USER MOD reduce.3.24.130724 H: found=0, std=0, add=673, rem=0, adj=8 USER MOD reduce.3.24.130724 removed 675 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 32 TYR OH : rot 150:sc= -0.95 USER MOD Set 1.2: A 115 MET CE :methyl 180:sc= -0.0231 (180deg=-0.0231) USER MOD Single : A 43 THR OG1 : rot -87:sc= 0.0843 USER MOD Single : A 45 GLN :FLIP amide:sc= -0.461 F(o=-1.2,f=-0.46) USER MOD Single : A 46 GLN : amide:sc= -4.75! C(o=-4.7!,f=-13!) USER MOD Single : A 54 MET CE :methyl -129:sc= -9.26! (180deg=-12.5!) USER MOD Single : A 57 HIS : no HE2:sc= -3.4 K(o=-3.4,f=-6.3) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 MET CE :methyl -145:sc= -4.42! (180deg=-7.23!) USER MOD Single : A 110 THR OG1 : rot -140:sc= -0.286 USER MOD Single : A 113 GLN : amide:sc= 0.472 K(o=0.47,f=-4!) USER MOD Single : A 123 HIS : no HD1:sc= -0.15 X(o=-0.15,f=-0.33) USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 THR OG1 : rot -60:sc= -1.11 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 507 N ASP A 31 7.283 12.423 9.064 1.00 0.00 N ATOM 508 CA ASP A 31 8.407 11.649 9.579 1.00 0.00 C ATOM 509 C ASP A 31 8.172 10.155 9.383 1.00 0.00 C ATOM 510 O ASP A 31 9.114 9.388 9.183 1.00 0.00 O ATOM 511 CB ASP A 31 8.625 11.952 11.063 1.00 0.00 C ATOM 512 CG ASP A 31 9.180 13.345 11.293 1.00 0.00 C ATOM 513 OD1 ASP A 31 8.982 14.215 10.419 1.00 0.00 O ATOM 514 OD2 ASP A 31 9.811 13.565 12.348 1.00 0.00 O ATOM 0 HA ASP A 31 9.299 11.935 9.022 1.00 0.00 H new ATOM 0 HB2 ASP A 31 7.679 11.848 11.595 1.00 0.00 H new ATOM 0 HB3 ASP A 31 9.310 11.217 11.484 1.00 0.00 H new ATOM 519 N TYR A 32 6.908 9.751 9.439 1.00 0.00 N ATOM 520 CA TYR A 32 6.541 8.350 9.265 1.00 0.00 C ATOM 521 C TYR A 32 5.687 8.170 8.017 1.00 0.00 C ATOM 522 O TYR A 32 5.226 9.144 7.423 1.00 0.00 O ATOM 523 CB TYR A 32 5.783 7.845 10.490 1.00 0.00 C ATOM 524 CG TYR A 32 6.682 7.427 11.630 1.00 0.00 C ATOM 525 CD1 TYR A 32 7.719 6.522 11.431 1.00 0.00 C ATOM 526 CD2 TYR A 32 6.488 7.933 12.907 1.00 0.00 C ATOM 527 CE1 TYR A 32 8.535 6.134 12.476 1.00 0.00 C ATOM 528 CE2 TYR A 32 7.302 7.552 13.957 1.00 0.00 C ATOM 529 CZ TYR A 32 8.323 6.652 13.736 1.00 0.00 C ATOM 530 OH TYR A 32 9.135 6.268 14.779 1.00 0.00 O ATOM 0 H TYR A 32 6.118 10.375 9.604 1.00 0.00 H new ATOM 0 HA TYR A 32 7.456 7.769 9.149 1.00 0.00 H new ATOM 0 HB2 TYR A 32 5.110 8.628 10.838 1.00 0.00 H new ATOM 0 HB3 TYR A 32 5.162 6.998 10.199 1.00 0.00 H new ATOM 0 HD1 TYR A 32 7.889 6.116 10.445 1.00 0.00 H new ATOM 0 HD2 TYR A 32 5.688 8.636 13.084 1.00 0.00 H new ATOM 0 HE1 TYR A 32 9.335 5.428 12.307 1.00 0.00 H new ATOM 0 HE2 TYR A 32 7.139 7.957 14.945 1.00 0.00 H new ATOM 0 HH TYR A 32 9.204 7.000 15.427 1.00 0.00 H new ATOM 540 N GLY A 33 5.480 6.919 7.622 1.00 0.00 N ATOM 541 CA GLY A 33 4.683 6.641 6.445 1.00 0.00 C ATOM 542 C GLY A 33 4.054 5.263 6.473 1.00 0.00 C ATOM 543 O GLY A 33 4.735 4.266 6.714 1.00 0.00 O ATOM 0 H GLY A 33 5.850 6.095 8.096 1.00 0.00 H new ATOM 0 HA2 GLY A 33 3.898 7.392 6.358 1.00 0.00 H new ATOM 0 HA3 GLY A 33 5.310 6.731 5.558 1.00 0.00 H new ATOM 547 N LEU A 34 2.752 5.207 6.213 1.00 0.00 N ATOM 548 CA LEU A 34 2.030 3.942 6.196 1.00 0.00 C ATOM 549 C LEU A 34 2.031 3.364 4.787 1.00 0.00 C ATOM 550 O LEU A 34 1.436 3.932 3.872 1.00 0.00 O ATOM 551 CB LEU A 34 0.592 4.142 6.684 1.00 0.00 C ATOM 552 CG LEU A 34 -0.143 2.872 7.129 1.00 0.00 C ATOM 553 CD1 LEU A 34 -0.742 2.158 5.929 1.00 0.00 C ATOM 554 CD2 LEU A 34 0.787 1.941 7.898 1.00 0.00 C ATOM 0 H LEU A 34 2.176 6.024 6.011 1.00 0.00 H new ATOM 0 HA LEU A 34 2.529 3.243 6.867 1.00 0.00 H new ATOM 0 HB2 LEU A 34 0.605 4.843 7.519 1.00 0.00 H new ATOM 0 HB3 LEU A 34 0.018 4.610 5.884 1.00 0.00 H new ATOM 0 HG LEU A 34 -0.952 3.166 7.798 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -1.260 1.259 6.262 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -1.449 2.819 5.428 1.00 0.00 H new ATOM 0 HD13 LEU A 34 0.053 1.883 5.235 1.00 0.00 H new ATOM 0 HD21 LEU A 34 0.239 1.049 8.201 1.00 0.00 H new ATOM 0 HD22 LEU A 34 1.623 1.654 7.261 1.00 0.00 H new ATOM 0 HD23 LEU A 34 1.164 2.453 8.783 1.00 0.00 H new ATOM 566 N VAL A 35 2.722 2.244 4.613 1.00 0.00 N ATOM 567 CA VAL A 35 2.819 1.609 3.307 1.00 0.00 C ATOM 568 C VAL A 35 1.906 0.398 3.188 1.00 0.00 C ATOM 569 O VAL A 35 1.706 -0.345 4.148 1.00 0.00 O ATOM 570 CB VAL A 35 4.264 1.166 3.006 1.00 0.00 C ATOM 571 CG1 VAL A 35 4.811 0.322 4.146 1.00 0.00 C ATOM 572 CG2 VAL A 35 4.329 0.398 1.694 1.00 0.00 C ATOM 0 H VAL A 35 3.222 1.759 5.358 1.00 0.00 H new ATOM 0 HA VAL A 35 2.505 2.360 2.583 1.00 0.00 H new ATOM 0 HB VAL A 35 4.882 2.059 2.910 1.00 0.00 H new ATOM 0 HG11 VAL A 35 5.832 0.018 3.916 1.00 0.00 H new ATOM 0 HG12 VAL A 35 4.805 0.906 5.066 1.00 0.00 H new ATOM 0 HG13 VAL A 35 4.189 -0.564 4.274 1.00 0.00 H new ATOM 0 HG21 VAL A 35 5.358 0.095 1.501 1.00 0.00 H new ATOM 0 HG22 VAL A 35 3.696 -0.487 1.759 1.00 0.00 H new ATOM 0 HG23 VAL A 35 3.980 1.035 0.882 1.00 0.00 H new ATOM 582 N ALA A 36 1.382 0.195 1.985 1.00 0.00 N ATOM 583 CA ALA A 36 0.516 -0.938 1.704 1.00 0.00 C ATOM 584 C ALA A 36 1.329 -2.058 1.067 1.00 0.00 C ATOM 585 O ALA A 36 1.809 -1.921 -0.057 1.00 0.00 O ATOM 586 CB ALA A 36 -0.625 -0.517 0.791 1.00 0.00 C ATOM 0 H ALA A 36 1.545 0.806 1.185 1.00 0.00 H new ATOM 0 HA ALA A 36 0.087 -1.301 2.638 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -1.265 -1.376 0.589 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -1.209 0.265 1.276 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -0.219 -0.138 -0.147 1.00 0.00 H new ATOM 592 N LEU A 37 1.500 -3.154 1.801 1.00 0.00 N ATOM 593 CA LEU A 37 2.276 -4.293 1.318 1.00 0.00 C ATOM 594 C LEU A 37 1.458 -5.195 0.395 1.00 0.00 C ATOM 595 O LEU A 37 1.929 -6.255 -0.018 1.00 0.00 O ATOM 596 CB LEU A 37 2.800 -5.107 2.501 1.00 0.00 C ATOM 597 CG LEU A 37 3.366 -4.277 3.654 1.00 0.00 C ATOM 598 CD1 LEU A 37 3.371 -5.085 4.942 1.00 0.00 C ATOM 599 CD2 LEU A 37 4.768 -3.793 3.317 1.00 0.00 C ATOM 0 H LEU A 37 1.110 -3.278 2.735 1.00 0.00 H new ATOM 0 HA LEU A 37 3.111 -3.897 0.740 1.00 0.00 H new ATOM 0 HB2 LEU A 37 1.990 -5.728 2.883 1.00 0.00 H new ATOM 0 HB3 LEU A 37 3.577 -5.782 2.143 1.00 0.00 H new ATOM 0 HG LEU A 37 2.727 -3.406 3.802 1.00 0.00 H new ATOM 0 HD11 LEU A 37 3.777 -4.478 5.751 1.00 0.00 H new ATOM 0 HD12 LEU A 37 2.352 -5.383 5.188 1.00 0.00 H new ATOM 0 HD13 LEU A 37 3.988 -5.974 4.811 1.00 0.00 H new ATOM 0 HD21 LEU A 37 5.159 -3.204 4.146 1.00 0.00 H new ATOM 0 HD22 LEU A 37 5.417 -4.651 3.144 1.00 0.00 H new ATOM 0 HD23 LEU A 37 4.734 -3.177 2.418 1.00 0.00 H new ATOM 611 N GLU A 38 0.237 -4.781 0.071 1.00 0.00 N ATOM 612 CA GLU A 38 -0.621 -5.572 -0.802 1.00 0.00 C ATOM 613 C GLU A 38 -1.542 -4.675 -1.626 1.00 0.00 C ATOM 614 O GLU A 38 -1.961 -3.612 -1.167 1.00 0.00 O ATOM 615 CB GLU A 38 -1.451 -6.558 0.024 1.00 0.00 C ATOM 616 CG GLU A 38 -1.107 -8.015 -0.242 1.00 0.00 C ATOM 617 CD GLU A 38 -2.338 -8.888 -0.388 1.00 0.00 C ATOM 618 OE1 GLU A 38 -3.235 -8.522 -1.176 1.00 0.00 O ATOM 619 OE2 GLU A 38 -2.405 -9.937 0.287 1.00 0.00 O ATOM 0 H GLU A 38 -0.178 -3.908 0.398 1.00 0.00 H new ATOM 0 HA GLU A 38 0.017 -6.129 -1.488 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -1.304 -6.346 1.083 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -2.508 -6.398 -0.189 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -0.508 -8.083 -1.150 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -0.492 -8.394 0.574 1.00 0.00 H new ATOM 626 N PRO A 39 -1.873 -5.096 -2.860 1.00 0.00 N ATOM 627 CA PRO A 39 -2.751 -4.327 -3.746 1.00 0.00 C ATOM 628 C PRO A 39 -4.201 -4.348 -3.277 1.00 0.00 C ATOM 629 O PRO A 39 -4.733 -5.399 -2.921 1.00 0.00 O ATOM 630 CB PRO A 39 -2.612 -5.043 -5.091 1.00 0.00 C ATOM 631 CG PRO A 39 -2.249 -6.443 -4.737 1.00 0.00 C ATOM 632 CD PRO A 39 -1.420 -6.354 -3.485 1.00 0.00 C ATOM 0 HA PRO A 39 -2.477 -3.273 -3.781 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -3.543 -5.006 -5.657 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -1.844 -4.579 -5.709 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -3.141 -7.047 -4.572 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -1.688 -6.916 -5.543 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -1.587 -7.210 -2.831 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -0.354 -6.329 -3.711 1.00 0.00 H new ATOM 640 N ALA A 40 -4.836 -3.180 -3.274 1.00 0.00 N ATOM 641 CA ALA A 40 -6.223 -3.071 -2.843 1.00 0.00 C ATOM 642 C ALA A 40 -6.853 -1.767 -3.320 1.00 0.00 C ATOM 643 O ALA A 40 -6.169 -0.892 -3.852 1.00 0.00 O ATOM 644 CB ALA A 40 -6.311 -3.178 -1.328 1.00 0.00 C ATOM 0 H ALA A 40 -4.413 -2.299 -3.565 1.00 0.00 H new ATOM 0 HA ALA A 40 -6.780 -3.893 -3.291 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -7.352 -3.095 -1.017 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -5.912 -4.140 -1.007 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -5.731 -2.375 -0.872 1.00 0.00 H new ATOM 650 N TRP A 41 -8.161 -1.645 -3.121 1.00 0.00 N ATOM 651 CA TRP A 41 -8.892 -0.450 -3.524 1.00 0.00 C ATOM 652 C TRP A 41 -9.358 0.332 -2.300 1.00 0.00 C ATOM 653 O TRP A 41 -10.277 -0.089 -1.597 1.00 0.00 O ATOM 654 CB TRP A 41 -10.096 -0.831 -4.388 1.00 0.00 C ATOM 655 CG TRP A 41 -9.716 -1.414 -5.715 1.00 0.00 C ATOM 656 CD1 TRP A 41 -8.678 -1.028 -6.511 1.00 0.00 C ATOM 657 CD2 TRP A 41 -10.373 -2.486 -6.401 1.00 0.00 C ATOM 658 NE1 TRP A 41 -8.647 -1.794 -7.651 1.00 0.00 N ATOM 659 CE2 TRP A 41 -9.677 -2.696 -7.607 1.00 0.00 C ATOM 660 CE3 TRP A 41 -11.480 -3.289 -6.113 1.00 0.00 C ATOM 661 CZ2 TRP A 41 -10.054 -3.676 -8.522 1.00 0.00 C ATOM 662 CZ3 TRP A 41 -11.853 -4.260 -7.023 1.00 0.00 C ATOM 663 CH2 TRP A 41 -11.141 -4.447 -8.214 1.00 0.00 C ATOM 0 H TRP A 41 -8.738 -2.362 -2.681 1.00 0.00 H new ATOM 0 HA TRP A 41 -8.222 0.181 -4.107 1.00 0.00 H new ATOM 0 HB2 TRP A 41 -10.710 -1.550 -3.846 1.00 0.00 H new ATOM 0 HB3 TRP A 41 -10.711 0.054 -4.551 1.00 0.00 H new ATOM 0 HD1 TRP A 41 -7.982 -0.236 -6.279 1.00 0.00 H new ATOM 0 HE1 TRP A 41 -7.968 -1.706 -8.407 1.00 0.00 H new ATOM 0 HE3 TRP A 41 -12.034 -3.153 -5.196 1.00 0.00 H new ATOM 0 HZ2 TRP A 41 -9.507 -3.822 -9.442 1.00 0.00 H new ATOM 0 HZ3 TRP A 41 -12.708 -4.885 -6.812 1.00 0.00 H new ATOM 0 HH2 TRP A 41 -11.457 -5.216 -8.904 1.00 0.00 H new ATOM 674 N ILE A 42 -8.720 1.471 -2.048 1.00 0.00 N ATOM 675 CA ILE A 42 -9.073 2.304 -0.904 1.00 0.00 C ATOM 676 C ILE A 42 -10.254 3.212 -1.228 1.00 0.00 C ATOM 677 O ILE A 42 -10.197 4.012 -2.161 1.00 0.00 O ATOM 678 CB ILE A 42 -7.886 3.175 -0.445 1.00 0.00 C ATOM 679 CG1 ILE A 42 -6.596 2.350 -0.408 1.00 0.00 C ATOM 680 CG2 ILE A 42 -8.174 3.784 0.920 1.00 0.00 C ATOM 681 CD1 ILE A 42 -6.593 1.271 0.654 1.00 0.00 C ATOM 0 H ILE A 42 -7.958 1.837 -2.619 1.00 0.00 H new ATOM 0 HA ILE A 42 -9.347 1.624 -0.097 1.00 0.00 H new ATOM 0 HB ILE A 42 -7.752 3.985 -1.162 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -6.443 1.888 -1.383 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -5.753 3.019 -0.236 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -7.328 4.396 1.231 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -9.068 4.405 0.860 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -8.333 2.988 1.647 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -5.648 0.729 0.619 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -6.714 1.727 1.637 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -7.415 0.579 0.472 1.00 0.00 H new ATOM 693 N THR A 43 -11.323 3.083 -0.449 1.00 0.00 N ATOM 694 CA THR A 43 -12.519 3.890 -0.650 1.00 0.00 C ATOM 695 C THR A 43 -12.336 5.290 -0.077 1.00 0.00 C ATOM 696 O THR A 43 -11.360 5.564 0.621 1.00 0.00 O ATOM 697 CB THR A 43 -13.727 3.221 0.005 1.00 0.00 C ATOM 698 OG1 THR A 43 -13.331 2.455 1.131 1.00 0.00 O ATOM 699 CG2 THR A 43 -14.479 2.308 -0.935 1.00 0.00 C ATOM 0 H THR A 43 -11.385 2.426 0.329 1.00 0.00 H new ATOM 0 HA THR A 43 -12.691 3.973 -1.723 1.00 0.00 H new ATOM 0 HB THR A 43 -14.387 4.036 0.301 1.00 0.00 H new ATOM 0 HG1 THR A 43 -13.081 1.553 0.841 1.00 0.00 H new ATOM 0 HG21 THR A 43 -15.325 1.863 -0.411 1.00 0.00 H new ATOM 0 HG22 THR A 43 -14.841 2.882 -1.788 1.00 0.00 H new ATOM 0 HG23 THR A 43 -13.814 1.519 -1.285 1.00 0.00 H new ATOM 707 N ALA A 44 -13.286 6.170 -0.374 1.00 0.00 N ATOM 708 CA ALA A 44 -13.234 7.539 0.115 1.00 0.00 C ATOM 709 C ALA A 44 -13.235 7.569 1.638 1.00 0.00 C ATOM 710 O ALA A 44 -12.458 8.298 2.255 1.00 0.00 O ATOM 711 CB ALA A 44 -14.406 8.341 -0.431 1.00 0.00 C ATOM 0 H ALA A 44 -14.100 5.958 -0.951 1.00 0.00 H new ATOM 0 HA ALA A 44 -12.307 7.992 -0.235 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -14.353 9.363 -0.056 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -14.364 8.351 -1.520 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -15.341 7.884 -0.108 1.00 0.00 H new ATOM 717 N GLN A 45 -14.114 6.773 2.241 1.00 0.00 N ATOM 718 CA GLN A 45 -14.229 6.698 3.667 1.00 0.00 C ATOM 719 C GLN A 45 -12.935 6.229 4.319 1.00 0.00 C ATOM 720 O GLN A 45 -12.557 6.718 5.373 1.00 0.00 O ATOM 721 CB GLN A 45 -15.358 5.739 3.983 1.00 0.00 C ATOM 722 CG GLN A 45 -16.522 6.401 4.672 1.00 0.00 C ATOM 723 CD GLN A 45 -16.693 5.952 6.110 1.00 0.00 C ATOM 724 OE1 GLN A 45 -16.553 6.886 7.043 1.00 0.00 O flip ATOM 725 NE2 GLN A 45 -16.950 4.779 6.379 1.00 0.00 N flip ATOM 0 H GLN A 45 -14.762 6.166 1.739 1.00 0.00 H new ATOM 0 HA GLN A 45 -14.435 7.691 4.068 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -15.705 5.279 3.058 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -14.978 4.936 4.615 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -16.384 7.482 4.649 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -17.436 6.184 4.118 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -17.049 4.094 5.630 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -17.064 4.492 7.351 1.00 0.00 H new ATOM 734 N GLN A 46 -12.260 5.277 3.695 1.00 0.00 N ATOM 735 CA GLN A 46 -11.019 4.753 4.247 1.00 0.00 C ATOM 736 C GLN A 46 -9.987 5.863 4.416 1.00 0.00 C ATOM 737 O GLN A 46 -9.195 5.848 5.359 1.00 0.00 O ATOM 738 CB GLN A 46 -10.467 3.644 3.351 1.00 0.00 C ATOM 739 CG GLN A 46 -10.995 2.263 3.705 1.00 0.00 C ATOM 740 CD GLN A 46 -10.466 1.180 2.786 1.00 0.00 C ATOM 741 OE1 GLN A 46 -9.453 1.363 2.112 1.00 0.00 O ATOM 742 NE2 GLN A 46 -11.151 0.042 2.754 1.00 0.00 N ATOM 0 H GLN A 46 -12.547 4.853 2.813 1.00 0.00 H new ATOM 0 HA GLN A 46 -11.232 4.336 5.231 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -10.718 3.866 2.314 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -9.379 3.638 3.421 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -10.721 2.027 4.733 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -12.084 2.272 3.659 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -11.986 -0.067 3.330 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -10.842 -0.723 2.154 1.00 0.00 H new ATOM 751 N ILE A 47 -10.000 6.824 3.501 1.00 0.00 N ATOM 752 CA ILE A 47 -9.064 7.940 3.557 1.00 0.00 C ATOM 753 C ILE A 47 -9.399 8.900 4.697 1.00 0.00 C ATOM 754 O ILE A 47 -8.528 9.266 5.486 1.00 0.00 O ATOM 755 CB ILE A 47 -9.045 8.724 2.230 1.00 0.00 C ATOM 756 CG1 ILE A 47 -8.851 7.770 1.049 1.00 0.00 C ATOM 757 CG2 ILE A 47 -7.948 9.778 2.251 1.00 0.00 C ATOM 758 CD1 ILE A 47 -9.388 8.310 -0.258 1.00 0.00 C ATOM 0 H ILE A 47 -10.647 6.853 2.713 1.00 0.00 H new ATOM 0 HA ILE A 47 -8.079 7.509 3.735 1.00 0.00 H new ATOM 0 HB ILE A 47 -10.004 9.228 2.112 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -7.788 7.557 0.935 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -9.344 6.824 1.272 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -7.948 10.322 1.307 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -8.127 10.474 3.071 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -6.981 9.294 2.391 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -9.216 7.582 -1.051 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -10.458 8.497 -0.162 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -8.878 9.241 -0.504 1.00 0.00 H new ATOM 770 N GLU A 48 -10.661 9.314 4.774 1.00 0.00 N ATOM 771 CA GLU A 48 -11.101 10.243 5.813 1.00 0.00 C ATOM 772 C GLU A 48 -11.417 9.518 7.119 1.00 0.00 C ATOM 773 O GLU A 48 -11.004 9.951 8.195 1.00 0.00 O ATOM 774 CB GLU A 48 -12.331 11.018 5.339 1.00 0.00 C ATOM 775 CG GLU A 48 -12.399 12.439 5.877 1.00 0.00 C ATOM 776 CD GLU A 48 -12.080 13.478 4.821 1.00 0.00 C ATOM 777 OE1 GLU A 48 -11.030 13.348 4.157 1.00 0.00 O ATOM 778 OE2 GLU A 48 -12.880 14.423 4.657 1.00 0.00 O ATOM 0 H GLU A 48 -11.397 9.022 4.131 1.00 0.00 H new ATOM 0 HA GLU A 48 -10.283 10.938 6.004 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -12.332 11.050 4.249 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -13.229 10.480 5.643 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -13.396 12.625 6.275 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -11.700 12.543 6.707 1.00 0.00 H new ATOM 785 N ALA A 49 -12.157 8.419 7.019 1.00 0.00 N ATOM 786 CA ALA A 49 -12.536 7.635 8.193 1.00 0.00 C ATOM 787 C ALA A 49 -11.311 7.238 9.010 1.00 0.00 C ATOM 788 O ALA A 49 -11.292 7.387 10.232 1.00 0.00 O ATOM 789 CB ALA A 49 -13.322 6.396 7.777 1.00 0.00 C ATOM 0 H ALA A 49 -12.508 8.049 6.136 1.00 0.00 H new ATOM 0 HA ALA A 49 -13.172 8.259 8.821 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -13.596 5.824 8.664 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -14.225 6.699 7.247 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -12.707 5.778 7.122 1.00 0.00 H new ATOM 795 N ALA A 50 -10.288 6.734 8.328 1.00 0.00 N ATOM 796 CA ALA A 50 -9.059 6.319 8.991 1.00 0.00 C ATOM 797 C ALA A 50 -8.325 7.518 9.582 1.00 0.00 C ATOM 798 O ALA A 50 -7.800 7.451 10.693 1.00 0.00 O ATOM 799 CB ALA A 50 -8.158 5.575 8.017 1.00 0.00 C ATOM 0 H ALA A 50 -10.286 6.603 7.316 1.00 0.00 H new ATOM 0 HA ALA A 50 -9.324 5.648 9.808 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -7.244 5.271 8.527 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -8.676 4.692 7.644 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -7.908 6.228 7.181 1.00 0.00 H new ATOM 805 N ARG A 51 -8.294 8.615 8.831 1.00 0.00 N ATOM 806 CA ARG A 51 -7.625 9.830 9.282 1.00 0.00 C ATOM 807 C ARG A 51 -8.238 10.334 10.585 1.00 0.00 C ATOM 808 O ARG A 51 -7.525 10.748 11.498 1.00 0.00 O ATOM 809 CB ARG A 51 -7.711 10.914 8.205 1.00 0.00 C ATOM 810 CG ARG A 51 -6.357 11.471 7.796 1.00 0.00 C ATOM 811 CD ARG A 51 -6.470 12.902 7.295 1.00 0.00 C ATOM 812 NE ARG A 51 -7.183 12.982 6.022 1.00 0.00 N ATOM 813 CZ ARG A 51 -7.466 14.125 5.402 1.00 0.00 C ATOM 814 NH1 ARG A 51 -7.100 15.285 5.934 1.00 0.00 N ATOM 815 NH2 ARG A 51 -8.116 14.109 4.247 1.00 0.00 N ATOM 0 H ARG A 51 -8.724 8.687 7.909 1.00 0.00 H new ATOM 0 HA ARG A 51 -6.576 9.595 9.464 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -8.207 10.503 7.326 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -8.335 11.729 8.570 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -5.676 11.435 8.646 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -5.926 10.844 7.015 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -6.988 13.507 8.039 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -5.472 13.325 7.179 1.00 0.00 H new ATOM 0 HE ARG A 51 -7.481 12.111 5.583 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -6.599 15.303 6.822 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -7.320 16.158 5.454 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -8.399 13.221 3.833 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -8.333 14.985 3.772 1.00 0.00 H new ATOM 829 N VAL A 52 -9.564 10.291 10.665 1.00 0.00 N ATOM 830 CA VAL A 52 -10.272 10.739 11.857 1.00 0.00 C ATOM 831 C VAL A 52 -9.828 9.949 13.084 1.00 0.00 C ATOM 832 O VAL A 52 -9.554 10.521 14.139 1.00 0.00 O ATOM 833 CB VAL A 52 -11.798 10.598 11.691 1.00 0.00 C ATOM 834 CG1 VAL A 52 -12.525 11.176 12.897 1.00 0.00 C ATOM 835 CG2 VAL A 52 -12.261 11.271 10.406 1.00 0.00 C ATOM 0 H VAL A 52 -10.169 9.950 9.918 1.00 0.00 H new ATOM 0 HA VAL A 52 -10.027 11.792 11.996 1.00 0.00 H new ATOM 0 HB VAL A 52 -12.040 9.537 11.626 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -13.601 11.067 12.760 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -12.218 10.643 13.797 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -12.278 12.233 12.999 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -13.341 11.161 10.306 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -12.006 12.330 10.438 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -11.768 10.804 9.553 1.00 0.00 H new ATOM 845 N ALA A 53 -9.756 8.630 12.936 1.00 0.00 N ATOM 846 CA ALA A 53 -9.343 7.759 14.028 1.00 0.00 C ATOM 847 C ALA A 53 -7.903 8.043 14.441 1.00 0.00 C ATOM 848 O ALA A 53 -7.563 7.989 15.623 1.00 0.00 O ATOM 849 CB ALA A 53 -9.499 6.300 13.624 1.00 0.00 C ATOM 0 H ALA A 53 -9.979 8.141 12.069 1.00 0.00 H new ATOM 0 HA ALA A 53 -9.986 7.960 14.885 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -9.187 5.659 14.448 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -10.543 6.099 13.383 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -8.879 6.096 12.751 1.00 0.00 H new ATOM 855 N MET A 54 -7.061 8.343 13.458 1.00 0.00 N ATOM 856 CA MET A 54 -5.656 8.633 13.715 1.00 0.00 C ATOM 857 C MET A 54 -5.486 9.981 14.408 1.00 0.00 C ATOM 858 O MET A 54 -4.770 10.091 15.402 1.00 0.00 O ATOM 859 CB MET A 54 -4.866 8.617 12.406 1.00 0.00 C ATOM 860 CG MET A 54 -4.766 7.238 11.777 1.00 0.00 C ATOM 861 SD MET A 54 -3.468 7.137 10.531 1.00 0.00 S ATOM 862 CE MET A 54 -4.332 7.775 9.099 1.00 0.00 C ATOM 0 H MET A 54 -7.328 8.392 12.475 1.00 0.00 H new ATOM 0 HA MET A 54 -5.270 7.859 14.379 1.00 0.00 H new ATOM 0 HB2 MET A 54 -5.338 9.298 11.697 1.00 0.00 H new ATOM 0 HB3 MET A 54 -3.861 8.997 12.592 1.00 0.00 H new ATOM 0 HG2 MET A 54 -4.575 6.500 12.556 1.00 0.00 H new ATOM 0 HG3 MET A 54 -5.722 6.980 11.322 1.00 0.00 H new ATOM 0 HE1 MET A 54 -4.212 7.085 8.264 1.00 0.00 H new ATOM 0 HE2 MET A 54 -5.392 7.882 9.331 1.00 0.00 H new ATOM 0 HE3 MET A 54 -3.920 8.747 8.829 1.00 0.00 H new ATOM 872 N VAL A 55 -6.147 11.005 13.876 1.00 0.00 N ATOM 873 CA VAL A 55 -6.063 12.346 14.445 1.00 0.00 C ATOM 874 C VAL A 55 -6.483 12.348 15.911 1.00 0.00 C ATOM 875 O VAL A 55 -5.878 13.028 16.740 1.00 0.00 O ATOM 876 CB VAL A 55 -6.944 13.343 13.667 1.00 0.00 C ATOM 877 CG1 VAL A 55 -6.733 14.760 14.181 1.00 0.00 C ATOM 878 CG2 VAL A 55 -6.654 13.261 12.174 1.00 0.00 C ATOM 0 H VAL A 55 -6.746 10.932 13.053 1.00 0.00 H new ATOM 0 HA VAL A 55 -5.021 12.658 14.368 1.00 0.00 H new ATOM 0 HB VAL A 55 -7.989 13.076 13.827 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -7.364 15.449 13.619 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -6.996 14.807 15.238 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -5.687 15.041 14.055 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -7.285 13.972 11.641 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -5.606 13.500 11.993 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -6.863 12.252 11.818 1.00 0.00 H new ATOM 888 N ARG A 56 -7.519 11.579 16.225 1.00 0.00 N ATOM 889 CA ARG A 56 -8.017 11.487 17.591 1.00 0.00 C ATOM 890 C ARG A 56 -7.088 10.635 18.450 1.00 0.00 C ATOM 891 O ARG A 56 -6.978 10.842 19.659 1.00 0.00 O ATOM 892 CB ARG A 56 -9.427 10.896 17.600 1.00 0.00 C ATOM 893 CG ARG A 56 -10.517 11.931 17.378 1.00 0.00 C ATOM 894 CD ARG A 56 -11.553 11.449 16.375 1.00 0.00 C ATOM 895 NE ARG A 56 -11.974 10.075 16.638 1.00 0.00 N ATOM 896 CZ ARG A 56 -12.871 9.738 17.562 1.00 0.00 C ATOM 897 NH1 ARG A 56 -13.440 10.670 18.316 1.00 0.00 N ATOM 898 NH2 ARG A 56 -13.199 8.464 17.733 1.00 0.00 N ATOM 0 H ARG A 56 -8.031 11.010 15.551 1.00 0.00 H new ATOM 0 HA ARG A 56 -8.050 12.492 18.011 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -9.498 10.133 16.825 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -9.598 10.398 18.554 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -11.005 12.155 18.327 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -10.070 12.860 17.022 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -12.422 12.106 16.407 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -11.141 11.515 15.368 1.00 0.00 H new ATOM 0 HE ARG A 56 -11.556 9.330 16.081 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -13.191 11.651 18.189 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -14.127 10.405 19.022 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -12.764 7.744 17.157 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -13.886 8.205 18.441 1.00 0.00 H new ATOM 912 N HIS A 57 -6.426 9.674 17.816 1.00 0.00 N ATOM 913 CA HIS A 57 -5.507 8.784 18.518 1.00 0.00 C ATOM 914 C HIS A 57 -4.381 9.569 19.185 1.00 0.00 C ATOM 915 O HIS A 57 -4.140 9.428 20.384 1.00 0.00 O ATOM 916 CB HIS A 57 -4.921 7.755 17.549 1.00 0.00 C ATOM 917 CG HIS A 57 -4.350 6.550 18.231 1.00 0.00 C ATOM 918 ND1 HIS A 57 -5.099 5.711 19.028 1.00 0.00 N ATOM 919 CD2 HIS A 57 -3.094 6.045 18.233 1.00 0.00 C ATOM 920 CE1 HIS A 57 -4.329 4.742 19.491 1.00 0.00 C ATOM 921 NE2 HIS A 57 -3.108 4.922 19.023 1.00 0.00 N ATOM 0 H HIS A 57 -6.508 9.491 16.816 1.00 0.00 H new ATOM 0 HA HIS A 57 -6.070 8.266 19.294 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -5.699 7.436 16.856 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -4.141 8.230 16.955 1.00 0.00 H new ATOM 0 HD1 HIS A 57 -6.093 5.821 19.229 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -2.240 6.450 17.711 1.00 0.00 H new ATOM 0 HE1 HIS A 57 -4.645 3.940 20.141 1.00 0.00 H new ATOM 930 N PHE A 58 -3.690 10.395 18.402 1.00 0.00 N ATOM 931 CA PHE A 58 -2.587 11.199 18.922 1.00 0.00 C ATOM 932 C PHE A 58 -3.022 12.001 20.145 1.00 0.00 C ATOM 933 O PHE A 58 -3.636 13.060 20.019 1.00 0.00 O ATOM 934 CB PHE A 58 -2.060 12.146 17.842 1.00 0.00 C ATOM 935 CG PHE A 58 -1.839 11.484 16.511 1.00 0.00 C ATOM 936 CD1 PHE A 58 -0.827 10.551 16.344 1.00 0.00 C ATOM 937 CD2 PHE A 58 -2.643 11.796 15.427 1.00 0.00 C ATOM 938 CE1 PHE A 58 -0.623 9.943 15.120 1.00 0.00 C ATOM 939 CE2 PHE A 58 -2.444 11.191 14.201 1.00 0.00 C ATOM 940 CZ PHE A 58 -1.432 10.263 14.048 1.00 0.00 C ATOM 0 H PHE A 58 -3.874 10.525 17.407 1.00 0.00 H new ATOM 0 HA PHE A 58 -1.790 10.518 19.220 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -2.765 12.967 17.716 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -1.120 12.582 18.181 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -0.191 10.297 17.179 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -3.435 12.521 15.542 1.00 0.00 H new ATOM 0 HE1 PHE A 58 0.169 9.218 15.002 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -3.078 11.443 13.364 1.00 0.00 H new ATOM 0 HZ PHE A 58 -1.274 9.788 13.091 1.00 0.00 H new ATOM 950 N ARG A 59 -2.699 11.487 21.328 1.00 0.00 N ATOM 951 CA ARG A 59 -3.056 12.156 22.574 1.00 0.00 C ATOM 952 C ARG A 59 -2.429 13.544 22.645 1.00 0.00 C ATOM 953 O ARG A 59 -3.002 14.466 23.226 1.00 0.00 O ATOM 954 CB ARG A 59 -2.607 11.318 23.773 1.00 0.00 C ATOM 955 CG ARG A 59 -3.334 9.988 23.893 1.00 0.00 C ATOM 956 CD ARG A 59 -2.847 9.195 25.095 1.00 0.00 C ATOM 957 NE ARG A 59 -3.566 7.931 25.245 1.00 0.00 N ATOM 958 CZ ARG A 59 -3.324 7.052 26.214 1.00 0.00 C ATOM 959 NH1 ARG A 59 -2.385 7.293 27.120 1.00 0.00 N ATOM 960 NH2 ARG A 59 -4.024 5.927 26.278 1.00 0.00 N ATOM 0 H ARG A 59 -2.191 10.611 21.450 1.00 0.00 H new ATOM 0 HA ARG A 59 -4.140 12.266 22.602 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -1.536 11.131 23.694 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -2.764 11.892 24.686 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -4.406 10.165 23.982 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -3.181 9.405 22.985 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -1.781 8.995 24.990 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -2.972 9.792 25.998 1.00 0.00 H new ATOM 0 HE ARG A 59 -4.296 7.710 24.567 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -1.844 8.156 27.076 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -2.205 6.615 27.860 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -4.747 5.736 25.585 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -3.839 5.253 27.021 1.00 0.00 H new ATOM 974 N ARG A 60 -1.250 13.686 22.050 1.00 0.00 N ATOM 975 CA ARG A 60 -0.545 14.963 22.045 1.00 0.00 C ATOM 976 C ARG A 60 -0.695 15.662 20.698 1.00 0.00 C ATOM 977 O ARG A 60 0.210 16.365 20.248 1.00 0.00 O ATOM 978 CB ARG A 60 0.937 14.751 22.361 1.00 0.00 C ATOM 979 CG ARG A 60 1.182 14.069 23.697 1.00 0.00 C ATOM 980 CD ARG A 60 1.119 15.059 24.848 1.00 0.00 C ATOM 981 NE ARG A 60 -0.243 15.530 25.091 1.00 0.00 N ATOM 982 CZ ARG A 60 -0.535 16.635 25.774 1.00 0.00 C ATOM 983 NH1 ARG A 60 0.435 17.384 26.284 1.00 0.00 N ATOM 984 NH2 ARG A 60 -1.800 16.991 25.947 1.00 0.00 N ATOM 0 H ARG A 60 -0.762 12.933 21.565 1.00 0.00 H new ATOM 0 HA ARG A 60 -0.987 15.597 22.814 1.00 0.00 H new ATOM 0 HB2 ARG A 60 1.387 14.152 21.569 1.00 0.00 H new ATOM 0 HB3 ARG A 60 1.443 15.717 22.357 1.00 0.00 H new ATOM 0 HG2 ARG A 60 0.439 13.286 23.848 1.00 0.00 H new ATOM 0 HG3 ARG A 60 2.158 13.584 23.686 1.00 0.00 H new ATOM 0 HD2 ARG A 60 1.507 14.589 25.752 1.00 0.00 H new ATOM 0 HD3 ARG A 60 1.764 15.910 24.630 1.00 0.00 H new ATOM 0 HE ARG A 60 -1.015 14.980 24.715 1.00 0.00 H new ATOM 0 HH11 ARG A 60 1.410 17.114 26.154 1.00 0.00 H new ATOM 0 HH12 ARG A 60 0.205 18.229 26.806 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -2.549 16.419 25.557 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -2.025 17.837 26.470 1.00 0.00 H new ATOM 998 N GLY A 61 -1.843 15.465 20.059 1.00 0.00 N ATOM 999 CA GLY A 61 -2.091 16.083 18.771 1.00 0.00 C ATOM 1000 C GLY A 61 -1.182 15.544 17.684 1.00 0.00 C ATOM 1001 O GLY A 61 -0.188 14.877 17.972 1.00 0.00 O ATOM 0 H GLY A 61 -2.607 14.888 20.411 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -3.130 15.918 18.486 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -1.951 17.161 18.856 1.00 0.00 H new ATOM 1005 N GLY A 62 -1.523 15.833 16.433 1.00 0.00 N ATOM 1006 CA GLY A 62 -0.720 15.364 15.319 1.00 0.00 C ATOM 1007 C GLY A 62 -1.355 15.672 13.977 1.00 0.00 C ATOM 1008 O GLY A 62 -2.545 15.978 13.901 1.00 0.00 O ATOM 0 H GLY A 62 -2.341 16.383 16.170 1.00 0.00 H new ATOM 0 HA2 GLY A 62 0.266 15.826 15.366 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -0.572 14.288 15.409 1.00 0.00 H new ATOM 1012 N LYS A 63 -0.559 15.592 12.916 1.00 0.00 N ATOM 1013 CA LYS A 63 -1.049 15.865 11.570 1.00 0.00 C ATOM 1014 C LYS A 63 -0.663 14.741 10.614 1.00 0.00 C ATOM 1015 O LYS A 63 0.451 14.217 10.673 1.00 0.00 O ATOM 1016 CB LYS A 63 -0.493 17.197 11.063 1.00 0.00 C ATOM 1017 CG LYS A 63 1.025 17.249 11.028 1.00 0.00 C ATOM 1018 CD LYS A 63 1.527 18.649 10.715 1.00 0.00 C ATOM 1019 CE LYS A 63 2.856 18.614 9.979 1.00 0.00 C ATOM 1020 NZ LYS A 63 4.010 18.766 10.908 1.00 0.00 N ATOM 0 H LYS A 63 0.428 15.340 12.962 1.00 0.00 H new ATOM 0 HA LYS A 63 -2.137 15.926 11.610 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -0.878 17.384 10.060 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -0.861 18.001 11.700 1.00 0.00 H new ATOM 0 HG2 LYS A 63 1.424 16.925 11.989 1.00 0.00 H new ATOM 0 HG3 LYS A 63 1.397 16.552 10.277 1.00 0.00 H new ATOM 0 HD2 LYS A 63 0.788 19.174 10.109 1.00 0.00 H new ATOM 0 HD3 LYS A 63 1.638 19.212 11.642 1.00 0.00 H new ATOM 0 HE2 LYS A 63 2.947 17.672 9.439 1.00 0.00 H new ATOM 0 HE3 LYS A 63 2.881 19.411 9.236 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 4.898 18.737 10.367 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 3.938 19.676 11.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 4.002 17.991 11.601 1.00 0.00 H new ATOM 1034 N ILE A 64 -1.591 14.374 9.734 1.00 0.00 N ATOM 1035 CA ILE A 64 -1.346 13.312 8.765 1.00 0.00 C ATOM 1036 C ILE A 64 -1.368 13.848 7.339 1.00 0.00 C ATOM 1037 O ILE A 64 -2.083 14.803 7.034 1.00 0.00 O ATOM 1038 CB ILE A 64 -2.385 12.176 8.875 1.00 0.00 C ATOM 1039 CG1 ILE A 64 -2.844 11.991 10.325 1.00 0.00 C ATOM 1040 CG2 ILE A 64 -1.805 10.881 8.328 1.00 0.00 C ATOM 1041 CD1 ILE A 64 -3.781 10.817 10.519 1.00 0.00 C ATOM 0 H ILE A 64 -2.518 14.796 9.673 1.00 0.00 H new ATOM 0 HA ILE A 64 -0.358 12.915 8.996 1.00 0.00 H new ATOM 0 HB ILE A 64 -3.257 12.449 8.280 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -1.969 11.855 10.960 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -3.342 12.901 10.659 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -2.547 10.087 8.411 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -1.534 11.017 7.281 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -0.918 10.610 8.900 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -4.064 10.747 11.569 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -4.674 10.960 9.911 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -3.280 9.898 10.217 1.00 0.00 H new ATOM 1053 N PHE A 65 -0.590 13.217 6.468 1.00 0.00 N ATOM 1054 CA PHE A 65 -0.524 13.615 5.068 1.00 0.00 C ATOM 1055 C PHE A 65 -1.017 12.482 4.175 1.00 0.00 C ATOM 1056 O PHE A 65 -0.456 11.386 4.183 1.00 0.00 O ATOM 1057 CB PHE A 65 0.906 14.003 4.688 1.00 0.00 C ATOM 1058 CG PHE A 65 1.419 15.207 5.425 1.00 0.00 C ATOM 1059 CD1 PHE A 65 1.198 16.483 4.933 1.00 0.00 C ATOM 1060 CD2 PHE A 65 2.122 15.062 6.611 1.00 0.00 C ATOM 1061 CE1 PHE A 65 1.668 17.593 5.609 1.00 0.00 C ATOM 1062 CE2 PHE A 65 2.596 16.168 7.291 1.00 0.00 C ATOM 1063 CZ PHE A 65 2.368 17.435 6.790 1.00 0.00 C ATOM 0 H PHE A 65 0.006 12.425 6.708 1.00 0.00 H new ATOM 0 HA PHE A 65 -1.168 14.483 4.924 1.00 0.00 H new ATOM 0 HB2 PHE A 65 1.567 13.159 4.884 1.00 0.00 H new ATOM 0 HB3 PHE A 65 0.948 14.198 3.616 1.00 0.00 H new ATOM 0 HD1 PHE A 65 0.652 16.612 4.010 1.00 0.00 H new ATOM 0 HD2 PHE A 65 2.301 14.074 7.008 1.00 0.00 H new ATOM 0 HE1 PHE A 65 1.489 18.582 5.215 1.00 0.00 H new ATOM 0 HE2 PHE A 65 3.144 16.042 8.213 1.00 0.00 H new ATOM 0 HZ PHE A 65 2.736 18.301 7.320 1.00 0.00 H new ATOM 1073 N ILE A 66 -2.075 12.747 3.416 1.00 0.00 N ATOM 1074 CA ILE A 66 -2.647 11.740 2.529 1.00 0.00 C ATOM 1075 C ILE A 66 -2.407 12.088 1.064 1.00 0.00 C ATOM 1076 O ILE A 66 -2.560 13.238 0.654 1.00 0.00 O ATOM 1077 CB ILE A 66 -4.164 11.574 2.757 1.00 0.00 C ATOM 1078 CG1 ILE A 66 -4.517 11.767 4.236 1.00 0.00 C ATOM 1079 CG2 ILE A 66 -4.624 10.207 2.272 1.00 0.00 C ATOM 1080 CD1 ILE A 66 -3.708 10.897 5.174 1.00 0.00 C ATOM 0 H ILE A 66 -2.553 13.648 3.397 1.00 0.00 H new ATOM 0 HA ILE A 66 -2.145 10.802 2.766 1.00 0.00 H new ATOM 0 HB ILE A 66 -4.684 12.341 2.182 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -4.365 12.813 4.503 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -5.576 11.552 4.378 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -5.696 10.104 2.439 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -4.411 10.108 1.208 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -4.094 9.429 2.822 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -4.013 11.089 6.203 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -3.878 9.847 4.935 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -2.649 11.127 5.061 1.00 0.00 H new ATOM 1092 N ARG A 67 -2.034 11.082 0.281 1.00 0.00 N ATOM 1093 CA ARG A 67 -1.775 11.273 -1.142 1.00 0.00 C ATOM 1094 C ARG A 67 -2.758 10.466 -1.987 1.00 0.00 C ATOM 1095 O ARG A 67 -3.094 10.855 -3.106 1.00 0.00 O ATOM 1096 CB ARG A 67 -0.340 10.865 -1.479 1.00 0.00 C ATOM 1097 CG ARG A 67 0.271 11.674 -2.613 1.00 0.00 C ATOM 1098 CD ARG A 67 1.646 12.207 -2.242 1.00 0.00 C ATOM 1099 NE ARG A 67 2.426 12.576 -3.420 1.00 0.00 N ATOM 1100 CZ ARG A 67 2.178 13.650 -4.167 1.00 0.00 C ATOM 1101 NH1 ARG A 67 1.175 14.463 -3.860 1.00 0.00 N ATOM 1102 NH2 ARG A 67 2.936 13.913 -5.222 1.00 0.00 N ATOM 0 H ARG A 67 -1.904 10.125 0.608 1.00 0.00 H new ATOM 0 HA ARG A 67 -1.908 12.330 -1.372 1.00 0.00 H new ATOM 0 HB2 ARG A 67 0.279 10.977 -0.589 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -0.325 9.809 -1.748 1.00 0.00 H new ATOM 0 HG2 ARG A 67 0.350 11.051 -3.504 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -0.387 12.506 -2.863 1.00 0.00 H new ATOM 0 HD2 ARG A 67 1.535 13.076 -1.594 1.00 0.00 H new ATOM 0 HD3 ARG A 67 2.186 11.451 -1.672 1.00 0.00 H new ATOM 0 HE ARG A 67 3.207 11.976 -3.686 1.00 0.00 H new ATOM 0 HH11 ARG A 67 0.589 14.267 -3.048 1.00 0.00 H new ATOM 0 HH12 ARG A 67 0.990 15.284 -4.436 1.00 0.00 H new ATOM 0 HH21 ARG A 67 3.709 13.293 -5.462 1.00 0.00 H new ATOM 0 HH22 ARG A 67 2.746 14.736 -5.794 1.00 0.00 H new ATOM 1116 N ILE A 68 -3.215 9.340 -1.445 1.00 0.00 N ATOM 1117 CA ILE A 68 -4.157 8.479 -2.148 1.00 0.00 C ATOM 1118 C ILE A 68 -5.482 9.195 -2.393 1.00 0.00 C ATOM 1119 O ILE A 68 -6.011 9.862 -1.505 1.00 0.00 O ATOM 1120 CB ILE A 68 -4.426 7.181 -1.361 1.00 0.00 C ATOM 1121 CG1 ILE A 68 -5.007 7.504 0.017 1.00 0.00 C ATOM 1122 CG2 ILE A 68 -3.145 6.370 -1.226 1.00 0.00 C ATOM 1123 CD1 ILE A 68 -5.293 6.277 0.856 1.00 0.00 C ATOM 0 H ILE A 68 -2.947 9.004 -0.520 1.00 0.00 H new ATOM 0 HA ILE A 68 -3.701 8.228 -3.106 1.00 0.00 H new ATOM 0 HB ILE A 68 -5.155 6.585 -1.910 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -4.310 8.147 0.554 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -5.930 8.070 -0.110 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -3.350 5.456 -0.668 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -2.770 6.114 -2.217 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -2.396 6.958 -0.696 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -5.703 6.582 1.819 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -6.014 5.643 0.339 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -4.369 5.721 1.015 1.00 0.00 H new ATOM 1135 N PHE A 69 -6.011 9.051 -3.604 1.00 0.00 N ATOM 1136 CA PHE A 69 -7.274 9.683 -3.966 1.00 0.00 C ATOM 1137 C PHE A 69 -8.122 8.747 -4.827 1.00 0.00 C ATOM 1138 O PHE A 69 -7.604 8.068 -5.713 1.00 0.00 O ATOM 1139 CB PHE A 69 -7.011 10.991 -4.715 1.00 0.00 C ATOM 1140 CG PHE A 69 -7.349 12.217 -3.915 1.00 0.00 C ATOM 1141 CD1 PHE A 69 -8.639 12.721 -3.908 1.00 0.00 C ATOM 1142 CD2 PHE A 69 -6.375 12.863 -3.171 1.00 0.00 C ATOM 1143 CE1 PHE A 69 -8.952 13.849 -3.173 1.00 0.00 C ATOM 1144 CE2 PHE A 69 -6.683 13.991 -2.434 1.00 0.00 C ATOM 1145 CZ PHE A 69 -7.973 14.485 -2.435 1.00 0.00 C ATOM 0 H PHE A 69 -5.585 8.502 -4.351 1.00 0.00 H new ATOM 0 HA PHE A 69 -7.824 9.900 -3.050 1.00 0.00 H new ATOM 0 HB2 PHE A 69 -5.960 11.032 -5.001 1.00 0.00 H new ATOM 0 HB3 PHE A 69 -7.593 10.996 -5.637 1.00 0.00 H new ATOM 0 HD1 PHE A 69 -9.409 12.227 -4.483 1.00 0.00 H new ATOM 0 HD2 PHE A 69 -5.365 12.481 -3.167 1.00 0.00 H new ATOM 0 HE1 PHE A 69 -9.961 14.233 -3.176 1.00 0.00 H new ATOM 0 HE2 PHE A 69 -5.915 14.486 -1.858 1.00 0.00 H new ATOM 0 HZ PHE A 69 -8.215 15.366 -1.860 1.00 0.00 H new ATOM 1155 N PRO A 70 -9.444 8.697 -4.579 1.00 0.00 N ATOM 1156 CA PRO A 70 -10.357 7.838 -5.340 1.00 0.00 C ATOM 1157 C PRO A 70 -10.560 8.332 -6.768 1.00 0.00 C ATOM 1158 O PRO A 70 -10.986 9.466 -6.988 1.00 0.00 O ATOM 1159 CB PRO A 70 -11.666 7.924 -4.553 1.00 0.00 C ATOM 1160 CG PRO A 70 -11.603 9.239 -3.858 1.00 0.00 C ATOM 1161 CD PRO A 70 -10.151 9.472 -3.541 1.00 0.00 C ATOM 0 HA PRO A 70 -9.972 6.823 -5.442 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -12.530 7.867 -5.215 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -11.755 7.104 -3.841 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -11.996 10.034 -4.491 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -12.204 9.229 -2.949 1.00 0.00 H new ATOM 0 HD2 PRO A 70 -9.895 10.531 -3.586 1.00 0.00 H new ATOM 0 HD3 PRO A 70 -9.898 9.125 -2.539 1.00 0.00 H new ATOM 1539 N VAL A 94 -12.589 4.410 -5.682 1.00 0.00 N ATOM 1540 CA VAL A 94 -11.508 3.903 -4.845 1.00 0.00 C ATOM 1541 C VAL A 94 -10.145 4.302 -5.401 1.00 0.00 C ATOM 1542 O VAL A 94 -10.042 4.807 -6.518 1.00 0.00 O ATOM 1543 CB VAL A 94 -11.564 2.369 -4.719 1.00 0.00 C ATOM 1544 CG1 VAL A 94 -12.631 1.950 -3.719 1.00 0.00 C ATOM 1545 CG2 VAL A 94 -11.814 1.728 -6.077 1.00 0.00 C ATOM 0 HA VAL A 94 -11.641 4.348 -3.859 1.00 0.00 H new ATOM 0 HB VAL A 94 -10.599 2.021 -4.351 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -12.654 0.863 -3.645 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -12.401 2.375 -2.742 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -13.604 2.311 -4.052 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -11.850 0.644 -5.967 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -12.763 2.084 -6.478 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -11.008 1.996 -6.760 1.00 0.00 H new ATOM 1555 N ALA A 95 -9.101 4.068 -4.612 1.00 0.00 N ATOM 1556 CA ALA A 95 -7.742 4.398 -5.022 1.00 0.00 C ATOM 1557 C ALA A 95 -6.874 3.146 -5.085 1.00 0.00 C ATOM 1558 O ALA A 95 -6.453 2.618 -4.056 1.00 0.00 O ATOM 1559 CB ALA A 95 -7.135 5.416 -4.068 1.00 0.00 C ATOM 0 H ALA A 95 -9.171 3.651 -3.684 1.00 0.00 H new ATOM 0 HA ALA A 95 -7.783 4.834 -6.020 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -6.120 5.653 -4.387 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -7.738 6.324 -4.073 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -7.111 5.001 -3.060 1.00 0.00 H new ATOM 1565 N VAL A 96 -6.612 2.673 -6.299 1.00 0.00 N ATOM 1566 CA VAL A 96 -5.797 1.479 -6.495 1.00 0.00 C ATOM 1567 C VAL A 96 -4.404 1.659 -5.900 1.00 0.00 C ATOM 1568 O VAL A 96 -3.737 2.664 -6.147 1.00 0.00 O ATOM 1569 CB VAL A 96 -5.661 1.119 -7.988 1.00 0.00 C ATOM 1570 CG1 VAL A 96 -5.123 -0.294 -8.147 1.00 0.00 C ATOM 1571 CG2 VAL A 96 -6.997 1.270 -8.702 1.00 0.00 C ATOM 0 H VAL A 96 -6.952 3.098 -7.162 1.00 0.00 H new ATOM 0 HA VAL A 96 -6.309 0.666 -5.981 1.00 0.00 H new ATOM 0 HB VAL A 96 -4.953 1.810 -8.445 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -5.033 -0.532 -9.207 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -4.143 -0.366 -7.675 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -5.806 -0.999 -7.674 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -6.879 1.011 -9.754 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -7.731 0.606 -8.245 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -7.340 2.301 -8.619 1.00 0.00 H new ATOM 1581 N VAL A 97 -3.973 0.678 -5.113 1.00 0.00 N ATOM 1582 CA VAL A 97 -2.661 0.725 -4.480 1.00 0.00 C ATOM 1583 C VAL A 97 -1.857 -0.535 -4.784 1.00 0.00 C ATOM 1584 O VAL A 97 -2.418 -1.562 -5.166 1.00 0.00 O ATOM 1585 CB VAL A 97 -2.782 0.882 -2.952 1.00 0.00 C ATOM 1586 CG1 VAL A 97 -1.422 1.162 -2.336 1.00 0.00 C ATOM 1587 CG2 VAL A 97 -3.769 1.984 -2.601 1.00 0.00 C ATOM 0 H VAL A 97 -4.514 -0.160 -4.899 1.00 0.00 H new ATOM 0 HA VAL A 97 -2.143 1.592 -4.890 1.00 0.00 H new ATOM 0 HB VAL A 97 -3.159 -0.054 -2.540 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -1.527 1.270 -1.256 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -0.747 0.335 -2.554 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -1.015 2.082 -2.755 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -3.839 2.078 -1.517 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -3.427 2.928 -3.026 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -4.750 1.737 -3.008 1.00 0.00 H new ATOM 1597 N LYS A 98 -0.541 -0.450 -4.611 1.00 0.00 N ATOM 1598 CA LYS A 98 0.339 -1.587 -4.865 1.00 0.00 C ATOM 1599 C LYS A 98 1.289 -1.811 -3.688 1.00 0.00 C ATOM 1600 O LYS A 98 1.515 -0.908 -2.885 1.00 0.00 O ATOM 1601 CB LYS A 98 1.139 -1.363 -6.151 1.00 0.00 C ATOM 1602 CG LYS A 98 0.861 -2.401 -7.227 1.00 0.00 C ATOM 1603 CD LYS A 98 0.316 -1.763 -8.495 1.00 0.00 C ATOM 1604 CE LYS A 98 -1.196 -1.896 -8.579 1.00 0.00 C ATOM 1605 NZ LYS A 98 -1.748 -1.203 -9.776 1.00 0.00 N ATOM 0 H LYS A 98 -0.061 0.393 -4.296 1.00 0.00 H new ATOM 0 HA LYS A 98 -0.279 -2.477 -4.984 1.00 0.00 H new ATOM 0 HB2 LYS A 98 0.909 -0.373 -6.545 1.00 0.00 H new ATOM 0 HB3 LYS A 98 2.203 -1.373 -5.914 1.00 0.00 H new ATOM 0 HG2 LYS A 98 1.779 -2.942 -7.457 1.00 0.00 H new ATOM 0 HG3 LYS A 98 0.146 -3.133 -6.851 1.00 0.00 H new ATOM 0 HD2 LYS A 98 0.592 -0.709 -8.521 1.00 0.00 H new ATOM 0 HD3 LYS A 98 0.773 -2.233 -9.366 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -1.466 -2.951 -8.613 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -1.648 -1.480 -7.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -2.782 -1.317 -9.797 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -1.512 -0.191 -9.731 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -1.336 -1.616 -10.637 1.00 0.00 H new ATOM 1619 N PRO A 99 1.864 -3.021 -3.571 1.00 0.00 N ATOM 1620 CA PRO A 99 2.795 -3.345 -2.485 1.00 0.00 C ATOM 1621 C PRO A 99 3.965 -2.373 -2.434 1.00 0.00 C ATOM 1622 O PRO A 99 4.771 -2.303 -3.362 1.00 0.00 O ATOM 1623 CB PRO A 99 3.281 -4.755 -2.829 1.00 0.00 C ATOM 1624 CG PRO A 99 2.225 -5.321 -3.716 1.00 0.00 C ATOM 1625 CD PRO A 99 1.658 -4.159 -4.483 1.00 0.00 C ATOM 0 HA PRO A 99 2.320 -3.280 -1.506 1.00 0.00 H new ATOM 0 HB2 PRO A 99 4.247 -4.728 -3.333 1.00 0.00 H new ATOM 0 HB3 PRO A 99 3.407 -5.359 -1.931 1.00 0.00 H new ATOM 0 HG2 PRO A 99 2.643 -6.067 -4.392 1.00 0.00 H new ATOM 0 HG3 PRO A 99 1.450 -5.818 -3.132 1.00 0.00 H new ATOM 0 HD2 PRO A 99 2.174 -4.013 -5.432 1.00 0.00 H new ATOM 0 HD3 PRO A 99 0.603 -4.305 -4.713 1.00 0.00 H new ATOM 1633 N GLY A 100 4.046 -1.615 -1.347 1.00 0.00 N ATOM 1634 CA GLY A 100 5.114 -0.646 -1.197 1.00 0.00 C ATOM 1635 C GLY A 100 4.645 0.766 -1.493 1.00 0.00 C ATOM 1636 O GLY A 100 5.426 1.609 -1.933 1.00 0.00 O ATOM 0 H GLY A 100 3.390 -1.654 -0.567 1.00 0.00 H new ATOM 0 HA2 GLY A 100 5.506 -0.692 -0.181 1.00 0.00 H new ATOM 0 HA3 GLY A 100 5.934 -0.904 -1.867 1.00 0.00 H new ATOM 1640 N ARG A 101 3.359 1.019 -1.258 1.00 0.00 N ATOM 1641 CA ARG A 101 2.777 2.334 -1.511 1.00 0.00 C ATOM 1642 C ARG A 101 2.435 3.048 -0.208 1.00 0.00 C ATOM 1643 O ARG A 101 1.664 2.539 0.604 1.00 0.00 O ATOM 1644 CB ARG A 101 1.513 2.193 -2.357 1.00 0.00 C ATOM 1645 CG ARG A 101 1.331 3.298 -3.382 1.00 0.00 C ATOM 1646 CD ARG A 101 1.952 2.925 -4.716 1.00 0.00 C ATOM 1647 NE ARG A 101 1.190 3.456 -5.843 1.00 0.00 N ATOM 1648 CZ ARG A 101 1.302 3.008 -7.091 1.00 0.00 C ATOM 1649 NH1 ARG A 101 2.146 2.024 -7.377 1.00 0.00 N ATOM 1650 NH2 ARG A 101 0.569 3.546 -8.057 1.00 0.00 N ATOM 0 H ARG A 101 2.701 0.330 -0.893 1.00 0.00 H new ATOM 0 HA ARG A 101 3.517 2.928 -2.048 1.00 0.00 H new ATOM 0 HB2 ARG A 101 1.538 1.233 -2.873 1.00 0.00 H new ATOM 0 HB3 ARG A 101 0.646 2.177 -1.697 1.00 0.00 H new ATOM 0 HG2 ARG A 101 0.268 3.499 -3.517 1.00 0.00 H new ATOM 0 HG3 ARG A 101 1.785 4.217 -3.012 1.00 0.00 H new ATOM 0 HD2 ARG A 101 2.973 3.304 -4.759 1.00 0.00 H new ATOM 0 HD3 ARG A 101 2.011 1.840 -4.798 1.00 0.00 H new ATOM 0 HE ARG A 101 0.533 4.215 -5.663 1.00 0.00 H new ATOM 0 HH11 ARG A 101 2.713 1.607 -6.638 1.00 0.00 H new ATOM 0 HH12 ARG A 101 2.228 1.685 -8.335 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -0.080 4.303 -7.843 1.00 0.00 H new ATOM 0 HH22 ARG A 101 0.655 3.203 -9.014 1.00 0.00 H new ATOM 1664 N VAL A 102 3.001 4.236 -0.021 1.00 0.00 N ATOM 1665 CA VAL A 102 2.742 5.024 1.178 1.00 0.00 C ATOM 1666 C VAL A 102 1.424 5.781 1.053 1.00 0.00 C ATOM 1667 O VAL A 102 1.339 6.788 0.351 1.00 0.00 O ATOM 1668 CB VAL A 102 3.876 6.031 1.448 1.00 0.00 C ATOM 1669 CG1 VAL A 102 3.679 6.709 2.796 1.00 0.00 C ATOM 1670 CG2 VAL A 102 5.231 5.341 1.382 1.00 0.00 C ATOM 0 H VAL A 102 3.641 4.673 -0.684 1.00 0.00 H new ATOM 0 HA VAL A 102 2.685 4.326 2.013 1.00 0.00 H new ATOM 0 HB VAL A 102 3.847 6.798 0.674 1.00 0.00 H new ATOM 0 HG11 VAL A 102 4.490 7.417 2.969 1.00 0.00 H new ATOM 0 HG12 VAL A 102 2.727 7.240 2.801 1.00 0.00 H new ATOM 0 HG13 VAL A 102 3.679 5.957 3.585 1.00 0.00 H new ATOM 0 HG21 VAL A 102 6.019 6.068 1.575 1.00 0.00 H new ATOM 0 HG22 VAL A 102 5.274 4.551 2.132 1.00 0.00 H new ATOM 0 HG23 VAL A 102 5.371 4.909 0.391 1.00 0.00 H new ATOM 1680 N MET A 103 0.395 5.285 1.733 1.00 0.00 N ATOM 1681 CA MET A 103 -0.922 5.909 1.691 1.00 0.00 C ATOM 1682 C MET A 103 -1.073 6.969 2.780 1.00 0.00 C ATOM 1683 O MET A 103 -1.923 7.853 2.682 1.00 0.00 O ATOM 1684 CB MET A 103 -2.013 4.848 1.842 1.00 0.00 C ATOM 1685 CG MET A 103 -1.825 3.647 0.929 1.00 0.00 C ATOM 1686 SD MET A 103 -2.796 2.220 1.449 1.00 0.00 S ATOM 1687 CE MET A 103 -1.914 1.728 2.928 1.00 0.00 C ATOM 0 H MET A 103 0.448 4.452 2.320 1.00 0.00 H new ATOM 0 HA MET A 103 -1.027 6.401 0.724 1.00 0.00 H new ATOM 0 HB2 MET A 103 -2.036 4.507 2.877 1.00 0.00 H new ATOM 0 HB3 MET A 103 -2.982 5.303 1.635 1.00 0.00 H new ATOM 0 HG2 MET A 103 -2.106 3.921 -0.088 1.00 0.00 H new ATOM 0 HG3 MET A 103 -0.770 3.375 0.906 1.00 0.00 H new ATOM 0 HE1 MET A 103 -1.932 0.642 3.018 1.00 0.00 H new ATOM 0 HE2 MET A 103 -0.881 2.070 2.866 1.00 0.00 H new ATOM 0 HE3 MET A 103 -2.392 2.172 3.801 1.00 0.00 H new ATOM 1697 N PHE A 104 -0.250 6.875 3.821 1.00 0.00 N ATOM 1698 CA PHE A 104 -0.306 7.828 4.923 1.00 0.00 C ATOM 1699 C PHE A 104 1.091 8.171 5.430 1.00 0.00 C ATOM 1700 O PHE A 104 2.054 7.455 5.160 1.00 0.00 O ATOM 1701 CB PHE A 104 -1.144 7.261 6.069 1.00 0.00 C ATOM 1702 CG PHE A 104 -2.609 7.160 5.756 1.00 0.00 C ATOM 1703 CD1 PHE A 104 -3.095 6.124 4.974 1.00 0.00 C ATOM 1704 CD2 PHE A 104 -3.501 8.099 6.246 1.00 0.00 C ATOM 1705 CE1 PHE A 104 -4.443 6.026 4.687 1.00 0.00 C ATOM 1706 CE2 PHE A 104 -4.850 8.008 5.964 1.00 0.00 C ATOM 1707 CZ PHE A 104 -5.322 6.970 5.183 1.00 0.00 C ATOM 0 H PHE A 104 0.461 6.151 3.924 1.00 0.00 H new ATOM 0 HA PHE A 104 -0.770 8.741 4.550 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -0.768 6.271 6.326 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -1.013 7.891 6.949 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -2.412 5.384 4.584 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -3.137 8.913 6.856 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -4.809 5.214 4.077 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -5.535 8.747 6.353 1.00 0.00 H new ATOM 0 HZ PHE A 104 -6.376 6.897 4.961 1.00 0.00 H new ATOM 1717 N GLU A 105 1.188 9.269 6.173 1.00 0.00 N ATOM 1718 CA GLU A 105 2.461 9.712 6.731 1.00 0.00 C ATOM 1719 C GLU A 105 2.239 10.805 7.772 1.00 0.00 C ATOM 1720 O GLU A 105 1.680 11.859 7.469 1.00 0.00 O ATOM 1721 CB GLU A 105 3.390 10.218 5.624 1.00 0.00 C ATOM 1722 CG GLU A 105 2.676 11.012 4.542 1.00 0.00 C ATOM 1723 CD GLU A 105 2.663 10.297 3.204 1.00 0.00 C ATOM 1724 OE1 GLU A 105 2.362 9.086 3.181 1.00 0.00 O ATOM 1725 OE2 GLU A 105 2.953 10.950 2.179 1.00 0.00 O ATOM 0 H GLU A 105 0.397 9.870 6.403 1.00 0.00 H new ATOM 0 HA GLU A 105 2.934 8.858 7.217 1.00 0.00 H new ATOM 0 HB2 GLU A 105 4.164 10.843 6.069 1.00 0.00 H new ATOM 0 HB3 GLU A 105 3.892 9.366 5.166 1.00 0.00 H new ATOM 0 HG2 GLU A 105 1.650 11.205 4.856 1.00 0.00 H new ATOM 0 HG3 GLU A 105 3.162 11.981 4.427 1.00 0.00 H new ATOM 1732 N VAL A 106 2.673 10.543 9.001 1.00 0.00 N ATOM 1733 CA VAL A 106 2.511 11.501 10.089 1.00 0.00 C ATOM 1734 C VAL A 106 3.839 12.148 10.467 1.00 0.00 C ATOM 1735 O VAL A 106 4.905 11.699 10.045 1.00 0.00 O ATOM 1736 CB VAL A 106 1.907 10.836 11.340 1.00 0.00 C ATOM 1737 CG1 VAL A 106 0.509 10.318 11.046 1.00 0.00 C ATOM 1738 CG2 VAL A 106 2.805 9.713 11.841 1.00 0.00 C ATOM 0 H VAL A 106 3.139 9.676 9.268 1.00 0.00 H new ATOM 0 HA VAL A 106 1.829 12.269 9.725 1.00 0.00 H new ATOM 0 HB VAL A 106 1.835 11.587 12.126 1.00 0.00 H new ATOM 0 HG11 VAL A 106 0.098 9.851 11.941 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -0.130 11.147 10.743 1.00 0.00 H new ATOM 0 HG13 VAL A 106 0.555 9.583 10.242 1.00 0.00 H new ATOM 0 HG21 VAL A 106 2.359 9.257 12.725 1.00 0.00 H new ATOM 0 HG22 VAL A 106 2.915 8.960 11.061 1.00 0.00 H new ATOM 0 HG23 VAL A 106 3.785 10.117 12.096 1.00 0.00 H new ATOM 1748 N ALA A 107 3.764 13.205 11.271 1.00 0.00 N ATOM 1749 CA ALA A 107 4.956 13.916 11.714 1.00 0.00 C ATOM 1750 C ALA A 107 4.679 14.715 12.983 1.00 0.00 C ATOM 1751 O ALA A 107 3.609 15.305 13.136 1.00 0.00 O ATOM 1752 CB ALA A 107 5.465 14.833 10.612 1.00 0.00 C ATOM 0 H ALA A 107 2.888 13.587 11.629 1.00 0.00 H new ATOM 0 HA ALA A 107 5.725 13.178 11.941 1.00 0.00 H new ATOM 0 HB1 ALA A 107 6.356 15.357 10.958 1.00 0.00 H new ATOM 0 HB2 ALA A 107 5.712 14.241 9.731 1.00 0.00 H new ATOM 0 HB3 ALA A 107 4.693 15.559 10.357 1.00 0.00 H new ATOM 1758 N GLY A 108 5.650 14.732 13.890 1.00 0.00 N ATOM 1759 CA GLY A 108 5.492 15.463 15.132 1.00 0.00 C ATOM 1760 C GLY A 108 5.110 14.567 16.295 1.00 0.00 C ATOM 1761 O GLY A 108 5.551 14.783 17.423 1.00 0.00 O ATOM 0 H GLY A 108 6.544 14.252 13.786 1.00 0.00 H new ATOM 0 HA2 GLY A 108 6.424 15.978 15.366 1.00 0.00 H new ATOM 0 HA3 GLY A 108 4.728 16.229 15.003 1.00 0.00 H new ATOM 1765 N VAL A 109 4.284 13.562 16.021 1.00 0.00 N ATOM 1766 CA VAL A 109 3.842 12.635 17.057 1.00 0.00 C ATOM 1767 C VAL A 109 4.947 11.650 17.426 1.00 0.00 C ATOM 1768 O VAL A 109 5.891 11.446 16.663 1.00 0.00 O ATOM 1769 CB VAL A 109 2.593 11.849 16.615 1.00 0.00 C ATOM 1770 CG1 VAL A 109 1.415 12.791 16.409 1.00 0.00 C ATOM 1771 CG2 VAL A 109 2.879 11.050 15.351 1.00 0.00 C ATOM 0 H VAL A 109 3.908 13.369 15.093 1.00 0.00 H new ATOM 0 HA VAL A 109 3.592 13.237 17.931 1.00 0.00 H new ATOM 0 HB VAL A 109 2.331 11.145 17.405 1.00 0.00 H new ATOM 0 HG11 VAL A 109 0.542 12.218 16.097 1.00 0.00 H new ATOM 0 HG12 VAL A 109 1.195 13.308 17.343 1.00 0.00 H new ATOM 0 HG13 VAL A 109 1.664 13.522 15.639 1.00 0.00 H new ATOM 0 HG21 VAL A 109 1.984 10.502 15.056 1.00 0.00 H new ATOM 0 HG22 VAL A 109 3.169 11.729 14.549 1.00 0.00 H new ATOM 0 HG23 VAL A 109 3.689 10.346 15.541 1.00 0.00 H new ATOM 1781 N THR A 110 4.821 11.043 18.602 1.00 0.00 N ATOM 1782 CA THR A 110 5.808 10.080 19.075 1.00 0.00 C ATOM 1783 C THR A 110 5.742 8.788 18.267 1.00 0.00 C ATOM 1784 O THR A 110 4.773 8.542 17.550 1.00 0.00 O ATOM 1785 CB THR A 110 5.586 9.778 20.558 1.00 0.00 C ATOM 1786 OG1 THR A 110 4.334 9.147 20.760 1.00 0.00 O ATOM 1787 CG2 THR A 110 5.623 11.014 21.432 1.00 0.00 C ATOM 0 H THR A 110 4.045 11.201 19.245 1.00 0.00 H new ATOM 0 HA THR A 110 6.797 10.519 18.943 1.00 0.00 H new ATOM 0 HB THR A 110 6.409 9.123 20.846 1.00 0.00 H new ATOM 0 HG1 THR A 110 3.917 9.501 21.573 1.00 0.00 H new ATOM 0 HG21 THR A 110 5.459 10.730 22.471 1.00 0.00 H new ATOM 0 HG22 THR A 110 6.595 11.498 21.337 1.00 0.00 H new ATOM 0 HG23 THR A 110 4.842 11.706 21.117 1.00 0.00 H new ATOM 1795 N GLU A 111 6.780 7.968 18.388 1.00 0.00 N ATOM 1796 CA GLU A 111 6.843 6.700 17.669 1.00 0.00 C ATOM 1797 C GLU A 111 5.670 5.799 18.044 1.00 0.00 C ATOM 1798 O GLU A 111 5.066 5.158 17.184 1.00 0.00 O ATOM 1799 CB GLU A 111 8.165 5.989 17.967 1.00 0.00 C ATOM 1800 CG GLU A 111 8.289 4.624 17.309 1.00 0.00 C ATOM 1801 CD GLU A 111 9.497 3.848 17.798 1.00 0.00 C ATOM 1802 OE1 GLU A 111 10.406 4.471 18.384 1.00 0.00 O ATOM 1803 OE2 GLU A 111 9.532 2.616 17.596 1.00 0.00 O ATOM 0 H GLU A 111 7.590 8.158 18.978 1.00 0.00 H new ATOM 0 HA GLU A 111 6.784 6.913 16.602 1.00 0.00 H new ATOM 0 HB2 GLU A 111 8.989 6.619 17.633 1.00 0.00 H new ATOM 0 HB3 GLU A 111 8.269 5.873 19.046 1.00 0.00 H new ATOM 0 HG2 GLU A 111 7.386 4.046 17.507 1.00 0.00 H new ATOM 0 HG3 GLU A 111 8.356 4.750 16.228 1.00 0.00 H new ATOM 1810 N GLU A 112 5.355 5.752 19.334 1.00 0.00 N ATOM 1811 CA GLU A 112 4.258 4.925 19.824 1.00 0.00 C ATOM 1812 C GLU A 112 2.916 5.415 19.286 1.00 0.00 C ATOM 1813 O GLU A 112 2.075 4.618 18.872 1.00 0.00 O ATOM 1814 CB GLU A 112 4.241 4.922 21.355 1.00 0.00 C ATOM 1815 CG GLU A 112 4.360 3.533 21.961 1.00 0.00 C ATOM 1816 CD GLU A 112 5.698 2.883 21.667 1.00 0.00 C ATOM 1817 OE1 GLU A 112 6.211 3.060 20.542 1.00 0.00 O ATOM 1818 OE2 GLU A 112 6.233 2.195 22.562 1.00 0.00 O ATOM 0 H GLU A 112 5.844 6.277 20.059 1.00 0.00 H new ATOM 0 HA GLU A 112 4.417 3.908 19.466 1.00 0.00 H new ATOM 0 HB2 GLU A 112 5.061 5.540 21.721 1.00 0.00 H new ATOM 0 HB3 GLU A 112 3.316 5.382 21.701 1.00 0.00 H new ATOM 0 HG2 GLU A 112 4.221 3.598 23.040 1.00 0.00 H new ATOM 0 HG3 GLU A 112 3.560 2.902 21.574 1.00 0.00 H new ATOM 1825 N GLN A 113 2.721 6.729 19.298 1.00 0.00 N ATOM 1826 CA GLN A 113 1.479 7.322 18.814 1.00 0.00 C ATOM 1827 C GLN A 113 1.420 7.300 17.291 1.00 0.00 C ATOM 1828 O GLN A 113 0.360 7.084 16.703 1.00 0.00 O ATOM 1829 CB GLN A 113 1.345 8.759 19.320 1.00 0.00 C ATOM 1830 CG GLN A 113 1.326 8.871 20.836 1.00 0.00 C ATOM 1831 CD GLN A 113 0.026 8.381 21.441 1.00 0.00 C ATOM 1832 OE1 GLN A 113 -0.895 9.162 21.680 1.00 0.00 O ATOM 1833 NE2 GLN A 113 -0.056 7.079 21.692 1.00 0.00 N ATOM 0 H GLN A 113 3.406 7.404 19.637 1.00 0.00 H new ATOM 0 HA GLN A 113 0.650 6.729 19.199 1.00 0.00 H new ATOM 0 HB2 GLN A 113 2.173 9.351 18.931 1.00 0.00 H new ATOM 0 HB3 GLN A 113 0.428 9.192 18.920 1.00 0.00 H new ATOM 0 HG2 GLN A 113 2.154 8.296 21.249 1.00 0.00 H new ATOM 0 HG3 GLN A 113 1.486 9.911 21.122 1.00 0.00 H new ATOM 0 HE21 GLN A 113 0.732 6.468 21.478 1.00 0.00 H new ATOM 0 HE22 GLN A 113 -0.907 6.691 22.099 1.00 0.00 H new ATOM 1842 N ALA A 114 2.564 7.531 16.659 1.00 0.00 N ATOM 1843 CA ALA A 114 2.647 7.545 15.204 1.00 0.00 C ATOM 1844 C ALA A 114 2.507 6.141 14.624 1.00 0.00 C ATOM 1845 O ALA A 114 1.737 5.920 13.690 1.00 0.00 O ATOM 1846 CB ALA A 114 3.961 8.168 14.765 1.00 0.00 C ATOM 0 H ALA A 114 3.449 7.712 17.133 1.00 0.00 H new ATOM 0 HA ALA A 114 1.820 8.145 14.824 1.00 0.00 H new ATOM 0 HB1 ALA A 114 4.015 8.174 13.676 1.00 0.00 H new ATOM 0 HB2 ALA A 114 4.021 9.191 15.137 1.00 0.00 H new ATOM 0 HB3 ALA A 114 4.791 7.587 15.166 1.00 0.00 H new ATOM 1852 N MET A 115 3.255 5.196 15.183 1.00 0.00 N ATOM 1853 CA MET A 115 3.212 3.815 14.717 1.00 0.00 C ATOM 1854 C MET A 115 1.816 3.228 14.894 1.00 0.00 C ATOM 1855 O MET A 115 1.297 2.554 14.004 1.00 0.00 O ATOM 1856 CB MET A 115 4.235 2.967 15.474 1.00 0.00 C ATOM 1857 CG MET A 115 5.677 3.291 15.115 1.00 0.00 C ATOM 1858 SD MET A 115 6.505 1.938 14.257 1.00 0.00 S ATOM 1859 CE MET A 115 7.738 2.836 13.319 1.00 0.00 C ATOM 0 H MET A 115 3.897 5.361 15.958 1.00 0.00 H new ATOM 0 HA MET A 115 3.460 3.806 13.656 1.00 0.00 H new ATOM 0 HB2 MET A 115 4.094 3.112 16.545 1.00 0.00 H new ATOM 0 HB3 MET A 115 4.046 1.914 15.268 1.00 0.00 H new ATOM 0 HG2 MET A 115 5.699 4.181 14.486 1.00 0.00 H new ATOM 0 HG3 MET A 115 6.228 3.530 16.025 1.00 0.00 H new ATOM 0 HE1 MET A 115 8.333 2.134 12.734 1.00 0.00 H new ATOM 0 HE2 MET A 115 7.244 3.540 12.649 1.00 0.00 H new ATOM 0 HE3 MET A 115 8.389 3.382 14.002 1.00 0.00 H new ATOM 1869 N GLU A 116 1.212 3.491 16.048 1.00 0.00 N ATOM 1870 CA GLU A 116 -0.125 2.991 16.338 1.00 0.00 C ATOM 1871 C GLU A 116 -1.157 3.651 15.430 1.00 0.00 C ATOM 1872 O GLU A 116 -1.988 2.974 14.826 1.00 0.00 O ATOM 1873 CB GLU A 116 -0.482 3.245 17.803 1.00 0.00 C ATOM 1874 CG GLU A 116 -1.469 2.239 18.373 1.00 0.00 C ATOM 1875 CD GLU A 116 -1.166 1.877 19.813 1.00 0.00 C ATOM 1876 OE1 GLU A 116 -1.215 2.779 20.676 1.00 0.00 O ATOM 1877 OE2 GLU A 116 -0.880 0.690 20.079 1.00 0.00 O ATOM 0 H GLU A 116 1.627 4.047 16.796 1.00 0.00 H new ATOM 0 HA GLU A 116 -0.134 1.917 16.152 1.00 0.00 H new ATOM 0 HB2 GLU A 116 0.430 3.224 18.399 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -0.902 4.247 17.897 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -2.477 2.649 18.310 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -1.453 1.335 17.764 1.00 0.00 H new ATOM 1884 N ALA A 117 -1.095 4.976 15.336 1.00 0.00 N ATOM 1885 CA ALA A 117 -2.025 5.726 14.499 1.00 0.00 C ATOM 1886 C ALA A 117 -1.976 5.241 13.055 1.00 0.00 C ATOM 1887 O ALA A 117 -3.011 4.971 12.445 1.00 0.00 O ATOM 1888 CB ALA A 117 -1.713 7.213 14.568 1.00 0.00 C ATOM 0 H ALA A 117 -0.412 5.551 15.828 1.00 0.00 H new ATOM 0 HA ALA A 117 -3.033 5.558 14.877 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -2.414 7.761 13.939 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -1.805 7.557 15.598 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -0.696 7.388 14.216 1.00 0.00 H new ATOM 1894 N LEU A 118 -0.768 5.123 12.515 1.00 0.00 N ATOM 1895 CA LEU A 118 -0.590 4.661 11.144 1.00 0.00 C ATOM 1896 C LEU A 118 -1.165 3.259 10.975 1.00 0.00 C ATOM 1897 O LEU A 118 -1.650 2.900 9.902 1.00 0.00 O ATOM 1898 CB LEU A 118 0.896 4.667 10.770 1.00 0.00 C ATOM 1899 CG LEU A 118 1.409 5.935 10.074 1.00 0.00 C ATOM 1900 CD1 LEU A 118 0.581 7.153 10.458 1.00 0.00 C ATOM 1901 CD2 LEU A 118 2.874 6.163 10.412 1.00 0.00 C ATOM 0 H LEU A 118 0.100 5.340 13.004 1.00 0.00 H new ATOM 0 HA LEU A 118 -1.124 5.340 10.479 1.00 0.00 H new ATOM 0 HB2 LEU A 118 1.479 4.513 11.678 1.00 0.00 H new ATOM 0 HB3 LEU A 118 1.090 3.815 10.118 1.00 0.00 H new ATOM 0 HG LEU A 118 1.310 5.791 8.998 1.00 0.00 H new ATOM 0 HD11 LEU A 118 0.971 8.034 9.948 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -0.457 6.994 10.166 1.00 0.00 H new ATOM 0 HD13 LEU A 118 0.635 7.305 11.536 1.00 0.00 H new ATOM 0 HD21 LEU A 118 3.226 7.065 9.912 1.00 0.00 H new ATOM 0 HD22 LEU A 118 2.985 6.278 11.490 1.00 0.00 H new ATOM 0 HD23 LEU A 118 3.462 5.309 10.076 1.00 0.00 H new ATOM 1913 N ARG A 119 -1.111 2.474 12.046 1.00 0.00 N ATOM 1914 CA ARG A 119 -1.628 1.112 12.024 1.00 0.00 C ATOM 1915 C ARG A 119 -3.154 1.113 12.053 1.00 0.00 C ATOM 1916 O ARG A 119 -3.797 0.301 11.389 1.00 0.00 O ATOM 1917 CB ARG A 119 -1.076 0.315 13.208 1.00 0.00 C ATOM 1918 CG ARG A 119 -0.418 -0.995 12.804 1.00 0.00 C ATOM 1919 CD ARG A 119 0.813 -1.285 13.647 1.00 0.00 C ATOM 1920 NE ARG A 119 1.438 -2.555 13.286 1.00 0.00 N ATOM 1921 CZ ARG A 119 2.528 -3.040 13.875 1.00 0.00 C ATOM 1922 NH1 ARG A 119 3.117 -2.365 14.855 1.00 0.00 N ATOM 1923 NH2 ARG A 119 3.032 -4.203 13.485 1.00 0.00 N ATOM 0 H ARG A 119 -0.714 2.759 12.941 1.00 0.00 H new ATOM 0 HA ARG A 119 -1.302 0.637 11.099 1.00 0.00 H new ATOM 0 HB2 ARG A 119 -0.349 0.928 13.741 1.00 0.00 H new ATOM 0 HB3 ARG A 119 -1.888 0.105 13.904 1.00 0.00 H new ATOM 0 HG2 ARG A 119 -1.133 -1.810 12.911 1.00 0.00 H new ATOM 0 HG3 ARG A 119 -0.138 -0.953 11.752 1.00 0.00 H new ATOM 0 HD2 ARG A 119 1.535 -0.478 13.524 1.00 0.00 H new ATOM 0 HD3 ARG A 119 0.534 -1.305 14.701 1.00 0.00 H new ATOM 0 HE ARG A 119 1.013 -3.103 12.538 1.00 0.00 H new ATOM 0 HH11 ARG A 119 2.734 -1.470 15.160 1.00 0.00 H new ATOM 0 HH12 ARG A 119 3.952 -2.741 15.303 1.00 0.00 H new ATOM 0 HH21 ARG A 119 2.584 -4.726 12.733 1.00 0.00 H new ATOM 0 HH22 ARG A 119 3.868 -4.574 13.937 1.00 0.00 H new ATOM 1937 N ILE A 120 -3.730 2.036 12.822 1.00 0.00 N ATOM 1938 CA ILE A 120 -5.182 2.144 12.927 1.00 0.00 C ATOM 1939 C ILE A 120 -5.809 2.313 11.547 1.00 0.00 C ATOM 1940 O ILE A 120 -6.878 1.771 11.268 1.00 0.00 O ATOM 1941 CB ILE A 120 -5.597 3.330 13.827 1.00 0.00 C ATOM 1942 CG1 ILE A 120 -5.104 3.108 15.258 1.00 0.00 C ATOM 1943 CG2 ILE A 120 -7.109 3.521 13.812 1.00 0.00 C ATOM 1944 CD1 ILE A 120 -5.018 4.380 16.071 1.00 0.00 C ATOM 0 H ILE A 120 -3.214 2.717 13.379 1.00 0.00 H new ATOM 0 HA ILE A 120 -5.544 1.221 13.380 1.00 0.00 H new ATOM 0 HB ILE A 120 -5.136 4.235 13.432 1.00 0.00 H new ATOM 0 HG12 ILE A 120 -5.774 2.410 15.760 1.00 0.00 H new ATOM 0 HG13 ILE A 120 -4.120 2.639 15.226 1.00 0.00 H new ATOM 0 HG21 ILE A 120 -7.376 4.361 14.453 1.00 0.00 H new ATOM 0 HG22 ILE A 120 -7.440 3.722 12.793 1.00 0.00 H new ATOM 0 HG23 ILE A 120 -7.594 2.616 14.179 1.00 0.00 H new ATOM 0 HD11 ILE A 120 -4.662 4.147 17.074 1.00 0.00 H new ATOM 0 HD12 ILE A 120 -4.326 5.072 15.592 1.00 0.00 H new ATOM 0 HD13 ILE A 120 -6.005 4.839 16.134 1.00 0.00 H new ATOM 1956 N ALA A 121 -5.130 3.064 10.686 1.00 0.00 N ATOM 1957 CA ALA A 121 -5.614 3.298 9.333 1.00 0.00 C ATOM 1958 C ALA A 121 -5.585 2.011 8.519 1.00 0.00 C ATOM 1959 O ALA A 121 -6.549 1.677 7.831 1.00 0.00 O ATOM 1960 CB ALA A 121 -4.784 4.376 8.653 1.00 0.00 C ATOM 0 H ALA A 121 -4.244 3.520 10.902 1.00 0.00 H new ATOM 0 HA ALA A 121 -6.647 3.640 9.393 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -5.158 4.540 7.642 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -4.856 5.303 9.221 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -3.742 4.059 8.607 1.00 0.00 H new ATOM 1966 N GLY A 122 -4.472 1.290 8.606 1.00 0.00 N ATOM 1967 CA GLY A 122 -4.336 0.043 7.877 1.00 0.00 C ATOM 1968 C GLY A 122 -5.170 -1.074 8.476 1.00 0.00 C ATOM 1969 O GLY A 122 -5.474 -2.058 7.803 1.00 0.00 O ATOM 0 H GLY A 122 -3.661 1.547 9.169 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -4.633 0.198 6.840 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -3.288 -0.256 7.867 1.00 0.00 H new ATOM 1973 N HIS A 123 -5.540 -0.923 9.744 1.00 0.00 N ATOM 1974 CA HIS A 123 -6.344 -1.928 10.430 1.00 0.00 C ATOM 1975 C HIS A 123 -7.677 -2.134 9.718 1.00 0.00 C ATOM 1976 O HIS A 123 -8.154 -3.261 9.588 1.00 0.00 O ATOM 1977 CB HIS A 123 -6.585 -1.515 11.883 1.00 0.00 C ATOM 1978 CG HIS A 123 -6.678 -2.674 12.826 1.00 0.00 C ATOM 1979 ND1 HIS A 123 -6.774 -3.983 12.403 1.00 0.00 N ATOM 1980 CD2 HIS A 123 -6.689 -2.716 14.180 1.00 0.00 C ATOM 1981 CE1 HIS A 123 -6.840 -4.780 13.455 1.00 0.00 C ATOM 1982 NE2 HIS A 123 -6.790 -4.036 14.545 1.00 0.00 N ATOM 0 H HIS A 123 -5.296 -0.115 10.317 1.00 0.00 H new ATOM 0 HA HIS A 123 -5.795 -2.870 10.415 1.00 0.00 H new ATOM 0 HB2 HIS A 123 -5.776 -0.859 12.205 1.00 0.00 H new ATOM 0 HB3 HIS A 123 -7.507 -0.936 11.940 1.00 0.00 H new ATOM 0 HD2 HIS A 123 -6.629 -1.869 14.848 1.00 0.00 H new ATOM 0 HE1 HIS A 123 -6.921 -5.857 13.428 1.00 0.00 H new ATOM 0 HE2 HIS A 123 -6.821 -4.385 15.503 1.00 0.00 H new ATOM 1991 N LYS A 124 -8.273 -1.038 9.258 1.00 0.00 N ATOM 1992 CA LYS A 124 -9.552 -1.102 8.558 1.00 0.00 C ATOM 1993 C LYS A 124 -9.354 -1.266 7.051 1.00 0.00 C ATOM 1994 O LYS A 124 -10.321 -1.269 6.289 1.00 0.00 O ATOM 1995 CB LYS A 124 -10.377 0.154 8.842 1.00 0.00 C ATOM 1996 CG LYS A 124 -9.617 1.450 8.606 1.00 0.00 C ATOM 1997 CD LYS A 124 -9.236 2.121 9.916 1.00 0.00 C ATOM 1998 CE LYS A 124 -10.377 2.963 10.463 1.00 0.00 C ATOM 1999 NZ LYS A 124 -10.005 3.647 11.732 1.00 0.00 N ATOM 0 H LYS A 124 -7.892 -0.097 9.357 1.00 0.00 H new ATOM 0 HA LYS A 124 -10.090 -1.975 8.927 1.00 0.00 H new ATOM 0 HB2 LYS A 124 -11.266 0.144 8.212 1.00 0.00 H new ATOM 0 HB3 LYS A 124 -10.719 0.127 9.876 1.00 0.00 H new ATOM 0 HG2 LYS A 124 -8.717 1.244 8.026 1.00 0.00 H new ATOM 0 HG3 LYS A 124 -10.230 2.129 8.013 1.00 0.00 H new ATOM 0 HD2 LYS A 124 -8.959 1.362 10.648 1.00 0.00 H new ATOM 0 HD3 LYS A 124 -8.359 2.750 9.762 1.00 0.00 H new ATOM 0 HE2 LYS A 124 -10.667 3.707 9.721 1.00 0.00 H new ATOM 0 HE3 LYS A 124 -11.246 2.328 10.634 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 -10.810 4.211 12.072 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 -9.753 2.936 12.448 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 -9.191 4.272 11.564 1.00 0.00 H new ATOM 2013 N LEU A 125 -8.100 -1.406 6.623 1.00 0.00 N ATOM 2014 CA LEU A 125 -7.793 -1.575 5.208 1.00 0.00 C ATOM 2015 C LEU A 125 -7.923 -3.040 4.800 1.00 0.00 C ATOM 2016 O LEU A 125 -7.823 -3.936 5.638 1.00 0.00 O ATOM 2017 CB LEU A 125 -6.377 -1.078 4.903 1.00 0.00 C ATOM 2018 CG LEU A 125 -6.220 0.441 4.822 1.00 0.00 C ATOM 2019 CD1 LEU A 125 -4.794 0.810 4.442 1.00 0.00 C ATOM 2020 CD2 LEU A 125 -7.203 1.028 3.822 1.00 0.00 C ATOM 0 H LEU A 125 -7.284 -1.405 7.235 1.00 0.00 H new ATOM 0 HA LEU A 125 -8.508 -0.985 4.635 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -5.704 -1.456 5.673 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -6.054 -1.511 3.956 1.00 0.00 H new ATOM 0 HG LEU A 125 -6.436 0.860 5.805 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -4.701 1.895 4.389 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -4.106 0.423 5.193 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -4.553 0.377 3.471 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -7.076 2.110 3.779 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -7.018 0.601 2.836 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -8.221 0.795 4.133 1.00 0.00 H new ATOM 2032 N PRO A 126 -8.147 -3.305 3.502 1.00 0.00 N ATOM 2033 CA PRO A 126 -8.288 -4.662 2.987 1.00 0.00 C ATOM 2034 C PRO A 126 -6.947 -5.290 2.614 1.00 0.00 C ATOM 2035 O PRO A 126 -6.898 -6.288 1.896 1.00 0.00 O ATOM 2036 CB PRO A 126 -9.146 -4.451 1.744 1.00 0.00 C ATOM 2037 CG PRO A 126 -8.758 -3.100 1.239 1.00 0.00 C ATOM 2038 CD PRO A 126 -8.282 -2.301 2.431 1.00 0.00 C ATOM 0 HA PRO A 126 -8.716 -5.345 3.721 1.00 0.00 H new ATOM 0 HB2 PRO A 126 -8.957 -5.222 0.997 1.00 0.00 H new ATOM 0 HB3 PRO A 126 -10.208 -4.494 1.984 1.00 0.00 H new ATOM 0 HG2 PRO A 126 -7.971 -3.180 0.490 1.00 0.00 H new ATOM 0 HG3 PRO A 126 -9.605 -2.610 0.760 1.00 0.00 H new ATOM 0 HD2 PRO A 126 -7.333 -1.806 2.226 1.00 0.00 H new ATOM 0 HD3 PRO A 126 -8.996 -1.523 2.701 1.00 0.00 H new ATOM 2046 N ILE A 127 -5.859 -4.700 3.105 1.00 0.00 N ATOM 2047 CA ILE A 127 -4.521 -5.203 2.821 1.00 0.00 C ATOM 2048 C ILE A 127 -3.577 -4.947 3.991 1.00 0.00 C ATOM 2049 O ILE A 127 -3.898 -4.187 4.904 1.00 0.00 O ATOM 2050 CB ILE A 127 -3.937 -4.560 1.549 1.00 0.00 C ATOM 2051 CG1 ILE A 127 -4.143 -3.043 1.571 1.00 0.00 C ATOM 2052 CG2 ILE A 127 -4.578 -5.166 0.310 1.00 0.00 C ATOM 2053 CD1 ILE A 127 -3.169 -2.313 2.469 1.00 0.00 C ATOM 0 H ILE A 127 -5.880 -3.873 3.701 1.00 0.00 H new ATOM 0 HA ILE A 127 -4.613 -6.278 2.664 1.00 0.00 H new ATOM 0 HB ILE A 127 -2.866 -4.760 1.520 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -4.048 -2.657 0.556 1.00 0.00 H new ATOM 0 HG13 ILE A 127 -5.160 -2.827 1.900 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -4.156 -4.702 -0.582 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -4.384 -6.238 0.288 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -5.654 -4.992 0.335 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -3.374 -1.243 2.435 1.00 0.00 H new ATOM 0 HD12 ILE A 127 -3.279 -2.671 3.493 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -2.151 -2.498 2.128 1.00 0.00 H new ATOM 2065 N LYS A 128 -2.415 -5.591 3.959 1.00 0.00 N ATOM 2066 CA LYS A 128 -1.426 -5.437 5.020 1.00 0.00 C ATOM 2067 C LYS A 128 -0.621 -4.153 4.845 1.00 0.00 C ATOM 2068 O LYS A 128 -0.240 -3.792 3.732 1.00 0.00 O ATOM 2069 CB LYS A 128 -0.483 -6.642 5.043 1.00 0.00 C ATOM 2070 CG LYS A 128 0.506 -6.619 6.197 1.00 0.00 C ATOM 2071 CD LYS A 128 -0.083 -7.250 7.448 1.00 0.00 C ATOM 2072 CE LYS A 128 0.845 -7.096 8.643 1.00 0.00 C ATOM 2073 NZ LYS A 128 0.132 -6.557 9.834 1.00 0.00 N ATOM 0 H LYS A 128 -2.135 -6.224 3.210 1.00 0.00 H new ATOM 0 HA LYS A 128 -1.960 -5.378 5.968 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -1.075 -7.555 5.101 1.00 0.00 H new ATOM 0 HB3 LYS A 128 0.068 -6.679 4.104 1.00 0.00 H new ATOM 0 HG2 LYS A 128 1.413 -7.153 5.911 1.00 0.00 H new ATOM 0 HG3 LYS A 128 0.795 -5.590 6.409 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -1.044 -6.788 7.671 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -0.272 -8.308 7.268 1.00 0.00 H new ATOM 0 HE2 LYS A 128 1.283 -8.063 8.889 1.00 0.00 H new ATOM 0 HE3 LYS A 128 1.668 -6.431 8.380 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 0.799 -6.467 10.627 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -0.265 -5.623 9.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -0.637 -7.204 10.101 1.00 0.00 H new ATOM 2087 N THR A 129 -0.364 -3.470 5.957 1.00 0.00 N ATOM 2088 CA THR A 129 0.400 -2.228 5.937 1.00 0.00 C ATOM 2089 C THR A 129 1.315 -2.141 7.156 1.00 0.00 C ATOM 2090 O THR A 129 0.975 -2.636 8.231 1.00 0.00 O ATOM 2091 CB THR A 129 -0.541 -1.021 5.907 1.00 0.00 C ATOM 2092 OG1 THR A 129 -1.086 -0.777 7.191 1.00 0.00 O ATOM 2093 CG2 THR A 129 -1.696 -1.180 4.941 1.00 0.00 C ATOM 0 H THR A 129 -0.675 -3.757 6.885 1.00 0.00 H new ATOM 0 HA THR A 129 1.013 -2.221 5.036 1.00 0.00 H new ATOM 0 HB THR A 129 0.076 -0.186 5.573 1.00 0.00 H new ATOM 0 HG1 THR A 129 -1.592 -1.563 7.486 1.00 0.00 H new ATOM 0 HG21 THR A 129 -2.322 -0.288 4.972 1.00 0.00 H new ATOM 0 HG22 THR A 129 -1.309 -1.317 3.931 1.00 0.00 H new ATOM 0 HG23 THR A 129 -2.290 -2.049 5.224 1.00 0.00 H new ATOM 2101 N LYS A 130 2.477 -1.516 6.986 1.00 0.00 N ATOM 2102 CA LYS A 130 3.432 -1.378 8.083 1.00 0.00 C ATOM 2103 C LYS A 130 3.901 0.067 8.232 1.00 0.00 C ATOM 2104 O LYS A 130 3.794 0.865 7.301 1.00 0.00 O ATOM 2105 CB LYS A 130 4.634 -2.296 7.857 1.00 0.00 C ATOM 2106 CG LYS A 130 5.310 -2.093 6.511 1.00 0.00 C ATOM 2107 CD LYS A 130 6.812 -2.308 6.604 1.00 0.00 C ATOM 2108 CE LYS A 130 7.525 -1.805 5.359 1.00 0.00 C ATOM 2109 NZ LYS A 130 9.005 -1.855 5.508 1.00 0.00 N ATOM 0 H LYS A 130 2.779 -1.099 6.105 1.00 0.00 H new ATOM 0 HA LYS A 130 2.926 -1.668 9.004 1.00 0.00 H new ATOM 0 HB2 LYS A 130 5.363 -2.128 8.649 1.00 0.00 H new ATOM 0 HB3 LYS A 130 4.309 -3.333 7.938 1.00 0.00 H new ATOM 0 HG2 LYS A 130 4.887 -2.784 5.782 1.00 0.00 H new ATOM 0 HG3 LYS A 130 5.107 -1.085 6.149 1.00 0.00 H new ATOM 0 HD2 LYS A 130 7.201 -1.791 7.481 1.00 0.00 H new ATOM 0 HD3 LYS A 130 7.021 -3.369 6.741 1.00 0.00 H new ATOM 0 HE2 LYS A 130 7.226 -2.407 4.501 1.00 0.00 H new ATOM 0 HE3 LYS A 130 7.215 -0.781 5.152 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 9.454 -1.504 4.638 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 9.293 -1.260 6.311 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 9.304 -2.836 5.680 1.00 0.00 H new ATOM 2123 N ILE A 131 4.426 0.394 9.411 1.00 0.00 N ATOM 2124 CA ILE A 131 4.918 1.742 9.684 1.00 0.00 C ATOM 2125 C ILE A 131 6.386 1.873 9.302 1.00 0.00 C ATOM 2126 O ILE A 131 7.191 0.986 9.586 1.00 0.00 O ATOM 2127 CB ILE A 131 4.779 2.126 11.173 1.00 0.00 C ATOM 2128 CG1 ILE A 131 3.531 1.489 11.793 1.00 0.00 C ATOM 2129 CG2 ILE A 131 4.749 3.642 11.330 1.00 0.00 C ATOM 2130 CD1 ILE A 131 2.239 1.908 11.130 1.00 0.00 C ATOM 0 H ILE A 131 4.521 -0.256 10.192 1.00 0.00 H new ATOM 0 HA ILE A 131 4.305 2.413 9.083 1.00 0.00 H new ATOM 0 HB ILE A 131 5.648 1.741 11.706 1.00 0.00 H new ATOM 0 HG12 ILE A 131 3.622 0.404 11.737 1.00 0.00 H new ATOM 0 HG13 ILE A 131 3.488 1.751 12.850 1.00 0.00 H new ATOM 0 HG21 ILE A 131 4.651 3.897 12.385 1.00 0.00 H new ATOM 0 HG22 ILE A 131 5.674 4.067 10.939 1.00 0.00 H new ATOM 0 HG23 ILE A 131 3.901 4.048 10.778 1.00 0.00 H new ATOM 0 HD11 ILE A 131 1.401 1.416 11.624 1.00 0.00 H new ATOM 0 HD12 ILE A 131 2.123 2.989 11.209 1.00 0.00 H new ATOM 0 HD13 ILE A 131 2.260 1.621 10.079 1.00 0.00 H new ATOM 2142 N VAL A 132 6.734 2.986 8.670 1.00 0.00 N ATOM 2143 CA VAL A 132 8.111 3.229 8.270 1.00 0.00 C ATOM 2144 C VAL A 132 8.441 4.717 8.322 1.00 0.00 C ATOM 2145 O VAL A 132 7.614 5.562 7.984 1.00 0.00 O ATOM 2146 CB VAL A 132 8.393 2.692 6.853 1.00 0.00 C ATOM 2147 CG1 VAL A 132 7.932 1.248 6.730 1.00 0.00 C ATOM 2148 CG2 VAL A 132 7.726 3.565 5.801 1.00 0.00 C ATOM 0 H VAL A 132 6.083 3.732 8.424 1.00 0.00 H new ATOM 0 HA VAL A 132 8.746 2.695 8.977 1.00 0.00 H new ATOM 0 HB VAL A 132 9.469 2.724 6.682 1.00 0.00 H new ATOM 0 HG11 VAL A 132 8.139 0.885 5.723 1.00 0.00 H new ATOM 0 HG12 VAL A 132 8.466 0.633 7.455 1.00 0.00 H new ATOM 0 HG13 VAL A 132 6.861 1.190 6.924 1.00 0.00 H new ATOM 0 HG21 VAL A 132 7.939 3.166 4.809 1.00 0.00 H new ATOM 0 HG22 VAL A 132 6.648 3.573 5.965 1.00 0.00 H new ATOM 0 HG23 VAL A 132 8.112 4.582 5.874 1.00 0.00 H new ATOM 2158 N ARG A 133 9.655 5.024 8.746 1.00 0.00 N ATOM 2159 CA ARG A 133 10.107 6.404 8.844 1.00 0.00 C ATOM 2160 C ARG A 133 10.472 6.957 7.477 1.00 0.00 C ATOM 2161 O ARG A 133 10.646 6.202 6.522 1.00 0.00 O ATOM 2162 CB ARG A 133 11.325 6.506 9.750 1.00 0.00 C ATOM 2163 CG ARG A 133 11.134 7.440 10.934 1.00 0.00 C ATOM 2164 CD ARG A 133 11.812 6.903 12.184 1.00 0.00 C ATOM 2165 NE ARG A 133 11.868 7.903 13.248 1.00 0.00 N ATOM 2166 CZ ARG A 133 12.631 8.993 13.201 1.00 0.00 C ATOM 2167 NH1 ARG A 133 13.405 9.225 12.148 1.00 0.00 N ATOM 2168 NH2 ARG A 133 12.622 9.852 14.211 1.00 0.00 N ATOM 0 H ARG A 133 10.350 4.333 9.030 1.00 0.00 H new ATOM 0 HA ARG A 133 9.285 6.986 9.262 1.00 0.00 H new ATOM 0 HB2 ARG A 133 11.575 5.512 10.120 1.00 0.00 H new ATOM 0 HB3 ARG A 133 12.176 6.850 9.162 1.00 0.00 H new ATOM 0 HG2 ARG A 133 11.540 8.422 10.693 1.00 0.00 H new ATOM 0 HG3 ARG A 133 10.069 7.573 11.125 1.00 0.00 H new ATOM 0 HD2 ARG A 133 11.273 6.025 12.540 1.00 0.00 H new ATOM 0 HD3 ARG A 133 12.823 6.579 11.937 1.00 0.00 H new ATOM 0 HE ARG A 133 11.289 7.757 14.075 1.00 0.00 H new ATOM 0 HH11 ARG A 133 13.417 8.566 11.369 1.00 0.00 H new ATOM 0 HH12 ARG A 133 13.987 10.062 12.118 1.00 0.00 H new ATOM 0 HH21 ARG A 133 12.031 9.678 15.024 1.00 0.00 H new ATOM 0 HH22 ARG A 133 13.206 10.687 14.175 1.00 0.00 H new