USER MOD reduce.3.24.130724 H: found=0, std=0, add=673, rem=0, adj=9 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 180:sc= -0.897 USER MOD Set 1.2: A 113 GLN : amide:sc= -0.218 K(o=-1.1,f=-8.1!) USER MOD Set 2.1: A 43 THR OG1 : rot 180:sc= -0.892 USER MOD Set 2.2: A 46 GLN : amide:sc= -4.67! C(o=-5.6!,f=-10!) USER MOD Set 3.1: A 32 TYR OH : rot -40:sc= -0.401 USER MOD Set 3.2: A 115 MET CE :methyl -165:sc= -0.108 (180deg=-0.48) USER MOD Single : A 45 GLN : amide:sc= -1.55 K(o=-1.6,f=-4.7!) USER MOD Single : A 54 MET CE :methyl -121:sc= -10.1! (180deg=-12.5!) USER MOD Single : A 57 HIS : no HE2:sc= -3.17 K(o=-3.2,f=-8!) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 MET CE :methyl -144:sc= -3.49! (180deg=-5.95!) USER MOD Single : A 123 HIS : no HD1:sc= -0.189 X(o=-0.19,f=-0.47) USER MOD Single : A 124 LYS NZ :NH3+ 163:sc= -0.0339 (180deg=-0.142) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 THR OG1 : rot -66:sc= -1.35 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 507 N ASP A 31 7.367 12.344 8.849 1.00 0.00 N ATOM 508 CA ASP A 31 8.469 11.562 9.397 1.00 0.00 C ATOM 509 C ASP A 31 8.209 10.070 9.227 1.00 0.00 C ATOM 510 O ASP A 31 9.121 9.299 8.934 1.00 0.00 O ATOM 511 CB ASP A 31 8.669 11.891 10.879 1.00 0.00 C ATOM 512 CG ASP A 31 9.335 13.237 11.087 1.00 0.00 C ATOM 513 OD1 ASP A 31 8.620 14.261 11.075 1.00 0.00 O ATOM 514 OD2 ASP A 31 10.571 13.267 11.263 1.00 0.00 O ATOM 0 HA ASP A 31 9.375 11.821 8.850 1.00 0.00 H new ATOM 0 HB2 ASP A 31 7.703 11.885 11.383 1.00 0.00 H new ATOM 0 HB3 ASP A 31 9.276 11.113 11.343 1.00 0.00 H new ATOM 519 N TYR A 32 6.954 9.673 9.407 1.00 0.00 N ATOM 520 CA TYR A 32 6.564 8.275 9.269 1.00 0.00 C ATOM 521 C TYR A 32 5.737 8.075 8.005 1.00 0.00 C ATOM 522 O TYR A 32 5.341 9.040 7.353 1.00 0.00 O ATOM 523 CB TYR A 32 5.764 7.825 10.490 1.00 0.00 C ATOM 524 CG TYR A 32 6.624 7.417 11.664 1.00 0.00 C ATOM 525 CD1 TYR A 32 7.673 6.519 11.509 1.00 0.00 C ATOM 526 CD2 TYR A 32 6.378 7.924 12.933 1.00 0.00 C ATOM 527 CE1 TYR A 32 8.451 6.141 12.584 1.00 0.00 C ATOM 528 CE2 TYR A 32 7.152 7.549 14.013 1.00 0.00 C ATOM 529 CZ TYR A 32 8.187 6.658 13.835 1.00 0.00 C ATOM 530 OH TYR A 32 8.961 6.282 14.909 1.00 0.00 O ATOM 0 H TYR A 32 6.188 10.301 9.649 1.00 0.00 H new ATOM 0 HA TYR A 32 7.469 7.671 9.196 1.00 0.00 H new ATOM 0 HB2 TYR A 32 5.104 8.635 10.799 1.00 0.00 H new ATOM 0 HB3 TYR A 32 5.128 6.986 10.208 1.00 0.00 H new ATOM 0 HD1 TYR A 32 7.883 6.110 10.532 1.00 0.00 H new ATOM 0 HD2 TYR A 32 5.568 8.623 13.078 1.00 0.00 H new ATOM 0 HE1 TYR A 32 9.264 5.443 12.446 1.00 0.00 H new ATOM 0 HE2 TYR A 32 6.947 7.953 14.993 1.00 0.00 H new ATOM 0 HH TYR A 32 9.159 5.324 14.850 1.00 0.00 H new ATOM 540 N GLY A 33 5.480 6.817 7.660 1.00 0.00 N ATOM 541 CA GLY A 33 4.703 6.527 6.471 1.00 0.00 C ATOM 542 C GLY A 33 4.071 5.150 6.500 1.00 0.00 C ATOM 543 O GLY A 33 4.748 4.152 6.746 1.00 0.00 O ATOM 0 H GLY A 33 5.794 5.998 8.180 1.00 0.00 H new ATOM 0 HA2 GLY A 33 3.920 7.278 6.363 1.00 0.00 H new ATOM 0 HA3 GLY A 33 5.346 6.608 5.594 1.00 0.00 H new ATOM 547 N LEU A 34 2.770 5.098 6.236 1.00 0.00 N ATOM 548 CA LEU A 34 2.041 3.837 6.218 1.00 0.00 C ATOM 549 C LEU A 34 2.042 3.257 4.809 1.00 0.00 C ATOM 550 O LEU A 34 1.411 3.801 3.904 1.00 0.00 O ATOM 551 CB LEU A 34 0.604 4.049 6.704 1.00 0.00 C ATOM 552 CG LEU A 34 -0.142 2.787 7.150 1.00 0.00 C ATOM 553 CD1 LEU A 34 -0.762 2.088 5.952 1.00 0.00 C ATOM 554 CD2 LEU A 34 0.785 1.841 7.905 1.00 0.00 C ATOM 0 H LEU A 34 2.198 5.917 6.031 1.00 0.00 H new ATOM 0 HA LEU A 34 2.534 3.134 6.889 1.00 0.00 H new ATOM 0 HB2 LEU A 34 0.622 4.751 7.538 1.00 0.00 H new ATOM 0 HB3 LEU A 34 0.035 4.520 5.903 1.00 0.00 H new ATOM 0 HG LEU A 34 -0.940 3.086 7.829 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -1.288 1.193 6.285 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -1.465 2.761 5.462 1.00 0.00 H new ATOM 0 HD13 LEU A 34 0.022 1.807 5.249 1.00 0.00 H new ATOM 0 HD21 LEU A 34 0.230 0.954 8.210 1.00 0.00 H new ATOM 0 HD22 LEU A 34 1.611 1.547 7.257 1.00 0.00 H new ATOM 0 HD23 LEU A 34 1.178 2.345 8.788 1.00 0.00 H new ATOM 566 N VAL A 35 2.771 2.164 4.628 1.00 0.00 N ATOM 567 CA VAL A 35 2.877 1.526 3.324 1.00 0.00 C ATOM 568 C VAL A 35 1.932 0.342 3.185 1.00 0.00 C ATOM 569 O VAL A 35 1.691 -0.396 4.139 1.00 0.00 O ATOM 570 CB VAL A 35 4.311 1.035 3.055 1.00 0.00 C ATOM 571 CG1 VAL A 35 4.772 0.105 4.165 1.00 0.00 C ATOM 572 CG2 VAL A 35 4.396 0.335 1.707 1.00 0.00 C ATOM 0 H VAL A 35 3.298 1.701 5.369 1.00 0.00 H new ATOM 0 HA VAL A 35 2.602 2.289 2.595 1.00 0.00 H new ATOM 0 HB VAL A 35 4.970 1.903 3.033 1.00 0.00 H new ATOM 0 HG11 VAL A 35 5.788 -0.233 3.959 1.00 0.00 H new ATOM 0 HG12 VAL A 35 4.753 0.636 5.116 1.00 0.00 H new ATOM 0 HG13 VAL A 35 4.107 -0.757 4.217 1.00 0.00 H new ATOM 0 HG21 VAL A 35 5.418 -0.004 1.537 1.00 0.00 H new ATOM 0 HG22 VAL A 35 3.723 -0.523 1.699 1.00 0.00 H new ATOM 0 HG23 VAL A 35 4.108 1.029 0.918 1.00 0.00 H new ATOM 582 N ALA A 36 1.427 0.155 1.971 1.00 0.00 N ATOM 583 CA ALA A 36 0.538 -0.953 1.670 1.00 0.00 C ATOM 584 C ALA A 36 1.333 -2.088 1.038 1.00 0.00 C ATOM 585 O ALA A 36 1.892 -1.930 -0.046 1.00 0.00 O ATOM 586 CB ALA A 36 -0.578 -0.498 0.741 1.00 0.00 C ATOM 0 H ALA A 36 1.622 0.763 1.176 1.00 0.00 H new ATOM 0 HA ALA A 36 0.085 -1.311 2.595 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -1.236 -1.339 0.524 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -1.150 0.296 1.221 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -0.148 -0.125 -0.188 1.00 0.00 H new ATOM 592 N LEU A 37 1.400 -3.222 1.732 1.00 0.00 N ATOM 593 CA LEU A 37 2.151 -4.379 1.250 1.00 0.00 C ATOM 594 C LEU A 37 1.284 -5.309 0.400 1.00 0.00 C ATOM 595 O LEU A 37 1.612 -6.483 0.226 1.00 0.00 O ATOM 596 CB LEU A 37 2.732 -5.153 2.433 1.00 0.00 C ATOM 597 CG LEU A 37 3.303 -4.284 3.554 1.00 0.00 C ATOM 598 CD1 LEU A 37 3.396 -5.073 4.851 1.00 0.00 C ATOM 599 CD2 LEU A 37 4.667 -3.741 3.158 1.00 0.00 C ATOM 0 H LEU A 37 0.942 -3.364 2.632 1.00 0.00 H new ATOM 0 HA LEU A 37 2.958 -4.007 0.619 1.00 0.00 H new ATOM 0 HB2 LEU A 37 1.952 -5.791 2.849 1.00 0.00 H new ATOM 0 HB3 LEU A 37 3.520 -5.811 2.066 1.00 0.00 H new ATOM 0 HG LEU A 37 2.629 -3.443 3.716 1.00 0.00 H new ATOM 0 HD11 LEU A 37 3.805 -4.436 5.636 1.00 0.00 H new ATOM 0 HD12 LEU A 37 2.402 -5.414 5.141 1.00 0.00 H new ATOM 0 HD13 LEU A 37 4.048 -5.935 4.707 1.00 0.00 H new ATOM 0 HD21 LEU A 37 5.061 -3.124 3.965 1.00 0.00 H new ATOM 0 HD22 LEU A 37 5.348 -4.571 2.969 1.00 0.00 H new ATOM 0 HD23 LEU A 37 4.570 -3.138 2.255 1.00 0.00 H new ATOM 611 N GLU A 38 0.183 -4.785 -0.129 1.00 0.00 N ATOM 612 CA GLU A 38 -0.713 -5.582 -0.958 1.00 0.00 C ATOM 613 C GLU A 38 -1.661 -4.680 -1.747 1.00 0.00 C ATOM 614 O GLU A 38 -2.167 -3.690 -1.219 1.00 0.00 O ATOM 615 CB GLU A 38 -1.511 -6.559 -0.092 1.00 0.00 C ATOM 616 CG GLU A 38 -2.078 -7.739 -0.864 1.00 0.00 C ATOM 617 CD GLU A 38 -2.890 -8.672 0.012 1.00 0.00 C ATOM 618 OE1 GLU A 38 -3.722 -8.172 0.799 1.00 0.00 O ATOM 619 OE2 GLU A 38 -2.695 -9.901 -0.089 1.00 0.00 O ATOM 0 H GLU A 38 -0.109 -3.816 0.001 1.00 0.00 H new ATOM 0 HA GLU A 38 -0.110 -6.152 -1.665 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -0.868 -6.933 0.705 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -2.330 -6.021 0.386 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -2.706 -7.370 -1.675 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -1.260 -8.296 -1.322 1.00 0.00 H new ATOM 626 N PRO A 39 -1.913 -5.007 -3.028 1.00 0.00 N ATOM 627 CA PRO A 39 -2.800 -4.211 -3.883 1.00 0.00 C ATOM 628 C PRO A 39 -4.247 -4.231 -3.405 1.00 0.00 C ATOM 629 O PRO A 39 -4.811 -5.292 -3.139 1.00 0.00 O ATOM 630 CB PRO A 39 -2.682 -4.883 -5.254 1.00 0.00 C ATOM 631 CG PRO A 39 -2.224 -6.270 -4.963 1.00 0.00 C ATOM 632 CD PRO A 39 -1.351 -6.166 -3.744 1.00 0.00 C ATOM 0 HA PRO A 39 -2.517 -3.158 -3.884 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -3.638 -4.884 -5.777 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -1.971 -4.358 -5.892 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -3.071 -6.932 -4.782 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -1.671 -6.684 -5.806 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -1.393 -7.072 -3.140 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -0.306 -6.008 -4.009 1.00 0.00 H new ATOM 640 N ALA A 40 -4.844 -3.047 -3.301 1.00 0.00 N ATOM 641 CA ALA A 40 -6.227 -2.925 -2.858 1.00 0.00 C ATOM 642 C ALA A 40 -6.839 -1.608 -3.322 1.00 0.00 C ATOM 643 O ALA A 40 -6.137 -0.727 -3.820 1.00 0.00 O ATOM 644 CB ALA A 40 -6.311 -3.043 -1.342 1.00 0.00 C ATOM 0 H ALA A 40 -4.391 -2.159 -3.518 1.00 0.00 H new ATOM 0 HA ALA A 40 -6.797 -3.739 -3.306 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -7.350 -2.950 -1.027 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -5.923 -4.013 -1.030 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -5.720 -2.251 -0.882 1.00 0.00 H new ATOM 650 N TRP A 41 -8.150 -1.478 -3.151 1.00 0.00 N ATOM 651 CA TRP A 41 -8.860 -0.268 -3.546 1.00 0.00 C ATOM 652 C TRP A 41 -9.335 0.502 -2.317 1.00 0.00 C ATOM 653 O TRP A 41 -10.281 0.093 -1.645 1.00 0.00 O ATOM 654 CB TRP A 41 -10.055 -0.618 -4.436 1.00 0.00 C ATOM 655 CG TRP A 41 -9.661 -1.210 -5.755 1.00 0.00 C ATOM 656 CD1 TRP A 41 -8.605 -0.840 -6.536 1.00 0.00 C ATOM 657 CD2 TRP A 41 -10.321 -2.275 -6.448 1.00 0.00 C ATOM 658 NE1 TRP A 41 -8.566 -1.612 -7.671 1.00 0.00 N ATOM 659 CE2 TRP A 41 -9.609 -2.500 -7.641 1.00 0.00 C ATOM 660 CE3 TRP A 41 -11.444 -3.061 -6.175 1.00 0.00 C ATOM 661 CZ2 TRP A 41 -9.984 -3.478 -8.559 1.00 0.00 C ATOM 662 CZ3 TRP A 41 -11.815 -4.032 -7.087 1.00 0.00 C ATOM 663 CH2 TRP A 41 -11.086 -4.233 -8.266 1.00 0.00 C ATOM 0 H TRP A 41 -8.744 -2.198 -2.740 1.00 0.00 H new ATOM 0 HA TRP A 41 -8.172 0.363 -4.109 1.00 0.00 H new ATOM 0 HB2 TRP A 41 -10.698 -1.322 -3.908 1.00 0.00 H new ATOM 0 HB3 TRP A 41 -10.644 0.282 -4.611 1.00 0.00 H new ATOM 0 HD1 TRP A 41 -7.903 -0.055 -6.297 1.00 0.00 H new ATOM 0 HE1 TRP A 41 -7.873 -1.537 -8.416 1.00 0.00 H new ATOM 0 HE3 TRP A 41 -12.012 -2.913 -5.268 1.00 0.00 H new ATOM 0 HZ2 TRP A 41 -9.425 -3.635 -9.469 1.00 0.00 H new ATOM 0 HZ3 TRP A 41 -12.681 -4.645 -6.887 1.00 0.00 H new ATOM 0 HH2 TRP A 41 -11.401 -5.000 -8.958 1.00 0.00 H new ATOM 674 N ILE A 42 -8.669 1.615 -2.028 1.00 0.00 N ATOM 675 CA ILE A 42 -9.023 2.436 -0.877 1.00 0.00 C ATOM 676 C ILE A 42 -10.168 3.387 -1.209 1.00 0.00 C ATOM 677 O ILE A 42 -10.048 4.233 -2.095 1.00 0.00 O ATOM 678 CB ILE A 42 -7.819 3.258 -0.375 1.00 0.00 C ATOM 679 CG1 ILE A 42 -6.554 2.397 -0.345 1.00 0.00 C ATOM 680 CG2 ILE A 42 -8.108 3.830 1.005 1.00 0.00 C ATOM 681 CD1 ILE A 42 -6.606 1.279 0.674 1.00 0.00 C ATOM 0 H ILE A 42 -7.883 1.968 -2.574 1.00 0.00 H new ATOM 0 HA ILE A 42 -9.338 1.751 -0.090 1.00 0.00 H new ATOM 0 HB ILE A 42 -7.653 4.085 -1.065 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -6.393 1.969 -1.334 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -5.696 3.034 -0.130 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -7.249 4.408 1.347 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -8.984 4.477 0.955 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -8.298 3.016 1.704 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -5.676 0.711 0.639 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -6.736 1.701 1.671 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -7.443 0.619 0.447 1.00 0.00 H new ATOM 693 N THR A 43 -11.278 3.240 -0.494 1.00 0.00 N ATOM 694 CA THR A 43 -12.447 4.084 -0.711 1.00 0.00 C ATOM 695 C THR A 43 -12.269 5.447 -0.057 1.00 0.00 C ATOM 696 O THR A 43 -11.283 5.690 0.638 1.00 0.00 O ATOM 697 CB THR A 43 -13.698 3.407 -0.151 1.00 0.00 C ATOM 698 OG1 THR A 43 -13.370 2.580 0.952 1.00 0.00 O ATOM 699 CG2 THR A 43 -14.419 2.552 -1.165 1.00 0.00 C ATOM 0 H THR A 43 -11.393 2.543 0.242 1.00 0.00 H new ATOM 0 HA THR A 43 -12.561 4.228 -1.785 1.00 0.00 H new ATOM 0 HB THR A 43 -14.357 4.222 0.148 1.00 0.00 H new ATOM 0 HG1 THR A 43 -14.184 2.157 1.297 1.00 0.00 H new ATOM 0 HG21 THR A 43 -15.297 2.101 -0.702 1.00 0.00 H new ATOM 0 HG22 THR A 43 -14.730 3.170 -2.007 1.00 0.00 H new ATOM 0 HG23 THR A 43 -13.751 1.766 -1.519 1.00 0.00 H new ATOM 707 N ALA A 44 -13.234 6.331 -0.281 1.00 0.00 N ATOM 708 CA ALA A 44 -13.189 7.667 0.291 1.00 0.00 C ATOM 709 C ALA A 44 -13.216 7.604 1.812 1.00 0.00 C ATOM 710 O ALA A 44 -12.463 8.305 2.487 1.00 0.00 O ATOM 711 CB ALA A 44 -14.350 8.504 -0.227 1.00 0.00 C ATOM 0 H ALA A 44 -14.056 6.145 -0.855 1.00 0.00 H new ATOM 0 HA ALA A 44 -12.255 8.139 -0.014 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -14.303 9.501 0.210 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -14.288 8.580 -1.313 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -15.292 8.031 0.050 1.00 0.00 H new ATOM 717 N GLN A 45 -14.093 6.759 2.350 1.00 0.00 N ATOM 718 CA GLN A 45 -14.233 6.595 3.765 1.00 0.00 C ATOM 719 C GLN A 45 -12.934 6.137 4.416 1.00 0.00 C ATOM 720 O GLN A 45 -12.574 6.609 5.483 1.00 0.00 O ATOM 721 CB GLN A 45 -15.328 5.576 3.999 1.00 0.00 C ATOM 722 CG GLN A 45 -16.522 6.145 4.719 1.00 0.00 C ATOM 723 CD GLN A 45 -16.688 5.591 6.121 1.00 0.00 C ATOM 724 OE1 GLN A 45 -15.759 5.018 6.689 1.00 0.00 O ATOM 725 NE2 GLN A 45 -17.878 5.759 6.686 1.00 0.00 N ATOM 0 H GLN A 45 -14.722 6.174 1.800 1.00 0.00 H new ATOM 0 HA GLN A 45 -14.486 7.553 4.219 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -15.649 5.170 3.040 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -14.925 4.745 4.578 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -16.425 7.229 4.772 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -17.422 5.934 4.142 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -18.620 6.240 6.178 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -18.050 5.407 7.628 1.00 0.00 H new ATOM 734 N GLN A 46 -12.233 5.217 3.775 1.00 0.00 N ATOM 735 CA GLN A 46 -10.989 4.706 4.320 1.00 0.00 C ATOM 736 C GLN A 46 -9.981 5.833 4.527 1.00 0.00 C ATOM 737 O GLN A 46 -9.196 5.811 5.475 1.00 0.00 O ATOM 738 CB GLN A 46 -10.415 3.639 3.390 1.00 0.00 C ATOM 739 CG GLN A 46 -11.282 2.395 3.291 1.00 0.00 C ATOM 740 CD GLN A 46 -10.735 1.374 2.314 1.00 0.00 C ATOM 741 OE1 GLN A 46 -9.522 1.194 2.201 1.00 0.00 O ATOM 742 NE2 GLN A 46 -11.628 0.700 1.600 1.00 0.00 N ATOM 0 H GLN A 46 -12.504 4.810 2.880 1.00 0.00 H new ATOM 0 HA GLN A 46 -11.194 4.257 5.292 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -10.289 4.065 2.395 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -9.424 3.355 3.743 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -11.368 1.938 4.277 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -12.288 2.682 2.984 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -12.624 0.881 1.726 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -11.319 0.001 0.925 1.00 0.00 H new ATOM 751 N ILE A 47 -10.010 6.817 3.637 1.00 0.00 N ATOM 752 CA ILE A 47 -9.101 7.952 3.727 1.00 0.00 C ATOM 753 C ILE A 47 -9.473 8.881 4.881 1.00 0.00 C ATOM 754 O ILE A 47 -8.621 9.257 5.685 1.00 0.00 O ATOM 755 CB ILE A 47 -9.085 8.761 2.416 1.00 0.00 C ATOM 756 CG1 ILE A 47 -8.865 7.834 1.219 1.00 0.00 C ATOM 757 CG2 ILE A 47 -8.007 9.833 2.464 1.00 0.00 C ATOM 758 CD1 ILE A 47 -9.419 8.381 -0.078 1.00 0.00 C ATOM 0 H ILE A 47 -10.652 6.852 2.846 1.00 0.00 H new ATOM 0 HA ILE A 47 -8.108 7.541 3.909 1.00 0.00 H new ATOM 0 HB ILE A 47 -10.052 9.251 2.301 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -7.797 7.654 1.101 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -9.330 6.870 1.426 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -8.010 10.394 1.530 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -8.204 10.510 3.295 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -7.033 9.364 2.602 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -9.227 7.672 -0.883 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -10.493 8.535 0.022 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -8.936 9.331 -0.308 1.00 0.00 H new ATOM 770 N GLU A 48 -10.747 9.255 4.953 1.00 0.00 N ATOM 771 CA GLU A 48 -11.225 10.149 6.006 1.00 0.00 C ATOM 772 C GLU A 48 -11.531 9.387 7.294 1.00 0.00 C ATOM 773 O GLU A 48 -11.134 9.802 8.382 1.00 0.00 O ATOM 774 CB GLU A 48 -12.474 10.896 5.537 1.00 0.00 C ATOM 775 CG GLU A 48 -12.589 12.305 6.097 1.00 0.00 C ATOM 776 CD GLU A 48 -13.199 13.278 5.108 1.00 0.00 C ATOM 777 OE1 GLU A 48 -12.772 13.278 3.934 1.00 0.00 O ATOM 778 OE2 GLU A 48 -14.104 14.041 5.508 1.00 0.00 O ATOM 0 H GLU A 48 -11.467 8.954 4.296 1.00 0.00 H new ATOM 0 HA GLU A 48 -10.431 10.865 6.218 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -12.469 10.946 4.448 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -13.357 10.326 5.826 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -13.197 12.284 7.002 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -11.599 12.659 6.386 1.00 0.00 H new ATOM 785 N ALA A 49 -12.243 8.272 7.160 1.00 0.00 N ATOM 786 CA ALA A 49 -12.610 7.449 8.311 1.00 0.00 C ATOM 787 C ALA A 49 -11.379 7.058 9.122 1.00 0.00 C ATOM 788 O ALA A 49 -11.368 7.172 10.347 1.00 0.00 O ATOM 789 CB ALA A 49 -13.366 6.204 7.858 1.00 0.00 C ATOM 0 H ALA A 49 -12.578 7.916 6.265 1.00 0.00 H new ATOM 0 HA ALA A 49 -13.263 8.041 8.953 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -13.631 5.603 8.728 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -14.273 6.501 7.331 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -12.734 5.618 7.191 1.00 0.00 H new ATOM 795 N ALA A 50 -10.343 6.599 8.428 1.00 0.00 N ATOM 796 CA ALA A 50 -9.106 6.195 9.084 1.00 0.00 C ATOM 797 C ALA A 50 -8.400 7.395 9.704 1.00 0.00 C ATOM 798 O ALA A 50 -7.874 7.312 10.813 1.00 0.00 O ATOM 799 CB ALA A 50 -8.188 5.493 8.094 1.00 0.00 C ATOM 0 H ALA A 50 -10.336 6.498 7.413 1.00 0.00 H new ATOM 0 HA ALA A 50 -9.357 5.499 9.884 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -7.268 5.197 8.598 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -8.687 4.608 7.700 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -7.951 6.171 7.274 1.00 0.00 H new ATOM 805 N ARG A 51 -8.396 8.511 8.982 1.00 0.00 N ATOM 806 CA ARG A 51 -7.756 9.730 9.462 1.00 0.00 C ATOM 807 C ARG A 51 -8.380 10.188 10.777 1.00 0.00 C ATOM 808 O ARG A 51 -7.678 10.613 11.694 1.00 0.00 O ATOM 809 CB ARG A 51 -7.869 10.839 8.414 1.00 0.00 C ATOM 810 CG ARG A 51 -6.647 10.954 7.516 1.00 0.00 C ATOM 811 CD ARG A 51 -6.431 12.384 7.050 1.00 0.00 C ATOM 812 NE ARG A 51 -7.257 12.714 5.892 1.00 0.00 N ATOM 813 CZ ARG A 51 -7.105 13.815 5.161 1.00 0.00 C ATOM 814 NH1 ARG A 51 -6.159 14.695 5.465 1.00 0.00 N ATOM 815 NH2 ARG A 51 -7.900 14.038 4.124 1.00 0.00 N ATOM 0 H ARG A 51 -8.829 8.596 8.062 1.00 0.00 H new ATOM 0 HA ARG A 51 -6.702 9.514 9.636 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -8.748 10.655 7.796 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -8.029 11.791 8.920 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -5.765 10.609 8.055 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -6.768 10.302 6.651 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -6.660 13.069 7.866 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -5.380 12.528 6.798 1.00 0.00 H new ATOM 0 HE ARG A 51 -7.995 12.061 5.628 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -5.545 14.529 6.262 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -6.046 15.538 4.902 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -8.629 13.365 3.886 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -7.783 14.882 3.564 1.00 0.00 H new ATOM 829 N VAL A 52 -9.703 10.093 10.863 1.00 0.00 N ATOM 830 CA VAL A 52 -10.422 10.494 12.067 1.00 0.00 C ATOM 831 C VAL A 52 -9.953 9.690 13.276 1.00 0.00 C ATOM 832 O VAL A 52 -9.792 10.231 14.370 1.00 0.00 O ATOM 833 CB VAL A 52 -11.944 10.312 11.898 1.00 0.00 C ATOM 834 CG1 VAL A 52 -12.686 10.817 13.127 1.00 0.00 C ATOM 835 CG2 VAL A 52 -12.430 11.022 10.642 1.00 0.00 C ATOM 0 H VAL A 52 -10.299 9.742 10.113 1.00 0.00 H new ATOM 0 HA VAL A 52 -10.208 11.550 12.231 1.00 0.00 H new ATOM 0 HB VAL A 52 -12.153 9.248 11.791 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -13.758 10.679 12.987 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -12.360 10.258 14.004 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -12.472 11.876 13.272 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -13.506 10.883 10.539 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -12.207 12.086 10.716 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -11.925 10.606 9.770 1.00 0.00 H new ATOM 845 N ALA A 53 -9.736 8.396 13.068 1.00 0.00 N ATOM 846 CA ALA A 53 -9.284 7.515 14.138 1.00 0.00 C ATOM 847 C ALA A 53 -7.847 7.829 14.538 1.00 0.00 C ATOM 848 O ALA A 53 -7.491 7.769 15.715 1.00 0.00 O ATOM 849 CB ALA A 53 -9.410 6.061 13.707 1.00 0.00 C ATOM 0 H ALA A 53 -9.866 7.934 12.168 1.00 0.00 H new ATOM 0 HA ALA A 53 -9.918 7.682 15.009 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -9.070 5.412 14.514 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -10.452 5.839 13.477 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -8.799 5.890 12.821 1.00 0.00 H new ATOM 855 N MET A 54 -7.025 8.162 13.549 1.00 0.00 N ATOM 856 CA MET A 54 -5.623 8.484 13.793 1.00 0.00 C ATOM 857 C MET A 54 -5.482 9.830 14.500 1.00 0.00 C ATOM 858 O MET A 54 -4.758 9.948 15.489 1.00 0.00 O ATOM 859 CB MET A 54 -4.849 8.503 12.475 1.00 0.00 C ATOM 860 CG MET A 54 -4.784 7.147 11.794 1.00 0.00 C ATOM 861 SD MET A 54 -3.528 7.078 10.502 1.00 0.00 S ATOM 862 CE MET A 54 -4.440 7.751 9.116 1.00 0.00 C ATOM 0 H MET A 54 -7.305 8.216 12.570 1.00 0.00 H new ATOM 0 HA MET A 54 -5.208 7.713 14.442 1.00 0.00 H new ATOM 0 HB2 MET A 54 -5.316 9.219 11.798 1.00 0.00 H new ATOM 0 HB3 MET A 54 -3.835 8.856 12.663 1.00 0.00 H new ATOM 0 HG2 MET A 54 -4.575 6.380 12.540 1.00 0.00 H new ATOM 0 HG3 MET A 54 -5.757 6.915 11.362 1.00 0.00 H new ATOM 0 HE1 MET A 54 -4.467 7.019 8.309 1.00 0.00 H new ATOM 0 HE2 MET A 54 -5.458 7.984 9.429 1.00 0.00 H new ATOM 0 HE3 MET A 54 -3.951 8.660 8.765 1.00 0.00 H new ATOM 872 N VAL A 55 -6.176 10.840 13.987 1.00 0.00 N ATOM 873 CA VAL A 55 -6.124 12.176 14.568 1.00 0.00 C ATOM 874 C VAL A 55 -6.530 12.156 16.038 1.00 0.00 C ATOM 875 O VAL A 55 -5.976 12.890 16.857 1.00 0.00 O ATOM 876 CB VAL A 55 -7.040 13.155 13.808 1.00 0.00 C ATOM 877 CG1 VAL A 55 -6.887 14.568 14.351 1.00 0.00 C ATOM 878 CG2 VAL A 55 -6.746 13.115 12.315 1.00 0.00 C ATOM 0 H VAL A 55 -6.781 10.759 13.170 1.00 0.00 H new ATOM 0 HA VAL A 55 -5.091 12.515 14.485 1.00 0.00 H new ATOM 0 HB VAL A 55 -8.074 12.844 13.960 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -7.543 15.242 13.800 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -7.156 14.583 15.407 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -5.853 14.892 14.235 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -7.403 13.813 11.796 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -5.707 13.396 12.141 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -6.917 12.107 11.937 1.00 0.00 H new ATOM 888 N ARG A 56 -7.504 11.313 16.367 1.00 0.00 N ATOM 889 CA ARG A 56 -7.986 11.200 17.738 1.00 0.00 C ATOM 890 C ARG A 56 -6.995 10.433 18.609 1.00 0.00 C ATOM 891 O ARG A 56 -6.909 10.663 19.815 1.00 0.00 O ATOM 892 CB ARG A 56 -9.349 10.505 17.761 1.00 0.00 C ATOM 893 CG ARG A 56 -10.517 11.450 17.535 1.00 0.00 C ATOM 894 CD ARG A 56 -11.696 10.736 16.894 1.00 0.00 C ATOM 895 NE ARG A 56 -12.254 9.706 17.767 1.00 0.00 N ATOM 896 CZ ARG A 56 -13.242 8.888 17.411 1.00 0.00 C ATOM 897 NH1 ARG A 56 -13.784 8.978 16.203 1.00 0.00 N ATOM 898 NH2 ARG A 56 -13.690 7.978 18.266 1.00 0.00 N ATOM 0 H ARG A 56 -7.974 10.699 15.703 1.00 0.00 H new ATOM 0 HA ARG A 56 -8.088 12.206 18.144 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -9.366 9.730 16.994 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -9.477 10.006 18.721 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -10.826 11.882 18.487 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -10.200 12.276 16.898 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -12.471 11.463 16.650 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -11.378 10.282 15.955 1.00 0.00 H new ATOM 0 HE ARG A 56 -11.864 9.608 18.704 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -13.444 9.676 15.542 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -14.541 8.349 15.935 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -13.277 7.905 19.196 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -14.447 7.351 17.993 1.00 0.00 H new ATOM 912 N HIS A 57 -6.252 9.519 17.993 1.00 0.00 N ATOM 913 CA HIS A 57 -5.272 8.718 18.717 1.00 0.00 C ATOM 914 C HIS A 57 -4.169 9.595 19.304 1.00 0.00 C ATOM 915 O HIS A 57 -3.865 9.510 20.493 1.00 0.00 O ATOM 916 CB HIS A 57 -4.661 7.663 17.794 1.00 0.00 C ATOM 917 CG HIS A 57 -4.091 6.488 18.526 1.00 0.00 C ATOM 918 ND1 HIS A 57 -4.835 5.700 19.378 1.00 0.00 N ATOM 919 CD2 HIS A 57 -2.840 5.969 18.533 1.00 0.00 C ATOM 920 CE1 HIS A 57 -4.068 4.749 19.878 1.00 0.00 C ATOM 921 NE2 HIS A 57 -2.853 4.889 19.380 1.00 0.00 N ATOM 0 H HIS A 57 -6.310 9.315 16.995 1.00 0.00 H new ATOM 0 HA HIS A 57 -5.788 8.220 19.538 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -5.425 7.313 17.100 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -3.875 8.125 17.197 1.00 0.00 H new ATOM 0 HD1 HIS A 57 -5.824 5.831 19.589 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -1.991 6.336 17.976 1.00 0.00 H new ATOM 0 HE1 HIS A 57 -4.381 3.986 20.576 1.00 0.00 H new ATOM 930 N PHE A 58 -3.573 10.436 18.464 1.00 0.00 N ATOM 931 CA PHE A 58 -2.502 11.327 18.905 1.00 0.00 C ATOM 932 C PHE A 58 -2.936 12.146 20.117 1.00 0.00 C ATOM 933 O PHE A 58 -3.850 12.965 20.030 1.00 0.00 O ATOM 934 CB PHE A 58 -2.085 12.262 17.768 1.00 0.00 C ATOM 935 CG PHE A 58 -1.892 11.566 16.451 1.00 0.00 C ATOM 936 CD1 PHE A 58 -0.948 10.559 16.314 1.00 0.00 C ATOM 937 CD2 PHE A 58 -2.653 11.919 15.349 1.00 0.00 C ATOM 938 CE1 PHE A 58 -0.768 9.920 15.103 1.00 0.00 C ATOM 939 CE2 PHE A 58 -2.478 11.283 14.135 1.00 0.00 C ATOM 940 CZ PHE A 58 -1.534 10.281 14.012 1.00 0.00 C ATOM 0 H PHE A 58 -3.812 10.520 17.476 1.00 0.00 H new ATOM 0 HA PHE A 58 -1.650 10.711 19.192 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -2.842 13.037 17.651 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -1.157 12.762 18.043 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -0.347 10.271 17.164 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -3.392 12.701 15.440 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -0.029 9.138 15.009 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -3.078 11.568 13.283 1.00 0.00 H new ATOM 0 HZ PHE A 58 -1.396 9.781 13.065 1.00 0.00 H new ATOM 950 N ARG A 59 -2.272 11.918 21.246 1.00 0.00 N ATOM 951 CA ARG A 59 -2.589 12.635 22.477 1.00 0.00 C ATOM 952 C ARG A 59 -2.064 14.065 22.425 1.00 0.00 C ATOM 953 O ARG A 59 -2.705 14.991 22.924 1.00 0.00 O ATOM 954 CB ARG A 59 -1.992 11.908 23.684 1.00 0.00 C ATOM 955 CG ARG A 59 -2.675 10.586 23.998 1.00 0.00 C ATOM 956 CD ARG A 59 -2.271 10.064 25.367 1.00 0.00 C ATOM 957 NE ARG A 59 -2.117 8.611 25.376 1.00 0.00 N ATOM 958 CZ ARG A 59 -3.134 7.758 25.464 1.00 0.00 C ATOM 959 NH1 ARG A 59 -4.382 8.205 25.546 1.00 0.00 N ATOM 960 NH2 ARG A 59 -2.904 6.451 25.470 1.00 0.00 N ATOM 0 H ARG A 59 -1.512 11.243 21.334 1.00 0.00 H new ATOM 0 HA ARG A 59 -3.674 12.667 22.578 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -0.933 11.726 23.500 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -2.057 12.557 24.557 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -3.757 10.716 23.961 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -2.416 9.851 23.236 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -1.333 10.530 25.670 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -3.023 10.353 26.101 1.00 0.00 H new ATOM 0 HE ARG A 59 -1.174 8.228 25.311 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -4.566 9.208 25.542 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -5.157 7.545 25.613 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -1.948 6.101 25.407 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -3.683 5.796 25.537 1.00 0.00 H new ATOM 974 N ARG A 60 -0.895 14.238 21.821 1.00 0.00 N ATOM 975 CA ARG A 60 -0.280 15.555 21.705 1.00 0.00 C ATOM 976 C ARG A 60 -0.534 16.155 20.326 1.00 0.00 C ATOM 977 O ARG A 60 0.302 16.885 19.793 1.00 0.00 O ATOM 978 CB ARG A 60 1.224 15.461 21.967 1.00 0.00 C ATOM 979 CG ARG A 60 1.568 14.998 23.374 1.00 0.00 C ATOM 980 CD ARG A 60 2.875 15.607 23.861 1.00 0.00 C ATOM 981 NE ARG A 60 2.703 16.345 25.110 1.00 0.00 N ATOM 982 CZ ARG A 60 2.259 17.599 25.177 1.00 0.00 C ATOM 983 NH1 ARG A 60 1.934 18.257 24.071 1.00 0.00 N ATOM 984 NH2 ARG A 60 2.136 18.196 26.354 1.00 0.00 N ATOM 0 H ARG A 60 -0.353 13.482 21.403 1.00 0.00 H new ATOM 0 HA ARG A 60 -0.732 16.208 22.452 1.00 0.00 H new ATOM 0 HB2 ARG A 60 1.667 14.772 21.248 1.00 0.00 H new ATOM 0 HB3 ARG A 60 1.676 16.437 21.794 1.00 0.00 H new ATOM 0 HG2 ARG A 60 0.762 15.272 24.055 1.00 0.00 H new ATOM 0 HG3 ARG A 60 1.644 13.911 23.391 1.00 0.00 H new ATOM 0 HD2 ARG A 60 3.612 14.817 24.005 1.00 0.00 H new ATOM 0 HD3 ARG A 60 3.271 16.276 23.096 1.00 0.00 H new ATOM 0 HE ARG A 60 2.937 15.872 25.983 1.00 0.00 H new ATOM 0 HH11 ARG A 60 2.024 17.803 23.162 1.00 0.00 H new ATOM 0 HH12 ARG A 60 1.595 19.217 24.130 1.00 0.00 H new ATOM 0 HH21 ARG A 60 2.381 17.695 27.208 1.00 0.00 H new ATOM 0 HH22 ARG A 60 1.796 19.156 26.406 1.00 0.00 H new ATOM 998 N GLY A 61 -1.692 15.844 19.754 1.00 0.00 N ATOM 999 CA GLY A 61 -2.034 16.362 18.442 1.00 0.00 C ATOM 1000 C GLY A 61 -1.122 15.833 17.353 1.00 0.00 C ATOM 1001 O GLY A 61 -0.101 15.207 17.639 1.00 0.00 O ATOM 0 H GLY A 61 -2.400 15.243 20.175 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -3.065 16.097 18.208 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -1.980 17.451 18.459 1.00 0.00 H new ATOM 1005 N GLY A 62 -1.490 16.084 16.102 1.00 0.00 N ATOM 1006 CA GLY A 62 -0.687 15.622 14.986 1.00 0.00 C ATOM 1007 C GLY A 62 -1.380 15.819 13.652 1.00 0.00 C ATOM 1008 O GLY A 62 -2.579 16.093 13.602 1.00 0.00 O ATOM 0 H GLY A 62 -2.331 16.599 15.841 1.00 0.00 H new ATOM 0 HA2 GLY A 62 0.263 16.156 14.981 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -0.458 14.565 15.120 1.00 0.00 H new ATOM 1012 N LYS A 63 -0.623 15.680 12.569 1.00 0.00 N ATOM 1013 CA LYS A 63 -1.170 15.843 11.227 1.00 0.00 C ATOM 1014 C LYS A 63 -0.788 14.666 10.337 1.00 0.00 C ATOM 1015 O LYS A 63 0.322 14.142 10.428 1.00 0.00 O ATOM 1016 CB LYS A 63 -0.675 17.151 10.605 1.00 0.00 C ATOM 1017 CG LYS A 63 0.813 17.395 10.803 1.00 0.00 C ATOM 1018 CD LYS A 63 1.160 18.866 10.643 1.00 0.00 C ATOM 1019 CE LYS A 63 2.539 19.048 10.029 1.00 0.00 C ATOM 1020 NZ LYS A 63 2.668 20.359 9.333 1.00 0.00 N ATOM 0 H LYS A 63 0.371 15.455 12.594 1.00 0.00 H new ATOM 0 HA LYS A 63 -2.257 15.877 11.307 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -0.894 17.141 9.537 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -1.232 17.983 11.037 1.00 0.00 H new ATOM 0 HG2 LYS A 63 1.110 17.055 11.795 1.00 0.00 H new ATOM 0 HG3 LYS A 63 1.379 16.806 10.082 1.00 0.00 H new ATOM 0 HD2 LYS A 63 0.413 19.351 10.014 1.00 0.00 H new ATOM 0 HD3 LYS A 63 1.125 19.357 11.615 1.00 0.00 H new ATOM 0 HE2 LYS A 63 3.296 18.975 10.809 1.00 0.00 H new ATOM 0 HE3 LYS A 63 2.731 18.241 9.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 3.622 20.445 8.928 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 1.962 20.419 8.572 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 2.510 21.130 10.013 1.00 0.00 H new ATOM 1034 N ILE A 64 -1.715 14.254 9.478 1.00 0.00 N ATOM 1035 CA ILE A 64 -1.474 13.137 8.571 1.00 0.00 C ATOM 1036 C ILE A 64 -1.530 13.589 7.116 1.00 0.00 C ATOM 1037 O ILE A 64 -2.501 14.212 6.686 1.00 0.00 O ATOM 1038 CB ILE A 64 -2.499 12.000 8.771 1.00 0.00 C ATOM 1039 CG1 ILE A 64 -2.957 11.928 10.231 1.00 0.00 C ATOM 1040 CG2 ILE A 64 -1.899 10.671 8.332 1.00 0.00 C ATOM 1041 CD1 ILE A 64 -3.961 10.827 10.495 1.00 0.00 C ATOM 0 H ILE A 64 -2.639 14.676 9.391 1.00 0.00 H new ATOM 0 HA ILE A 64 -0.477 12.762 8.805 1.00 0.00 H new ATOM 0 HB ILE A 64 -3.373 12.211 8.155 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -2.087 11.776 10.869 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -3.396 12.885 10.513 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -2.630 9.876 8.477 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -1.627 10.725 7.278 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -1.010 10.459 8.926 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -4.241 10.835 11.548 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -4.848 10.989 9.883 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -3.518 9.863 10.244 1.00 0.00 H new ATOM 1053 N PHE A 65 -0.487 13.265 6.361 1.00 0.00 N ATOM 1054 CA PHE A 65 -0.420 13.630 4.952 1.00 0.00 C ATOM 1055 C PHE A 65 -0.916 12.482 4.080 1.00 0.00 C ATOM 1056 O PHE A 65 -0.254 11.450 3.962 1.00 0.00 O ATOM 1057 CB PHE A 65 1.013 13.999 4.566 1.00 0.00 C ATOM 1058 CG PHE A 65 1.564 15.160 5.345 1.00 0.00 C ATOM 1059 CD1 PHE A 65 2.157 14.963 6.582 1.00 0.00 C ATOM 1060 CD2 PHE A 65 1.491 16.448 4.838 1.00 0.00 C ATOM 1061 CE1 PHE A 65 2.666 16.028 7.300 1.00 0.00 C ATOM 1062 CE2 PHE A 65 1.998 17.517 5.552 1.00 0.00 C ATOM 1063 CZ PHE A 65 2.585 17.308 6.784 1.00 0.00 C ATOM 0 H PHE A 65 0.325 12.750 6.702 1.00 0.00 H new ATOM 0 HA PHE A 65 -1.062 14.496 4.790 1.00 0.00 H new ATOM 0 HB2 PHE A 65 1.656 13.132 4.717 1.00 0.00 H new ATOM 0 HB3 PHE A 65 1.044 14.237 3.503 1.00 0.00 H new ATOM 0 HD1 PHE A 65 2.222 13.965 6.990 1.00 0.00 H new ATOM 0 HD2 PHE A 65 1.033 16.618 3.875 1.00 0.00 H new ATOM 0 HE1 PHE A 65 3.126 15.861 8.263 1.00 0.00 H new ATOM 0 HE2 PHE A 65 1.935 18.516 5.146 1.00 0.00 H new ATOM 0 HZ PHE A 65 2.980 18.143 7.344 1.00 0.00 H new ATOM 1073 N ILE A 66 -2.085 12.664 3.478 1.00 0.00 N ATOM 1074 CA ILE A 66 -2.669 11.637 2.622 1.00 0.00 C ATOM 1075 C ILE A 66 -2.303 11.863 1.160 1.00 0.00 C ATOM 1076 O ILE A 66 -2.514 12.947 0.616 1.00 0.00 O ATOM 1077 CB ILE A 66 -4.206 11.592 2.749 1.00 0.00 C ATOM 1078 CG1 ILE A 66 -4.642 11.904 4.184 1.00 0.00 C ATOM 1079 CG2 ILE A 66 -4.730 10.231 2.317 1.00 0.00 C ATOM 1080 CD1 ILE A 66 -4.152 10.893 5.200 1.00 0.00 C ATOM 0 H ILE A 66 -2.647 13.511 3.566 1.00 0.00 H new ATOM 0 HA ILE A 66 -2.258 10.685 2.958 1.00 0.00 H new ATOM 0 HB ILE A 66 -4.628 12.353 2.093 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -4.274 12.892 4.460 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -5.730 11.947 4.223 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -5.816 10.212 2.411 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -4.453 10.047 1.279 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -4.297 9.457 2.951 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -4.499 11.178 6.193 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -4.542 9.907 4.949 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -3.062 10.866 5.190 1.00 0.00 H new ATOM 1092 N ARG A 67 -1.754 10.831 0.528 1.00 0.00 N ATOM 1093 CA ARG A 67 -1.359 10.913 -0.872 1.00 0.00 C ATOM 1094 C ARG A 67 -2.378 10.209 -1.765 1.00 0.00 C ATOM 1095 O ARG A 67 -2.585 10.599 -2.915 1.00 0.00 O ATOM 1096 CB ARG A 67 0.027 10.296 -1.071 1.00 0.00 C ATOM 1097 CG ARG A 67 1.135 11.325 -1.219 1.00 0.00 C ATOM 1098 CD ARG A 67 1.096 11.994 -2.583 1.00 0.00 C ATOM 1099 NE ARG A 67 1.463 13.406 -2.512 1.00 0.00 N ATOM 1100 CZ ARG A 67 1.505 14.216 -3.568 1.00 0.00 C ATOM 1101 NH1 ARG A 67 1.204 13.758 -4.777 1.00 0.00 N ATOM 1102 NH2 ARG A 67 1.849 15.488 -3.416 1.00 0.00 N ATOM 0 H ARG A 67 -1.573 9.927 0.965 1.00 0.00 H new ATOM 0 HA ARG A 67 -1.322 11.965 -1.153 1.00 0.00 H new ATOM 0 HB2 ARG A 67 0.253 9.650 -0.223 1.00 0.00 H new ATOM 0 HB3 ARG A 67 0.010 9.663 -1.958 1.00 0.00 H new ATOM 0 HG2 ARG A 67 1.038 12.080 -0.439 1.00 0.00 H new ATOM 0 HG3 ARG A 67 2.102 10.843 -1.077 1.00 0.00 H new ATOM 0 HD2 ARG A 67 1.776 11.477 -3.260 1.00 0.00 H new ATOM 0 HD3 ARG A 67 0.095 11.901 -3.004 1.00 0.00 H new ATOM 0 HE ARG A 67 1.701 13.795 -1.599 1.00 0.00 H new ATOM 0 HH11 ARG A 67 0.939 12.781 -4.901 1.00 0.00 H new ATOM 0 HH12 ARG A 67 1.238 14.383 -5.582 1.00 0.00 H new ATOM 0 HH21 ARG A 67 2.082 15.846 -2.490 1.00 0.00 H new ATOM 0 HH22 ARG A 67 1.881 16.108 -4.225 1.00 0.00 H new ATOM 1116 N ILE A 68 -3.011 9.173 -1.227 1.00 0.00 N ATOM 1117 CA ILE A 68 -4.008 8.415 -1.973 1.00 0.00 C ATOM 1118 C ILE A 68 -5.289 9.222 -2.153 1.00 0.00 C ATOM 1119 O ILE A 68 -5.738 9.905 -1.232 1.00 0.00 O ATOM 1120 CB ILE A 68 -4.345 7.085 -1.271 1.00 0.00 C ATOM 1121 CG1 ILE A 68 -4.886 7.346 0.136 1.00 0.00 C ATOM 1122 CG2 ILE A 68 -3.117 6.189 -1.214 1.00 0.00 C ATOM 1123 CD1 ILE A 68 -5.461 6.115 0.800 1.00 0.00 C ATOM 0 H ILE A 68 -2.851 8.839 -0.277 1.00 0.00 H new ATOM 0 HA ILE A 68 -3.576 8.201 -2.951 1.00 0.00 H new ATOM 0 HB ILE A 68 -5.117 6.575 -1.847 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -4.083 7.743 0.757 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -5.657 8.114 0.083 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -3.372 5.254 -0.715 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -2.773 5.978 -2.227 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -2.325 6.692 -0.659 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -5.825 6.374 1.794 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -6.286 5.730 0.200 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -4.687 5.352 0.885 1.00 0.00 H new ATOM 1135 N PHE A 69 -5.875 9.137 -3.343 1.00 0.00 N ATOM 1136 CA PHE A 69 -7.106 9.860 -3.641 1.00 0.00 C ATOM 1137 C PHE A 69 -8.010 9.038 -4.560 1.00 0.00 C ATOM 1138 O PHE A 69 -7.543 8.454 -5.537 1.00 0.00 O ATOM 1139 CB PHE A 69 -6.784 11.206 -4.291 1.00 0.00 C ATOM 1140 CG PHE A 69 -7.550 12.357 -3.704 1.00 0.00 C ATOM 1141 CD1 PHE A 69 -7.074 13.028 -2.588 1.00 0.00 C ATOM 1142 CD2 PHE A 69 -8.747 12.769 -4.268 1.00 0.00 C ATOM 1143 CE1 PHE A 69 -7.776 14.088 -2.047 1.00 0.00 C ATOM 1144 CE2 PHE A 69 -9.454 13.828 -3.730 1.00 0.00 C ATOM 1145 CZ PHE A 69 -8.968 14.488 -2.619 1.00 0.00 C ATOM 0 H PHE A 69 -5.518 8.575 -4.116 1.00 0.00 H new ATOM 0 HA PHE A 69 -7.634 10.035 -2.704 1.00 0.00 H new ATOM 0 HB2 PHE A 69 -5.717 11.402 -4.191 1.00 0.00 H new ATOM 0 HB3 PHE A 69 -6.998 11.145 -5.358 1.00 0.00 H new ATOM 0 HD1 PHE A 69 -6.143 12.718 -2.136 1.00 0.00 H new ATOM 0 HD2 PHE A 69 -9.132 12.257 -5.138 1.00 0.00 H new ATOM 0 HE1 PHE A 69 -7.393 14.603 -1.178 1.00 0.00 H new ATOM 0 HE2 PHE A 69 -10.386 14.139 -4.178 1.00 0.00 H new ATOM 0 HZ PHE A 69 -9.519 15.316 -2.198 1.00 0.00 H new ATOM 1155 N PRO A 70 -9.323 8.982 -4.264 1.00 0.00 N ATOM 1156 CA PRO A 70 -10.281 8.225 -5.077 1.00 0.00 C ATOM 1157 C PRO A 70 -10.382 8.767 -6.500 1.00 0.00 C ATOM 1158 O PRO A 70 -10.957 9.831 -6.730 1.00 0.00 O ATOM 1159 CB PRO A 70 -11.616 8.409 -4.344 1.00 0.00 C ATOM 1160 CG PRO A 70 -11.252 8.870 -2.974 1.00 0.00 C ATOM 1161 CD PRO A 70 -9.977 9.645 -3.125 1.00 0.00 C ATOM 0 HA PRO A 70 -9.983 7.182 -5.182 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -12.245 9.140 -4.851 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -12.177 7.475 -4.309 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -12.039 9.493 -2.550 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -11.117 8.024 -2.300 1.00 0.00 H new ATOM 0 HD2 PRO A 70 -10.166 10.699 -3.326 1.00 0.00 H new ATOM 0 HD3 PRO A 70 -9.366 9.597 -2.224 1.00 0.00 H new ATOM 1539 N VAL A 94 -12.409 4.800 -5.620 1.00 0.00 N ATOM 1540 CA VAL A 94 -11.345 4.200 -4.824 1.00 0.00 C ATOM 1541 C VAL A 94 -9.971 4.586 -5.361 1.00 0.00 C ATOM 1542 O VAL A 94 -9.852 5.121 -6.463 1.00 0.00 O ATOM 1543 CB VAL A 94 -11.455 2.663 -4.796 1.00 0.00 C ATOM 1544 CG1 VAL A 94 -12.524 2.219 -3.811 1.00 0.00 C ATOM 1545 CG2 VAL A 94 -11.740 2.120 -6.188 1.00 0.00 C ATOM 0 HA VAL A 94 -11.460 4.583 -3.810 1.00 0.00 H new ATOM 0 HB VAL A 94 -10.500 2.257 -4.463 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -12.585 1.131 -3.807 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -12.267 2.572 -2.812 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -13.487 2.636 -4.107 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -11.814 1.033 -6.147 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -12.679 2.534 -6.555 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -10.931 2.403 -6.862 1.00 0.00 H new ATOM 1555 N ALA A 95 -8.937 4.308 -4.573 1.00 0.00 N ATOM 1556 CA ALA A 95 -7.569 4.622 -4.968 1.00 0.00 C ATOM 1557 C ALA A 95 -6.724 3.355 -5.052 1.00 0.00 C ATOM 1558 O ALA A 95 -6.300 2.812 -4.032 1.00 0.00 O ATOM 1559 CB ALA A 95 -6.950 5.608 -3.989 1.00 0.00 C ATOM 0 H ALA A 95 -9.021 3.866 -3.658 1.00 0.00 H new ATOM 0 HA ALA A 95 -7.595 5.080 -5.957 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -5.929 5.833 -4.296 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -7.537 6.527 -3.978 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -6.940 5.172 -2.990 1.00 0.00 H new ATOM 1565 N VAL A 96 -6.488 2.885 -6.272 1.00 0.00 N ATOM 1566 CA VAL A 96 -5.699 1.678 -6.485 1.00 0.00 C ATOM 1567 C VAL A 96 -4.293 1.829 -5.915 1.00 0.00 C ATOM 1568 O VAL A 96 -3.604 2.813 -6.184 1.00 0.00 O ATOM 1569 CB VAL A 96 -5.597 1.321 -7.981 1.00 0.00 C ATOM 1570 CG1 VAL A 96 -5.062 -0.093 -8.153 1.00 0.00 C ATOM 1571 CG2 VAL A 96 -6.949 1.476 -8.666 1.00 0.00 C ATOM 0 H VAL A 96 -6.832 3.321 -7.128 1.00 0.00 H new ATOM 0 HA VAL A 96 -6.217 0.873 -5.963 1.00 0.00 H new ATOM 0 HB VAL A 96 -4.899 2.012 -8.454 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -4.996 -0.330 -9.215 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -4.072 -0.165 -7.703 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -5.735 -0.798 -7.665 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -6.854 1.219 -9.721 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -7.674 0.812 -8.195 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -7.288 2.508 -8.573 1.00 0.00 H new ATOM 1581 N VAL A 97 -3.875 0.847 -5.125 1.00 0.00 N ATOM 1582 CA VAL A 97 -2.553 0.866 -4.511 1.00 0.00 C ATOM 1583 C VAL A 97 -1.789 -0.419 -4.815 1.00 0.00 C ATOM 1584 O VAL A 97 -2.384 -1.431 -5.184 1.00 0.00 O ATOM 1585 CB VAL A 97 -2.648 1.040 -2.984 1.00 0.00 C ATOM 1586 CG1 VAL A 97 -1.267 1.240 -2.380 1.00 0.00 C ATOM 1587 CG2 VAL A 97 -3.563 2.202 -2.632 1.00 0.00 C ATOM 0 H VAL A 97 -4.434 0.026 -4.894 1.00 0.00 H new ATOM 0 HA VAL A 97 -2.018 1.715 -4.936 1.00 0.00 H new ATOM 0 HB VAL A 97 -3.076 0.130 -2.562 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -1.356 1.361 -1.300 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -0.645 0.371 -2.598 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -0.808 2.131 -2.808 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -3.616 2.308 -1.548 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -3.169 3.120 -3.067 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -4.561 2.012 -3.028 1.00 0.00 H new ATOM 1597 N LYS A 98 -0.470 -0.372 -4.655 1.00 0.00 N ATOM 1598 CA LYS A 98 0.376 -1.534 -4.906 1.00 0.00 C ATOM 1599 C LYS A 98 1.329 -1.770 -3.735 1.00 0.00 C ATOM 1600 O LYS A 98 1.581 -0.865 -2.941 1.00 0.00 O ATOM 1601 CB LYS A 98 1.170 -1.344 -6.199 1.00 0.00 C ATOM 1602 CG LYS A 98 0.535 -2.016 -7.407 1.00 0.00 C ATOM 1603 CD LYS A 98 0.607 -1.132 -8.641 1.00 0.00 C ATOM 1604 CE LYS A 98 0.418 -1.939 -9.916 1.00 0.00 C ATOM 1605 NZ LYS A 98 -0.983 -2.419 -10.070 1.00 0.00 N ATOM 0 H LYS A 98 0.037 0.460 -4.352 1.00 0.00 H new ATOM 0 HA LYS A 98 -0.266 -2.408 -5.012 1.00 0.00 H new ATOM 0 HB2 LYS A 98 1.273 -0.277 -6.399 1.00 0.00 H new ATOM 0 HB3 LYS A 98 2.176 -1.741 -6.060 1.00 0.00 H new ATOM 0 HG2 LYS A 98 1.040 -2.961 -7.606 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -0.506 -2.251 -7.188 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -0.159 -0.359 -8.581 1.00 0.00 H new ATOM 0 HD3 LYS A 98 1.571 -0.624 -8.670 1.00 0.00 H new ATOM 0 HE2 LYS A 98 0.688 -1.326 -10.776 1.00 0.00 H new ATOM 0 HE3 LYS A 98 1.095 -2.793 -9.908 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -1.068 -2.964 -10.951 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -1.233 -3.025 -9.263 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -1.628 -1.604 -10.104 1.00 0.00 H new ATOM 1619 N PRO A 99 1.872 -2.993 -3.608 1.00 0.00 N ATOM 1620 CA PRO A 99 2.801 -3.331 -2.524 1.00 0.00 C ATOM 1621 C PRO A 99 3.985 -2.374 -2.463 1.00 0.00 C ATOM 1622 O PRO A 99 4.786 -2.300 -3.395 1.00 0.00 O ATOM 1623 CB PRO A 99 3.270 -4.744 -2.876 1.00 0.00 C ATOM 1624 CG PRO A 99 2.191 -5.301 -3.740 1.00 0.00 C ATOM 1625 CD PRO A 99 1.630 -4.135 -4.505 1.00 0.00 C ATOM 0 HA PRO A 99 2.326 -3.262 -1.545 1.00 0.00 H new ATOM 0 HB2 PRO A 99 4.225 -4.724 -3.400 1.00 0.00 H new ATOM 0 HB3 PRO A 99 3.411 -5.349 -1.980 1.00 0.00 H new ATOM 0 HG2 PRO A 99 2.585 -6.059 -4.417 1.00 0.00 H new ATOM 0 HG3 PRO A 99 1.419 -5.781 -3.139 1.00 0.00 H new ATOM 0 HD2 PRO A 99 2.130 -4.006 -5.465 1.00 0.00 H new ATOM 0 HD3 PRO A 99 0.568 -4.264 -4.714 1.00 0.00 H new ATOM 1633 N GLY A 100 4.086 -1.639 -1.361 1.00 0.00 N ATOM 1634 CA GLY A 100 5.170 -0.691 -1.199 1.00 0.00 C ATOM 1635 C GLY A 100 4.733 0.733 -1.480 1.00 0.00 C ATOM 1636 O GLY A 100 5.532 1.558 -1.926 1.00 0.00 O ATOM 0 H GLY A 100 3.435 -1.684 -0.577 1.00 0.00 H new ATOM 0 HA2 GLY A 100 5.558 -0.756 -0.183 1.00 0.00 H new ATOM 0 HA3 GLY A 100 5.987 -0.958 -1.870 1.00 0.00 H new ATOM 1640 N ARG A 101 3.460 1.023 -1.227 1.00 0.00 N ATOM 1641 CA ARG A 101 2.918 2.358 -1.462 1.00 0.00 C ATOM 1642 C ARG A 101 2.509 3.030 -0.155 1.00 0.00 C ATOM 1643 O ARG A 101 1.687 2.503 0.594 1.00 0.00 O ATOM 1644 CB ARG A 101 1.715 2.283 -2.402 1.00 0.00 C ATOM 1645 CG ARG A 101 1.733 3.333 -3.498 1.00 0.00 C ATOM 1646 CD ARG A 101 1.612 4.734 -2.923 1.00 0.00 C ATOM 1647 NE ARG A 101 1.183 5.704 -3.928 1.00 0.00 N ATOM 1648 CZ ARG A 101 1.187 7.021 -3.735 1.00 0.00 C ATOM 1649 NH1 ARG A 101 1.595 7.529 -2.579 1.00 0.00 N ATOM 1650 NH2 ARG A 101 0.781 7.833 -4.701 1.00 0.00 N ATOM 0 H ARG A 101 2.785 0.352 -0.860 1.00 0.00 H new ATOM 0 HA ARG A 101 3.702 2.958 -1.924 1.00 0.00 H new ATOM 0 HB2 ARG A 101 1.683 1.294 -2.859 1.00 0.00 H new ATOM 0 HB3 ARG A 101 0.801 2.395 -1.818 1.00 0.00 H new ATOM 0 HG2 ARG A 101 2.658 3.250 -4.068 1.00 0.00 H new ATOM 0 HG3 ARG A 101 0.913 3.151 -4.193 1.00 0.00 H new ATOM 0 HD2 ARG A 101 0.899 4.727 -2.099 1.00 0.00 H new ATOM 0 HD3 ARG A 101 2.573 5.041 -2.510 1.00 0.00 H new ATOM 0 HE ARG A 101 0.862 5.352 -4.830 1.00 0.00 H new ATOM 0 HH11 ARG A 101 1.908 6.909 -1.832 1.00 0.00 H new ATOM 0 HH12 ARG A 101 1.596 8.539 -2.438 1.00 0.00 H new ATOM 0 HH21 ARG A 101 0.466 7.448 -5.592 1.00 0.00 H new ATOM 0 HH22 ARG A 101 0.784 8.842 -4.554 1.00 0.00 H new ATOM 1664 N VAL A 102 3.081 4.201 0.107 1.00 0.00 N ATOM 1665 CA VAL A 102 2.770 4.951 1.319 1.00 0.00 C ATOM 1666 C VAL A 102 1.463 5.720 1.158 1.00 0.00 C ATOM 1667 O VAL A 102 1.413 6.744 0.476 1.00 0.00 O ATOM 1668 CB VAL A 102 3.896 5.941 1.672 1.00 0.00 C ATOM 1669 CG1 VAL A 102 3.662 6.549 3.047 1.00 0.00 C ATOM 1670 CG2 VAL A 102 5.253 5.255 1.608 1.00 0.00 C ATOM 0 H VAL A 102 3.763 4.651 -0.504 1.00 0.00 H new ATOM 0 HA VAL A 102 2.670 4.227 2.128 1.00 0.00 H new ATOM 0 HB VAL A 102 3.888 6.747 0.938 1.00 0.00 H new ATOM 0 HG11 VAL A 102 4.468 7.246 3.279 1.00 0.00 H new ATOM 0 HG12 VAL A 102 2.710 7.080 3.053 1.00 0.00 H new ATOM 0 HG13 VAL A 102 3.640 5.757 3.796 1.00 0.00 H new ATOM 0 HG21 VAL A 102 6.035 5.971 1.861 1.00 0.00 H new ATOM 0 HG22 VAL A 102 5.276 4.427 2.317 1.00 0.00 H new ATOM 0 HG23 VAL A 102 5.421 4.874 0.601 1.00 0.00 H new ATOM 1680 N MET A 103 0.404 5.214 1.781 1.00 0.00 N ATOM 1681 CA MET A 103 -0.907 5.848 1.697 1.00 0.00 C ATOM 1682 C MET A 103 -1.094 6.905 2.784 1.00 0.00 C ATOM 1683 O MET A 103 -1.927 7.801 2.649 1.00 0.00 O ATOM 1684 CB MET A 103 -2.009 4.793 1.807 1.00 0.00 C ATOM 1685 CG MET A 103 -1.786 3.585 0.912 1.00 0.00 C ATOM 1686 SD MET A 103 -2.760 2.155 1.420 1.00 0.00 S ATOM 1687 CE MET A 103 -1.947 1.720 2.955 1.00 0.00 C ATOM 0 H MET A 103 0.428 4.367 2.349 1.00 0.00 H new ATOM 0 HA MET A 103 -0.971 6.346 0.729 1.00 0.00 H new ATOM 0 HB2 MET A 103 -2.079 4.460 2.842 1.00 0.00 H new ATOM 0 HB3 MET A 103 -2.965 5.251 1.554 1.00 0.00 H new ATOM 0 HG2 MET A 103 -2.040 3.847 -0.115 1.00 0.00 H new ATOM 0 HG3 MET A 103 -0.728 3.321 0.921 1.00 0.00 H new ATOM 0 HE1 MET A 103 -1.936 0.636 3.066 1.00 0.00 H new ATOM 0 HE2 MET A 103 -0.923 2.094 2.943 1.00 0.00 H new ATOM 0 HE3 MET A 103 -2.487 2.165 3.791 1.00 0.00 H new ATOM 1697 N PHE A 104 -0.325 6.796 3.863 1.00 0.00 N ATOM 1698 CA PHE A 104 -0.427 7.748 4.964 1.00 0.00 C ATOM 1699 C PHE A 104 0.948 8.135 5.496 1.00 0.00 C ATOM 1700 O PHE A 104 1.905 7.369 5.393 1.00 0.00 O ATOM 1701 CB PHE A 104 -1.273 7.156 6.091 1.00 0.00 C ATOM 1702 CG PHE A 104 -2.735 7.073 5.763 1.00 0.00 C ATOM 1703 CD1 PHE A 104 -3.221 6.050 4.963 1.00 0.00 C ATOM 1704 CD2 PHE A 104 -3.623 8.014 6.255 1.00 0.00 C ATOM 1705 CE1 PHE A 104 -4.567 5.970 4.661 1.00 0.00 C ATOM 1706 CE2 PHE A 104 -4.969 7.939 5.957 1.00 0.00 C ATOM 1707 CZ PHE A 104 -5.444 6.916 5.159 1.00 0.00 C ATOM 0 H PHE A 104 0.371 6.063 3.998 1.00 0.00 H new ATOM 0 HA PHE A 104 -0.907 8.650 4.583 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -0.904 6.157 6.325 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -1.144 7.762 6.988 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -2.541 5.308 4.572 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -3.259 8.816 6.879 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -4.934 5.169 4.036 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -5.651 8.680 6.348 1.00 0.00 H new ATOM 0 HZ PHE A 104 -6.497 6.855 4.925 1.00 0.00 H new ATOM 1717 N GLU A 105 1.034 9.332 6.068 1.00 0.00 N ATOM 1718 CA GLU A 105 2.286 9.834 6.626 1.00 0.00 C ATOM 1719 C GLU A 105 2.011 10.817 7.760 1.00 0.00 C ATOM 1720 O GLU A 105 1.268 11.782 7.588 1.00 0.00 O ATOM 1721 CB GLU A 105 3.119 10.521 5.541 1.00 0.00 C ATOM 1722 CG GLU A 105 3.414 9.636 4.340 1.00 0.00 C ATOM 1723 CD GLU A 105 2.300 9.659 3.312 1.00 0.00 C ATOM 1724 OE1 GLU A 105 1.903 10.766 2.890 1.00 0.00 O ATOM 1725 OE2 GLU A 105 1.824 8.570 2.928 1.00 0.00 O ATOM 0 H GLU A 105 0.248 9.975 6.158 1.00 0.00 H new ATOM 0 HA GLU A 105 2.845 8.985 7.020 1.00 0.00 H new ATOM 0 HB2 GLU A 105 2.592 11.413 5.202 1.00 0.00 H new ATOM 0 HB3 GLU A 105 4.062 10.853 5.976 1.00 0.00 H new ATOM 0 HG2 GLU A 105 4.342 9.963 3.872 1.00 0.00 H new ATOM 0 HG3 GLU A 105 3.571 8.612 4.678 1.00 0.00 H new ATOM 1732 N VAL A 106 2.612 10.570 8.921 1.00 0.00 N ATOM 1733 CA VAL A 106 2.422 11.445 10.072 1.00 0.00 C ATOM 1734 C VAL A 106 3.740 12.070 10.516 1.00 0.00 C ATOM 1735 O VAL A 106 4.808 11.487 10.336 1.00 0.00 O ATOM 1736 CB VAL A 106 1.792 10.695 11.263 1.00 0.00 C ATOM 1737 CG1 VAL A 106 0.416 10.168 10.893 1.00 0.00 C ATOM 1738 CG2 VAL A 106 2.697 9.564 11.732 1.00 0.00 C ATOM 0 H VAL A 106 3.231 9.776 9.088 1.00 0.00 H new ATOM 0 HA VAL A 106 1.740 12.233 9.753 1.00 0.00 H new ATOM 0 HB VAL A 106 1.679 11.398 12.088 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -0.013 9.642 11.745 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -0.231 11.001 10.618 1.00 0.00 H new ATOM 0 HG13 VAL A 106 0.503 9.483 10.050 1.00 0.00 H new ATOM 0 HG21 VAL A 106 2.231 9.050 12.573 1.00 0.00 H new ATOM 0 HG22 VAL A 106 2.851 8.859 10.915 1.00 0.00 H new ATOM 0 HG23 VAL A 106 3.658 9.973 12.044 1.00 0.00 H new ATOM 1748 N ALA A 107 3.654 13.261 11.100 1.00 0.00 N ATOM 1749 CA ALA A 107 4.838 13.967 11.570 1.00 0.00 C ATOM 1750 C ALA A 107 4.528 14.792 12.814 1.00 0.00 C ATOM 1751 O ALA A 107 3.454 15.382 12.927 1.00 0.00 O ATOM 1752 CB ALA A 107 5.396 14.858 10.469 1.00 0.00 C ATOM 0 H ALA A 107 2.777 13.756 11.258 1.00 0.00 H new ATOM 0 HA ALA A 107 5.590 13.224 11.836 1.00 0.00 H new ATOM 0 HB1 ALA A 107 6.280 15.379 10.836 1.00 0.00 H new ATOM 0 HB2 ALA A 107 5.666 14.247 9.608 1.00 0.00 H new ATOM 0 HB3 ALA A 107 4.642 15.587 10.174 1.00 0.00 H new ATOM 1758 N GLY A 108 5.475 14.829 13.745 1.00 0.00 N ATOM 1759 CA GLY A 108 5.283 15.585 14.968 1.00 0.00 C ATOM 1760 C GLY A 108 4.867 14.710 16.135 1.00 0.00 C ATOM 1761 O GLY A 108 5.233 14.977 17.280 1.00 0.00 O ATOM 0 H GLY A 108 6.372 14.349 13.674 1.00 0.00 H new ATOM 0 HA2 GLY A 108 6.208 16.104 15.219 1.00 0.00 H new ATOM 0 HA3 GLY A 108 4.524 16.349 14.803 1.00 0.00 H new ATOM 1765 N VAL A 109 4.100 13.662 15.847 1.00 0.00 N ATOM 1766 CA VAL A 109 3.636 12.751 16.885 1.00 0.00 C ATOM 1767 C VAL A 109 4.720 11.747 17.264 1.00 0.00 C ATOM 1768 O VAL A 109 5.628 11.474 16.479 1.00 0.00 O ATOM 1769 CB VAL A 109 2.370 11.990 16.444 1.00 0.00 C ATOM 1770 CG1 VAL A 109 1.232 12.962 16.175 1.00 0.00 C ATOM 1771 CG2 VAL A 109 2.655 11.131 15.218 1.00 0.00 C ATOM 0 H VAL A 109 3.788 13.424 14.905 1.00 0.00 H new ATOM 0 HA VAL A 109 3.395 13.362 17.755 1.00 0.00 H new ATOM 0 HB VAL A 109 2.067 11.327 17.254 1.00 0.00 H new ATOM 0 HG11 VAL A 109 0.346 12.408 15.865 1.00 0.00 H new ATOM 0 HG12 VAL A 109 1.010 13.523 17.083 1.00 0.00 H new ATOM 0 HG13 VAL A 109 1.523 13.653 15.384 1.00 0.00 H new ATOM 0 HG21 VAL A 109 1.748 10.603 14.925 1.00 0.00 H new ATOM 0 HG22 VAL A 109 2.986 11.767 14.397 1.00 0.00 H new ATOM 0 HG23 VAL A 109 3.435 10.407 15.454 1.00 0.00 H new ATOM 1781 N THR A 110 4.618 11.202 18.472 1.00 0.00 N ATOM 1782 CA THR A 110 5.591 10.229 18.956 1.00 0.00 C ATOM 1783 C THR A 110 5.508 8.931 18.159 1.00 0.00 C ATOM 1784 O THR A 110 4.596 8.742 17.353 1.00 0.00 O ATOM 1785 CB THR A 110 5.364 9.943 20.441 1.00 0.00 C ATOM 1786 OG1 THR A 110 4.048 9.470 20.666 1.00 0.00 O ATOM 1787 CG2 THR A 110 5.574 11.155 21.322 1.00 0.00 C ATOM 0 H THR A 110 3.872 11.417 19.133 1.00 0.00 H new ATOM 0 HA THR A 110 6.586 10.653 18.822 1.00 0.00 H new ATOM 0 HB THR A 110 6.104 9.188 20.706 1.00 0.00 H new ATOM 0 HG1 THR A 110 3.923 9.292 21.622 1.00 0.00 H new ATOM 0 HG21 THR A 110 5.397 10.883 22.363 1.00 0.00 H new ATOM 0 HG22 THR A 110 6.597 11.514 21.209 1.00 0.00 H new ATOM 0 HG23 THR A 110 4.879 11.942 21.029 1.00 0.00 H new ATOM 1795 N GLU A 111 6.468 8.040 18.389 1.00 0.00 N ATOM 1796 CA GLU A 111 6.506 6.759 17.694 1.00 0.00 C ATOM 1797 C GLU A 111 5.335 5.876 18.113 1.00 0.00 C ATOM 1798 O GLU A 111 4.770 5.149 17.295 1.00 0.00 O ATOM 1799 CB GLU A 111 7.828 6.043 17.977 1.00 0.00 C ATOM 1800 CG GLU A 111 7.954 4.698 17.281 1.00 0.00 C ATOM 1801 CD GLU A 111 9.355 4.127 17.364 1.00 0.00 C ATOM 1802 OE1 GLU A 111 10.018 4.328 18.403 1.00 0.00 O ATOM 1803 OE2 GLU A 111 9.792 3.479 16.389 1.00 0.00 O ATOM 0 H GLU A 111 7.230 8.182 19.052 1.00 0.00 H new ATOM 0 HA GLU A 111 6.426 6.951 16.624 1.00 0.00 H new ATOM 0 HB2 GLU A 111 8.652 6.683 17.663 1.00 0.00 H new ATOM 0 HB3 GLU A 111 7.929 5.897 19.052 1.00 0.00 H new ATOM 0 HG2 GLU A 111 7.252 3.994 17.729 1.00 0.00 H new ATOM 0 HG3 GLU A 111 7.672 4.807 16.234 1.00 0.00 H new ATOM 1810 N GLU A 112 4.977 5.943 19.390 1.00 0.00 N ATOM 1811 CA GLU A 112 3.874 5.147 19.918 1.00 0.00 C ATOM 1812 C GLU A 112 2.548 5.570 19.293 1.00 0.00 C ATOM 1813 O GLU A 112 1.752 4.729 18.875 1.00 0.00 O ATOM 1814 CB GLU A 112 3.802 5.286 21.441 1.00 0.00 C ATOM 1815 CG GLU A 112 4.580 4.213 22.187 1.00 0.00 C ATOM 1816 CD GLU A 112 4.559 4.418 23.689 1.00 0.00 C ATOM 1817 OE1 GLU A 112 3.531 4.905 24.208 1.00 0.00 O ATOM 1818 OE2 GLU A 112 5.569 4.093 24.347 1.00 0.00 O ATOM 0 H GLU A 112 5.434 6.540 20.079 1.00 0.00 H new ATOM 0 HA GLU A 112 4.057 4.103 19.663 1.00 0.00 H new ATOM 0 HB2 GLU A 112 4.185 6.266 21.727 1.00 0.00 H new ATOM 0 HB3 GLU A 112 2.758 5.249 21.752 1.00 0.00 H new ATOM 0 HG2 GLU A 112 4.161 3.235 21.951 1.00 0.00 H new ATOM 0 HG3 GLU A 112 5.613 4.209 21.839 1.00 0.00 H new ATOM 1825 N GLN A 113 2.318 6.877 19.230 1.00 0.00 N ATOM 1826 CA GLN A 113 1.089 7.411 18.654 1.00 0.00 C ATOM 1827 C GLN A 113 1.114 7.320 17.133 1.00 0.00 C ATOM 1828 O GLN A 113 0.092 7.056 16.499 1.00 0.00 O ATOM 1829 CB GLN A 113 0.887 8.865 19.088 1.00 0.00 C ATOM 1830 CG GLN A 113 1.032 9.078 20.586 1.00 0.00 C ATOM 1831 CD GLN A 113 0.999 10.543 20.973 1.00 0.00 C ATOM 1832 OE1 GLN A 113 0.305 11.347 20.349 1.00 0.00 O ATOM 1833 NE2 GLN A 113 1.753 10.899 22.007 1.00 0.00 N ATOM 0 H GLN A 113 2.967 7.587 19.571 1.00 0.00 H new ATOM 0 HA GLN A 113 0.256 6.811 19.020 1.00 0.00 H new ATOM 0 HB2 GLN A 113 1.609 9.494 18.568 1.00 0.00 H new ATOM 0 HB3 GLN A 113 -0.104 9.194 18.777 1.00 0.00 H new ATOM 0 HG2 GLN A 113 0.230 8.551 21.103 1.00 0.00 H new ATOM 0 HG3 GLN A 113 1.971 8.638 20.922 1.00 0.00 H new ATOM 0 HE21 GLN A 113 2.312 10.200 22.495 1.00 0.00 H new ATOM 0 HE22 GLN A 113 1.773 11.872 22.313 1.00 0.00 H new ATOM 1842 N ALA A 114 2.289 7.544 16.554 1.00 0.00 N ATOM 1843 CA ALA A 114 2.452 7.490 15.107 1.00 0.00 C ATOM 1844 C ALA A 114 2.341 6.061 14.587 1.00 0.00 C ATOM 1845 O ALA A 114 1.623 5.795 13.623 1.00 0.00 O ATOM 1846 CB ALA A 114 3.791 8.089 14.713 1.00 0.00 C ATOM 0 H ALA A 114 3.143 7.765 17.066 1.00 0.00 H new ATOM 0 HA ALA A 114 1.649 8.073 14.655 1.00 0.00 H new ATOM 0 HB1 ALA A 114 3.905 8.045 13.630 1.00 0.00 H new ATOM 0 HB2 ALA A 114 3.835 9.128 15.040 1.00 0.00 H new ATOM 0 HB3 ALA A 114 4.595 7.525 15.186 1.00 0.00 H new ATOM 1852 N MET A 115 3.057 5.146 15.230 1.00 0.00 N ATOM 1853 CA MET A 115 3.036 3.745 14.830 1.00 0.00 C ATOM 1854 C MET A 115 1.638 3.160 14.989 1.00 0.00 C ATOM 1855 O MET A 115 1.135 2.476 14.097 1.00 0.00 O ATOM 1856 CB MET A 115 4.040 2.940 15.658 1.00 0.00 C ATOM 1857 CG MET A 115 5.489 3.299 15.372 1.00 0.00 C ATOM 1858 SD MET A 115 6.374 1.989 14.505 1.00 0.00 S ATOM 1859 CE MET A 115 7.486 2.952 13.482 1.00 0.00 C ATOM 0 H MET A 115 3.658 5.349 16.029 1.00 0.00 H new ATOM 0 HA MET A 115 3.318 3.686 13.779 1.00 0.00 H new ATOM 0 HB2 MET A 115 3.837 3.100 16.717 1.00 0.00 H new ATOM 0 HB3 MET A 115 3.892 1.878 15.462 1.00 0.00 H new ATOM 0 HG2 MET A 115 5.522 4.210 14.775 1.00 0.00 H new ATOM 0 HG3 MET A 115 5.998 3.515 16.312 1.00 0.00 H new ATOM 0 HE1 MET A 115 7.907 2.316 12.704 1.00 0.00 H new ATOM 0 HE2 MET A 115 6.937 3.774 13.022 1.00 0.00 H new ATOM 0 HE3 MET A 115 8.291 3.353 14.098 1.00 0.00 H new ATOM 1869 N GLU A 116 1.012 3.439 16.126 1.00 0.00 N ATOM 1870 CA GLU A 116 -0.331 2.945 16.398 1.00 0.00 C ATOM 1871 C GLU A 116 -1.339 3.579 15.447 1.00 0.00 C ATOM 1872 O GLU A 116 -2.154 2.887 14.838 1.00 0.00 O ATOM 1873 CB GLU A 116 -0.726 3.238 17.847 1.00 0.00 C ATOM 1874 CG GLU A 116 -1.724 2.243 18.417 1.00 0.00 C ATOM 1875 CD GLU A 116 -1.424 1.878 19.858 1.00 0.00 C ATOM 1876 OE1 GLU A 116 -1.473 2.779 20.721 1.00 0.00 O ATOM 1877 OE2 GLU A 116 -1.141 0.690 20.123 1.00 0.00 O ATOM 0 H GLU A 116 1.413 4.005 16.874 1.00 0.00 H new ATOM 0 HA GLU A 116 -0.334 1.866 16.243 1.00 0.00 H new ATOM 0 HB2 GLU A 116 0.171 3.237 18.467 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -1.151 4.240 17.904 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -2.728 2.664 18.354 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -1.718 1.339 17.808 1.00 0.00 H new ATOM 1884 N ALA A 117 -1.273 4.901 15.318 1.00 0.00 N ATOM 1885 CA ALA A 117 -2.179 5.628 14.438 1.00 0.00 C ATOM 1886 C ALA A 117 -2.068 5.121 13.004 1.00 0.00 C ATOM 1887 O ALA A 117 -3.073 4.827 12.358 1.00 0.00 O ATOM 1888 CB ALA A 117 -1.884 7.119 14.494 1.00 0.00 C ATOM 0 H ALA A 117 -0.602 5.489 15.812 1.00 0.00 H new ATOM 0 HA ALA A 117 -3.199 5.457 14.782 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -2.568 7.650 13.832 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -2.015 7.478 15.515 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -0.857 7.299 14.175 1.00 0.00 H new ATOM 1894 N LEU A 118 -0.838 5.009 12.514 1.00 0.00 N ATOM 1895 CA LEU A 118 -0.599 4.526 11.160 1.00 0.00 C ATOM 1896 C LEU A 118 -1.135 3.107 10.999 1.00 0.00 C ATOM 1897 O LEU A 118 -1.584 2.720 9.920 1.00 0.00 O ATOM 1898 CB LEU A 118 0.899 4.565 10.837 1.00 0.00 C ATOM 1899 CG LEU A 118 1.400 5.825 10.118 1.00 0.00 C ATOM 1900 CD1 LEU A 118 0.523 7.030 10.428 1.00 0.00 C ATOM 1901 CD2 LEU A 118 2.844 6.109 10.500 1.00 0.00 C ATOM 0 H LEU A 118 0.007 5.246 13.034 1.00 0.00 H new ATOM 0 HA LEU A 118 -1.124 5.178 10.463 1.00 0.00 H new ATOM 0 HB2 LEU A 118 1.454 4.458 11.769 1.00 0.00 H new ATOM 0 HB3 LEU A 118 1.140 3.699 10.221 1.00 0.00 H new ATOM 0 HG LEU A 118 1.345 5.642 9.045 1.00 0.00 H new ATOM 0 HD11 LEU A 118 0.907 7.904 9.902 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -0.498 6.830 10.103 1.00 0.00 H new ATOM 0 HD13 LEU A 118 0.531 7.219 11.501 1.00 0.00 H new ATOM 0 HD21 LEU A 118 3.188 7.005 9.983 1.00 0.00 H new ATOM 0 HD22 LEU A 118 2.912 6.262 11.577 1.00 0.00 H new ATOM 0 HD23 LEU A 118 3.469 5.263 10.214 1.00 0.00 H new ATOM 1913 N ARG A 119 -1.089 2.339 12.083 1.00 0.00 N ATOM 1914 CA ARG A 119 -1.574 0.965 12.067 1.00 0.00 C ATOM 1915 C ARG A 119 -3.099 0.932 12.056 1.00 0.00 C ATOM 1916 O ARG A 119 -3.708 0.135 11.342 1.00 0.00 O ATOM 1917 CB ARG A 119 -1.037 0.197 13.277 1.00 0.00 C ATOM 1918 CG ARG A 119 -0.412 -1.141 12.919 1.00 0.00 C ATOM 1919 CD ARG A 119 0.726 -1.499 13.863 1.00 0.00 C ATOM 1920 NE ARG A 119 0.565 -2.833 14.435 1.00 0.00 N ATOM 1921 CZ ARG A 119 1.557 -3.528 14.986 1.00 0.00 C ATOM 1922 NH1 ARG A 119 2.782 -3.019 15.042 1.00 0.00 N ATOM 1923 NH2 ARG A 119 1.325 -4.735 15.483 1.00 0.00 N ATOM 0 H ARG A 119 -0.721 2.646 12.983 1.00 0.00 H new ATOM 0 HA ARG A 119 -1.212 0.485 11.158 1.00 0.00 H new ATOM 0 HB2 ARG A 119 -0.294 0.811 13.786 1.00 0.00 H new ATOM 0 HB3 ARG A 119 -1.851 0.031 13.982 1.00 0.00 H new ATOM 0 HG2 ARG A 119 -1.174 -1.920 12.955 1.00 0.00 H new ATOM 0 HG3 ARG A 119 -0.039 -1.107 11.895 1.00 0.00 H new ATOM 0 HD2 ARG A 119 1.673 -1.447 13.325 1.00 0.00 H new ATOM 0 HD3 ARG A 119 0.775 -0.764 14.666 1.00 0.00 H new ATOM 0 HE ARG A 119 -0.362 -3.257 14.411 1.00 0.00 H new ATOM 0 HH11 ARG A 119 2.966 -2.091 14.662 1.00 0.00 H new ATOM 0 HH12 ARG A 119 3.539 -3.556 15.466 1.00 0.00 H new ATOM 0 HH21 ARG A 119 0.386 -5.131 15.443 1.00 0.00 H new ATOM 0 HH22 ARG A 119 2.086 -5.267 15.905 1.00 0.00 H new ATOM 1937 N ILE A 120 -3.713 1.809 12.848 1.00 0.00 N ATOM 1938 CA ILE A 120 -5.168 1.884 12.922 1.00 0.00 C ATOM 1939 C ILE A 120 -5.766 2.087 11.533 1.00 0.00 C ATOM 1940 O ILE A 120 -6.798 1.507 11.198 1.00 0.00 O ATOM 1941 CB ILE A 120 -5.626 3.029 13.855 1.00 0.00 C ATOM 1942 CG1 ILE A 120 -5.195 2.743 15.293 1.00 0.00 C ATOM 1943 CG2 ILE A 120 -7.135 3.221 13.784 1.00 0.00 C ATOM 1944 CD1 ILE A 120 -5.116 3.982 16.158 1.00 0.00 C ATOM 0 H ILE A 120 -3.225 2.476 13.446 1.00 0.00 H new ATOM 0 HA ILE A 120 -5.523 0.939 13.333 1.00 0.00 H new ATOM 0 HB ILE A 120 -5.151 3.951 13.520 1.00 0.00 H new ATOM 0 HG12 ILE A 120 -5.898 2.041 15.742 1.00 0.00 H new ATOM 0 HG13 ILE A 120 -4.220 2.255 15.281 1.00 0.00 H new ATOM 0 HG21 ILE A 120 -7.430 4.032 14.450 1.00 0.00 H new ATOM 0 HG22 ILE A 120 -7.423 3.467 12.762 1.00 0.00 H new ATOM 0 HG23 ILE A 120 -7.634 2.301 14.090 1.00 0.00 H new ATOM 0 HD11 ILE A 120 -4.804 3.704 17.165 1.00 0.00 H new ATOM 0 HD12 ILE A 120 -4.392 4.677 15.733 1.00 0.00 H new ATOM 0 HD13 ILE A 120 -6.095 4.459 16.200 1.00 0.00 H new ATOM 1956 N ALA A 121 -5.104 2.909 10.726 1.00 0.00 N ATOM 1957 CA ALA A 121 -5.563 3.183 9.372 1.00 0.00 C ATOM 1958 C ALA A 121 -5.486 1.925 8.515 1.00 0.00 C ATOM 1959 O ALA A 121 -6.402 1.627 7.749 1.00 0.00 O ATOM 1960 CB ALA A 121 -4.740 4.301 8.749 1.00 0.00 C ATOM 0 H ALA A 121 -4.247 3.397 10.988 1.00 0.00 H new ATOM 0 HA ALA A 121 -6.604 3.503 9.420 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -5.096 4.494 7.737 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -4.843 5.206 9.348 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -3.691 4.005 8.715 1.00 0.00 H new ATOM 1966 N GLY A 122 -4.388 1.190 8.652 1.00 0.00 N ATOM 1967 CA GLY A 122 -4.210 -0.031 7.887 1.00 0.00 C ATOM 1968 C GLY A 122 -5.038 -1.182 8.428 1.00 0.00 C ATOM 1969 O GLY A 122 -5.320 -2.140 7.710 1.00 0.00 O ATOM 0 H GLY A 122 -3.617 1.418 9.280 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -4.484 0.152 6.848 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -3.156 -0.310 7.895 1.00 0.00 H new ATOM 1973 N HIS A 123 -5.427 -1.088 9.695 1.00 0.00 N ATOM 1974 CA HIS A 123 -6.226 -2.132 10.326 1.00 0.00 C ATOM 1975 C HIS A 123 -7.574 -2.280 9.627 1.00 0.00 C ATOM 1976 O HIS A 123 -8.041 -3.394 9.388 1.00 0.00 O ATOM 1977 CB HIS A 123 -6.434 -1.819 11.810 1.00 0.00 C ATOM 1978 CG HIS A 123 -5.556 -2.621 12.719 1.00 0.00 C ATOM 1979 ND1 HIS A 123 -4.386 -3.219 12.300 1.00 0.00 N ATOM 1980 CD2 HIS A 123 -5.680 -2.921 14.033 1.00 0.00 C ATOM 1981 CE1 HIS A 123 -3.830 -3.854 13.317 1.00 0.00 C ATOM 1982 NE2 HIS A 123 -4.595 -3.688 14.380 1.00 0.00 N ATOM 0 H HIS A 123 -5.203 -0.301 10.304 1.00 0.00 H new ATOM 0 HA HIS A 123 -5.686 -3.075 10.236 1.00 0.00 H new ATOM 0 HB2 HIS A 123 -6.246 -0.759 11.979 1.00 0.00 H new ATOM 0 HB3 HIS A 123 -7.477 -2.003 12.069 1.00 0.00 H new ATOM 0 HD2 HIS A 123 -6.483 -2.614 14.687 1.00 0.00 H new ATOM 0 HE1 HIS A 123 -2.907 -4.414 13.284 1.00 0.00 H new ATOM 0 HE2 HIS A 123 -4.410 -4.068 15.308 1.00 0.00 H new ATOM 1991 N LYS A 124 -8.194 -1.151 9.301 1.00 0.00 N ATOM 1992 CA LYS A 124 -9.489 -1.158 8.627 1.00 0.00 C ATOM 1993 C LYS A 124 -9.327 -1.311 7.114 1.00 0.00 C ATOM 1994 O LYS A 124 -10.314 -1.339 6.379 1.00 0.00 O ATOM 1995 CB LYS A 124 -10.261 0.124 8.945 1.00 0.00 C ATOM 1996 CG LYS A 124 -9.447 1.393 8.747 1.00 0.00 C ATOM 1997 CD LYS A 124 -9.211 2.119 10.062 1.00 0.00 C ATOM 1998 CE LYS A 124 -10.423 2.943 10.469 1.00 0.00 C ATOM 1999 NZ LYS A 124 -10.204 3.652 11.759 1.00 0.00 N ATOM 0 H LYS A 124 -7.822 -0.221 9.492 1.00 0.00 H new ATOM 0 HA LYS A 124 -10.052 -2.015 8.996 1.00 0.00 H new ATOM 0 HB2 LYS A 124 -11.148 0.170 8.313 1.00 0.00 H new ATOM 0 HB3 LYS A 124 -10.607 0.082 9.978 1.00 0.00 H new ATOM 0 HG2 LYS A 124 -8.489 1.144 8.292 1.00 0.00 H new ATOM 0 HG3 LYS A 124 -9.967 2.055 8.054 1.00 0.00 H new ATOM 0 HD2 LYS A 124 -8.984 1.394 10.843 1.00 0.00 H new ATOM 0 HD3 LYS A 124 -8.342 2.770 9.969 1.00 0.00 H new ATOM 0 HE2 LYS A 124 -10.646 3.670 9.688 1.00 0.00 H new ATOM 0 HE3 LYS A 124 -11.292 2.291 10.556 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 -10.908 4.411 11.862 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 -10.303 2.979 12.546 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 -9.248 4.062 11.772 1.00 0.00 H new ATOM 2013 N LEU A 125 -8.082 -1.413 6.653 1.00 0.00 N ATOM 2014 CA LEU A 125 -7.808 -1.567 5.229 1.00 0.00 C ATOM 2015 C LEU A 125 -7.907 -3.032 4.815 1.00 0.00 C ATOM 2016 O LEU A 125 -7.763 -3.930 5.644 1.00 0.00 O ATOM 2017 CB LEU A 125 -6.413 -1.031 4.894 1.00 0.00 C ATOM 2018 CG LEU A 125 -6.314 0.490 4.764 1.00 0.00 C ATOM 2019 CD1 LEU A 125 -4.871 0.915 4.530 1.00 0.00 C ATOM 2020 CD2 LEU A 125 -7.205 0.986 3.638 1.00 0.00 C ATOM 0 H LEU A 125 -7.251 -1.392 7.244 1.00 0.00 H new ATOM 0 HA LEU A 125 -8.554 -0.995 4.678 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -5.719 -1.359 5.668 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -6.083 -1.482 3.958 1.00 0.00 H new ATOM 0 HG LEU A 125 -6.656 0.938 5.697 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -4.821 2.000 4.440 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -4.256 0.592 5.370 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -4.501 0.458 3.612 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -7.123 2.070 3.559 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -6.893 0.529 2.699 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -8.240 0.715 3.847 1.00 0.00 H new ATOM 2032 N PRO A 126 -8.152 -3.295 3.520 1.00 0.00 N ATOM 2033 CA PRO A 126 -8.269 -4.650 2.996 1.00 0.00 C ATOM 2034 C PRO A 126 -6.923 -5.231 2.569 1.00 0.00 C ATOM 2035 O PRO A 126 -6.865 -6.159 1.761 1.00 0.00 O ATOM 2036 CB PRO A 126 -9.172 -4.452 1.785 1.00 0.00 C ATOM 2037 CG PRO A 126 -8.820 -3.093 1.273 1.00 0.00 C ATOM 2038 CD PRO A 126 -8.339 -2.288 2.459 1.00 0.00 C ATOM 0 HA PRO A 126 -8.651 -5.353 3.736 1.00 0.00 H new ATOM 0 HB2 PRO A 126 -8.997 -5.218 1.030 1.00 0.00 H new ATOM 0 HB3 PRO A 126 -10.225 -4.512 2.061 1.00 0.00 H new ATOM 0 HG2 PRO A 126 -8.045 -3.157 0.510 1.00 0.00 H new ATOM 0 HG3 PRO A 126 -9.685 -2.619 0.810 1.00 0.00 H new ATOM 0 HD2 PRO A 126 -7.409 -1.765 2.236 1.00 0.00 H new ATOM 0 HD3 PRO A 126 -9.068 -1.532 2.750 1.00 0.00 H new ATOM 2046 N ILE A 127 -5.840 -4.677 3.110 1.00 0.00 N ATOM 2047 CA ILE A 127 -4.499 -5.139 2.778 1.00 0.00 C ATOM 2048 C ILE A 127 -3.538 -4.932 3.943 1.00 0.00 C ATOM 2049 O ILE A 127 -3.835 -4.195 4.883 1.00 0.00 O ATOM 2050 CB ILE A 127 -3.948 -4.415 1.534 1.00 0.00 C ATOM 2051 CG1 ILE A 127 -4.221 -2.911 1.622 1.00 0.00 C ATOM 2052 CG2 ILE A 127 -4.562 -4.997 0.270 1.00 0.00 C ATOM 2053 CD1 ILE A 127 -3.274 -2.178 2.545 1.00 0.00 C ATOM 0 H ILE A 127 -5.867 -3.908 3.780 1.00 0.00 H new ATOM 0 HA ILE A 127 -4.577 -6.205 2.564 1.00 0.00 H new ATOM 0 HB ILE A 127 -2.869 -4.564 1.495 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -4.150 -2.478 0.624 1.00 0.00 H new ATOM 0 HG13 ILE A 127 -5.244 -2.755 1.966 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -4.164 -4.476 -0.601 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -4.318 -6.057 0.202 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -5.645 -4.875 0.302 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -3.527 -1.118 2.558 1.00 0.00 H new ATOM 0 HD12 ILE A 127 -3.361 -2.584 3.553 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -2.251 -2.303 2.190 1.00 0.00 H new ATOM 2065 N LYS A 128 -2.385 -5.591 3.873 1.00 0.00 N ATOM 2066 CA LYS A 128 -1.377 -5.484 4.921 1.00 0.00 C ATOM 2067 C LYS A 128 -0.585 -4.188 4.786 1.00 0.00 C ATOM 2068 O LYS A 128 -0.210 -3.790 3.684 1.00 0.00 O ATOM 2069 CB LYS A 128 -0.427 -6.683 4.865 1.00 0.00 C ATOM 2070 CG LYS A 128 0.589 -6.709 5.996 1.00 0.00 C ATOM 2071 CD LYS A 128 0.298 -7.826 6.986 1.00 0.00 C ATOM 2072 CE LYS A 128 1.501 -8.118 7.868 1.00 0.00 C ATOM 2073 NZ LYS A 128 2.307 -9.257 7.348 1.00 0.00 N ATOM 0 H LYS A 128 -2.126 -6.205 3.101 1.00 0.00 H new ATOM 0 HA LYS A 128 -1.889 -5.476 5.883 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -1.013 -7.602 4.893 1.00 0.00 H new ATOM 0 HB3 LYS A 128 0.103 -6.672 3.912 1.00 0.00 H new ATOM 0 HG2 LYS A 128 1.590 -6.839 5.584 1.00 0.00 H new ATOM 0 HG3 LYS A 128 0.580 -5.751 6.515 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -0.552 -7.549 7.609 1.00 0.00 H new ATOM 0 HD3 LYS A 128 0.015 -8.729 6.444 1.00 0.00 H new ATOM 0 HE2 LYS A 128 2.128 -7.229 7.933 1.00 0.00 H new ATOM 0 HE3 LYS A 128 1.163 -8.344 8.879 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 3.118 -9.424 7.977 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 1.716 -10.112 7.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 2.651 -9.031 6.393 1.00 0.00 H new ATOM 2087 N THR A 129 -0.332 -3.534 5.916 1.00 0.00 N ATOM 2088 CA THR A 129 0.418 -2.284 5.923 1.00 0.00 C ATOM 2089 C THR A 129 1.348 -2.215 7.131 1.00 0.00 C ATOM 2090 O THR A 129 1.022 -2.723 8.204 1.00 0.00 O ATOM 2091 CB THR A 129 -0.534 -1.087 5.936 1.00 0.00 C ATOM 2092 OG1 THR A 129 -1.094 -0.905 7.224 1.00 0.00 O ATOM 2093 CG2 THR A 129 -1.679 -1.214 4.952 1.00 0.00 C ATOM 0 H THR A 129 -0.635 -3.849 6.837 1.00 0.00 H new ATOM 0 HA THR A 129 1.020 -2.250 5.015 1.00 0.00 H new ATOM 0 HB THR A 129 0.078 -0.233 5.645 1.00 0.00 H new ATOM 0 HG1 THR A 129 -1.672 -1.666 7.440 1.00 0.00 H new ATOM 0 HG21 THR A 129 -2.313 -0.330 5.016 1.00 0.00 H new ATOM 0 HG22 THR A 129 -1.282 -1.303 3.941 1.00 0.00 H new ATOM 0 HG23 THR A 129 -2.267 -2.100 5.190 1.00 0.00 H new ATOM 2101 N LYS A 130 2.507 -1.587 6.951 1.00 0.00 N ATOM 2102 CA LYS A 130 3.477 -1.459 8.036 1.00 0.00 C ATOM 2103 C LYS A 130 3.952 -0.016 8.188 1.00 0.00 C ATOM 2104 O LYS A 130 3.885 0.772 7.245 1.00 0.00 O ATOM 2105 CB LYS A 130 4.673 -2.380 7.788 1.00 0.00 C ATOM 2106 CG LYS A 130 5.339 -2.160 6.441 1.00 0.00 C ATOM 2107 CD LYS A 130 6.743 -2.739 6.414 1.00 0.00 C ATOM 2108 CE LYS A 130 7.570 -2.136 5.292 1.00 0.00 C ATOM 2109 NZ LYS A 130 9.022 -2.426 5.452 1.00 0.00 N ATOM 0 H LYS A 130 2.797 -1.161 6.071 1.00 0.00 H new ATOM 0 HA LYS A 130 2.983 -1.753 8.962 1.00 0.00 H new ATOM 0 HB2 LYS A 130 5.409 -2.227 8.577 1.00 0.00 H new ATOM 0 HB3 LYS A 130 4.343 -3.417 7.856 1.00 0.00 H new ATOM 0 HG2 LYS A 130 4.739 -2.622 5.657 1.00 0.00 H new ATOM 0 HG3 LYS A 130 5.380 -1.093 6.224 1.00 0.00 H new ATOM 0 HD2 LYS A 130 7.233 -2.553 7.370 1.00 0.00 H new ATOM 0 HD3 LYS A 130 6.690 -3.820 6.288 1.00 0.00 H new ATOM 0 HE2 LYS A 130 7.225 -2.529 4.336 1.00 0.00 H new ATOM 0 HE3 LYS A 130 7.416 -1.057 5.268 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 9.550 -1.997 4.666 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 9.358 -2.029 6.353 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 9.173 -3.455 5.450 1.00 0.00 H new ATOM 2123 N ILE A 131 4.440 0.319 9.381 1.00 0.00 N ATOM 2124 CA ILE A 131 4.933 1.666 9.654 1.00 0.00 C ATOM 2125 C ILE A 131 6.401 1.793 9.264 1.00 0.00 C ATOM 2126 O ILE A 131 7.205 0.907 9.551 1.00 0.00 O ATOM 2127 CB ILE A 131 4.802 2.048 11.146 1.00 0.00 C ATOM 2128 CG1 ILE A 131 3.581 1.378 11.786 1.00 0.00 C ATOM 2129 CG2 ILE A 131 4.733 3.562 11.302 1.00 0.00 C ATOM 2130 CD1 ILE A 131 2.269 1.752 11.139 1.00 0.00 C ATOM 0 H ILE A 131 4.504 -0.322 10.171 1.00 0.00 H new ATOM 0 HA ILE A 131 4.317 2.340 9.059 1.00 0.00 H new ATOM 0 HB ILE A 131 5.688 1.686 11.667 1.00 0.00 H new ATOM 0 HG12 ILE A 131 3.704 0.296 11.736 1.00 0.00 H new ATOM 0 HG13 ILE A 131 3.544 1.646 12.842 1.00 0.00 H new ATOM 0 HG21 ILE A 131 4.641 3.815 12.358 1.00 0.00 H new ATOM 0 HG22 ILE A 131 5.641 4.011 10.899 1.00 0.00 H new ATOM 0 HG23 ILE A 131 3.868 3.945 10.760 1.00 0.00 H new ATOM 0 HD11 ILE A 131 1.453 1.238 11.647 1.00 0.00 H new ATOM 0 HD12 ILE A 131 2.121 2.829 11.213 1.00 0.00 H new ATOM 0 HD13 ILE A 131 2.284 1.459 10.089 1.00 0.00 H new ATOM 2142 N VAL A 132 6.750 2.902 8.622 1.00 0.00 N ATOM 2143 CA VAL A 132 8.127 3.134 8.215 1.00 0.00 C ATOM 2144 C VAL A 132 8.470 4.619 8.255 1.00 0.00 C ATOM 2145 O VAL A 132 7.653 5.469 7.904 1.00 0.00 O ATOM 2146 CB VAL A 132 8.402 2.578 6.804 1.00 0.00 C ATOM 2147 CG1 VAL A 132 7.916 1.139 6.695 1.00 0.00 C ATOM 2148 CG2 VAL A 132 7.750 3.451 5.743 1.00 0.00 C ATOM 0 H VAL A 132 6.102 3.649 8.374 1.00 0.00 H new ATOM 0 HA VAL A 132 8.761 2.604 8.926 1.00 0.00 H new ATOM 0 HB VAL A 132 9.479 2.590 6.634 1.00 0.00 H new ATOM 0 HG11 VAL A 132 8.118 0.762 5.692 1.00 0.00 H new ATOM 0 HG12 VAL A 132 8.438 0.522 7.427 1.00 0.00 H new ATOM 0 HG13 VAL A 132 6.844 1.101 6.888 1.00 0.00 H new ATOM 0 HG21 VAL A 132 7.957 3.039 4.755 1.00 0.00 H new ATOM 0 HG22 VAL A 132 6.673 3.478 5.906 1.00 0.00 H new ATOM 0 HG23 VAL A 132 8.152 4.462 5.806 1.00 0.00 H new ATOM 2158 N ARG A 133 9.685 4.918 8.691 1.00 0.00 N ATOM 2159 CA ARG A 133 10.155 6.293 8.789 1.00 0.00 C ATOM 2160 C ARG A 133 10.627 6.817 7.445 1.00 0.00 C ATOM 2161 O ARG A 133 10.852 6.046 6.514 1.00 0.00 O ATOM 2162 CB ARG A 133 11.306 6.392 9.779 1.00 0.00 C ATOM 2163 CG ARG A 133 11.007 7.285 10.971 1.00 0.00 C ATOM 2164 CD ARG A 133 11.662 6.776 12.247 1.00 0.00 C ATOM 2165 NE ARG A 133 11.628 5.318 12.360 1.00 0.00 N ATOM 2166 CZ ARG A 133 12.444 4.616 13.143 1.00 0.00 C ATOM 2167 NH1 ARG A 133 13.350 5.233 13.893 1.00 0.00 N ATOM 2168 NH2 ARG A 133 12.352 3.294 13.179 1.00 0.00 N ATOM 0 H ARG A 133 10.369 4.220 8.985 1.00 0.00 H new ATOM 0 HA ARG A 133 9.314 6.896 9.130 1.00 0.00 H new ATOM 0 HB2 ARG A 133 11.553 5.393 10.137 1.00 0.00 H new ATOM 0 HB3 ARG A 133 12.187 6.773 9.262 1.00 0.00 H new ATOM 0 HG2 ARG A 133 11.357 8.296 10.763 1.00 0.00 H new ATOM 0 HG3 ARG A 133 9.928 7.345 11.117 1.00 0.00 H new ATOM 0 HD2 ARG A 133 12.698 7.114 12.278 1.00 0.00 H new ATOM 0 HD3 ARG A 133 11.158 7.214 13.108 1.00 0.00 H new ATOM 0 HE ARG A 133 10.939 4.809 11.806 1.00 0.00 H new ATOM 0 HH11 ARG A 133 13.423 6.250 13.871 1.00 0.00 H new ATOM 0 HH12 ARG A 133 13.973 4.690 14.491 1.00 0.00 H new ATOM 0 HH21 ARG A 133 11.656 2.815 12.607 1.00 0.00 H new ATOM 0 HH22 ARG A 133 12.977 2.755 13.779 1.00 0.00 H new