ATOM 0 HE2 PHE A 69 -6.818 15.060 -1.840 1.00 0.00 H new ATOM 0 HZ PHE A 69 -9.209 15.639 -1.933 1.00 0.00 H new ATOM 1155 N PRO A 70 -9.622 8.896 -4.394 1.00 0.00 N ATOM 1156 CA PRO A 70 -10.481 7.962 -5.127 1.00 0.00 C ATOM 1157 C PRO A 70 -10.788 8.450 -6.540 1.00 0.00 C ATOM 1158 O PRO A 70 -11.599 9.357 -6.730 1.00 0.00 O ATOM 1159 CB PRO A 70 -11.758 7.920 -4.287 1.00 0.00 C ATOM 1160 CG PRO A 70 -11.793 9.233 -3.586 1.00 0.00 C ATOM 1161 CD PRO A 70 -10.357 9.602 -3.327 1.00 0.00 C ATOM 0 HA PRO A 70 -10.009 6.988 -5.257 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -12.639 7.782 -4.913 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -11.738 7.093 -3.578 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -12.286 9.989 -4.197 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -12.352 9.163 -2.653 1.00 0.00 H new ATOM 0 HD2 PRO A 70 -10.204 10.680 -3.380 1.00 0.00 H new ATOM 0 HD3 PRO A 70 -10.033 9.282 -2.337 1.00 0.00 H new ATOM 1539 N VAL A 94 -12.384 4.511 -5.850 1.00 0.00 N ATOM 1540 CA VAL A 94 -11.336 4.069 -4.938 1.00 0.00 C ATOM 1541 C VAL A 94 -9.952 4.426 -5.470 1.00 0.00 C ATOM 1542 O VAL A 94 -9.810 4.885 -6.603 1.00 0.00 O ATOM 1543 CB VAL A 94 -11.399 2.547 -4.701 1.00 0.00 C ATOM 1544 CG1 VAL A 94 -12.516 2.201 -3.730 1.00 0.00 C ATOM 1545 CG2 VAL A 94 -11.579 1.807 -6.018 1.00 0.00 C ATOM 0 HA VAL A 94 -11.506 4.587 -3.994 1.00 0.00 H new ATOM 0 HB VAL A 94 -10.455 2.229 -4.259 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -12.543 1.122 -3.576 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -12.337 2.699 -2.777 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -13.470 2.534 -4.139 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -11.621 0.734 -5.830 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -12.506 2.129 -6.492 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -10.739 2.027 -6.677 1.00 0.00 H new ATOM 1555 N ALA A 95 -8.934 4.205 -4.644 1.00 0.00 N ATOM 1556 CA ALA A 95 -7.558 4.496 -5.027 1.00 0.00 C ATOM 1557 C ALA A 95 -6.729 3.217 -5.082 1.00 0.00 C ATOM 1558 O ALA A 95 -6.334 2.678 -4.049 1.00 0.00 O ATOM 1559 CB ALA A 95 -6.938 5.489 -4.057 1.00 0.00 C ATOM 0 H ALA A 95 -9.037 3.824 -3.703 1.00 0.00 H new ATOM 0 HA ALA A 95 -7.566 4.939 -6.023 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -5.911 5.697 -4.356 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -7.513 6.415 -4.067 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -6.945 5.068 -3.051 1.00 0.00 H new ATOM 1565 N VAL A 96 -6.474 2.734 -6.294 1.00 0.00 N ATOM 1566 CA VAL A 96 -5.697 1.515 -6.481 1.00 0.00 C ATOM 1567 C VAL A 96 -4.290 1.662 -5.912 1.00 0.00 C ATOM 1568 O VAL A 96 -3.596 2.641 -6.187 1.00 0.00 O ATOM 1569 CB VAL A 96 -5.598 1.123 -7.968 1.00 0.00 C ATOM 1570 CG1 VAL A 96 -5.130 -0.317 -8.109 1.00 0.00 C ATOM 1571 CG2 VAL A 96 -6.935 1.322 -8.669 1.00 0.00 C ATOM 0 H VAL A 96 -6.794 3.168 -7.160 1.00 0.00 H new ATOM 0 HA VAL A 96 -6.224 0.727 -5.943 1.00 0.00 H new ATOM 0 HB VAL A 96 -4.864 1.773 -8.444 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -5.066 -0.577 -9.166 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -4.149 -0.427 -7.648 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -5.840 -0.980 -7.615 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -6.842 1.039 -9.718 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -7.692 0.700 -8.191 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -7.229 2.369 -8.601 1.00 0.00 H new ATOM 1581 N VAL A 97 -3.880 0.683 -5.113 1.00 0.00 N ATOM 1582 CA VAL A 97 -2.558 0.698 -4.498 1.00 0.00 C ATOM 1583 C VAL A 97 -1.801 -0.595 -4.790 1.00 0.00 C ATOM 1584 O VAL A 97 -2.401 -1.609 -5.146 1.00 0.00 O ATOM 1585 CB VAL A 97 -2.658 0.886 -2.973 1.00 0.00 C ATOM 1586 CG1 VAL A 97 -1.278 1.079 -2.363 1.00 0.00 C ATOM 1587 CG2 VAL A 97 -3.565 2.059 -2.638 1.00 0.00 C ATOM 0 H VAL A 97 -4.445 -0.132 -4.876 1.00 0.00 H new ATOM 0 HA VAL A 97 -2.014 1.538 -4.929 1.00 0.00 H new ATOM 0 HB VAL A 97 -3.094 -0.016 -2.544 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -1.372 1.210 -1.285 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -0.663 0.203 -2.570 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -0.809 1.962 -2.796 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -3.623 2.176 -1.556 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -3.161 2.969 -3.080 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -4.562 1.873 -3.037 1.00 0.00 H new ATOM 1597 N LYS A 98 -0.480 -0.551 -4.638 1.00 0.00 N ATOM 1598 CA LYS A 98 0.358 -1.721 -4.882 1.00 0.00 C ATOM 1599 C LYS A 98 1.318 -1.952 -3.716 1.00 0.00 C ATOM 1600 O LYS A 98 1.585 -1.041 -2.934 1.00 0.00 O ATOM 1601 CB LYS A 98 1.148 -1.546 -6.181 1.00 0.00 C ATOM 1602 CG LYS A 98 0.294 -1.101 -7.357 1.00 0.00 C ATOM 1603 CD LYS A 98 0.136 0.411 -7.391 1.00 0.00 C ATOM 1604 CE LYS A 98 -1.255 0.815 -7.851 1.00 0.00 C ATOM 1605 NZ LYS A 98 -1.384 0.772 -9.334 1.00 0.00 N ATOM 0 H LYS A 98 0.033 0.282 -4.347 1.00 0.00 H new ATOM 0 HA LYS A 98 -0.291 -2.592 -4.975 1.00 0.00 H new ATOM 0 HB2 LYS A 98 1.939 -0.814 -6.020 1.00 0.00 H new ATOM 0 HB3 LYS A 98 1.633 -2.489 -6.431 1.00 0.00 H new ATOM 0 HG2 LYS A 98 0.749 -1.441 -8.287 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -0.688 -1.569 -7.292 1.00 0.00 H new ATOM 0 HD2 LYS A 98 0.325 0.820 -6.399 1.00 0.00 H new ATOM 0 HD3 LYS A 98 0.881 0.841 -8.061 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -1.993 0.150 -7.403 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -1.477 1.822 -7.496 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -2.347 1.054 -9.607 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -0.697 1.426 -9.761 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -1.198 -0.194 -9.671 1.00 0.00 H new ATOM 1619 N PRO A 99 1.855 -3.178 -3.583 1.00 0.00 N ATOM 1620 CA PRO A 99 2.790 -3.511 -2.503 1.00 0.00 C ATOM 1621 C PRO A 99 3.979 -2.559 -2.462 1.00 0.00 C ATOM 1622 O PRO A 99 4.771 -2.496 -3.403 1.00 0.00 O ATOM 1623 CB PRO A 99 3.250 -4.930 -2.847 1.00 0.00 C ATOM 1624 CG PRO A 99 2.163 -5.489 -3.699 1.00 0.00 C ATOM 1625 CD PRO A 99 1.597 -4.328 -4.468 1.00 0.00 C ATOM 0 HA PRO A 99 2.324 -3.432 -1.521 1.00 0.00 H new ATOM 0 HB2 PRO A 99 4.202 -4.919 -3.378 1.00 0.00 H new ATOM 0 HB3 PRO A 99 3.394 -5.528 -1.947 1.00 0.00 H new ATOM 0 HG2 PRO A 99 2.550 -6.252 -4.374 1.00 0.00 H new ATOM 0 HG3 PRO A 99 1.395 -5.964 -3.089 1.00 0.00 H new ATOM 0 HD2 PRO A 99 2.086 -4.209 -5.435 1.00 0.00 H new ATOM 0 HD3 PRO A 99 0.532 -4.455 -4.663 1.00 0.00 H new ATOM 1633 N GLY A 100 4.092 -1.812 -1.370 1.00 0.00 N ATOM 1634 CA GLY A 100 5.181 -0.866 -1.229 1.00 0.00 C ATOM 1635 C GLY A 100 4.754 0.550 -1.559 1.00 0.00 C ATOM 1636 O GLY A 100 5.540 1.336 -2.089 1.00 0.00 O ATOM 0 H GLY A 100 3.448 -1.845 -0.580 1.00 0.00 H new ATOM 0 HA2 GLY A 100 5.561 -0.901 -0.208 1.00 0.00 H new ATOM 0 HA3 GLY A 100 6.002 -1.159 -1.884 1.00 0.00 H new ATOM 1640 N ARG A 101 3.500 0.875 -1.253 1.00 0.00 N ATOM 1641 CA ARG A 101 2.967 2.207 -1.531 1.00 0.00 C ATOM 1642 C ARG A 101 2.620 2.954 -0.245 1.00 0.00 C ATOM 1643 O ARG A 101 1.757 2.523 0.521 1.00 0.00 O ATOM 1644 CB ARG A 101 1.724 2.103 -2.416 1.00 0.00 C ATOM 1645 CG ARG A 101 1.652 3.173 -3.490 1.00 0.00 C ATOM 1646 CD ARG A 101 1.648 4.565 -2.883 1.00 0.00 C ATOM 1647 NE ARG A 101 1.273 5.587 -3.856 1.00 0.00 N ATOM 1648 CZ ARG A 101 0.022 5.815 -4.249 1.00 0.00 C ATOM 1649 NH1 ARG A 101 -0.977 5.094 -3.756 1.00 0.00 N ATOM 1650 NH2 ARG A 101 -0.231 6.765 -5.139 1.00 0.00 N ATOM 0 H ARG A 101 2.836 0.237 -0.814 1.00 0.00 H new ATOM 0 HA ARG A 101 3.742 2.770 -2.052 1.00 0.00 H new ATOM 0 HB2 ARG A 101 1.707 1.122 -2.891 1.00 0.00 H new ATOM 0 HB3 ARG A 101 0.835 2.169 -1.789 1.00 0.00 H new ATOM 0 HG2 ARG A 101 2.501 3.071 -4.165 1.00 0.00 H new ATOM 0 HG3 ARG A 101 0.751 3.032 -4.087 1.00 0.00 H new ATOM 0 HD2 ARG A 101 0.953 4.592 -2.043 1.00 0.00 H new ATOM 0 HD3 ARG A 101 2.638 4.789 -2.485 1.00 0.00 H new ATOM 0 HE ARG A 101 2.014 6.161 -4.259 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -0.788 4.361 -3.072 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -1.934 5.273 -4.061 1.00 0.00 H new ATOM 0 HH21 ARG A 101 0.533 7.321 -5.523 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -1.190 6.940 -5.440 1.00 0.00 H new ATOM 1664 N VAL A 102 3.287 4.083 -0.026 1.00 0.00 N ATOM 1665 CA VAL A 102 3.042 4.902 1.157 1.00 0.00 C ATOM 1666 C VAL A 102 1.811 5.781 0.951 1.00 0.00 C ATOM 1667 O VAL A 102 1.865 6.781 0.235 1.00 0.00 O ATOM 1668 CB VAL A 102 4.254 5.799 1.486 1.00 0.00 C ATOM 1669 CG1 VAL A 102 4.080 6.456 2.846 1.00 0.00 C ATOM 1670 CG2 VAL A 102 5.548 4.996 1.435 1.00 0.00 C ATOM 0 H VAL A 102 4.002 4.452 -0.653 1.00 0.00 H new ATOM 0 HA VAL A 102 2.875 4.222 1.992 1.00 0.00 H new ATOM 0 HB VAL A 102 4.313 6.585 0.733 1.00 0.00 H new ATOM 0 HG11 VAL A 102 4.945 7.084 3.060 1.00 0.00 H new ATOM 0 HG12 VAL A 102 3.179 7.069 2.841 1.00 0.00 H new ATOM 0 HG13 VAL A 102 3.992 5.687 3.613 1.00 0.00 H new ATOM 0 HG21 VAL A 102 6.390 5.647 1.670 1.00 0.00 H new ATOM 0 HG22 VAL A 102 5.502 4.186 2.162 1.00 0.00 H new ATOM 0 HG23 VAL A 102 5.679 4.580 0.436 1.00 0.00 H new ATOM 1680 N MET A 103 0.696 5.391 1.565 1.00 0.00 N ATOM 1681 CA MET A 103 -0.552 6.136 1.428 1.00 0.00 C ATOM 1682 C MET A 103 -0.754 7.136 2.566 1.00 0.00 C ATOM 1683 O MET A 103 -1.402 8.166 2.384 1.00 0.00 O ATOM 1684 CB MET A 103 -1.738 5.173 1.368 1.00 0.00 C ATOM 1685 CG MET A 103 -1.695 4.086 2.431 1.00 0.00 C ATOM 1686 SD MET A 103 -1.258 2.470 1.761 1.00 0.00 S ATOM 1687 CE MET A 103 -2.197 1.394 2.840 1.00 0.00 C ATOM 0 H MET A 103 0.632 4.565 2.161 1.00 0.00 H new ATOM 0 HA MET A 103 -0.490 6.701 0.498 1.00 0.00 H new ATOM 0 HB2 MET A 103 -2.662 5.741 1.478 1.00 0.00 H new ATOM 0 HB3 MET A 103 -1.766 4.706 0.384 1.00 0.00 H new ATOM 0 HG2 MET A 103 -0.973 4.363 3.199 1.00 0.00 H new ATOM 0 HG3 MET A 103 -2.668 4.021 2.918 1.00 0.00 H new ATOM 0 HE1 MET A 103 -1.556 0.589 3.199 1.00 0.00 H new ATOM 0 HE2 MET A 103 -2.571 1.966 3.689 1.00 0.00 H new ATOM 0 HE3 MET A 103 -3.037 0.971 2.290 1.00 0.00 H new ATOM 1697 N PHE A 104 -0.210 6.830 3.740 1.00 0.00 N ATOM 1698 CA PHE A 104 -0.353 7.717 4.893 1.00 0.00 C ATOM 1699 C PHE A 104 1.006 8.107 5.465 1.00 0.00 C ATOM 1700 O PHE A 104 1.959 7.333 5.411 1.00 0.00 O ATOM 1701 CB PHE A 104 -1.195 7.047 5.981 1.00 0.00 C ATOM 1702 CG PHE A 104 -2.665 7.011 5.672 1.00 0.00 C ATOM 1703 CD1 PHE A 104 -3.192 6.027 4.852 1.00 0.00 C ATOM 1704 CD2 PHE A 104 -3.520 7.959 6.209 1.00 0.00 C ATOM 1705 CE1 PHE A 104 -4.545 5.989 4.571 1.00 0.00 C ATOM 1706 CE2 PHE A 104 -4.872 7.928 5.933 1.00 0.00 C ATOM 1707 CZ PHE A 104 -5.387 6.943 5.113 1.00 0.00 C ATOM 0 H PHE A 104 0.329 5.983 3.919 1.00 0.00 H new ATOM 0 HA PHE A 104 -0.856 8.622 4.552 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -0.839 6.027 6.127 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -1.044 7.576 6.922 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -2.538 5.280 4.427 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -3.124 8.732 6.851 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -4.943 5.216 3.930 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -5.527 8.674 6.358 1.00 0.00 H new ATOM 0 HZ PHE A 104 -6.445 6.918 4.896 1.00 0.00 H new ATOM 1717 N GLU A 105 1.083 9.315 6.016 1.00 0.00 N ATOM 1718 CA GLU A 105 2.321 9.817 6.603 1.00 0.00 C ATOM 1719 C GLU A 105 2.022 10.816 7.718 1.00 0.00 C ATOM 1720 O GLU A 105 1.282 11.778 7.516 1.00 0.00 O ATOM 1721 CB GLU A 105 3.191 10.484 5.533 1.00 0.00 C ATOM 1722 CG GLU A 105 3.404 9.630 4.293 1.00 0.00 C ATOM 1723 CD GLU A 105 2.243 9.711 3.322 1.00 0.00 C ATOM 1724 OE1 GLU A 105 1.801 10.840 3.017 1.00 0.00 O ATOM 1725 OE2 GLU A 105 1.773 8.647 2.867 1.00 0.00 O ATOM 0 H GLU A 105 0.300 9.966 6.068 1.00 0.00 H new ATOM 0 HA GLU A 105 2.862 8.970 7.024 1.00 0.00 H new ATOM 0 HB2 GLU A 105 2.729 11.426 5.238 1.00 0.00 H new ATOM 0 HB3 GLU A 105 4.161 10.726 5.967 1.00 0.00 H new ATOM 0 HG2 GLU A 105 4.317 9.949 3.789 1.00 0.00 H new ATOM 0 HG3 GLU A 105 3.551 8.592 4.592 1.00 0.00 H new ATOM 1732 N VAL A 106 2.601 10.585 8.893 1.00 0.00 N ATOM 1733 CA VAL A 106 2.389 11.474 10.030 1.00 0.00 C ATOM 1734 C VAL A 106 3.681 12.182 10.426 1.00 0.00 C ATOM 1735 O VAL A 106 4.774 11.740 10.075 1.00 0.00 O ATOM 1736 CB VAL A 106 1.837 10.715 11.254 1.00 0.00 C ATOM 1737 CG1 VAL A 106 0.478 10.111 10.939 1.00 0.00 C ATOM 1738 CG2 VAL A 106 2.815 9.643 11.712 1.00 0.00 C ATOM 0 H VAL A 106 3.217 9.794 9.082 1.00 0.00 H new ATOM 0 HA VAL A 106 1.653 12.213 9.713 1.00 0.00 H new ATOM 0 HB VAL A 106 1.713 11.426 12.070 1.00 0.00 H new ATOM 0 HG11 VAL A 106 0.104 9.579 11.814 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -0.220 10.905 10.671 1.00 0.00 H new ATOM 0 HG13 VAL A 106 0.573 9.415 10.105 1.00 0.00 H new ATOM 0 HG21 VAL A 106 2.404 9.121 12.576 1.00 0.00 H new ATOM 0 HG22 VAL A 106 2.980 8.931 10.903 1.00 0.00 H new ATOM 0 HG23 VAL A 106 3.762 10.108 11.985 1.00 0.00 H new ATOM 1748 N ALA A 107 3.546 13.282 11.160 1.00 0.00 N ATOM 1749 CA ALA A 107 4.702 14.049 11.603 1.00 0.00 C ATOM 1750 C ALA A 107 4.364 14.895 12.827 1.00 0.00 C ATOM 1751 O ALA A 107 3.276 15.464 12.920 1.00 0.00 O ATOM 1752 CB ALA A 107 5.213 14.932 10.476 1.00 0.00 C ATOM 0 H ALA A 107 2.648 13.661 11.460 1.00 0.00 H new ATOM 0 HA ALA A 107 5.486 13.346 11.884 1.00 0.00 H new ATOM 0 HB1 ALA A 107 6.077 15.499 10.822 1.00 0.00 H new ATOM 0 HB2 ALA A 107 5.502 14.310 9.629 1.00 0.00 H new ATOM 0 HB3 ALA A 107 4.426 15.621 10.168 1.00 0.00 H new ATOM 1758 N GLY A 108 5.305 14.974 13.762 1.00 0.00 N ATOM 1759 CA GLY A 108 5.089 15.753 14.966 1.00 0.00 C ATOM 1760 C GLY A 108 4.736 14.893 16.164 1.00 0.00 C ATOM 1761 O GLY A 108 4.981 15.279 17.307 1.00 0.00 O ATOM 0 H GLY A 108 6.213 14.512 13.707 1.00 0.00 H new ATOM 0 HA2 GLY A 108 5.988 16.327 15.189 1.00 0.00 H new ATOM 0 HA3 GLY A 108 4.288 16.471 14.791 1.00 0.00 H new ATOM 1765 N VAL A 109 4.155 13.726 15.904 1.00 0.00 N ATOM 1766 CA VAL A 109 3.767 12.812 16.972 1.00 0.00 C ATOM 1767 C VAL A 109 4.885 11.825 17.291 1.00 0.00 C ATOM 1768 O VAL A 109 5.818 11.654 16.506 1.00 0.00 O ATOM 1769 CB VAL A 109 2.489 12.031 16.608 1.00 0.00 C ATOM 1770 CG1 VAL A 109 1.322 12.985 16.400 1.00 0.00 C ATOM 1771 CG2 VAL A 109 2.716 11.174 15.370 1.00 0.00 C ATOM 0 H VAL A 109 3.943 13.391 14.964 1.00 0.00 H new ATOM 0 HA VAL A 109 3.570 13.423 17.853 1.00 0.00 H new ATOM 0 HB VAL A 109 2.243 11.368 17.437 1.00 0.00 H new ATOM 0 HG11 VAL A 109 0.428 12.416 16.144 1.00 0.00 H new ATOM 0 HG12 VAL A 109 1.144 13.547 17.317 1.00 0.00 H new ATOM 0 HG13 VAL A 109 1.557 13.676 15.590 1.00 0.00 H new ATOM 0 HG21 VAL A 109 1.802 10.631 15.131 1.00 0.00 H new ATOM 0 HG22 VAL A 109 2.989 11.813 14.530 1.00 0.00 H new ATOM 0 HG23 VAL A 109 3.520 10.463 15.562 1.00 0.00 H new ATOM 1781 N THR A 110 4.784 11.178 18.447 1.00 0.00 N ATOM 1782 CA THR A 110 5.787 10.208 18.872 1.00 0.00 C ATOM 1783 C THR A 110 5.722 8.946 18.019 1.00 0.00 C ATOM 1784 O THR A 110 4.876 8.825 17.132 1.00 0.00 O ATOM 1785 CB THR A 110 5.587 9.851 20.346 1.00 0.00 C ATOM 1786 OG1 THR A 110 4.380 9.131 20.529 1.00 0.00 O ATOM 1787 CG2 THR A 110 5.542 11.061 21.253 1.00 0.00 C ATOM 0 H THR A 110 4.017 11.308 19.107 1.00 0.00 H new ATOM 0 HA THR A 110 6.770 10.660 18.743 1.00 0.00 H new ATOM 0 HB THR A 110 6.452 9.246 20.617 1.00 0.00 H new ATOM 0 HG1 THR A 110 4.318 8.828 21.459 1.00 0.00 H new ATOM 0 HG21 THR A 110 5.398 10.738 22.284 1.00 0.00 H new ATOM 0 HG22 THR A 110 6.480 11.611 21.173 1.00 0.00 H new ATOM 0 HG23 THR A 110 4.716 11.707 20.957 1.00 0.00 H new ATOM 1795 N GLU A 111 6.621 8.005 18.294 1.00 0.00 N ATOM 1796 CA GLU A 111 6.667 6.750 17.553 1.00 0.00 C ATOM 1797 C GLU A 111 5.508 5.840 17.949 1.00 0.00 C ATOM 1798 O GLU A 111 4.852 5.246 17.094 1.00 0.00 O ATOM 1799 CB GLU A 111 7.999 6.037 17.800 1.00 0.00 C ATOM 1800 CG GLU A 111 8.121 4.704 17.081 1.00 0.00 C ATOM 1801 CD GLU A 111 9.531 4.146 17.121 1.00 0.00 C ATOM 1802 OE1 GLU A 111 10.473 4.931 17.358 1.00 0.00 O ATOM 1803 OE2 GLU A 111 9.692 2.925 16.917 1.00 0.00 O ATOM 0 H GLU A 111 7.327 8.089 19.025 1.00 0.00 H new ATOM 0 HA GLU A 111 6.577 6.980 16.491 1.00 0.00 H new ATOM 0 HB2 GLU A 111 8.814 6.687 17.481 1.00 0.00 H new ATOM 0 HB3 GLU A 111 8.121 5.875 18.871 1.00 0.00 H new ATOM 0 HG2 GLU A 111 7.437 3.987 17.535 1.00 0.00 H new ATOM 0 HG3 GLU A 111 7.812 4.826 16.043 1.00 0.00 H new ATOM 1810 N GLU A 112 5.262 5.736 19.251 1.00 0.00 N ATOM 1811 CA GLU A 112 4.183 4.898 19.760 1.00 0.00 C ATOM 1812 C GLU A 112 2.833 5.366 19.225 1.00 0.00 C ATOM 1813 O GLU A 112 1.995 4.555 18.829 1.00 0.00 O ATOM 1814 CB GLU A 112 4.174 4.915 21.291 1.00 0.00 C ATOM 1815 CG GLU A 112 3.990 3.541 21.913 1.00 0.00 C ATOM 1816 CD GLU A 112 2.648 2.922 21.572 1.00 0.00 C ATOM 1817 OE1 GLU A 112 1.642 3.661 21.548 1.00 0.00 O ATOM 1818 OE2 GLU A 112 2.605 1.698 21.330 1.00 0.00 O ATOM 0 H GLU A 112 5.795 6.222 19.972 1.00 0.00 H new ATOM 0 HA GLU A 112 4.355 3.878 19.417 1.00 0.00 H new ATOM 0 HB2 GLU A 112 5.111 5.343 21.647 1.00 0.00 H new ATOM 0 HB3 GLU A 112 3.373 5.570 21.634 1.00 0.00 H new ATOM 0 HG2 GLU A 112 4.788 2.882 21.571 1.00 0.00 H new ATOM 0 HG3 GLU A 112 4.085 3.621 22.996 1.00 0.00 H new ATOM 1825 N GLN A 113 2.629 6.680 19.214 1.00 0.00 N ATOM 1826 CA GLN A 113 1.383 7.256 18.726 1.00 0.00 C ATOM 1827 C GLN A 113 1.324 7.207 17.204 1.00 0.00 C ATOM 1828 O GLN A 113 0.279 6.923 16.620 1.00 0.00 O ATOM 1829 CB GLN A 113 1.241 8.701 19.209 1.00 0.00 C ATOM 1830 CG GLN A 113 1.217 8.837 20.722 1.00 0.00 C ATOM 1831 CD GLN A 113 0.824 10.229 21.175 1.00 0.00 C ATOM 1832 OE1 GLN A 113 -0.346 10.500 21.443 1.00 0.00 O ATOM 1833 NE2 GLN A 113 1.804 11.121 21.263 1.00 0.00 N ATOM 0 H GLN A 113 3.312 7.365 19.538 1.00 0.00 H new ATOM 0 HA GLN A 113 0.557 6.666 19.123 1.00 0.00 H new ATOM 0 HB2 GLN A 113 2.068 9.291 18.813 1.00 0.00 H new ATOM 0 HB3 GLN A 113 0.323 9.123 18.800 1.00 0.00 H new ATOM 0 HG2 GLN A 113 0.517 8.112 21.137 1.00 0.00 H new ATOM 0 HG3 GLN A 113 2.202 8.593 21.121 1.00 0.00 H new ATOM 0 HE21 GLN A 113 2.760 10.853 21.031 1.00 0.00 H new ATOM 0 HE22 GLN A 113 1.600 12.074 21.563 1.00 0.00 H new ATOM 1842 N ALA A 114 2.456 7.486 16.570 1.00 0.00 N ATOM 1843 CA ALA A 114 2.542 7.476 15.116 1.00 0.00 C ATOM 1844 C ALA A 114 2.389 6.063 14.566 1.00 0.00 C ATOM 1845 O ALA A 114 1.617 5.829 13.636 1.00 0.00 O ATOM 1846 CB ALA A 114 3.863 8.078 14.669 1.00 0.00 C ATOM 0 H ALA A 114 3.329 7.722 17.042 1.00 0.00 H new ATOM 0 HA ALA A 114 1.724 8.079 14.721 1.00 0.00 H new ATOM 0 HB1 ALA A 114 3.918 8.066 13.580 1.00 0.00 H new ATOM 0 HB2 ALA A 114 3.933 9.106 15.025 1.00 0.00 H new ATOM 0 HB3 ALA A 114 4.687 7.494 15.080 1.00 0.00 H new ATOM 1852 N MET A 115 3.128 5.123 15.146 1.00 0.00 N ATOM 1853 CA MET A 115 3.071 3.732 14.714 1.00 0.00 C ATOM 1854 C MET A 115 1.664 3.174 14.887 1.00 0.00 C ATOM 1855 O MET A 115 1.115 2.552 13.977 1.00 0.00 O ATOM 1856 CB MET A 115 4.070 2.888 15.508 1.00 0.00 C ATOM 1857 CG MET A 115 5.523 3.223 15.208 1.00 0.00 C ATOM 1858 SD MET A 115 6.399 1.874 14.394 1.00 0.00 S ATOM 1859 CE MET A 115 7.584 2.785 13.408 1.00 0.00 C ATOM 0 H MET A 115 3.773 5.300 15.916 1.00 0.00 H new ATOM 0 HA MET A 115 3.334 3.691 13.657 1.00 0.00 H new ATOM 0 HB2 MET A 115 3.886 3.028 16.573 1.00 0.00 H new ATOM 0 HB3 MET A 115 3.896 1.834 15.291 1.00 0.00 H new ATOM 0 HG2 MET A 115 5.563 4.110 14.576 1.00 0.00 H new ATOM 0 HG3 MET A 115 6.033 3.472 16.139 1.00 0.00 H new ATOM 0 HE1 MET A 115 8.142 2.092 12.778 1.00 0.00 H new ATOM 0 HE2 MET A 115 7.058 3.504 12.780 1.00 0.00 H new ATOM 0 HE3 MET A 115 8.274 3.314 14.065 1.00 0.00 H new ATOM 1869 N GLU A 116 1.082 3.407 16.058 1.00 0.00 N ATOM 1870 CA GLU A 116 -0.265 2.932 16.348 1.00 0.00 C ATOM 1871 C GLU A 116 -1.275 3.578 15.405 1.00 0.00 C ATOM 1872 O GLU A 116 -2.105 2.895 14.806 1.00 0.00 O ATOM 1873 CB GLU A 116 -0.638 3.235 17.800 1.00 0.00 C ATOM 1874 CG GLU A 116 -1.643 2.257 18.386 1.00 0.00 C ATOM 1875 CD GLU A 116 -1.431 2.022 19.869 1.00 0.00 C ATOM 1876 OE1 GLU A 116 -1.273 3.014 20.611 1.00 0.00 O ATOM 1877 OE2 GLU A 116 -1.423 0.845 20.288 1.00 0.00 O ATOM 0 H GLU A 116 1.522 3.922 16.821 1.00 0.00 H new ATOM 0 HA GLU A 116 -0.286 1.853 16.197 1.00 0.00 H new ATOM 0 HB2 GLU A 116 0.266 3.223 18.409 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -1.048 4.243 17.858 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -2.652 2.637 18.223 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -1.570 1.307 17.857 1.00 0.00 H new ATOM 1884 N ALA A 117 -1.193 4.899 15.274 1.00 0.00 N ATOM 1885 CA ALA A 117 -2.096 5.636 14.399 1.00 0.00 C ATOM 1886 C ALA A 117 -2.006 5.120 12.968 1.00 0.00 C ATOM 1887 O ALA A 117 -3.023 4.839 12.333 1.00 0.00 O ATOM 1888 CB ALA A 117 -1.781 7.123 14.446 1.00 0.00 C ATOM 0 H ALA A 117 -0.511 5.479 15.762 1.00 0.00 H new ATOM 0 HA ALA A 117 -3.115 5.482 14.753 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -2.463 7.660 13.788 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -1.899 7.488 15.466 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -0.755 7.288 14.118 1.00 0.00 H new ATOM 1894 N LEU A 118 -0.783 4.986 12.469 1.00 0.00 N ATOM 1895 CA LEU A 118 -0.562 4.493 11.116 1.00 0.00 C ATOM 1896 C LEU A 118 -1.100 3.073 10.972 1.00 0.00 C ATOM 1897 O LEU A 118 -1.551 2.673 9.899 1.00 0.00 O ATOM 1898 CB LEU A 118 0.932 4.528 10.774 1.00 0.00 C ATOM 1899 CG LEU A 118 1.426 5.793 10.057 1.00 0.00 C ATOM 1900 CD1 LEU A 118 0.551 6.994 10.384 1.00 0.00 C ATOM 1901 CD2 LEU A 118 2.873 6.078 10.428 1.00 0.00 C ATOM 0 H LEU A 118 0.070 5.212 12.981 1.00 0.00 H new ATOM 0 HA LEU A 118 -1.096 5.141 10.421 1.00 0.00 H new ATOM 0 HB2 LEU A 118 1.499 4.412 11.698 1.00 0.00 H new ATOM 0 HB3 LEU A 118 1.162 3.666 10.148 1.00 0.00 H new ATOM 0 HG LEU A 118 1.363 5.616 8.983 1.00 0.00 H new ATOM 0 HD11 LEU A 118 0.928 7.872 9.860 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -0.473 6.795 10.068 1.00 0.00 H new ATOM 0 HD13 LEU A 118 0.570 7.176 11.459 1.00 0.00 H new ATOM 0 HD21 LEU A 118 3.210 6.977 9.913 1.00 0.00 H new ATOM 0 HD22 LEU A 118 2.950 6.226 11.505 1.00 0.00 H new ATOM 0 HD23 LEU A 118 3.497 5.235 10.132 1.00 0.00 H new ATOM 1913 N ARG A 119 -1.054 2.318 12.066 1.00 0.00 N ATOM 1914 CA ARG A 119 -1.543 0.945 12.067 1.00 0.00 C ATOM 1915 C ARG A 119 -3.068 0.918 12.060 1.00 0.00 C ATOM 1916 O ARG A 119 -3.681 0.106 11.367 1.00 0.00 O ATOM 1917 CB ARG A 119 -1.008 0.191 13.287 1.00 0.00 C ATOM 1918 CG ARG A 119 0.217 -0.661 12.985 1.00 0.00 C ATOM 1919 CD ARG A 119 1.351 -0.388 13.964 1.00 0.00 C ATOM 1920 NE ARG A 119 1.685 -1.568 14.757 1.00 0.00 N ATOM 1921 CZ ARG A 119 1.002 -1.957 15.832 1.00 0.00 C ATOM 1922 NH1 ARG A 119 -0.054 -1.266 16.243 1.00 0.00 N ATOM 1923 NH2 ARG A 119 1.375 -3.042 16.497 1.00 0.00 N ATOM 0 H ARG A 119 -0.683 2.635 12.962 1.00 0.00 H new ATOM 0 HA ARG A 119 -1.184 0.452 11.164 1.00 0.00 H new ATOM 0 HB2 ARG A 119 -0.758 0.910 14.067 1.00 0.00 H new ATOM 0 HB3 ARG A 119 -1.797 -0.448 13.684 1.00 0.00 H new ATOM 0 HG2 ARG A 119 -0.054 -1.716 13.028 1.00 0.00 H new ATOM 0 HG3 ARG A 119 0.558 -0.461 11.969 1.00 0.00 H new ATOM 0 HD2 ARG A 119 2.233 -0.059 13.415 1.00 0.00 H new ATOM 0 HD3 ARG A 119 1.067 0.427 14.629 1.00 0.00 H new ATOM 0 HE ARG A 119 2.489 -2.127 14.471 1.00 0.00 H new ATOM 0 HH11 ARG A 119 -0.347 -0.432 15.735 1.00 0.00 H new ATOM 0 HH12 ARG A 119 -0.573 -1.569 17.067 1.00 0.00 H new ATOM 0 HH21 ARG A 119 2.185 -3.578 16.185 1.00 0.00 H new ATOM 0 HH22 ARG A 119 0.852 -3.340 17.320 1.00 0.00 H new ATOM 1937 N ILE A 120 -3.675 1.819 12.829 1.00 0.00 N ATOM 1938 CA ILE A 120 -5.129 1.903 12.905 1.00 0.00 C ATOM 1939 C ILE A 120 -5.725 2.134 11.520 1.00 0.00 C ATOM 1940 O ILE A 120 -6.799 1.625 11.202 1.00 0.00 O ATOM 1941 CB ILE A 120 -5.579 3.037 13.854 1.00 0.00 C ATOM 1942 CG1 ILE A 120 -5.140 2.731 15.287 1.00 0.00 C ATOM 1943 CG2 ILE A 120 -7.089 3.230 13.794 1.00 0.00 C ATOM 1944 CD1 ILE A 120 -5.053 3.960 16.167 1.00 0.00 C ATOM 0 H ILE A 120 -3.182 2.500 13.407 1.00 0.00 H new ATOM 0 HA ILE A 120 -5.490 0.954 13.302 1.00 0.00 H new ATOM 0 HB ILE A 120 -5.105 3.963 13.529 1.00 0.00 H new ATOM 0 HG12 ILE A 120 -5.842 2.025 15.731 1.00 0.00 H new ATOM 0 HG13 ILE A 120 -4.167 2.241 15.264 1.00 0.00 H new ATOM 0 HG21 ILE A 120 -7.380 4.033 14.471 1.00 0.00 H new ATOM 0 HG22 ILE A 120 -7.383 3.488 12.777 1.00 0.00 H new ATOM 0 HG23 ILE A 120 -7.586 2.307 14.092 1.00 0.00 H new ATOM 0 HD11 ILE A 120 -4.736 3.669 17.168 1.00 0.00 H new ATOM 0 HD12 ILE A 120 -4.329 4.658 15.746 1.00 0.00 H new ATOM 0 HD13 ILE A 120 -6.031 4.439 16.221 1.00 0.00 H new ATOM 1956 N ALA A 121 -5.016 2.898 10.698 1.00 0.00 N ATOM 1957 CA ALA A 121 -5.470 3.189 9.345 1.00 0.00 C ATOM 1958 C ALA A 121 -5.513 1.916 8.509 1.00 0.00 C ATOM 1959 O ALA A 121 -6.472 1.674 7.775 1.00 0.00 O ATOM 1960 CB ALA A 121 -4.564 4.223 8.692 1.00 0.00 C ATOM 0 H ALA A 121 -4.124 3.327 10.945 1.00 0.00 H new ATOM 0 HA ALA A 121 -6.479 3.598 9.401 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -4.917 4.429 7.682 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -4.581 5.143 9.277 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -3.545 3.839 8.649 1.00 0.00 H new ATOM 1966 N GLY A 122 -4.470 1.101 8.632 1.00 0.00 N ATOM 1967 CA GLY A 122 -4.404 -0.143 7.888 1.00 0.00 C ATOM 1968 C GLY A 122 -5.300 -1.220 8.472 1.00 0.00 C ATOM 1969 O GLY A 122 -5.647 -2.183 7.789 1.00 0.00 O ATOM 0 H GLY A 122 -3.668 1.281 9.235 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -4.691 0.041 6.853 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -3.374 -0.500 7.875 1.00 0.00 H new ATOM 1973 N HIS A 123 -5.676 -1.058 9.738 1.00 0.00 N ATOM 1974 CA HIS A 123 -6.536 -2.026 10.408 1.00 0.00 C ATOM 1975 C HIS A 123 -7.853 -2.194 9.657 1.00 0.00 C ATOM 1976 O HIS A 123 -8.354 -3.308 9.507 1.00 0.00 O ATOM 1977 CB HIS A 123 -6.808 -1.588 11.848 1.00 0.00 C ATOM 1978 CG HIS A 123 -5.734 -1.991 12.810 1.00 0.00 C ATOM 1979 ND1 HIS A 123 -4.575 -2.628 12.420 1.00 0.00 N ATOM 1980 CD2 HIS A 123 -5.646 -1.845 14.153 1.00 0.00 C ATOM 1981 CE1 HIS A 123 -3.822 -2.857 13.481 1.00 0.00 C ATOM 1982 NE2 HIS A 123 -4.448 -2.391 14.545 1.00 0.00 N ATOM 0 H HIS A 123 -5.399 -0.267 10.319 1.00 0.00 H new ATOM 0 HA HIS A 123 -6.020 -2.986 10.420 1.00 0.00 H new ATOM 0 HB2 HIS A 123 -6.920 -0.504 11.874 1.00 0.00 H new ATOM 0 HB3 HIS A 123 -7.756 -2.014 12.176 1.00 0.00 H new ATOM 0 HD2 HIS A 123 -6.381 -1.385 14.797 1.00 0.00 H new ATOM 0 HE1 HIS A 123 -2.858 -3.343 13.478 1.00 0.00 H new ATOM 0 HE2 HIS A 123 -4.099 -2.430 15.503 1.00 0.00 H new ATOM 1991 N LYS A 124 -8.405 -1.081 9.185 1.00 0.00 N ATOM 1992 CA LYS A 124 -9.662 -1.107 8.447 1.00 0.00 C ATOM 1993 C LYS A 124 -9.421 -1.313 6.951 1.00 0.00 C ATOM 1994 O LYS A 124 -10.366 -1.359 6.164 1.00 0.00 O ATOM 1995 CB LYS A 124 -10.439 0.190 8.674 1.00 0.00 C ATOM 1996 CG LYS A 124 -9.649 1.443 8.330 1.00 0.00 C ATOM 1997 CD LYS A 124 -9.095 2.113 9.578 1.00 0.00 C ATOM 1998 CE LYS A 124 -10.111 3.051 10.205 1.00 0.00 C ATOM 1999 NZ LYS A 124 -9.667 3.539 11.539 1.00 0.00 N ATOM 0 H LYS A 124 -8.002 -0.151 9.300 1.00 0.00 H new ATOM 0 HA LYS A 124 -10.249 -1.947 8.818 1.00 0.00 H new ATOM 0 HB2 LYS A 124 -11.349 0.168 8.074 1.00 0.00 H new ATOM 0 HB3 LYS A 124 -10.747 0.241 9.718 1.00 0.00 H new ATOM 0 HG2 LYS A 124 -8.829 1.185 7.660 1.00 0.00 H new ATOM 0 HG3 LYS A 124 -10.290 2.143 7.794 1.00 0.00 H new ATOM 0 HD2 LYS A 124 -8.806 1.352 10.303 1.00 0.00 H new ATOM 0 HD3 LYS A 124 -8.193 2.670 9.323 1.00 0.00 H new ATOM 0 HE2 LYS A 124 -10.276 3.902 9.544 1.00 0.00 H new ATOM 0 HE3 LYS A 124 -11.066 2.536 10.306 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 -10.457 4.021 12.013 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 -9.356 2.733 12.118 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 -8.877 4.205 11.420 1.00 0.00 H new ATOM 2013 N LEU A 125 -8.154 -1.438 6.562 1.00 0.00 N ATOM 2014 CA LEU A 125 -7.801 -1.642 5.162 1.00 0.00 C ATOM 2015 C LEU A 125 -7.890 -3.121 4.793 1.00 0.00 C ATOM 2016 O LEU A 125 -7.745 -3.992 5.651 1.00 0.00 O ATOM 2017 CB LEU A 125 -6.387 -1.126 4.885 1.00 0.00 C ATOM 2018 CG LEU A 125 -6.250 0.394 4.794 1.00 0.00 C ATOM 2019 CD1 LEU A 125 -4.810 0.787 4.496 1.00 0.00 C ATOM 2020 CD2 LEU A 125 -7.186 0.951 3.732 1.00 0.00 C ATOM 0 H LEU A 125 -7.357 -1.401 7.197 1.00 0.00 H new ATOM 0 HA LEU A 125 -8.510 -1.083 4.551 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -5.726 -1.487 5.673 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -6.036 -1.562 3.950 1.00 0.00 H new ATOM 0 HG LEU A 125 -6.528 0.821 5.757 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -4.734 1.873 4.435 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -4.161 0.422 5.292 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -4.502 0.348 3.547 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -7.075 2.034 3.681 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -6.939 0.515 2.764 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -8.216 0.703 3.989 1.00 0.00 H new ATOM 2032 N PRO A 126 -8.130 -3.423 3.507 1.00 0.00 N ATOM 2033 CA PRO A 126 -8.239 -4.793 3.022 1.00 0.00 C ATOM 2034 C PRO A 126 -6.889 -5.378 2.613 1.00 0.00 C ATOM 2035 O PRO A 126 -6.825 -6.310 1.812 1.00 0.00 O ATOM 2036 CB PRO A 126 -9.144 -4.635 1.805 1.00 0.00 C ATOM 2037 CG PRO A 126 -8.804 -3.287 1.257 1.00 0.00 C ATOM 2038 CD PRO A 126 -8.320 -2.448 2.418 1.00 0.00 C ATOM 0 HA PRO A 126 -8.617 -5.477 3.781 1.00 0.00 H new ATOM 0 HB2 PRO A 126 -8.962 -5.419 1.070 1.00 0.00 H new ATOM 0 HB3 PRO A 126 -10.196 -4.697 2.082 1.00 0.00 H new ATOM 0 HG2 PRO A 126 -8.033 -3.365 0.490 1.00 0.00 H new ATOM 0 HG3 PRO A 126 -9.675 -2.830 0.788 1.00 0.00 H new ATOM 0 HD2 PRO A 126 -7.391 -1.932 2.178 1.00 0.00 H new ATOM 0 HD3 PRO A 126 -9.048 -1.684 2.689 1.00 0.00 H new ATOM 2046 N ILE A 127 -5.812 -4.821 3.161 1.00 0.00 N ATOM 2047 CA ILE A 127 -4.468 -5.287 2.845 1.00 0.00 C ATOM 2048 C ILE A 127 -3.515 -5.066 4.015 1.00 0.00 C ATOM 2049 O ILE A 127 -3.819 -4.319 4.945 1.00 0.00 O ATOM 2050 CB ILE A 127 -3.907 -4.574 1.598 1.00 0.00 C ATOM 2051 CG1 ILE A 127 -4.196 -3.072 1.661 1.00 0.00 C ATOM 2052 CG2 ILE A 127 -4.500 -5.179 0.335 1.00 0.00 C ATOM 2053 CD1 ILE A 127 -3.314 -2.327 2.639 1.00 0.00 C ATOM 0 H ILE A 127 -5.845 -4.047 3.825 1.00 0.00 H new ATOM 0 HA ILE A 127 -4.544 -6.355 2.643 1.00 0.00 H new ATOM 0 HB ILE A 127 -2.826 -4.713 1.576 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -4.066 -2.643 0.667 1.00 0.00 H new ATOM 0 HG13 ILE A 127 -5.239 -2.922 1.938 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -4.096 -4.667 -0.538 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -4.246 -6.238 0.285 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -5.584 -5.067 0.352 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -3.575 -1.269 2.631 1.00 0.00 H new ATOM 0 HD12 ILE A 127 -3.461 -2.729 3.641 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -2.270 -2.446 2.350 1.00 0.00 H new ATOM 2065 N LYS A 128 -2.360 -5.723 3.961 1.00 0.00 N ATOM 2066 CA LYS A 128 -1.359 -5.602 5.015 1.00 0.00 C ATOM 2067 C LYS A 128 -0.539 -4.327 4.843 1.00 0.00 C ATOM 2068 O LYS A 128 -0.089 -4.010 3.742 1.00 0.00 O ATOM 2069 CB LYS A 128 -0.435 -6.821 5.011 1.00 0.00 C ATOM 2070 CG LYS A 128 0.617 -6.791 6.108 1.00 0.00 C ATOM 2071 CD LYS A 128 0.170 -7.577 7.330 1.00 0.00 C ATOM 2072 CE LYS A 128 1.260 -7.629 8.388 1.00 0.00 C ATOM 2073 NZ LYS A 128 0.700 -7.834 9.752 1.00 0.00 N ATOM 0 H LYS A 128 -2.094 -6.345 3.198 1.00 0.00 H new ATOM 0 HA LYS A 128 -1.879 -5.552 5.972 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -1.037 -7.723 5.121 1.00 0.00 H new ATOM 0 HB3 LYS A 128 0.063 -6.886 4.043 1.00 0.00 H new ATOM 0 HG2 LYS A 128 1.551 -7.206 5.729 1.00 0.00 H new ATOM 0 HG3 LYS A 128 0.819 -5.758 6.392 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -0.725 -7.119 7.751 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -0.099 -8.591 7.033 1.00 0.00 H new ATOM 0 HE2 LYS A 128 1.954 -8.437 8.155 1.00 0.00 H new ATOM 0 HE3 LYS A 128 1.832 -6.701 8.366 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 1.475 -7.864 10.445 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 0.057 -7.050 9.985 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 0.176 -8.732 9.781 1.00 0.00 H new ATOM 2087 N THR A 129 -0.347 -3.601 5.939 1.00 0.00 N ATOM 2088 CA THR A 129 0.421 -2.361 5.909 1.00 0.00 C ATOM 2089 C THR A 129 1.351 -2.269 7.114 1.00 0.00 C ATOM 2090 O THR A 129 1.039 -2.777 8.191 1.00 0.00 O ATOM 2091 CB THR A 129 -0.517 -1.152 5.884 1.00 0.00 C ATOM 2092 OG1 THR A 129 -1.053 -0.907 7.171 1.00 0.00 O ATOM 2093 CG2 THR A 129 -1.680 -1.310 4.925 1.00 0.00 C ATOM 0 H THR A 129 -0.712 -3.849 6.859 1.00 0.00 H new ATOM 0 HA THR A 129 1.026 -2.361 5.002 1.00 0.00 H new ATOM 0 HB THR A 129 0.099 -0.319 5.546 1.00 0.00 H new ATOM 0 HG1 THR A 129 -1.559 -1.692 7.470 1.00 0.00 H new ATOM 0 HG21 THR A 129 -2.303 -0.417 4.959 1.00 0.00 H new ATOM 0 HG22 THR A 129 -1.301 -1.450 3.913 1.00 0.00 H new ATOM 0 HG23 THR A 129 -2.274 -2.178 5.213 1.00 0.00 H new ATOM 2101 N LYS A 130 2.498 -1.621 6.928 1.00 0.00 N ATOM 2102 CA LYS A 130 3.471 -1.470 8.005 1.00 0.00 C ATOM 2103 C LYS A 130 3.917 -0.018 8.145 1.00 0.00 C ATOM 2104 O LYS A 130 3.763 0.781 7.221 1.00 0.00 O ATOM 2105 CB LYS A 130 4.683 -2.365 7.751 1.00 0.00 C ATOM 2106 CG LYS A 130 5.402 -2.048 6.453 1.00 0.00 C ATOM 2107 CD LYS A 130 6.865 -2.451 6.511 1.00 0.00 C ATOM 2108 CE LYS A 130 7.640 -1.879 5.338 1.00 0.00 C ATOM 2109 NZ LYS A 130 9.111 -2.020 5.521 1.00 0.00 N ATOM 0 H LYS A 130 2.775 -1.193 6.044 1.00 0.00 H new ATOM 0 HA LYS A 130 2.991 -1.771 8.936 1.00 0.00 H new ATOM 0 HB2 LYS A 130 5.383 -2.261 8.580 1.00 0.00 H new ATOM 0 HB3 LYS A 130 4.360 -3.406 7.735 1.00 0.00 H new ATOM 0 HG2 LYS A 130 4.913 -2.568 5.629 1.00 0.00 H new ATOM 0 HG3 LYS A 130 5.326 -0.981 6.246 1.00 0.00 H new ATOM 0 HD2 LYS A 130 7.304 -2.101 7.445 1.00 0.00 H new ATOM 0 HD3 LYS A 130 6.946 -3.538 6.508 1.00 0.00 H new ATOM 0 HE2 LYS A 130 7.338 -2.386 4.422 1.00 0.00 H new ATOM 0 HE3 LYS A 130 7.389 -0.825 5.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 9.603 -1.617 4.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 9.404 -1.515 6.381 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 9.355 -3.027 5.611 1.00 0.00 H new ATOM 2123 N ILE A 131 4.475 0.314 9.306 1.00 0.00 N ATOM 2124 CA ILE A 131 4.951 1.670 9.566 1.00 0.00 C ATOM 2125 C ILE A 131 6.414 1.813 9.166 1.00 0.00 C ATOM 2126 O ILE A 131 7.233 0.944 9.462 1.00 0.00 O ATOM 2127 CB ILE A 131 4.816 2.060 11.055 1.00 0.00 C ATOM 2128 CG1 ILE A 131 3.615 1.360 11.703 1.00 0.00 C ATOM 2129 CG2 ILE A 131 4.701 3.572 11.199 1.00 0.00 C ATOM 2130 CD1 ILE A 131 2.291 1.707 11.062 1.00 0.00 C ATOM 0 H ILE A 131 4.609 -0.336 10.081 1.00 0.00 H new ATOM 0 HA ILE A 131 4.327 2.335 8.969 1.00 0.00 H new ATOM 0 HB ILE A 131 5.715 1.729 11.576 1.00 0.00 H new ATOM 0 HG12 ILE A 131 3.763 0.281 11.650 1.00 0.00 H new ATOM 0 HG13 ILE A 131 3.578 1.625 12.760 1.00 0.00 H new ATOM 0 HG21 ILE A 131 4.607 3.831 12.254 1.00 0.00 H new ATOM 0 HG22 ILE A 131 5.592 4.046 10.788 1.00 0.00 H new ATOM 0 HG23 ILE A 131 3.822 3.923 10.659 1.00 0.00 H new ATOM 0 HD11 ILE A 131 1.489 1.175 11.573 1.00 0.00 H new ATOM 0 HD12 ILE A 131 2.120 2.781 11.138 1.00 0.00 H new ATOM 0 HD13 ILE A 131 2.308 1.416 10.012 1.00 0.00 H new ATOM 2142 N VAL A 132 6.744 2.916 8.502 1.00 0.00 N ATOM 2143 CA VAL A 132 8.117 3.160 8.080 1.00 0.00 C ATOM 2144 C VAL A 132 8.495 4.628 8.237 1.00 0.00 C ATOM 2145 O VAL A 132 7.762 5.523 7.819 1.00 0.00 O ATOM 2146 CB VAL A 132 8.355 2.721 6.620 1.00 0.00 C ATOM 2147 CG1 VAL A 132 7.800 1.326 6.386 1.00 0.00 C ATOM 2148 CG2 VAL A 132 7.748 3.716 5.642 1.00 0.00 C ATOM 0 H VAL A 132 6.084 3.650 8.246 1.00 0.00 H new ATOM 0 HA VAL A 132 8.752 2.559 8.731 1.00 0.00 H new ATOM 0 HB VAL A 132 9.431 2.697 6.445 1.00 0.00 H new ATOM 0 HG11 VAL A 132 7.977 1.033 5.351 1.00 0.00 H new ATOM 0 HG12 VAL A 132 8.296 0.621 7.053 1.00 0.00 H new ATOM 0 HG13 VAL A 132 6.729 1.322 6.586 1.00 0.00 H new ATOM 0 HG21 VAL A 132 7.931 3.381 4.621 1.00 0.00 H new ATOM 0 HG22 VAL A 132 6.674 3.786 5.814 1.00 0.00 H new ATOM 0 HG23 VAL A 132 8.203 4.695 5.790 1.00 0.00 H new ATOM 2158 N ARG A 133 9.647 4.862 8.843 1.00 0.00 N ATOM 2159 CA ARG A 133 10.141 6.213 9.061 1.00 0.00 C ATOM 2160 C ARG A 133 10.689 6.811 7.778 1.00 0.00 C ATOM 2161 O ARG A 133 10.948 6.095 6.812 1.00 0.00 O ATOM 2162 CB ARG A 133 11.248 6.213 10.106 1.00 0.00 C ATOM 2163 CG ARG A 133 11.069 7.262 11.191 1.00 0.00 C ATOM 2164 CD ARG A 133 11.653 6.800 12.516 1.00 0.00 C ATOM 2165 NE ARG A 133 11.766 7.895 13.477 1.00 0.00 N ATOM 2166 CZ ARG A 133 12.636 8.896 13.360 1.00 0.00 C ATOM 2167 NH1 ARG A 133 13.469 8.944 12.328 1.00 0.00 N ATOM 2168 NH2 ARG A 133 12.672 9.852 14.278 1.00 0.00 N ATOM 0 H ARG A 133 10.262 4.129 9.195 1.00 0.00 H new ATOM 0 HA ARG A 133 9.300 6.814 9.408 1.00 0.00 H new ATOM 0 HB2 ARG A 133 11.296 5.228 10.571 1.00 0.00 H new ATOM 0 HB3 ARG A 133 12.204 6.378 9.609 1.00 0.00 H new ATOM 0 HG2 ARG A 133 11.551 8.190 10.884 1.00 0.00 H new ATOM 0 HG3 ARG A 133 10.008 7.480 11.316 1.00 0.00 H new ATOM 0 HD2 ARG A 133 11.024 6.014 12.935 1.00 0.00 H new ATOM 0 HD3 ARG A 133 12.637 6.364 12.346 1.00 0.00 H new ATOM 0 HE ARG A 133 11.142 7.892 14.284 1.00 0.00 H new ATOM 0 HH11 ARG A 133 13.445 8.211 11.619 1.00 0.00 H new ATOM 0 HH12 ARG A 133 14.133 9.714 12.244 1.00 0.00 H new ATOM 0 HH21 ARG A 133 12.034 9.820 15.073 1.00 0.00 H new ATOM 0 HH22 ARG A 133 13.338 10.619 14.189 1.00 0.00 H new