USER MOD reduce.3.24.130724 H: found=0, std=0, add=832, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 834 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 108 ASN : amide:sc= 0.274 K(o=0.56,f=-0.2) USER MOD Set 1.2: A 112 ASN : amide:sc= 0.288 K(o=0.56,f=0) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 HIS : no HD1:sc= -3.39! K(o=-3.4!,f=-5.3) USER MOD Single : A 37 GLN : amide:sc= 1.25 K(o=1.3,f=-0.52) USER MOD Single : A 40 TYR OH : rot 16:sc= 0.407 USER MOD Single : A 50 SER OG : rot 35:sc= 0.132 USER MOD Single : A 51 HIS : no HD1:sc= -0.0432 X(o=-0.043,f=-0.02) USER MOD Single : A 54 GLN : amide:sc= -0.317 X(o=-0.32,f=-0.67) USER MOD Single : A 59 GLN : amide:sc= 0 K(o=0,f=-0.7) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 ASN : amide:sc= -1.93 K(o=-1.9,f=-2.5!) USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 MET CE :methyl 123:sc= -1.96 (180deg=-2.3!) USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 GLN : amide:sc= 1.05 K(o=1.1,f=-0.17) USER MOD Single : A 94 LYS NZ :NH3+ -170:sc= 2.52 (180deg=2.27) USER MOD Single : A 97 ASN : amide:sc= 0 X(o=0,f=-0.22) USER MOD Single : A 100 GLN : amide:sc= -0.29 K(o=-0.29,f=-1.1) USER MOD Single : A 105 SER OG : rot 180:sc= -0.58 USER MOD Single : A 113 SER OG : rot -93:sc= 1.49 USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 SER OG : rot 41:sc= -0.14 USER MOD Single : A 124 TYR OH : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot 180:sc= -0.445 USER MOD Single : A 127 GLN :FLIP amide:sc= 0 F(o=-1,f=0) USER MOD Single : A 128 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 137 THR OG1 : rot -52:sc= 1.21 USER MOD Single : A 139 MET CE :methyl -130:sc= 0 (180deg=-0.973) USER MOD Single : A 141 TYR OH : rot 30:sc= 0.394 USER MOD Single : A 142 CYS SG : rot -14:sc= 1.08 USER MOD Single : A 145 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 540 N LYS A 34 -8.164 1.992 -9.266 1.00 0.00 N ATOM 541 CA LYS A 34 -7.990 0.562 -9.034 1.00 0.00 C ATOM 542 C LYS A 34 -6.505 0.197 -9.089 1.00 0.00 C ATOM 543 O LYS A 34 -5.656 1.070 -9.307 1.00 0.00 O ATOM 544 CB LYS A 34 -8.753 -0.237 -10.095 1.00 0.00 C ATOM 545 CG LYS A 34 -10.184 0.226 -10.311 1.00 0.00 C ATOM 546 CD LYS A 34 -10.799 -0.448 -11.531 1.00 0.00 C ATOM 547 CE LYS A 34 -12.138 0.168 -11.904 1.00 0.00 C ATOM 548 NZ LYS A 34 -12.702 -0.426 -13.149 1.00 0.00 N ATOM 0 HA LYS A 34 -8.383 0.317 -8.047 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -8.215 -0.171 -11.041 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -8.762 -1.288 -9.806 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -10.780 -0.000 -9.427 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -10.204 1.308 -10.440 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -10.114 -0.366 -12.375 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -10.932 -1.511 -11.330 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -12.842 0.027 -11.084 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -12.017 1.243 -12.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -13.615 0.023 -13.366 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -12.043 -0.269 -13.938 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -12.843 -1.447 -13.013 1.00 0.00 H new ATOM 562 N HIS A 35 -6.199 -1.087 -8.868 1.00 0.00 N ATOM 563 CA HIS A 35 -4.829 -1.601 -9.002 1.00 0.00 C ATOM 564 C HIS A 35 -4.746 -3.110 -8.758 1.00 0.00 C ATOM 565 O HIS A 35 -3.861 -3.772 -9.289 1.00 0.00 O ATOM 566 CB HIS A 35 -3.847 -0.877 -8.067 1.00 0.00 C ATOM 567 CG HIS A 35 -4.336 -0.705 -6.663 1.00 0.00 C ATOM 568 ND1 HIS A 35 -4.670 -1.758 -5.843 1.00 0.00 N ATOM 569 CD2 HIS A 35 -4.562 0.417 -5.942 1.00 0.00 C ATOM 570 CE1 HIS A 35 -5.081 -1.292 -4.685 1.00 0.00 C ATOM 571 NE2 HIS A 35 -5.024 0.024 -4.717 1.00 0.00 N ATOM 0 H HIS A 35 -6.884 -1.792 -8.595 1.00 0.00 H new ATOM 0 HA HIS A 35 -4.541 -1.403 -10.034 1.00 0.00 H new ATOM 0 HB2 HIS A 35 -2.909 -1.432 -8.046 1.00 0.00 H new ATOM 0 HB3 HIS A 35 -3.626 0.106 -8.484 1.00 0.00 H new ATOM 0 HD2 HIS A 35 -4.406 1.433 -6.272 1.00 0.00 H new ATOM 0 HE1 HIS A 35 -5.411 -1.888 -3.847 1.00 0.00 H new ATOM 0 HE2 HIS A 35 -5.282 0.648 -3.952 1.00 0.00 H new ATOM 580 N GLY A 36 -5.649 -3.656 -7.945 1.00 0.00 N ATOM 581 CA GLY A 36 -5.608 -5.085 -7.664 1.00 0.00 C ATOM 582 C GLY A 36 -5.748 -5.405 -6.185 1.00 0.00 C ATOM 583 O GLY A 36 -5.932 -4.502 -5.368 1.00 0.00 O ATOM 0 H GLY A 36 -6.399 -3.144 -7.481 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -6.408 -5.581 -8.214 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -4.667 -5.495 -8.031 1.00 0.00 H new ATOM 587 N GLN A 37 -5.643 -6.692 -5.850 1.00 0.00 N ATOM 588 CA GLN A 37 -5.830 -7.168 -4.478 1.00 0.00 C ATOM 589 C GLN A 37 -4.576 -6.953 -3.621 1.00 0.00 C ATOM 590 O GLN A 37 -4.528 -6.035 -2.808 1.00 0.00 O ATOM 591 CB GLN A 37 -6.228 -8.654 -4.489 1.00 0.00 C ATOM 592 CG GLN A 37 -6.285 -9.302 -3.107 1.00 0.00 C ATOM 593 CD GLN A 37 -6.812 -10.729 -3.142 1.00 0.00 C ATOM 594 OE1 GLN A 37 -6.682 -11.430 -4.145 1.00 0.00 O ATOM 595 NE2 GLN A 37 -7.388 -11.178 -2.038 1.00 0.00 N ATOM 0 H GLN A 37 -5.427 -7.431 -6.519 1.00 0.00 H new ATOM 0 HA GLN A 37 -6.632 -6.583 -4.028 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -7.204 -8.753 -4.964 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -5.517 -9.204 -5.106 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -5.287 -9.300 -2.669 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -6.920 -8.702 -2.456 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -7.478 -10.568 -1.226 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -7.741 -12.134 -2.000 1.00 0.00 H new ATOM 604 N PHE A 38 -3.571 -7.806 -3.803 1.00 0.00 N ATOM 605 CA PHE A 38 -2.331 -7.698 -3.037 1.00 0.00 C ATOM 606 C PHE A 38 -1.297 -6.909 -3.824 1.00 0.00 C ATOM 607 O PHE A 38 -0.639 -7.451 -4.711 1.00 0.00 O ATOM 608 CB PHE A 38 -1.767 -9.085 -2.696 1.00 0.00 C ATOM 609 CG PHE A 38 -2.615 -9.899 -1.756 1.00 0.00 C ATOM 610 CD1 PHE A 38 -3.202 -9.317 -0.646 1.00 0.00 C ATOM 611 CD2 PHE A 38 -2.803 -11.256 -1.974 1.00 0.00 C ATOM 612 CE1 PHE A 38 -3.965 -10.069 0.230 1.00 0.00 C ATOM 613 CE2 PHE A 38 -3.567 -12.015 -1.103 1.00 0.00 C ATOM 614 CZ PHE A 38 -4.146 -11.419 0.001 1.00 0.00 C ATOM 0 H PHE A 38 -3.590 -8.577 -4.471 1.00 0.00 H new ATOM 0 HA PHE A 38 -2.557 -7.178 -2.106 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -1.635 -9.645 -3.622 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -0.778 -8.961 -2.255 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -3.063 -8.262 -0.461 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -2.348 -11.726 -2.833 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -4.418 -9.601 1.091 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -3.710 -13.070 -1.286 1.00 0.00 H new ATOM 0 HZ PHE A 38 -4.740 -12.008 0.684 1.00 0.00 H new ATOM 624 N ILE A 39 -1.154 -5.633 -3.500 1.00 0.00 N ATOM 625 CA ILE A 39 -0.273 -4.758 -4.258 1.00 0.00 C ATOM 626 C ILE A 39 0.803 -4.142 -3.363 1.00 0.00 C ATOM 627 O ILE A 39 0.503 -3.514 -2.345 1.00 0.00 O ATOM 628 CB ILE A 39 -1.064 -3.630 -4.965 1.00 0.00 C ATOM 629 CG1 ILE A 39 -2.138 -4.219 -5.890 1.00 0.00 C ATOM 630 CG2 ILE A 39 -0.125 -2.723 -5.753 1.00 0.00 C ATOM 631 CD1 ILE A 39 -1.584 -5.092 -6.998 1.00 0.00 C ATOM 0 H ILE A 39 -1.634 -5.182 -2.721 1.00 0.00 H new ATOM 0 HA ILE A 39 0.208 -5.376 -5.016 1.00 0.00 H new ATOM 0 HB ILE A 39 -1.557 -3.032 -4.199 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -2.835 -4.806 -5.293 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -2.708 -3.403 -6.334 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -0.702 -1.938 -6.241 1.00 0.00 H new ATOM 0 HG22 ILE A 39 0.600 -2.272 -5.075 1.00 0.00 H new ATOM 0 HG23 ILE A 39 0.400 -3.310 -6.507 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -2.404 -5.470 -7.608 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -0.909 -4.505 -7.621 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -1.039 -5.930 -6.563 1.00 0.00 H new ATOM 643 N TYR A 40 2.052 -4.349 -3.742 1.00 0.00 N ATOM 644 CA TYR A 40 3.186 -3.738 -3.067 1.00 0.00 C ATOM 645 C TYR A 40 3.807 -2.688 -3.980 1.00 0.00 C ATOM 646 O TYR A 40 4.152 -2.979 -5.129 1.00 0.00 O ATOM 647 CB TYR A 40 4.221 -4.810 -2.704 1.00 0.00 C ATOM 648 CG TYR A 40 5.450 -4.282 -1.997 1.00 0.00 C ATOM 649 CD1 TYR A 40 6.545 -3.823 -2.716 1.00 0.00 C ATOM 650 CD2 TYR A 40 5.519 -4.259 -0.611 1.00 0.00 C ATOM 651 CE1 TYR A 40 7.673 -3.357 -2.074 1.00 0.00 C ATOM 652 CE2 TYR A 40 6.643 -3.790 0.038 1.00 0.00 C ATOM 653 CZ TYR A 40 7.718 -3.342 -0.698 1.00 0.00 C ATOM 654 OH TYR A 40 8.843 -2.887 -0.056 1.00 0.00 O ATOM 0 H TYR A 40 2.310 -4.946 -4.528 1.00 0.00 H new ATOM 0 HA TYR A 40 2.849 -3.260 -2.147 1.00 0.00 H new ATOM 0 HB2 TYR A 40 3.745 -5.557 -2.069 1.00 0.00 H new ATOM 0 HB3 TYR A 40 4.533 -5.320 -3.616 1.00 0.00 H new ATOM 0 HD1 TYR A 40 6.513 -3.831 -3.795 1.00 0.00 H new ATOM 0 HD2 TYR A 40 4.680 -4.614 -0.031 1.00 0.00 H new ATOM 0 HE1 TYR A 40 8.517 -3.005 -2.648 1.00 0.00 H new ATOM 0 HE2 TYR A 40 6.680 -3.774 1.117 1.00 0.00 H new ATOM 0 HH TYR A 40 9.400 -2.386 -0.688 1.00 0.00 H new ATOM 664 N VAL A 41 3.931 -1.469 -3.481 1.00 0.00 N ATOM 665 CA VAL A 41 4.497 -0.380 -4.262 1.00 0.00 C ATOM 666 C VAL A 41 5.637 0.294 -3.506 1.00 0.00 C ATOM 667 O VAL A 41 5.591 0.428 -2.283 1.00 0.00 O ATOM 668 CB VAL A 41 3.428 0.675 -4.633 1.00 0.00 C ATOM 669 CG1 VAL A 41 2.432 0.106 -5.632 1.00 0.00 C ATOM 670 CG2 VAL A 41 2.701 1.188 -3.395 1.00 0.00 C ATOM 0 H VAL A 41 3.647 -1.208 -2.537 1.00 0.00 H new ATOM 0 HA VAL A 41 4.883 -0.816 -5.183 1.00 0.00 H new ATOM 0 HB VAL A 41 3.944 1.517 -5.095 1.00 0.00 H new ATOM 0 HG11 VAL A 41 1.690 0.865 -5.878 1.00 0.00 H new ATOM 0 HG12 VAL A 41 2.957 -0.195 -6.538 1.00 0.00 H new ATOM 0 HG13 VAL A 41 1.934 -0.760 -5.196 1.00 0.00 H new ATOM 0 HG21 VAL A 41 1.957 1.928 -3.690 1.00 0.00 H new ATOM 0 HG22 VAL A 41 2.207 0.356 -2.893 1.00 0.00 H new ATOM 0 HG23 VAL A 41 3.419 1.647 -2.716 1.00 0.00 H new ATOM 680 N TRP A 42 6.662 0.705 -4.236 1.00 0.00 N ATOM 681 CA TRP A 42 7.806 1.373 -3.633 1.00 0.00 C ATOM 682 C TRP A 42 8.178 2.621 -4.436 1.00 0.00 C ATOM 683 O TRP A 42 9.318 2.800 -4.854 1.00 0.00 O ATOM 684 CB TRP A 42 8.998 0.404 -3.508 1.00 0.00 C ATOM 685 CG TRP A 42 9.469 -0.190 -4.809 1.00 0.00 C ATOM 686 CD1 TRP A 42 8.786 -1.050 -5.623 1.00 0.00 C ATOM 687 CD2 TRP A 42 10.745 0.018 -5.426 1.00 0.00 C ATOM 688 NE1 TRP A 42 9.552 -1.372 -6.717 1.00 0.00 N ATOM 689 CE2 TRP A 42 10.761 -0.734 -6.617 1.00 0.00 C ATOM 690 CE3 TRP A 42 11.874 0.772 -5.091 1.00 0.00 C ATOM 691 CZ2 TRP A 42 11.861 -0.752 -7.471 1.00 0.00 C ATOM 692 CZ3 TRP A 42 12.965 0.751 -5.937 1.00 0.00 C ATOM 693 CH2 TRP A 42 12.952 -0.007 -7.115 1.00 0.00 C ATOM 0 H TRP A 42 6.726 0.588 -5.247 1.00 0.00 H new ATOM 0 HA TRP A 42 7.536 1.692 -2.626 1.00 0.00 H new ATOM 0 HB2 TRP A 42 9.831 0.933 -3.044 1.00 0.00 H new ATOM 0 HB3 TRP A 42 8.720 -0.407 -2.834 1.00 0.00 H new ATOM 0 HD1 TRP A 42 7.790 -1.422 -5.434 1.00 0.00 H new ATOM 0 HE1 TRP A 42 9.267 -1.986 -7.480 1.00 0.00 H new ATOM 0 HE3 TRP A 42 11.892 1.361 -4.186 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 11.853 -1.333 -8.381 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 13.843 1.328 -5.686 1.00 0.00 H new ATOM 0 HH2 TRP A 42 13.821 -0.003 -7.756 1.00 0.00 H new ATOM 787 N SER A 50 1.038 7.383 -0.905 1.00 0.00 N ATOM 788 CA SER A 50 -0.211 6.699 -0.568 1.00 0.00 C ATOM 789 C SER A 50 -1.486 7.272 -1.205 1.00 0.00 C ATOM 790 O SER A 50 -2.571 6.788 -0.900 1.00 0.00 O ATOM 791 CB SER A 50 -0.373 6.670 0.953 1.00 0.00 C ATOM 792 OG SER A 50 0.749 6.057 1.562 1.00 0.00 O ATOM 0 HA SER A 50 -0.111 5.700 -0.993 1.00 0.00 H new ATOM 0 HB2 SER A 50 -0.489 7.686 1.331 1.00 0.00 H new ATOM 0 HB3 SER A 50 -1.280 6.126 1.217 1.00 0.00 H new ATOM 0 HG SER A 50 1.558 6.280 1.056 1.00 0.00 H new ATOM 798 N HIS A 51 -1.399 8.261 -2.096 1.00 0.00 N ATOM 799 CA HIS A 51 -2.626 8.800 -2.694 1.00 0.00 C ATOM 800 C HIS A 51 -3.344 7.744 -3.543 1.00 0.00 C ATOM 801 O HIS A 51 -4.567 7.736 -3.623 1.00 0.00 O ATOM 802 CB HIS A 51 -2.403 10.107 -3.484 1.00 0.00 C ATOM 803 CG HIS A 51 -1.540 10.013 -4.708 1.00 0.00 C ATOM 804 ND1 HIS A 51 -0.296 10.593 -4.785 1.00 0.00 N ATOM 805 CD2 HIS A 51 -1.768 9.460 -5.927 1.00 0.00 C ATOM 806 CE1 HIS A 51 0.204 10.405 -5.990 1.00 0.00 C ATOM 807 NE2 HIS A 51 -0.667 9.719 -6.703 1.00 0.00 N ATOM 0 H HIS A 51 -0.530 8.692 -2.411 1.00 0.00 H new ATOM 0 HA HIS A 51 -3.276 9.065 -1.860 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -3.377 10.495 -3.783 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -1.960 10.841 -2.811 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -2.652 8.917 -6.229 1.00 0.00 H new ATOM 0 HE1 HIS A 51 1.166 10.754 -6.335 1.00 0.00 H new ATOM 0 HE2 HIS A 51 -0.543 9.428 -7.673 1.00 0.00 H new ATOM 816 N LEU A 52 -2.586 6.853 -4.174 1.00 0.00 N ATOM 817 CA LEU A 52 -3.192 5.770 -4.945 1.00 0.00 C ATOM 818 C LEU A 52 -3.727 4.675 -4.011 1.00 0.00 C ATOM 819 O LEU A 52 -4.642 3.934 -4.367 1.00 0.00 O ATOM 820 CB LEU A 52 -2.198 5.204 -5.973 1.00 0.00 C ATOM 821 CG LEU A 52 -0.981 4.459 -5.412 1.00 0.00 C ATOM 822 CD1 LEU A 52 -1.232 2.957 -5.404 1.00 0.00 C ATOM 823 CD2 LEU A 52 0.266 4.792 -6.217 1.00 0.00 C ATOM 0 H LEU A 52 -1.566 6.857 -4.169 1.00 0.00 H new ATOM 0 HA LEU A 52 -4.039 6.174 -5.500 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -2.739 4.525 -6.632 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -1.839 6.028 -6.589 1.00 0.00 H new ATOM 0 HG LEU A 52 -0.821 4.784 -4.384 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -0.358 2.444 -5.003 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -2.099 2.736 -4.782 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -1.419 2.614 -6.422 1.00 0.00 H new ATOM 0 HD21 LEU A 52 1.120 4.254 -5.804 1.00 0.00 H new ATOM 0 HD22 LEU A 52 0.118 4.496 -7.256 1.00 0.00 H new ATOM 0 HD23 LEU A 52 0.455 5.864 -6.168 1.00 0.00 H new ATOM 835 N LEU A 53 -3.131 4.572 -2.821 1.00 0.00 N ATOM 836 CA LEU A 53 -3.594 3.630 -1.802 1.00 0.00 C ATOM 837 C LEU A 53 -4.887 4.127 -1.156 1.00 0.00 C ATOM 838 O LEU A 53 -5.856 3.380 -1.029 1.00 0.00 O ATOM 839 CB LEU A 53 -2.530 3.416 -0.708 1.00 0.00 C ATOM 840 CG LEU A 53 -1.335 2.529 -1.085 1.00 0.00 C ATOM 841 CD1 LEU A 53 -0.402 3.234 -2.059 1.00 0.00 C ATOM 842 CD2 LEU A 53 -0.572 2.117 0.167 1.00 0.00 C ATOM 0 H LEU A 53 -2.325 5.131 -2.540 1.00 0.00 H new ATOM 0 HA LEU A 53 -3.778 2.679 -2.301 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -2.150 4.392 -0.405 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -3.018 2.980 0.163 1.00 0.00 H new ATOM 0 HG LEU A 53 -1.723 1.638 -1.579 1.00 0.00 H new ATOM 0 HD11 LEU A 53 0.432 2.577 -2.304 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -0.947 3.483 -2.969 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -0.022 4.148 -1.602 1.00 0.00 H new ATOM 0 HD21 LEU A 53 0.273 1.488 -0.112 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -0.208 3.007 0.681 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -1.234 1.561 0.830 1.00 0.00 H new ATOM 854 N GLN A 54 -4.891 5.402 -0.768 1.00 0.00 N ATOM 855 CA GLN A 54 -6.008 5.996 -0.035 1.00 0.00 C ATOM 856 C GLN A 54 -7.277 5.992 -0.873 1.00 0.00 C ATOM 857 O GLN A 54 -8.368 5.752 -0.358 1.00 0.00 O ATOM 858 CB GLN A 54 -5.677 7.433 0.389 1.00 0.00 C ATOM 859 CG GLN A 54 -5.591 8.407 -0.776 1.00 0.00 C ATOM 860 CD GLN A 54 -5.350 9.838 -0.351 1.00 0.00 C ATOM 861 OE1 GLN A 54 -4.700 10.104 0.659 1.00 0.00 O ATOM 862 NE2 GLN A 54 -5.874 10.772 -1.130 1.00 0.00 N ATOM 0 H GLN A 54 -4.124 6.049 -0.952 1.00 0.00 H new ATOM 0 HA GLN A 54 -6.175 5.390 0.856 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -6.438 7.781 1.087 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -4.728 7.435 0.925 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -4.787 8.094 -1.442 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -6.517 8.358 -1.349 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -6.406 10.506 -1.958 1.00 0.00 H new ATOM 0 HE22 GLN A 54 -5.745 11.758 -0.902 1.00 0.00 H new ATOM 871 N ALA A 55 -7.115 6.266 -2.163 1.00 0.00 N ATOM 872 CA ALA A 55 -8.230 6.289 -3.098 1.00 0.00 C ATOM 873 C ALA A 55 -8.946 4.950 -3.111 1.00 0.00 C ATOM 874 O ALA A 55 -10.178 4.876 -3.121 1.00 0.00 O ATOM 875 CB ALA A 55 -7.730 6.653 -4.487 1.00 0.00 C ATOM 0 H ALA A 55 -6.211 6.477 -2.587 1.00 0.00 H new ATOM 0 HA ALA A 55 -8.946 7.045 -2.777 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -8.569 6.669 -5.183 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -7.263 7.637 -4.459 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -6.999 5.914 -4.816 1.00 0.00 H new ATOM 881 N TRP A 56 -8.152 3.899 -3.067 1.00 0.00 N ATOM 882 CA TRP A 56 -8.657 2.539 -3.057 1.00 0.00 C ATOM 883 C TRP A 56 -9.349 2.231 -1.730 1.00 0.00 C ATOM 884 O TRP A 56 -10.417 1.611 -1.698 1.00 0.00 O ATOM 885 CB TRP A 56 -7.483 1.597 -3.304 1.00 0.00 C ATOM 886 CG TRP A 56 -7.788 0.142 -3.152 1.00 0.00 C ATOM 887 CD1 TRP A 56 -8.553 -0.633 -3.971 1.00 0.00 C ATOM 888 CD2 TRP A 56 -7.289 -0.719 -2.127 1.00 0.00 C ATOM 889 NE1 TRP A 56 -8.565 -1.928 -3.513 1.00 0.00 N ATOM 890 CE2 TRP A 56 -7.794 -2.002 -2.380 1.00 0.00 C ATOM 891 CE3 TRP A 56 -6.460 -0.525 -1.017 1.00 0.00 C ATOM 892 CZ2 TRP A 56 -7.499 -3.088 -1.564 1.00 0.00 C ATOM 893 CZ3 TRP A 56 -6.170 -1.604 -0.208 1.00 0.00 C ATOM 894 CH2 TRP A 56 -6.687 -2.870 -0.485 1.00 0.00 C ATOM 0 H TRP A 56 -7.134 3.963 -3.037 1.00 0.00 H new ATOM 0 HA TRP A 56 -9.402 2.406 -3.841 1.00 0.00 H new ATOM 0 HB2 TRP A 56 -7.107 1.769 -4.312 1.00 0.00 H new ATOM 0 HB3 TRP A 56 -6.679 1.857 -2.615 1.00 0.00 H new ATOM 0 HD1 TRP A 56 -9.073 -0.281 -4.850 1.00 0.00 H new ATOM 0 HE1 TRP A 56 -9.064 -2.706 -3.944 1.00 0.00 H new ATOM 0 HE3 TRP A 56 -6.054 0.452 -0.797 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 -7.897 -4.070 -1.775 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 -5.533 -1.467 0.653 1.00 0.00 H new ATOM 0 HH2 TRP A 56 -6.441 -3.695 0.166 1.00 0.00 H new ATOM 905 N VAL A 57 -8.737 2.685 -0.643 1.00 0.00 N ATOM 906 CA VAL A 57 -9.286 2.502 0.695 1.00 0.00 C ATOM 907 C VAL A 57 -10.629 3.221 0.836 1.00 0.00 C ATOM 908 O VAL A 57 -11.627 2.623 1.241 1.00 0.00 O ATOM 909 CB VAL A 57 -8.304 3.022 1.774 1.00 0.00 C ATOM 910 CG1 VAL A 57 -8.933 2.973 3.159 1.00 0.00 C ATOM 911 CG2 VAL A 57 -7.010 2.219 1.757 1.00 0.00 C ATOM 0 H VAL A 57 -7.850 3.188 -0.664 1.00 0.00 H new ATOM 0 HA VAL A 57 -9.438 1.433 0.843 1.00 0.00 H new ATOM 0 HB VAL A 57 -8.074 4.061 1.539 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -8.220 3.344 3.896 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -9.828 3.595 3.174 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -9.202 1.945 3.400 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -6.335 2.601 2.523 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -7.230 1.170 1.957 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -6.538 2.310 0.779 1.00 0.00 H new ATOM 921 N ALA A 58 -10.649 4.497 0.475 1.00 0.00 N ATOM 922 CA ALA A 58 -11.846 5.316 0.612 1.00 0.00 C ATOM 923 C ALA A 58 -12.970 4.807 -0.281 1.00 0.00 C ATOM 924 O ALA A 58 -14.139 4.841 0.105 1.00 0.00 O ATOM 925 CB ALA A 58 -11.527 6.766 0.293 1.00 0.00 C ATOM 0 H ALA A 58 -9.846 4.989 0.083 1.00 0.00 H new ATOM 0 HA ALA A 58 -12.187 5.248 1.645 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -12.429 7.369 0.399 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -10.764 7.131 0.981 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -11.158 6.841 -0.730 1.00 0.00 H new ATOM 931 N GLN A 59 -12.615 4.332 -1.470 1.00 0.00 N ATOM 932 CA GLN A 59 -13.599 3.786 -2.395 1.00 0.00 C ATOM 933 C GLN A 59 -14.264 2.553 -1.796 1.00 0.00 C ATOM 934 O GLN A 59 -15.468 2.349 -1.946 1.00 0.00 O ATOM 935 CB GLN A 59 -12.944 3.428 -3.730 1.00 0.00 C ATOM 936 CG GLN A 59 -13.946 3.061 -4.814 1.00 0.00 C ATOM 937 CD GLN A 59 -13.282 2.597 -6.096 1.00 0.00 C ATOM 938 OE1 GLN A 59 -12.213 1.990 -6.072 1.00 0.00 O ATOM 939 NE2 GLN A 59 -13.914 2.872 -7.225 1.00 0.00 N ATOM 0 H GLN A 59 -11.655 4.314 -1.815 1.00 0.00 H new ATOM 0 HA GLN A 59 -14.359 4.547 -2.572 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -12.344 4.272 -4.070 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -12.261 2.592 -3.579 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -14.602 2.273 -4.444 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -14.575 3.925 -5.028 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -14.799 3.378 -7.204 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -13.516 2.578 -8.117 1.00 0.00 H new ATOM 948 N ALA A 60 -13.471 1.740 -1.111 1.00 0.00 N ATOM 949 CA ALA A 60 -13.984 0.548 -0.453 1.00 0.00 C ATOM 950 C ALA A 60 -14.878 0.927 0.723 1.00 0.00 C ATOM 951 O ALA A 60 -15.880 0.271 0.992 1.00 0.00 O ATOM 952 CB ALA A 60 -12.839 -0.342 0.009 1.00 0.00 C ATOM 0 H ALA A 60 -12.468 1.886 -0.997 1.00 0.00 H new ATOM 0 HA ALA A 60 -14.583 -0.010 -1.172 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -13.242 -1.228 0.499 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -12.242 -0.643 -0.852 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -12.212 0.207 0.711 1.00 0.00 H new ATOM 958 N LEU A 61 -14.513 2.003 1.406 1.00 0.00 N ATOM 959 CA LEU A 61 -15.292 2.502 2.534 1.00 0.00 C ATOM 960 C LEU A 61 -16.708 2.873 2.105 1.00 0.00 C ATOM 961 O LEU A 61 -17.683 2.443 2.721 1.00 0.00 O ATOM 962 CB LEU A 61 -14.595 3.711 3.161 1.00 0.00 C ATOM 963 CG LEU A 61 -13.315 3.400 3.941 1.00 0.00 C ATOM 964 CD1 LEU A 61 -12.664 4.684 4.431 1.00 0.00 C ATOM 965 CD2 LEU A 61 -13.620 2.475 5.108 1.00 0.00 C ATOM 0 H LEU A 61 -13.678 2.551 1.198 1.00 0.00 H new ATOM 0 HA LEU A 61 -15.362 1.706 3.276 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -14.355 4.421 2.370 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -15.297 4.207 3.831 1.00 0.00 H new ATOM 0 HG LEU A 61 -12.616 2.896 3.274 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -11.756 4.444 4.983 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -12.414 5.314 3.577 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -13.356 5.216 5.084 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -12.701 2.262 5.654 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -14.335 2.955 5.776 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -14.043 1.543 4.733 1.00 0.00 H new ATOM 977 N GLU A 62 -16.825 3.646 1.031 1.00 0.00 N ATOM 978 CA GLU A 62 -18.135 4.072 0.545 1.00 0.00 C ATOM 979 C GLU A 62 -18.838 2.946 -0.201 1.00 0.00 C ATOM 980 O GLU A 62 -20.009 3.058 -0.568 1.00 0.00 O ATOM 981 CB GLU A 62 -18.012 5.308 -0.338 1.00 0.00 C ATOM 982 CG GLU A 62 -17.466 6.502 0.414 1.00 0.00 C ATOM 983 CD GLU A 62 -17.592 7.797 -0.361 1.00 0.00 C ATOM 984 OE1 GLU A 62 -18.667 8.032 -0.955 1.00 0.00 O ATOM 985 OE2 GLU A 62 -16.647 8.610 -0.339 1.00 0.00 O ATOM 0 H GLU A 62 -16.036 3.989 0.483 1.00 0.00 H new ATOM 0 HA GLU A 62 -18.742 4.331 1.412 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -17.360 5.085 -1.182 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -18.991 5.557 -0.748 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -17.994 6.600 1.362 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -16.416 6.327 0.650 1.00 0.00 H new ATOM 992 N ALA A 63 -18.111 1.863 -0.424 1.00 0.00 N ATOM 993 CA ALA A 63 -18.688 0.654 -0.992 1.00 0.00 C ATOM 994 C ALA A 63 -19.279 -0.217 0.110 1.00 0.00 C ATOM 995 O ALA A 63 -19.886 -1.258 -0.155 1.00 0.00 O ATOM 996 CB ALA A 63 -17.640 -0.118 -1.780 1.00 0.00 C ATOM 0 H ALA A 63 -17.114 1.796 -0.219 1.00 0.00 H new ATOM 0 HA ALA A 63 -19.488 0.939 -1.675 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -18.089 -1.019 -2.197 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -17.260 0.506 -2.589 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -16.819 -0.395 -1.119 1.00 0.00 H new ATOM 1002 N GLY A 64 -19.093 0.219 1.348 1.00 0.00 N ATOM 1003 CA GLY A 64 -19.637 -0.499 2.481 1.00 0.00 C ATOM 1004 C GLY A 64 -18.710 -1.594 2.970 1.00 0.00 C ATOM 1005 O GLY A 64 -19.152 -2.564 3.585 1.00 0.00 O ATOM 0 H GLY A 64 -18.572 1.062 1.588 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -19.828 0.202 3.294 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -20.597 -0.936 2.204 1.00 0.00 H new ATOM 1009 N LYS A 65 -17.425 -1.444 2.690 1.00 0.00 N ATOM 1010 CA LYS A 65 -16.433 -2.413 3.113 1.00 0.00 C ATOM 1011 C LYS A 65 -15.578 -1.801 4.207 1.00 0.00 C ATOM 1012 O LYS A 65 -15.529 -0.577 4.353 1.00 0.00 O ATOM 1013 CB LYS A 65 -15.540 -2.823 1.936 1.00 0.00 C ATOM 1014 CG LYS A 65 -16.304 -3.165 0.668 1.00 0.00 C ATOM 1015 CD LYS A 65 -17.228 -4.353 0.865 1.00 0.00 C ATOM 1016 CE LYS A 65 -18.076 -4.599 -0.371 1.00 0.00 C ATOM 1017 NZ LYS A 65 -18.984 -5.761 -0.197 1.00 0.00 N ATOM 0 H LYS A 65 -17.045 -0.654 2.168 1.00 0.00 H new ATOM 0 HA LYS A 65 -16.943 -3.301 3.487 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -14.845 -2.011 1.721 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -14.942 -3.685 2.231 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -16.887 -2.300 0.352 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -15.598 -3.384 -0.133 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -16.639 -5.242 1.088 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -17.875 -4.176 1.724 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -18.664 -3.708 -0.591 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -17.426 -4.771 -1.229 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -19.545 -5.896 -1.062 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -18.422 -6.616 -0.012 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -19.622 -5.586 0.606 1.00 0.00 H new ATOM 1031 N ASN A 66 -14.919 -2.636 4.982 1.00 0.00 N ATOM 1032 CA ASN A 66 -14.008 -2.137 5.997 1.00 0.00 C ATOM 1033 C ASN A 66 -12.639 -1.935 5.385 1.00 0.00 C ATOM 1034 O ASN A 66 -12.113 -2.821 4.709 1.00 0.00 O ATOM 1035 CB ASN A 66 -13.918 -3.092 7.186 1.00 0.00 C ATOM 1036 CG ASN A 66 -13.282 -2.435 8.400 1.00 0.00 C ATOM 1037 OD1 ASN A 66 -13.224 -1.210 8.502 1.00 0.00 O ATOM 1038 ND2 ASN A 66 -12.838 -3.239 9.347 1.00 0.00 N ATOM 0 H ASN A 66 -14.993 -3.652 4.932 1.00 0.00 H new ATOM 0 HA ASN A 66 -14.391 -1.186 6.367 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -14.917 -3.442 7.446 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -13.336 -3.969 6.903 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -12.431 -2.849 10.197 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -12.902 -4.250 9.229 1.00 0.00 H new ATOM 1045 N ALA A 67 -12.056 -0.780 5.647 1.00 0.00 N ATOM 1046 CA ALA A 67 -10.802 -0.403 5.026 1.00 0.00 C ATOM 1047 C ALA A 67 -10.085 0.649 5.856 1.00 0.00 C ATOM 1048 O ALA A 67 -10.718 1.544 6.421 1.00 0.00 O ATOM 1049 CB ALA A 67 -11.048 0.114 3.612 1.00 0.00 C ATOM 0 H ALA A 67 -12.434 -0.084 6.289 1.00 0.00 H new ATOM 0 HA ALA A 67 -10.166 -1.287 4.971 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -10.098 0.394 3.157 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -11.520 -0.667 3.016 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -11.702 0.985 3.652 1.00 0.00 H new ATOM 1055 N ALA A 68 -8.770 0.529 5.934 1.00 0.00 N ATOM 1056 CA ALA A 68 -7.961 1.485 6.670 1.00 0.00 C ATOM 1057 C ALA A 68 -6.532 1.502 6.150 1.00 0.00 C ATOM 1058 O ALA A 68 -5.973 0.455 5.815 1.00 0.00 O ATOM 1059 CB ALA A 68 -7.972 1.155 8.155 1.00 0.00 C ATOM 0 H ALA A 68 -8.239 -0.223 5.495 1.00 0.00 H new ATOM 0 HA ALA A 68 -8.392 2.476 6.524 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -7.362 1.880 8.693 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -8.995 1.194 8.529 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -7.567 0.155 8.308 1.00 0.00 H new ATOM 1065 N TYR A 69 -5.946 2.687 6.075 1.00 0.00 N ATOM 1066 CA TYR A 69 -4.555 2.815 5.705 1.00 0.00 C ATOM 1067 C TYR A 69 -3.784 3.452 6.853 1.00 0.00 C ATOM 1068 O TYR A 69 -4.235 4.433 7.448 1.00 0.00 O ATOM 1069 CB TYR A 69 -4.389 3.616 4.404 1.00 0.00 C ATOM 1070 CG TYR A 69 -4.799 5.076 4.482 1.00 0.00 C ATOM 1071 CD1 TYR A 69 -6.116 5.465 4.265 1.00 0.00 C ATOM 1072 CD2 TYR A 69 -3.859 6.064 4.754 1.00 0.00 C ATOM 1073 CE1 TYR A 69 -6.485 6.797 4.324 1.00 0.00 C ATOM 1074 CE2 TYR A 69 -4.221 7.394 4.810 1.00 0.00 C ATOM 1075 CZ TYR A 69 -5.532 7.757 4.594 1.00 0.00 C ATOM 1076 OH TYR A 69 -5.889 9.085 4.641 1.00 0.00 O ATOM 0 H TYR A 69 -6.417 3.571 6.267 1.00 0.00 H new ATOM 0 HA TYR A 69 -4.149 1.822 5.514 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -3.344 3.565 4.097 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -4.975 3.133 3.622 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -6.863 4.716 4.047 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -2.829 5.786 4.924 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -7.513 7.084 4.160 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -3.478 8.149 5.023 1.00 0.00 H new ATOM 0 HH TYR A 69 -5.099 9.629 4.844 1.00 0.00 H new ATOM 1086 N ILE A 70 -2.652 2.863 7.188 1.00 0.00 N ATOM 1087 CA ILE A 70 -1.854 3.316 8.314 1.00 0.00 C ATOM 1088 C ILE A 70 -0.451 3.715 7.868 1.00 0.00 C ATOM 1089 O ILE A 70 0.236 2.954 7.184 1.00 0.00 O ATOM 1090 CB ILE A 70 -1.761 2.225 9.408 1.00 0.00 C ATOM 1091 CG1 ILE A 70 -3.156 1.892 9.943 1.00 0.00 C ATOM 1092 CG2 ILE A 70 -0.847 2.674 10.541 1.00 0.00 C ATOM 1093 CD1 ILE A 70 -3.165 0.795 10.987 1.00 0.00 C ATOM 0 H ILE A 70 -2.261 2.062 6.692 1.00 0.00 H new ATOM 0 HA ILE A 70 -2.353 4.191 8.732 1.00 0.00 H new ATOM 0 HB ILE A 70 -1.334 1.326 8.964 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -3.595 2.793 10.372 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -3.792 1.593 9.110 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -0.796 1.892 11.299 1.00 0.00 H new ATOM 0 HG22 ILE A 70 0.152 2.865 10.149 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -1.242 3.587 10.987 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -4.188 0.616 11.318 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -2.757 -0.120 10.557 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -2.556 1.098 11.839 1.00 0.00 H new ATOM 1105 N ASP A 71 -0.038 4.915 8.250 1.00 0.00 N ATOM 1106 CA ASP A 71 1.299 5.400 7.951 1.00 0.00 C ATOM 1107 C ASP A 71 2.200 5.036 9.110 1.00 0.00 C ATOM 1108 O ASP A 71 2.077 5.614 10.182 1.00 0.00 O ATOM 1109 CB ASP A 71 1.319 6.923 7.777 1.00 0.00 C ATOM 1110 CG ASP A 71 0.139 7.461 6.998 1.00 0.00 C ATOM 1111 OD1 ASP A 71 -0.934 7.654 7.608 1.00 0.00 O ATOM 1112 OD2 ASP A 71 0.282 7.717 5.787 1.00 0.00 O ATOM 0 H ASP A 71 -0.616 5.574 8.772 1.00 0.00 H new ATOM 0 HA ASP A 71 1.637 4.945 7.020 1.00 0.00 H new ATOM 0 HB2 ASP A 71 1.338 7.392 8.761 1.00 0.00 H new ATOM 0 HB3 ASP A 71 2.240 7.210 7.269 1.00 0.00 H new ATOM 1117 N ALA A 72 3.100 4.094 8.906 1.00 0.00 N ATOM 1118 CA ALA A 72 3.926 3.566 9.997 1.00 0.00 C ATOM 1119 C ALA A 72 4.778 4.645 10.671 1.00 0.00 C ATOM 1120 O ALA A 72 5.298 4.435 11.766 1.00 0.00 O ATOM 1121 CB ALA A 72 4.811 2.441 9.492 1.00 0.00 C ATOM 0 H ALA A 72 3.285 3.672 7.996 1.00 0.00 H new ATOM 0 HA ALA A 72 3.241 3.182 10.753 1.00 0.00 H new ATOM 0 HB1 ALA A 72 5.418 2.059 10.313 1.00 0.00 H new ATOM 0 HB2 ALA A 72 4.189 1.638 9.097 1.00 0.00 H new ATOM 0 HB3 ALA A 72 5.463 2.817 8.703 1.00 0.00 H new ATOM 1127 N ALA A 73 4.920 5.794 10.021 1.00 0.00 N ATOM 1128 CA ALA A 73 5.705 6.887 10.583 1.00 0.00 C ATOM 1129 C ALA A 73 4.821 7.940 11.250 1.00 0.00 C ATOM 1130 O ALA A 73 5.319 8.900 11.835 1.00 0.00 O ATOM 1131 CB ALA A 73 6.570 7.527 9.508 1.00 0.00 C ATOM 0 H ALA A 73 4.505 5.993 9.111 1.00 0.00 H new ATOM 0 HA ALA A 73 6.349 6.463 11.354 1.00 0.00 H new ATOM 0 HB1 ALA A 73 7.149 8.341 9.944 1.00 0.00 H new ATOM 0 HB2 ALA A 73 7.248 6.780 9.094 1.00 0.00 H new ATOM 0 HB3 ALA A 73 5.934 7.919 8.715 1.00 0.00 H new ATOM 1137 N SER A 74 3.514 7.756 11.169 1.00 0.00 N ATOM 1138 CA SER A 74 2.572 8.710 11.744 1.00 0.00 C ATOM 1139 C SER A 74 1.604 8.003 12.692 1.00 0.00 C ATOM 1140 O SER A 74 1.125 8.584 13.668 1.00 0.00 O ATOM 1141 CB SER A 74 1.804 9.417 10.618 1.00 0.00 C ATOM 1142 OG SER A 74 0.929 10.417 11.116 1.00 0.00 O ATOM 0 H SER A 74 3.078 6.956 10.711 1.00 0.00 H new ATOM 0 HA SER A 74 3.125 9.453 12.319 1.00 0.00 H new ATOM 0 HB2 SER A 74 2.513 9.869 9.924 1.00 0.00 H new ATOM 0 HB3 SER A 74 1.230 8.682 10.054 1.00 0.00 H new ATOM 0 HG SER A 74 0.461 10.844 10.368 1.00 0.00 H new ATOM 1148 N MET A 75 1.336 6.741 12.399 1.00 0.00 N ATOM 1149 CA MET A 75 0.410 5.936 13.175 1.00 0.00 C ATOM 1150 C MET A 75 0.997 4.551 13.415 1.00 0.00 C ATOM 1151 O MET A 75 1.695 4.012 12.556 1.00 0.00 O ATOM 1152 CB MET A 75 -0.930 5.805 12.437 1.00 0.00 C ATOM 1153 CG MET A 75 -1.720 7.102 12.364 1.00 0.00 C ATOM 1154 SD MET A 75 -3.378 6.878 11.687 1.00 0.00 S ATOM 1155 CE MET A 75 -3.001 6.442 9.991 1.00 0.00 C ATOM 0 H MET A 75 1.757 6.245 11.613 1.00 0.00 H new ATOM 0 HA MET A 75 0.242 6.428 14.133 1.00 0.00 H new ATOM 0 HB2 MET A 75 -0.743 5.447 11.425 1.00 0.00 H new ATOM 0 HB3 MET A 75 -1.536 5.049 12.936 1.00 0.00 H new ATOM 0 HG2 MET A 75 -1.796 7.532 13.363 1.00 0.00 H new ATOM 0 HG3 MET A 75 -1.176 7.819 11.749 1.00 0.00 H new ATOM 0 HE1 MET A 75 -3.448 5.476 9.756 1.00 0.00 H new ATOM 0 HE2 MET A 75 -3.405 7.202 9.322 1.00 0.00 H new ATOM 0 HE3 MET A 75 -1.920 6.382 9.862 1.00 0.00 H new ATOM 1165 N PRO A 76 0.743 3.964 14.588 1.00 0.00 N ATOM 1166 CA PRO A 76 1.159 2.598 14.883 1.00 0.00 C ATOM 1167 C PRO A 76 0.176 1.578 14.321 1.00 0.00 C ATOM 1168 O PRO A 76 -0.956 1.918 13.982 1.00 0.00 O ATOM 1169 CB PRO A 76 1.158 2.561 16.408 1.00 0.00 C ATOM 1170 CG PRO A 76 0.102 3.536 16.811 1.00 0.00 C ATOM 1171 CD PRO A 76 0.044 4.588 15.730 1.00 0.00 C ATOM 0 HA PRO A 76 2.122 2.346 14.439 1.00 0.00 H new ATOM 0 HB2 PRO A 76 0.936 1.561 16.780 1.00 0.00 H new ATOM 0 HB3 PRO A 76 2.131 2.842 16.811 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -0.862 3.039 16.919 1.00 0.00 H new ATOM 0 HG3 PRO A 76 0.339 3.985 17.775 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -0.985 4.844 15.477 1.00 0.00 H new ATOM 0 HD3 PRO A 76 0.534 5.510 16.043 1.00 0.00 H new ATOM 1179 N LEU A 77 0.607 0.330 14.217 1.00 0.00 N ATOM 1180 CA LEU A 77 -0.268 -0.728 13.738 1.00 0.00 C ATOM 1181 C LEU A 77 -1.068 -1.298 14.906 1.00 0.00 C ATOM 1182 O LEU A 77 -0.563 -1.395 16.026 1.00 0.00 O ATOM 1183 CB LEU A 77 0.543 -1.829 13.046 1.00 0.00 C ATOM 1184 CG LEU A 77 -0.286 -2.919 12.359 1.00 0.00 C ATOM 1185 CD1 LEU A 77 -1.190 -2.317 11.291 1.00 0.00 C ATOM 1186 CD2 LEU A 77 0.625 -3.971 11.750 1.00 0.00 C ATOM 0 H LEU A 77 1.551 0.027 14.456 1.00 0.00 H new ATOM 0 HA LEU A 77 -0.960 -0.313 13.005 1.00 0.00 H new ATOM 0 HB2 LEU A 77 1.192 -1.366 12.303 1.00 0.00 H new ATOM 0 HB3 LEU A 77 1.190 -2.300 13.786 1.00 0.00 H new ATOM 0 HG LEU A 77 -0.915 -3.395 13.111 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -1.769 -3.109 10.816 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -1.867 -1.598 11.751 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -0.581 -1.813 10.540 1.00 0.00 H new ATOM 0 HD21 LEU A 77 0.021 -4.739 11.266 1.00 0.00 H new ATOM 0 HD22 LEU A 77 1.278 -3.504 11.013 1.00 0.00 H new ATOM 0 HD23 LEU A 77 1.230 -4.426 12.534 1.00 0.00 H new ATOM 1198 N THR A 78 -2.309 -1.665 14.642 1.00 0.00 N ATOM 1199 CA THR A 78 -3.205 -2.134 15.677 1.00 0.00 C ATOM 1200 C THR A 78 -3.743 -3.515 15.339 1.00 0.00 C ATOM 1201 O THR A 78 -3.699 -3.946 14.186 1.00 0.00 O ATOM 1202 CB THR A 78 -4.384 -1.160 15.857 1.00 0.00 C ATOM 1203 OG1 THR A 78 -5.006 -0.917 14.587 1.00 0.00 O ATOM 1204 CG2 THR A 78 -3.919 0.158 16.458 1.00 0.00 C ATOM 0 H THR A 78 -2.720 -1.646 13.709 1.00 0.00 H new ATOM 0 HA THR A 78 -2.638 -2.189 16.606 1.00 0.00 H new ATOM 0 HB THR A 78 -5.102 -1.614 16.540 1.00 0.00 H new ATOM 0 HG1 THR A 78 -5.757 -0.298 14.704 1.00 0.00 H new ATOM 0 HG21 THR A 78 -4.772 0.826 16.574 1.00 0.00 H new ATOM 0 HG22 THR A 78 -3.467 -0.026 17.433 1.00 0.00 H new ATOM 0 HG23 THR A 78 -3.184 0.619 15.799 1.00 0.00 H new ATOM 1212 N ASP A 79 -4.248 -4.203 16.349 1.00 0.00 N ATOM 1213 CA ASP A 79 -4.863 -5.509 16.154 1.00 0.00 C ATOM 1214 C ASP A 79 -6.240 -5.348 15.517 1.00 0.00 C ATOM 1215 O ASP A 79 -6.786 -6.291 14.944 1.00 0.00 O ATOM 1216 CB ASP A 79 -4.973 -6.264 17.483 1.00 0.00 C ATOM 1217 CG ASP A 79 -5.834 -5.554 18.511 1.00 0.00 C ATOM 1218 OD1 ASP A 79 -5.321 -4.643 19.196 1.00 0.00 O ATOM 1219 OD2 ASP A 79 -7.023 -5.909 18.650 1.00 0.00 O ATOM 0 H ASP A 79 -4.245 -3.879 17.316 1.00 0.00 H new ATOM 0 HA ASP A 79 -4.230 -6.093 15.485 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -5.387 -7.255 17.296 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -3.974 -6.408 17.894 1.00 0.00 H new ATOM 1224 N ALA A 80 -6.783 -4.136 15.615 1.00 0.00 N ATOM 1225 CA ALA A 80 -8.059 -3.788 14.993 1.00 0.00 C ATOM 1226 C ALA A 80 -7.985 -3.931 13.475 1.00 0.00 C ATOM 1227 O ALA A 80 -9.003 -4.112 12.805 1.00 0.00 O ATOM 1228 CB ALA A 80 -8.463 -2.371 15.372 1.00 0.00 C ATOM 0 H ALA A 80 -6.351 -3.368 16.128 1.00 0.00 H new ATOM 0 HA ALA A 80 -8.816 -4.480 15.362 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -9.415 -2.126 14.901 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -8.564 -2.299 16.455 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -7.699 -1.672 15.032 1.00 0.00 H new ATOM 1234 N ALA A 81 -6.769 -3.830 12.939 1.00 0.00 N ATOM 1235 CA ALA A 81 -6.537 -3.941 11.501 1.00 0.00 C ATOM 1236 C ALA A 81 -6.961 -5.308 10.960 1.00 0.00 C ATOM 1237 O ALA A 81 -7.158 -5.468 9.758 1.00 0.00 O ATOM 1238 CB ALA A 81 -5.073 -3.674 11.177 1.00 0.00 C ATOM 0 H ALA A 81 -5.923 -3.670 13.486 1.00 0.00 H new ATOM 0 HA ALA A 81 -7.153 -3.188 11.010 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -4.917 -3.761 10.102 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -4.806 -2.669 11.503 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -4.447 -4.401 11.694 1.00 0.00 H new ATOM 1244 N PHE A 82 -7.107 -6.288 11.851 1.00 0.00 N ATOM 1245 CA PHE A 82 -7.569 -7.621 11.462 1.00 0.00 C ATOM 1246 C PHE A 82 -8.992 -7.582 10.925 1.00 0.00 C ATOM 1247 O PHE A 82 -9.380 -8.413 10.108 1.00 0.00 O ATOM 1248 CB PHE A 82 -7.498 -8.584 12.648 1.00 0.00 C ATOM 1249 CG PHE A 82 -6.189 -9.300 12.751 1.00 0.00 C ATOM 1250 CD1 PHE A 82 -5.976 -10.458 12.027 1.00 0.00 C ATOM 1251 CD2 PHE A 82 -5.179 -8.825 13.569 1.00 0.00 C ATOM 1252 CE1 PHE A 82 -4.778 -11.131 12.115 1.00 0.00 C ATOM 1253 CE2 PHE A 82 -3.978 -9.495 13.659 1.00 0.00 C ATOM 1254 CZ PHE A 82 -3.779 -10.650 12.932 1.00 0.00 C ATOM 0 H PHE A 82 -6.912 -6.185 12.847 1.00 0.00 H new ATOM 0 HA PHE A 82 -6.909 -7.974 10.670 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -7.674 -8.029 13.569 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -8.300 -9.317 12.560 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -6.757 -10.839 11.386 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -5.333 -7.922 14.141 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -4.622 -12.035 11.544 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -3.194 -9.116 14.298 1.00 0.00 H new ATOM 0 HZ PHE A 82 -2.839 -11.178 13.003 1.00 0.00 H new ATOM 1264 N GLU A 83 -9.758 -6.606 11.382 1.00 0.00 N ATOM 1265 CA GLU A 83 -11.149 -6.483 10.987 1.00 0.00 C ATOM 1266 C GLU A 83 -11.261 -5.865 9.604 1.00 0.00 C ATOM 1267 O GLU A 83 -12.253 -6.054 8.897 1.00 0.00 O ATOM 1268 CB GLU A 83 -11.888 -5.615 11.988 1.00 0.00 C ATOM 1269 CG GLU A 83 -11.746 -6.077 13.425 1.00 0.00 C ATOM 1270 CD GLU A 83 -12.424 -5.138 14.394 1.00 0.00 C ATOM 1271 OE1 GLU A 83 -12.534 -3.933 14.079 1.00 0.00 O ATOM 1272 OE2 GLU A 83 -12.852 -5.593 15.474 1.00 0.00 O ATOM 0 H GLU A 83 -9.438 -5.885 12.029 1.00 0.00 H new ATOM 0 HA GLU A 83 -11.592 -7.479 10.963 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -11.521 -4.592 11.908 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -12.946 -5.595 11.726 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -12.173 -7.074 13.528 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -10.688 -6.156 13.677 1.00 0.00 H new ATOM 1279 N ALA A 84 -10.241 -5.110 9.233 1.00 0.00 N ATOM 1280 CA ALA A 84 -10.226 -4.411 7.962 1.00 0.00 C ATOM 1281 C ALA A 84 -10.019 -5.389 6.823 1.00 0.00 C ATOM 1282 O ALA A 84 -9.018 -6.106 6.781 1.00 0.00 O ATOM 1283 CB ALA A 84 -9.147 -3.339 7.953 1.00 0.00 C ATOM 0 H ALA A 84 -9.406 -4.966 9.801 1.00 0.00 H new ATOM 0 HA ALA A 84 -11.191 -3.923 7.825 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -9.152 -2.826 6.991 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -9.342 -2.620 8.749 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -8.173 -3.802 8.113 1.00 0.00 H new ATOM 1289 N GLU A 85 -10.987 -5.441 5.920 1.00 0.00 N ATOM 1290 CA GLU A 85 -10.887 -6.308 4.760 1.00 0.00 C ATOM 1291 C GLU A 85 -9.917 -5.706 3.748 1.00 0.00 C ATOM 1292 O GLU A 85 -9.207 -6.422 3.046 1.00 0.00 O ATOM 1293 CB GLU A 85 -12.261 -6.514 4.125 1.00 0.00 C ATOM 1294 CG GLU A 85 -12.533 -7.958 3.740 1.00 0.00 C ATOM 1295 CD GLU A 85 -12.489 -8.888 4.935 1.00 0.00 C ATOM 1296 OE1 GLU A 85 -13.458 -8.892 5.724 1.00 0.00 O ATOM 1297 OE2 GLU A 85 -11.489 -9.616 5.094 1.00 0.00 O ATOM 0 H GLU A 85 -11.847 -4.895 5.969 1.00 0.00 H new ATOM 0 HA GLU A 85 -10.510 -7.280 5.078 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -13.030 -6.180 4.822 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -12.341 -5.887 3.237 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -13.511 -8.027 3.264 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -11.797 -8.281 3.004 1.00 0.00 H new ATOM 1304 N TYR A 86 -9.898 -4.381 3.686 1.00 0.00 N ATOM 1305 CA TYR A 86 -8.975 -3.655 2.829 1.00 0.00 C ATOM 1306 C TYR A 86 -7.969 -2.908 3.701 1.00 0.00 C ATOM 1307 O TYR A 86 -8.283 -1.859 4.265 1.00 0.00 O ATOM 1308 CB TYR A 86 -9.739 -2.671 1.932 1.00 0.00 C ATOM 1309 CG TYR A 86 -10.713 -3.321 0.964 1.00 0.00 C ATOM 1310 CD1 TYR A 86 -11.857 -3.969 1.412 1.00 0.00 C ATOM 1311 CD2 TYR A 86 -10.486 -3.273 -0.404 1.00 0.00 C ATOM 1312 CE1 TYR A 86 -12.743 -4.552 0.524 1.00 0.00 C ATOM 1313 CE2 TYR A 86 -11.367 -3.853 -1.297 1.00 0.00 C ATOM 1314 CZ TYR A 86 -12.492 -4.490 -0.828 1.00 0.00 C ATOM 1315 OH TYR A 86 -13.370 -5.068 -1.719 1.00 0.00 O ATOM 0 H TYR A 86 -10.521 -3.782 4.228 1.00 0.00 H new ATOM 0 HA TYR A 86 -8.447 -4.359 2.186 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -10.288 -1.974 2.565 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -9.018 -2.085 1.362 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -12.058 -4.019 2.472 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -9.605 -2.773 -0.778 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -13.627 -5.053 0.890 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -11.173 -3.806 -2.358 1.00 0.00 H new ATOM 0 HH TYR A 86 -13.045 -4.933 -2.633 1.00 0.00 H new ATOM 1325 N LEU A 87 -6.777 -3.464 3.839 1.00 0.00 N ATOM 1326 CA LEU A 87 -5.787 -2.924 4.753 1.00 0.00 C ATOM 1327 C LEU A 87 -4.561 -2.428 3.982 1.00 0.00 C ATOM 1328 O LEU A 87 -4.025 -3.129 3.126 1.00 0.00 O ATOM 1329 CB LEU A 87 -5.405 -4.010 5.770 1.00 0.00 C ATOM 1330 CG LEU A 87 -4.812 -3.529 7.102 1.00 0.00 C ATOM 1331 CD1 LEU A 87 -3.365 -3.101 6.940 1.00 0.00 C ATOM 1332 CD2 LEU A 87 -5.640 -2.388 7.677 1.00 0.00 C ATOM 0 H LEU A 87 -6.472 -4.292 3.327 1.00 0.00 H new ATOM 0 HA LEU A 87 -6.203 -2.069 5.286 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -6.295 -4.601 5.987 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -4.685 -4.679 5.299 1.00 0.00 H new ATOM 0 HG LEU A 87 -4.839 -4.367 7.798 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -2.975 -2.766 7.901 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -2.774 -3.944 6.582 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -3.305 -2.285 6.220 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -5.203 -2.061 8.621 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -5.649 -1.555 6.974 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -6.661 -2.730 7.848 1.00 0.00 H new ATOM 1344 N ALA A 88 -4.138 -1.207 4.278 1.00 0.00 N ATOM 1345 CA ALA A 88 -2.972 -0.624 3.632 1.00 0.00 C ATOM 1346 C ALA A 88 -2.014 -0.041 4.663 1.00 0.00 C ATOM 1347 O ALA A 88 -2.438 0.624 5.606 1.00 0.00 O ATOM 1348 CB ALA A 88 -3.403 0.452 2.648 1.00 0.00 C ATOM 0 H ALA A 88 -4.587 -0.600 4.964 1.00 0.00 H new ATOM 0 HA ALA A 88 -2.450 -1.413 3.090 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -2.523 0.882 2.170 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -4.050 0.013 1.889 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -3.946 1.234 3.179 1.00 0.00 H new ATOM 1354 N VAL A 89 -0.726 -0.296 4.487 1.00 0.00 N ATOM 1355 CA VAL A 89 0.290 0.241 5.386 1.00 0.00 C ATOM 1356 C VAL A 89 1.440 0.847 4.590 1.00 0.00 C ATOM 1357 O VAL A 89 1.936 0.243 3.638 1.00 0.00 O ATOM 1358 CB VAL A 89 0.860 -0.835 6.346 1.00 0.00 C ATOM 1359 CG1 VAL A 89 1.887 -0.235 7.292 1.00 0.00 C ATOM 1360 CG2 VAL A 89 -0.251 -1.505 7.137 1.00 0.00 C ATOM 0 H VAL A 89 -0.357 -0.872 3.730 1.00 0.00 H new ATOM 0 HA VAL A 89 -0.201 1.008 5.985 1.00 0.00 H new ATOM 0 HB VAL A 89 1.353 -1.591 5.735 1.00 0.00 H new ATOM 0 HG11 VAL A 89 2.270 -1.012 7.954 1.00 0.00 H new ATOM 0 HG12 VAL A 89 2.709 0.188 6.715 1.00 0.00 H new ATOM 0 HG13 VAL A 89 1.419 0.550 7.887 1.00 0.00 H new ATOM 0 HG21 VAL A 89 0.177 -2.255 7.802 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -0.780 -0.757 7.727 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -0.948 -1.985 6.450 1.00 0.00 H new ATOM 1370 N ASP A 90 1.853 2.039 4.984 1.00 0.00 N ATOM 1371 CA ASP A 90 2.966 2.727 4.344 1.00 0.00 C ATOM 1372 C ASP A 90 4.191 2.706 5.251 1.00 0.00 C ATOM 1373 O ASP A 90 4.070 2.911 6.461 1.00 0.00 O ATOM 1374 CB ASP A 90 2.573 4.168 4.010 1.00 0.00 C ATOM 1375 CG ASP A 90 3.754 5.023 3.591 1.00 0.00 C ATOM 1376 OD1 ASP A 90 4.397 4.705 2.570 1.00 0.00 O ATOM 1377 OD2 ASP A 90 4.041 6.019 4.292 1.00 0.00 O ATOM 0 H ASP A 90 1.430 2.558 5.754 1.00 0.00 H new ATOM 0 HA ASP A 90 3.213 2.210 3.417 1.00 0.00 H new ATOM 0 HB2 ASP A 90 1.834 4.161 3.208 1.00 0.00 H new ATOM 0 HB3 ASP A 90 2.095 4.619 4.880 1.00 0.00 H new ATOM 1382 N GLN A 91 5.357 2.434 4.660 1.00 0.00 N ATOM 1383 CA GLN A 91 6.628 2.384 5.390 1.00 0.00 C ATOM 1384 C GLN A 91 6.644 1.228 6.395 1.00 0.00 C ATOM 1385 O GLN A 91 7.160 1.355 7.506 1.00 0.00 O ATOM 1386 CB GLN A 91 6.895 3.725 6.089 1.00 0.00 C ATOM 1387 CG GLN A 91 7.248 4.847 5.123 1.00 0.00 C ATOM 1388 CD GLN A 91 7.247 6.211 5.783 1.00 0.00 C ATOM 1389 OE1 GLN A 91 8.253 6.646 6.342 1.00 0.00 O ATOM 1390 NE2 GLN A 91 6.125 6.908 5.701 1.00 0.00 N ATOM 0 H GLN A 91 5.448 2.242 3.662 1.00 0.00 H new ATOM 0 HA GLN A 91 7.428 2.205 4.671 1.00 0.00 H new ATOM 0 HB2 GLN A 91 6.012 4.011 6.660 1.00 0.00 H new ATOM 0 HB3 GLN A 91 7.709 3.599 6.802 1.00 0.00 H new ATOM 0 HG2 GLN A 91 8.232 4.656 4.695 1.00 0.00 H new ATOM 0 HG3 GLN A 91 6.536 4.847 4.298 1.00 0.00 H new ATOM 0 HE21 GLN A 91 5.312 6.512 5.229 1.00 0.00 H new ATOM 0 HE22 GLN A 91 6.073 7.841 6.110 1.00 0.00 H new ATOM 1399 N VAL A 92 6.129 0.083 5.948 1.00 0.00 N ATOM 1400 CA VAL A 92 5.954 -1.112 6.784 1.00 0.00 C ATOM 1401 C VAL A 92 7.255 -1.558 7.459 1.00 0.00 C ATOM 1402 O VAL A 92 7.232 -2.114 8.556 1.00 0.00 O ATOM 1403 CB VAL A 92 5.405 -2.284 5.939 1.00 0.00 C ATOM 1404 CG1 VAL A 92 5.024 -3.467 6.818 1.00 0.00 C ATOM 1405 CG2 VAL A 92 4.222 -1.834 5.098 1.00 0.00 C ATOM 0 H VAL A 92 5.817 -0.046 4.985 1.00 0.00 H new ATOM 0 HA VAL A 92 5.245 -0.839 7.565 1.00 0.00 H new ATOM 0 HB VAL A 92 6.198 -2.611 5.267 1.00 0.00 H new ATOM 0 HG11 VAL A 92 4.641 -4.275 6.195 1.00 0.00 H new ATOM 0 HG12 VAL A 92 5.902 -3.813 7.363 1.00 0.00 H new ATOM 0 HG13 VAL A 92 4.255 -3.161 7.527 1.00 0.00 H new ATOM 0 HG21 VAL A 92 3.852 -2.675 4.511 1.00 0.00 H new ATOM 0 HG22 VAL A 92 3.429 -1.470 5.751 1.00 0.00 H new ATOM 0 HG23 VAL A 92 4.536 -1.034 4.427 1.00 0.00 H new ATOM 1415 N GLU A 93 8.386 -1.310 6.810 1.00 0.00 N ATOM 1416 CA GLU A 93 9.682 -1.710 7.352 1.00 0.00 C ATOM 1417 C GLU A 93 9.922 -1.116 8.739 1.00 0.00 C ATOM 1418 O GLU A 93 10.554 -1.739 9.594 1.00 0.00 O ATOM 1419 CB GLU A 93 10.809 -1.278 6.415 1.00 0.00 C ATOM 1420 CG GLU A 93 12.184 -1.441 7.038 1.00 0.00 C ATOM 1421 CD GLU A 93 13.299 -0.927 6.161 1.00 0.00 C ATOM 1422 OE1 GLU A 93 13.299 0.285 5.851 1.00 0.00 O ATOM 1423 OE2 GLU A 93 14.200 -1.723 5.814 1.00 0.00 O ATOM 0 H GLU A 93 8.434 -0.835 5.909 1.00 0.00 H new ATOM 0 HA GLU A 93 9.674 -2.796 7.440 1.00 0.00 H new ATOM 0 HB2 GLU A 93 10.758 -1.865 5.498 1.00 0.00 H new ATOM 0 HB3 GLU A 93 10.663 -0.235 6.135 1.00 0.00 H new ATOM 0 HG2 GLU A 93 12.208 -0.914 7.992 1.00 0.00 H new ATOM 0 HG3 GLU A 93 12.356 -2.496 7.252 1.00 0.00 H new ATOM 1430 N LYS A 94 9.394 0.075 8.967 1.00 0.00 N ATOM 1431 CA LYS A 94 9.695 0.810 10.182 1.00 0.00 C ATOM 1432 C LYS A 94 8.804 0.389 11.354 1.00 0.00 C ATOM 1433 O LYS A 94 8.659 1.131 12.329 1.00 0.00 O ATOM 1434 CB LYS A 94 9.584 2.313 9.925 1.00 0.00 C ATOM 1435 CG LYS A 94 10.919 3.038 10.025 1.00 0.00 C ATOM 1436 CD LYS A 94 11.924 2.557 8.984 1.00 0.00 C ATOM 1437 CE LYS A 94 11.598 3.071 7.589 1.00 0.00 C ATOM 1438 NZ LYS A 94 12.707 2.805 6.629 1.00 0.00 N ATOM 0 H LYS A 94 8.757 0.551 8.329 1.00 0.00 H new ATOM 0 HA LYS A 94 10.719 0.570 10.467 1.00 0.00 H new ATOM 0 HB2 LYS A 94 9.163 2.475 8.933 1.00 0.00 H new ATOM 0 HB3 LYS A 94 8.887 2.747 10.642 1.00 0.00 H new ATOM 0 HG2 LYS A 94 10.757 4.109 9.902 1.00 0.00 H new ATOM 0 HG3 LYS A 94 11.335 2.891 11.022 1.00 0.00 H new ATOM 0 HD2 LYS A 94 12.923 2.888 9.267 1.00 0.00 H new ATOM 0 HD3 LYS A 94 11.940 1.467 8.973 1.00 0.00 H new ATOM 0 HE2 LYS A 94 10.685 2.596 7.231 1.00 0.00 H new ATOM 0 HE3 LYS A 94 11.404 4.143 7.632 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 12.526 3.313 5.740 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 13.606 3.132 7.038 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 12.764 1.784 6.439 1.00 0.00 H new ATOM 1452 N LEU A 95 8.203 -0.790 11.258 1.00 0.00 N ATOM 1453 CA LEU A 95 7.509 -1.382 12.393 1.00 0.00 C ATOM 1454 C LEU A 95 8.521 -2.045 13.331 1.00 0.00 C ATOM 1455 O LEU A 95 9.463 -2.702 12.875 1.00 0.00 O ATOM 1456 CB LEU A 95 6.473 -2.397 11.915 1.00 0.00 C ATOM 1457 CG LEU A 95 5.382 -1.826 11.005 1.00 0.00 C ATOM 1458 CD1 LEU A 95 4.413 -2.917 10.577 1.00 0.00 C ATOM 1459 CD2 LEU A 95 4.641 -0.690 11.697 1.00 0.00 C ATOM 0 H LEU A 95 8.182 -1.354 10.408 1.00 0.00 H new ATOM 0 HA LEU A 95 6.987 -0.596 12.939 1.00 0.00 H new ATOM 0 HB2 LEU A 95 6.988 -3.196 11.382 1.00 0.00 H new ATOM 0 HB3 LEU A 95 5.999 -2.848 12.787 1.00 0.00 H new ATOM 0 HG LEU A 95 5.861 -1.425 10.112 1.00 0.00 H new ATOM 0 HD11 LEU A 95 3.646 -2.490 9.931 1.00 0.00 H new ATOM 0 HD12 LEU A 95 4.954 -3.692 10.034 1.00 0.00 H new ATOM 0 HD13 LEU A 95 3.943 -3.353 11.459 1.00 0.00 H new ATOM 0 HD21 LEU A 95 3.871 -0.300 11.032 1.00 0.00 H new ATOM 0 HD22 LEU A 95 4.177 -1.061 12.611 1.00 0.00 H new ATOM 0 HD23 LEU A 95 5.344 0.106 11.944 1.00 0.00 H new ATOM 1471 N GLY A 96 8.330 -1.878 14.633 1.00 0.00 N ATOM 1472 CA GLY A 96 9.327 -2.324 15.593 1.00 0.00 C ATOM 1473 C GLY A 96 9.040 -3.690 16.195 1.00 0.00 C ATOM 1474 O GLY A 96 8.720 -3.790 17.382 1.00 0.00 O ATOM 0 H GLY A 96 7.504 -1.442 15.044 1.00 0.00 H new ATOM 0 HA2 GLY A 96 10.301 -2.352 15.104 1.00 0.00 H new ATOM 0 HA3 GLY A 96 9.395 -1.591 16.397 1.00 0.00 H new ATOM 1478 N ASN A 97 9.166 -4.738 15.373 1.00 0.00 N ATOM 1479 CA ASN A 97 9.024 -6.136 15.822 1.00 0.00 C ATOM 1480 C ASN A 97 7.574 -6.487 16.167 1.00 0.00 C ATOM 1481 O ASN A 97 6.985 -7.374 15.553 1.00 0.00 O ATOM 1482 CB ASN A 97 9.939 -6.419 17.026 1.00 0.00 C ATOM 1483 CG ASN A 97 9.801 -7.835 17.568 1.00 0.00 C ATOM 1484 OD1 ASN A 97 9.542 -8.786 16.828 1.00 0.00 O ATOM 1485 ND2 ASN A 97 9.963 -7.977 18.875 1.00 0.00 N ATOM 0 H ASN A 97 9.369 -4.646 14.378 1.00 0.00 H new ATOM 0 HA ASN A 97 9.327 -6.769 14.988 1.00 0.00 H new ATOM 0 HB2 ASN A 97 10.975 -6.249 16.734 1.00 0.00 H new ATOM 0 HB3 ASN A 97 9.711 -5.709 17.821 1.00 0.00 H new ATOM 0 HD21 ASN A 97 9.874 -8.899 19.303 1.00 0.00 H new ATOM 0 HD22 ASN A 97 10.177 -7.165 19.454 1.00 0.00 H new ATOM 1492 N GLU A 98 7.004 -5.781 17.133 1.00 0.00 N ATOM 1493 CA GLU A 98 5.657 -6.067 17.619 1.00 0.00 C ATOM 1494 C GLU A 98 4.621 -5.851 16.522 1.00 0.00 C ATOM 1495 O GLU A 98 3.825 -6.746 16.224 1.00 0.00 O ATOM 1496 CB GLU A 98 5.342 -5.179 18.819 1.00 0.00 C ATOM 1497 CG GLU A 98 6.332 -5.337 19.956 1.00 0.00 C ATOM 1498 CD GLU A 98 6.143 -4.296 21.035 1.00 0.00 C ATOM 1499 OE1 GLU A 98 5.299 -4.509 21.931 1.00 0.00 O ATOM 1500 OE2 GLU A 98 6.836 -3.257 20.992 1.00 0.00 O ATOM 0 H GLU A 98 7.458 -4.997 17.602 1.00 0.00 H new ATOM 0 HA GLU A 98 5.616 -7.113 17.922 1.00 0.00 H new ATOM 0 HB2 GLU A 98 5.330 -4.137 18.499 1.00 0.00 H new ATOM 0 HB3 GLU A 98 4.341 -5.412 19.182 1.00 0.00 H new ATOM 0 HG2 GLU A 98 6.225 -6.331 20.391 1.00 0.00 H new ATOM 0 HG3 GLU A 98 7.346 -5.268 19.563 1.00 0.00 H new ATOM 1507 N GLU A 99 4.642 -4.671 15.918 1.00 0.00 N ATOM 1508 CA GLU A 99 3.731 -4.363 14.824 1.00 0.00 C ATOM 1509 C GLU A 99 4.077 -5.212 13.607 1.00 0.00 C ATOM 1510 O GLU A 99 3.211 -5.546 12.804 1.00 0.00 O ATOM 1511 CB GLU A 99 3.791 -2.878 14.440 1.00 0.00 C ATOM 1512 CG GLU A 99 3.908 -1.924 15.618 1.00 0.00 C ATOM 1513 CD GLU A 99 5.348 -1.688 16.023 1.00 0.00 C ATOM 1514 OE1 GLU A 99 5.878 -2.471 16.830 1.00 0.00 O ATOM 1515 OE2 GLU A 99 5.958 -0.726 15.516 1.00 0.00 O ATOM 0 H GLU A 99 5.278 -3.913 16.166 1.00 0.00 H new ATOM 0 HA GLU A 99 2.720 -4.588 15.162 1.00 0.00 H new ATOM 0 HB2 GLU A 99 4.642 -2.722 13.777 1.00 0.00 H new ATOM 0 HB3 GLU A 99 2.895 -2.626 13.873 1.00 0.00 H new ATOM 0 HG2 GLU A 99 3.444 -0.972 15.360 1.00 0.00 H new ATOM 0 HG3 GLU A 99 3.355 -2.328 16.466 1.00 0.00 H new ATOM 1522 N GLN A 100 5.351 -5.570 13.492 1.00 0.00 N ATOM 1523 CA GLN A 100 5.820 -6.375 12.373 1.00 0.00 C ATOM 1524 C GLN A 100 5.244 -7.787 12.465 1.00 0.00 C ATOM 1525 O GLN A 100 4.807 -8.358 11.469 1.00 0.00 O ATOM 1526 CB GLN A 100 7.350 -6.424 12.356 1.00 0.00 C ATOM 1527 CG GLN A 100 7.930 -6.831 11.015 1.00 0.00 C ATOM 1528 CD GLN A 100 7.593 -5.834 9.923 1.00 0.00 C ATOM 1529 OE1 GLN A 100 6.579 -5.958 9.244 1.00 0.00 O ATOM 1530 NE2 GLN A 100 8.444 -4.836 9.755 1.00 0.00 N ATOM 0 H GLN A 100 6.077 -5.315 14.161 1.00 0.00 H new ATOM 0 HA GLN A 100 5.479 -5.917 11.445 1.00 0.00 H new ATOM 0 HB2 GLN A 100 7.740 -5.443 12.628 1.00 0.00 H new ATOM 0 HB3 GLN A 100 7.691 -7.125 13.118 1.00 0.00 H new ATOM 0 HG2 GLN A 100 9.013 -6.922 11.101 1.00 0.00 H new ATOM 0 HG3 GLN A 100 7.549 -7.814 10.739 1.00 0.00 H new ATOM 0 HE21 GLN A 100 9.276 -4.771 10.342 1.00 0.00 H new ATOM 0 HE22 GLN A 100 8.269 -4.131 9.039 1.00 0.00 H new ATOM 1539 N ALA A 101 5.233 -8.337 13.678 1.00 0.00 N ATOM 1540 CA ALA A 101 4.643 -9.650 13.920 1.00 0.00 C ATOM 1541 C ALA A 101 3.133 -9.599 13.713 1.00 0.00 C ATOM 1542 O ALA A 101 2.515 -10.579 13.293 1.00 0.00 O ATOM 1543 CB ALA A 101 4.971 -10.135 15.325 1.00 0.00 C ATOM 0 H ALA A 101 5.626 -7.893 14.508 1.00 0.00 H new ATOM 0 HA ALA A 101 5.068 -10.355 13.206 1.00 0.00 H new ATOM 0 HB1 ALA A 101 4.522 -11.115 15.486 1.00 0.00 H new ATOM 0 HB2 ALA A 101 6.052 -10.207 15.442 1.00 0.00 H new ATOM 0 HB3 ALA A 101 4.574 -9.430 16.055 1.00 0.00 H new ATOM 1549 N LEU A 102 2.549 -8.447 14.014 1.00 0.00 N ATOM 1550 CA LEU A 102 1.133 -8.214 13.764 1.00 0.00 C ATOM 1551 C LEU A 102 0.878 -8.210 12.257 1.00 0.00 C ATOM 1552 O LEU A 102 -0.022 -8.887 11.765 1.00 0.00 O ATOM 1553 CB LEU A 102 0.712 -6.879 14.394 1.00 0.00 C ATOM 1554 CG LEU A 102 -0.781 -6.711 14.718 1.00 0.00 C ATOM 1555 CD1 LEU A 102 -1.627 -6.638 13.455 1.00 0.00 C ATOM 1556 CD2 LEU A 102 -1.259 -7.841 15.619 1.00 0.00 C ATOM 0 H LEU A 102 3.037 -7.656 14.434 1.00 0.00 H new ATOM 0 HA LEU A 102 0.540 -9.010 14.215 1.00 0.00 H new ATOM 0 HB2 LEU A 102 1.278 -6.744 15.316 1.00 0.00 H new ATOM 0 HB3 LEU A 102 1.006 -6.076 13.719 1.00 0.00 H new ATOM 0 HG LEU A 102 -0.900 -5.765 15.246 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -2.676 -6.519 13.726 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -1.309 -5.787 12.853 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -1.502 -7.556 12.880 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -2.318 -7.708 15.839 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -1.111 -8.796 15.115 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -0.691 -7.830 16.549 1.00 0.00 H new ATOM 1568 N LEU A 103 1.692 -7.445 11.535 1.00 0.00 N ATOM 1569 CA LEU A 103 1.628 -7.384 10.076 1.00 0.00 C ATOM 1570 C LEU A 103 1.767 -8.785 9.480 1.00 0.00 C ATOM 1571 O LEU A 103 1.032 -9.159 8.565 1.00 0.00 O ATOM 1572 CB LEU A 103 2.739 -6.454 9.557 1.00 0.00 C ATOM 1573 CG LEU A 103 2.694 -6.076 8.063 1.00 0.00 C ATOM 1574 CD1 LEU A 103 3.215 -7.206 7.182 1.00 0.00 C ATOM 1575 CD2 LEU A 103 1.283 -5.681 7.646 1.00 0.00 C ATOM 0 H LEU A 103 2.414 -6.851 11.943 1.00 0.00 H new ATOM 0 HA LEU A 103 0.661 -6.985 9.770 1.00 0.00 H new ATOM 0 HB2 LEU A 103 2.710 -5.534 10.140 1.00 0.00 H new ATOM 0 HB3 LEU A 103 3.699 -6.929 9.758 1.00 0.00 H new ATOM 0 HG LEU A 103 3.350 -5.217 7.924 1.00 0.00 H new ATOM 0 HD11 LEU A 103 3.168 -6.903 6.136 1.00 0.00 H new ATOM 0 HD12 LEU A 103 4.248 -7.429 7.449 1.00 0.00 H new ATOM 0 HD13 LEU A 103 2.602 -8.095 7.330 1.00 0.00 H new ATOM 0 HD21 LEU A 103 1.276 -5.419 6.588 1.00 0.00 H new ATOM 0 HD22 LEU A 103 0.606 -6.518 7.817 1.00 0.00 H new ATOM 0 HD23 LEU A 103 0.956 -4.824 8.235 1.00 0.00 H new ATOM 1587 N PHE A 104 2.713 -9.553 10.010 1.00 0.00 N ATOM 1588 CA PHE A 104 2.912 -10.940 9.599 1.00 0.00 C ATOM 1589 C PHE A 104 1.620 -11.742 9.756 1.00 0.00 C ATOM 1590 O PHE A 104 1.255 -12.537 8.890 1.00 0.00 O ATOM 1591 CB PHE A 104 4.023 -11.579 10.436 1.00 0.00 C ATOM 1592 CG PHE A 104 4.331 -13.002 10.057 1.00 0.00 C ATOM 1593 CD1 PHE A 104 4.949 -13.295 8.853 1.00 0.00 C ATOM 1594 CD2 PHE A 104 4.008 -14.045 10.911 1.00 0.00 C ATOM 1595 CE1 PHE A 104 5.236 -14.602 8.508 1.00 0.00 C ATOM 1596 CE2 PHE A 104 4.293 -15.352 10.571 1.00 0.00 C ATOM 1597 CZ PHE A 104 4.909 -15.632 9.369 1.00 0.00 C ATOM 0 H PHE A 104 3.360 -9.235 10.732 1.00 0.00 H new ATOM 0 HA PHE A 104 3.201 -10.949 8.548 1.00 0.00 H new ATOM 0 HB2 PHE A 104 4.929 -10.982 10.335 1.00 0.00 H new ATOM 0 HB3 PHE A 104 3.736 -11.547 11.487 1.00 0.00 H new ATOM 0 HD1 PHE A 104 5.209 -12.494 8.177 1.00 0.00 H new ATOM 0 HD2 PHE A 104 3.527 -13.832 11.854 1.00 0.00 H new ATOM 0 HE1 PHE A 104 5.716 -14.818 7.565 1.00 0.00 H new ATOM 0 HE2 PHE A 104 4.034 -16.155 11.245 1.00 0.00 H new ATOM 0 HZ PHE A 104 5.135 -16.654 9.102 1.00 0.00 H new ATOM 1607 N SER A 105 0.933 -11.518 10.867 1.00 0.00 N ATOM 1608 CA SER A 105 -0.321 -12.202 11.151 1.00 0.00 C ATOM 1609 C SER A 105 -1.417 -11.723 10.202 1.00 0.00 C ATOM 1610 O SER A 105 -2.321 -12.479 9.843 1.00 0.00 O ATOM 1611 CB SER A 105 -0.725 -11.961 12.605 1.00 0.00 C ATOM 1612 OG SER A 105 -1.702 -12.894 13.031 1.00 0.00 O ATOM 0 H SER A 105 1.226 -10.863 11.592 1.00 0.00 H new ATOM 0 HA SER A 105 -0.183 -13.272 10.998 1.00 0.00 H new ATOM 0 HB2 SER A 105 0.154 -12.034 13.245 1.00 0.00 H new ATOM 0 HB3 SER A 105 -1.115 -10.949 12.713 1.00 0.00 H new ATOM 0 HG SER A 105 -1.940 -12.715 13.965 1.00 0.00 H new ATOM 1618 N ILE A 106 -1.329 -10.463 9.795 1.00 0.00 N ATOM 1619 CA ILE A 106 -2.239 -9.922 8.791 1.00 0.00 C ATOM 1620 C ILE A 106 -2.062 -10.670 7.470 1.00 0.00 C ATOM 1621 O ILE A 106 -3.043 -11.057 6.832 1.00 0.00 O ATOM 1622 CB ILE A 106 -2.018 -8.407 8.571 1.00 0.00 C ATOM 1623 CG1 ILE A 106 -2.291 -7.638 9.866 1.00 0.00 C ATOM 1624 CG2 ILE A 106 -2.904 -7.889 7.443 1.00 0.00 C ATOM 1625 CD1 ILE A 106 -2.064 -6.145 9.746 1.00 0.00 C ATOM 0 H ILE A 106 -0.639 -9.797 10.143 1.00 0.00 H new ATOM 0 HA ILE A 106 -3.256 -10.059 9.158 1.00 0.00 H new ATOM 0 HB ILE A 106 -0.978 -8.249 8.285 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -3.321 -7.816 10.174 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -1.650 -8.032 10.654 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -2.732 -6.821 7.306 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -2.664 -8.417 6.520 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -3.951 -8.058 7.696 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -2.277 -5.667 10.702 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -1.027 -5.956 9.469 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -2.724 -5.737 8.981 1.00 0.00 H new ATOM 1637 N PHE A 107 -0.808 -10.880 7.071 1.00 0.00 N ATOM 1638 CA PHE A 107 -0.504 -11.709 5.909 1.00 0.00 C ATOM 1639 C PHE A 107 -1.076 -13.106 6.103 1.00 0.00 C ATOM 1640 O PHE A 107 -1.636 -13.699 5.178 1.00 0.00 O ATOM 1641 CB PHE A 107 1.011 -11.811 5.693 1.00 0.00 C ATOM 1642 CG PHE A 107 1.543 -10.929 4.602 1.00 0.00 C ATOM 1643 CD1 PHE A 107 1.387 -11.284 3.273 1.00 0.00 C ATOM 1644 CD2 PHE A 107 2.208 -9.753 4.903 1.00 0.00 C ATOM 1645 CE1 PHE A 107 1.883 -10.482 2.263 1.00 0.00 C ATOM 1646 CE2 PHE A 107 2.706 -8.946 3.898 1.00 0.00 C ATOM 1647 CZ PHE A 107 2.541 -9.310 2.575 1.00 0.00 C ATOM 0 H PHE A 107 0.011 -10.488 7.535 1.00 0.00 H new ATOM 0 HA PHE A 107 -0.956 -11.243 5.033 1.00 0.00 H new ATOM 0 HB2 PHE A 107 1.516 -11.560 6.625 1.00 0.00 H new ATOM 0 HB3 PHE A 107 1.264 -12.846 5.462 1.00 0.00 H new ATOM 0 HD1 PHE A 107 0.871 -12.199 3.023 1.00 0.00 H new ATOM 0 HD2 PHE A 107 2.339 -9.463 5.935 1.00 0.00 H new ATOM 0 HE1 PHE A 107 1.756 -10.772 1.231 1.00 0.00 H new ATOM 0 HE2 PHE A 107 3.224 -8.031 4.146 1.00 0.00 H new ATOM 0 HZ PHE A 107 2.926 -8.679 1.788 1.00 0.00 H new ATOM 1657 N ASN A 108 -0.931 -13.617 7.321 1.00 0.00 N ATOM 1658 CA ASN A 108 -1.416 -14.944 7.674 1.00 0.00 C ATOM 1659 C ASN A 108 -2.920 -15.069 7.443 1.00 0.00 C ATOM 1660 O ASN A 108 -3.359 -15.970 6.732 1.00 0.00 O ATOM 1661 CB ASN A 108 -1.086 -15.259 9.137 1.00 0.00 C ATOM 1662 CG ASN A 108 -1.614 -16.613 9.579 1.00 0.00 C ATOM 1663 OD1 ASN A 108 -1.670 -17.564 8.797 1.00 0.00 O ATOM 1664 ND2 ASN A 108 -2.004 -16.707 10.842 1.00 0.00 N ATOM 0 H ASN A 108 -0.475 -13.124 8.089 1.00 0.00 H new ATOM 0 HA ASN A 108 -0.913 -15.663 7.028 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -0.005 -15.232 9.275 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -1.508 -14.483 9.776 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -2.367 -17.591 11.199 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -1.941 -15.896 11.457 1.00 0.00 H new ATOM 1671 N ARG A 109 -3.705 -14.160 8.021 1.00 0.00 N ATOM 1672 CA ARG A 109 -5.163 -14.259 7.927 1.00 0.00 C ATOM 1673 C ARG A 109 -5.630 -14.165 6.473 1.00 0.00 C ATOM 1674 O ARG A 109 -6.579 -14.839 6.079 1.00 0.00 O ATOM 1675 CB ARG A 109 -5.879 -13.199 8.786 1.00 0.00 C ATOM 1676 CG ARG A 109 -5.770 -11.773 8.261 1.00 0.00 C ATOM 1677 CD ARG A 109 -7.019 -10.954 8.583 1.00 0.00 C ATOM 1678 NE ARG A 109 -8.206 -11.486 7.907 1.00 0.00 N ATOM 1679 CZ ARG A 109 -9.091 -10.739 7.238 1.00 0.00 C ATOM 1680 NH1 ARG A 109 -8.995 -9.417 7.236 1.00 0.00 N ATOM 1681 NH2 ARG A 109 -10.091 -11.318 6.589 1.00 0.00 N ATOM 0 H ARG A 109 -3.364 -13.358 8.552 1.00 0.00 H new ATOM 0 HA ARG A 109 -5.434 -15.239 8.321 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -6.934 -13.464 8.861 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -5.469 -13.232 9.795 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -4.896 -11.290 8.698 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -5.617 -11.793 7.182 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -7.184 -10.951 9.660 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -6.862 -9.918 8.282 1.00 0.00 H new ATOM 0 HE ARG A 109 -8.368 -12.492 7.950 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -8.241 -8.960 7.748 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -9.675 -8.857 6.722 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -10.186 -12.334 6.600 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -10.766 -10.748 6.079 1.00 0.00 H new ATOM 1695 N PHE A 110 -4.948 -13.343 5.676 1.00 0.00 N ATOM 1696 CA PHE A 110 -5.283 -13.201 4.263 1.00 0.00 C ATOM 1697 C PHE A 110 -4.947 -14.480 3.504 1.00 0.00 C ATOM 1698 O PHE A 110 -5.804 -15.067 2.843 1.00 0.00 O ATOM 1699 CB PHE A 110 -4.529 -12.023 3.633 1.00 0.00 C ATOM 1700 CG PHE A 110 -4.954 -10.667 4.124 1.00 0.00 C ATOM 1701 CD1 PHE A 110 -6.145 -10.490 4.809 1.00 0.00 C ATOM 1702 CD2 PHE A 110 -4.159 -9.558 3.880 1.00 0.00 C ATOM 1703 CE1 PHE A 110 -6.531 -9.235 5.241 1.00 0.00 C ATOM 1704 CE2 PHE A 110 -4.541 -8.304 4.311 1.00 0.00 C ATOM 1705 CZ PHE A 110 -5.729 -8.141 4.991 1.00 0.00 C ATOM 0 H PHE A 110 -4.164 -12.768 5.985 1.00 0.00 H new ATOM 0 HA PHE A 110 -6.354 -13.010 4.195 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -3.464 -12.146 3.827 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -4.663 -12.061 2.552 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -6.779 -11.342 5.008 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -3.228 -9.677 3.345 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -7.462 -9.111 5.775 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -3.909 -7.450 4.116 1.00 0.00 H new ATOM 0 HZ PHE A 110 -6.031 -7.160 5.327 1.00 0.00 H new ATOM 1715 N ARG A 111 -3.696 -14.914 3.630 1.00 0.00 N ATOM 1716 CA ARG A 111 -3.203 -16.101 2.940 1.00 0.00 C ATOM 1717 C ARG A 111 -4.018 -17.329 3.351 1.00 0.00 C ATOM 1718 O ARG A 111 -4.391 -18.155 2.517 1.00 0.00 O ATOM 1719 CB ARG A 111 -1.717 -16.300 3.287 1.00 0.00 C ATOM 1720 CG ARG A 111 -0.893 -17.084 2.266 1.00 0.00 C ATOM 1721 CD ARG A 111 -1.390 -18.509 2.090 1.00 0.00 C ATOM 1722 NE ARG A 111 -0.303 -19.453 1.808 1.00 0.00 N ATOM 1723 CZ ARG A 111 -0.311 -20.315 0.796 1.00 0.00 C ATOM 1724 NH1 ARG A 111 -1.262 -20.246 -0.127 1.00 0.00 N ATOM 1725 NH2 ARG A 111 0.661 -21.215 0.690 1.00 0.00 N ATOM 0 H ARG A 111 -2.997 -14.453 4.212 1.00 0.00 H new ATOM 0 HA ARG A 111 -3.309 -15.969 1.863 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -1.260 -15.319 3.418 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -1.653 -16.812 4.247 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -0.926 -16.570 1.305 1.00 0.00 H new ATOM 0 HG3 ARG A 111 0.150 -17.103 2.582 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -1.913 -18.822 2.994 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -2.114 -18.540 1.276 1.00 0.00 H new ATOM 0 HE ARG A 111 0.508 -19.448 2.426 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -1.987 -19.532 -0.060 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -1.268 -20.907 -0.903 1.00 0.00 H new ATOM 0 HH21 ARG A 111 1.409 -21.242 1.383 1.00 0.00 H new ATOM 0 HH22 ARG A 111 0.659 -21.879 -0.085 1.00 0.00 H new ATOM 1739 N ASN A 112 -4.301 -17.430 4.641 1.00 0.00 N ATOM 1740 CA ASN A 112 -4.977 -18.599 5.193 1.00 0.00 C ATOM 1741 C ASN A 112 -6.410 -18.719 4.683 1.00 0.00 C ATOM 1742 O ASN A 112 -6.842 -19.801 4.282 1.00 0.00 O ATOM 1743 CB ASN A 112 -4.991 -18.535 6.720 1.00 0.00 C ATOM 1744 CG ASN A 112 -4.461 -19.798 7.360 1.00 0.00 C ATOM 1745 OD1 ASN A 112 -5.194 -20.765 7.560 1.00 0.00 O ATOM 1746 ND2 ASN A 112 -3.190 -19.784 7.723 1.00 0.00 N ATOM 0 H ASN A 112 -4.072 -16.713 5.330 1.00 0.00 H new ATOM 0 HA ASN A 112 -4.420 -19.477 4.864 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -4.392 -17.686 7.050 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -6.010 -18.358 7.063 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -2.783 -20.596 8.188 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -2.616 -18.961 7.538 1.00 0.00 H new ATOM 1753 N SER A 113 -7.144 -17.615 4.699 1.00 0.00 N ATOM 1754 CA SER A 113 -8.552 -17.639 4.335 1.00 0.00 C ATOM 1755 C SER A 113 -8.739 -17.595 2.823 1.00 0.00 C ATOM 1756 O SER A 113 -9.552 -18.335 2.266 1.00 0.00 O ATOM 1757 CB SER A 113 -9.284 -16.466 4.991 1.00 0.00 C ATOM 1758 OG SER A 113 -8.747 -15.221 4.573 1.00 0.00 O ATOM 0 H SER A 113 -6.789 -16.695 4.959 1.00 0.00 H new ATOM 0 HA SER A 113 -8.976 -18.576 4.696 1.00 0.00 H new ATOM 0 HB2 SER A 113 -10.344 -16.510 4.739 1.00 0.00 H new ATOM 0 HB3 SER A 113 -9.210 -16.550 6.075 1.00 0.00 H new ATOM 0 HG SER A 113 -8.064 -14.928 5.212 1.00 0.00 H new ATOM 1764 N GLY A 114 -7.972 -16.741 2.161 1.00 0.00 N ATOM 1765 CA GLY A 114 -8.145 -16.533 0.741 1.00 0.00 C ATOM 1766 C GLY A 114 -8.846 -15.220 0.463 1.00 0.00 C ATOM 1767 O GLY A 114 -9.042 -14.837 -0.692 1.00 0.00 O ATOM 0 H GLY A 114 -7.229 -16.186 2.586 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -7.173 -16.541 0.248 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -8.724 -17.354 0.318 1.00 0.00 H new ATOM 1771 N LYS A 115 -9.223 -14.536 1.534 1.00 0.00 N ATOM 1772 CA LYS A 115 -9.862 -13.245 1.435 1.00 0.00 C ATOM 1773 C LYS A 115 -8.929 -12.188 2.023 1.00 0.00 C ATOM 1774 O LYS A 115 -7.894 -12.520 2.599 1.00 0.00 O ATOM 1775 CB LYS A 115 -11.210 -13.279 2.179 1.00 0.00 C ATOM 1776 CG LYS A 115 -11.988 -11.974 2.126 1.00 0.00 C ATOM 1777 CD LYS A 115 -13.394 -12.118 2.686 1.00 0.00 C ATOM 1778 CE LYS A 115 -14.260 -13.002 1.800 1.00 0.00 C ATOM 1779 NZ LYS A 115 -15.682 -13.006 2.230 1.00 0.00 N ATOM 0 H LYS A 115 -9.092 -14.865 2.491 1.00 0.00 H new ATOM 0 HA LYS A 115 -10.060 -12.995 0.393 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -11.825 -14.073 1.755 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -11.029 -13.538 3.222 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -11.451 -11.210 2.689 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -12.044 -11.628 1.094 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -13.346 -12.542 3.689 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -13.852 -11.133 2.778 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -14.195 -12.655 0.769 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -13.874 -14.021 1.818 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -16.234 -13.621 1.598 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -15.749 -13.362 3.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -16.060 -12.038 2.188 1.00 0.00 H new ATOM 1793 N GLY A 116 -9.299 -10.933 1.888 1.00 0.00 N ATOM 1794 CA GLY A 116 -8.472 -9.864 2.391 1.00 0.00 C ATOM 1795 C GLY A 116 -7.722 -9.163 1.283 1.00 0.00 C ATOM 1796 O GLY A 116 -7.304 -9.787 0.307 1.00 0.00 O ATOM 0 H GLY A 116 -10.162 -10.631 1.436 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -9.094 -9.143 2.921 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -7.761 -10.264 3.114 1.00 0.00 H new ATOM 1800 N PHE A 117 -7.575 -7.863 1.421 1.00 0.00 N ATOM 1801 CA PHE A 117 -6.872 -7.060 0.440 1.00 0.00 C ATOM 1802 C PHE A 117 -5.800 -6.243 1.145 1.00 0.00 C ATOM 1803 O PHE A 117 -6.089 -5.549 2.121 1.00 0.00 O ATOM 1804 CB PHE A 117 -7.853 -6.138 -0.288 1.00 0.00 C ATOM 1805 CG PHE A 117 -8.966 -6.862 -0.995 1.00 0.00 C ATOM 1806 CD1 PHE A 117 -10.115 -7.234 -0.316 1.00 0.00 C ATOM 1807 CD2 PHE A 117 -8.863 -7.162 -2.343 1.00 0.00 C ATOM 1808 CE1 PHE A 117 -11.137 -7.897 -0.967 1.00 0.00 C ATOM 1809 CE2 PHE A 117 -9.884 -7.824 -3.001 1.00 0.00 C ATOM 1810 CZ PHE A 117 -11.022 -8.191 -2.311 1.00 0.00 C ATOM 0 H PHE A 117 -7.938 -7.333 2.213 1.00 0.00 H new ATOM 0 HA PHE A 117 -6.404 -7.711 -0.299 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -8.285 -5.444 0.432 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -7.303 -5.541 -1.015 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -10.213 -7.003 0.734 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -7.975 -6.876 -2.887 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -12.026 -8.185 -0.425 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -9.791 -8.053 -4.052 1.00 0.00 H new ATOM 0 HZ PHE A 117 -11.821 -8.707 -2.822 1.00 0.00 H new ATOM 1820 N LEU A 118 -4.569 -6.336 0.667 1.00 0.00 N ATOM 1821 CA LEU A 118 -3.456 -5.681 1.334 1.00 0.00 C ATOM 1822 C LEU A 118 -2.690 -4.787 0.372 1.00 0.00 C ATOM 1823 O LEU A 118 -2.428 -5.157 -0.776 1.00 0.00 O ATOM 1824 CB LEU A 118 -2.501 -6.714 1.932 1.00 0.00 C ATOM 1825 CG LEU A 118 -1.469 -6.160 2.920 1.00 0.00 C ATOM 1826 CD1 LEU A 118 -2.152 -5.531 4.124 1.00 0.00 C ATOM 1827 CD2 LEU A 118 -0.523 -7.261 3.362 1.00 0.00 C ATOM 0 H LEU A 118 -4.317 -6.855 -0.174 1.00 0.00 H new ATOM 0 HA LEU A 118 -3.870 -5.067 2.133 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -3.090 -7.478 2.439 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -1.971 -7.208 1.118 1.00 0.00 H new ATOM 0 HG LEU A 118 -0.894 -5.384 2.415 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -1.398 -5.145 4.810 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -2.793 -4.714 3.793 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -2.756 -6.282 4.633 1.00 0.00 H new ATOM 0 HD21 LEU A 118 0.205 -6.855 4.064 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -1.090 -8.055 3.847 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -0.004 -7.665 2.493 1.00 0.00 H new ATOM 1839 N LEU A 119 -2.330 -3.621 0.865 1.00 0.00 N ATOM 1840 CA LEU A 119 -1.551 -2.654 0.109 1.00 0.00 C ATOM 1841 C LEU A 119 -0.358 -2.214 0.935 1.00 0.00 C ATOM 1842 O LEU A 119 -0.515 -1.732 2.056 1.00 0.00 O ATOM 1843 CB LEU A 119 -2.412 -1.443 -0.259 1.00 0.00 C ATOM 1844 CG LEU A 119 -2.619 -1.227 -1.756 1.00 0.00 C ATOM 1845 CD1 LEU A 119 -1.307 -0.868 -2.437 1.00 0.00 C ATOM 1846 CD2 LEU A 119 -3.218 -2.472 -2.384 1.00 0.00 C ATOM 0 H LEU A 119 -2.569 -3.312 1.807 1.00 0.00 H new ATOM 0 HA LEU A 119 -1.203 -3.119 -0.813 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -3.387 -1.553 0.215 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -1.952 -0.549 0.161 1.00 0.00 H new ATOM 0 HG LEU A 119 -3.310 -0.395 -1.892 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -1.479 -0.719 -3.503 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -0.910 0.049 -2.002 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -0.590 -1.677 -2.295 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -3.362 -2.308 -3.452 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -2.544 -3.315 -2.234 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -4.179 -2.688 -1.918 1.00 0.00 H new ATOM 1858 N LEU A 120 0.832 -2.395 0.396 1.00 0.00 N ATOM 1859 CA LEU A 120 2.043 -2.083 1.129 1.00 0.00 C ATOM 1860 C LEU A 120 2.881 -1.052 0.391 1.00 0.00 C ATOM 1861 O LEU A 120 3.183 -1.213 -0.791 1.00 0.00 O ATOM 1862 CB LEU A 120 2.865 -3.351 1.355 1.00 0.00 C ATOM 1863 CG LEU A 120 2.163 -4.466 2.136 1.00 0.00 C ATOM 1864 CD1 LEU A 120 3.069 -5.682 2.249 1.00 0.00 C ATOM 1865 CD2 LEU A 120 1.757 -3.980 3.520 1.00 0.00 C ATOM 0 H LEU A 120 0.986 -2.756 -0.545 1.00 0.00 H new ATOM 0 HA LEU A 120 1.753 -1.664 2.093 1.00 0.00 H new ATOM 0 HB2 LEU A 120 3.165 -3.746 0.384 1.00 0.00 H new ATOM 0 HB3 LEU A 120 3.778 -3.080 1.885 1.00 0.00 H new ATOM 0 HG LEU A 120 1.261 -4.750 1.593 1.00 0.00 H new ATOM 0 HD11 LEU A 120 2.557 -6.467 2.806 1.00 0.00 H new ATOM 0 HD12 LEU A 120 3.315 -6.047 1.252 1.00 0.00 H new ATOM 0 HD13 LEU A 120 3.986 -5.406 2.770 1.00 0.00 H new ATOM 0 HD21 LEU A 120 1.260 -4.787 4.058 1.00 0.00 H new ATOM 0 HD22 LEU A 120 2.644 -3.669 4.071 1.00 0.00 H new ATOM 0 HD23 LEU A 120 1.075 -3.135 3.423 1.00 0.00 H new ATOM 1877 N GLY A 121 3.233 0.011 1.095 1.00 0.00 N ATOM 1878 CA GLY A 121 4.131 1.002 0.549 1.00 0.00 C ATOM 1879 C GLY A 121 5.459 0.981 1.273 1.00 0.00 C ATOM 1880 O GLY A 121 5.507 0.689 2.471 1.00 0.00 O ATOM 0 H GLY A 121 2.909 0.205 2.043 1.00 0.00 H new ATOM 0 HA2 GLY A 121 4.288 0.812 -0.513 1.00 0.00 H new ATOM 0 HA3 GLY A 121 3.682 1.992 0.633 1.00 0.00 H new ATOM 1884 N SER A 122 6.539 1.262 0.563 1.00 0.00 N ATOM 1885 CA SER A 122 7.861 1.237 1.169 1.00 0.00 C ATOM 1886 C SER A 122 8.853 2.035 0.328 1.00 0.00 C ATOM 1887 O SER A 122 8.489 2.604 -0.702 1.00 0.00 O ATOM 1888 CB SER A 122 8.336 -0.213 1.323 1.00 0.00 C ATOM 1889 OG SER A 122 9.533 -0.301 2.084 1.00 0.00 O ATOM 0 H SER A 122 6.528 1.508 -0.427 1.00 0.00 H new ATOM 0 HA SER A 122 7.803 1.698 2.155 1.00 0.00 H new ATOM 0 HB2 SER A 122 7.555 -0.801 1.805 1.00 0.00 H new ATOM 0 HB3 SER A 122 8.500 -0.648 0.337 1.00 0.00 H new ATOM 0 HG SER A 122 9.486 0.320 2.841 1.00 0.00 H new ATOM 1895 N GLU A 123 10.103 2.059 0.776 1.00 0.00 N ATOM 1896 CA GLU A 123 11.157 2.817 0.120 1.00 0.00 C ATOM 1897 C GLU A 123 12.073 1.897 -0.684 1.00 0.00 C ATOM 1898 O GLU A 123 12.859 2.355 -1.512 1.00 0.00 O ATOM 1899 CB GLU A 123 11.966 3.577 1.171 1.00 0.00 C ATOM 1900 CG GLU A 123 12.500 2.687 2.285 1.00 0.00 C ATOM 1901 CD GLU A 123 13.210 3.468 3.368 1.00 0.00 C ATOM 1902 OE1 GLU A 123 12.523 4.015 4.258 1.00 0.00 O ATOM 1903 OE2 GLU A 123 14.455 3.537 3.341 1.00 0.00 O ATOM 0 H GLU A 123 10.413 1.552 1.605 1.00 0.00 H new ATOM 0 HA GLU A 123 10.700 3.525 -0.572 1.00 0.00 H new ATOM 0 HB2 GLU A 123 12.803 4.077 0.683 1.00 0.00 H new ATOM 0 HB3 GLU A 123 11.340 4.356 1.607 1.00 0.00 H new ATOM 0 HG2 GLU A 123 11.674 2.130 2.727 1.00 0.00 H new ATOM 0 HG3 GLU A 123 13.187 1.955 1.861 1.00 0.00 H new ATOM 1910 N TYR A 124 11.970 0.599 -0.428 1.00 0.00 N ATOM 1911 CA TYR A 124 12.781 -0.391 -1.126 1.00 0.00 C ATOM 1912 C TYR A 124 11.915 -1.557 -1.581 1.00 0.00 C ATOM 1913 O TYR A 124 10.696 -1.541 -1.412 1.00 0.00 O ATOM 1914 CB TYR A 124 13.907 -0.921 -0.225 1.00 0.00 C ATOM 1915 CG TYR A 124 15.020 0.065 0.046 1.00 0.00 C ATOM 1916 CD1 TYR A 124 15.824 0.536 -0.986 1.00 0.00 C ATOM 1917 CD2 TYR A 124 15.272 0.515 1.335 1.00 0.00 C ATOM 1918 CE1 TYR A 124 16.848 1.426 -0.739 1.00 0.00 C ATOM 1919 CE2 TYR A 124 16.298 1.403 1.589 1.00 0.00 C ATOM 1920 CZ TYR A 124 17.082 1.857 0.550 1.00 0.00 C ATOM 1921 OH TYR A 124 18.107 2.739 0.802 1.00 0.00 O ATOM 0 H TYR A 124 11.329 0.206 0.261 1.00 0.00 H new ATOM 0 HA TYR A 124 13.225 0.098 -1.993 1.00 0.00 H new ATOM 0 HB2 TYR A 124 13.476 -1.231 0.727 1.00 0.00 H new ATOM 0 HB3 TYR A 124 14.334 -1.811 -0.687 1.00 0.00 H new ATOM 0 HD1 TYR A 124 15.644 0.200 -1.996 1.00 0.00 H new ATOM 0 HD2 TYR A 124 14.657 0.165 2.151 1.00 0.00 H new ATOM 0 HE1 TYR A 124 17.464 1.784 -1.551 1.00 0.00 H new ATOM 0 HE2 TYR A 124 16.486 1.741 2.598 1.00 0.00 H new ATOM 0 HH TYR A 124 18.135 2.942 1.760 1.00 0.00 H new ATOM 1931 N THR A 125 12.558 -2.567 -2.147 1.00 0.00 N ATOM 1932 CA THR A 125 11.881 -3.786 -2.547 1.00 0.00 C ATOM 1933 C THR A 125 11.551 -4.637 -1.319 1.00 0.00 C ATOM 1934 O THR A 125 12.224 -4.536 -0.288 1.00 0.00 O ATOM 1935 CB THR A 125 12.751 -4.582 -3.537 1.00 0.00 C ATOM 1936 OG1 THR A 125 14.112 -4.573 -3.094 1.00 0.00 O ATOM 1937 CG2 THR A 125 12.656 -3.988 -4.934 1.00 0.00 C ATOM 0 H THR A 125 13.560 -2.563 -2.340 1.00 0.00 H new ATOM 0 HA THR A 125 10.948 -3.520 -3.045 1.00 0.00 H new ATOM 0 HB THR A 125 12.388 -5.609 -3.575 1.00 0.00 H new ATOM 0 HG1 THR A 125 14.664 -5.081 -3.724 1.00 0.00 H new ATOM 0 HG21 THR A 125 13.278 -4.565 -5.618 1.00 0.00 H new ATOM 0 HG22 THR A 125 11.620 -4.018 -5.272 1.00 0.00 H new ATOM 0 HG23 THR A 125 13.001 -2.954 -4.914 1.00 0.00 H new ATOM 1945 N PRO A 126 10.525 -5.498 -1.414 1.00 0.00 N ATOM 1946 CA PRO A 126 9.965 -6.210 -0.252 1.00 0.00 C ATOM 1947 C PRO A 126 10.944 -7.172 0.414 1.00 0.00 C ATOM 1948 O PRO A 126 10.877 -7.401 1.620 1.00 0.00 O ATOM 1949 CB PRO A 126 8.784 -6.982 -0.845 1.00 0.00 C ATOM 1950 CG PRO A 126 9.097 -7.113 -2.294 1.00 0.00 C ATOM 1951 CD PRO A 126 9.832 -5.858 -2.663 1.00 0.00 C ATOM 0 HA PRO A 126 9.697 -5.511 0.541 1.00 0.00 H new ATOM 0 HB2 PRO A 126 8.676 -7.959 -0.375 1.00 0.00 H new ATOM 0 HB3 PRO A 126 7.846 -6.448 -0.691 1.00 0.00 H new ATOM 0 HG2 PRO A 126 9.708 -7.995 -2.485 1.00 0.00 H new ATOM 0 HG3 PRO A 126 8.187 -7.222 -2.883 1.00 0.00 H new ATOM 0 HD2 PRO A 126 10.534 -6.027 -3.479 1.00 0.00 H new ATOM 0 HD3 PRO A 126 9.150 -5.072 -2.987 1.00 0.00 H new ATOM 1959 N GLN A 127 11.850 -7.733 -0.369 1.00 0.00 N ATOM 1960 CA GLN A 127 12.791 -8.718 0.145 1.00 0.00 C ATOM 1961 C GLN A 127 14.119 -8.069 0.509 1.00 0.00 C ATOM 1962 O GLN A 127 15.016 -8.726 1.043 1.00 0.00 O ATOM 1963 CB GLN A 127 13.017 -9.824 -0.885 1.00 0.00 C ATOM 1964 CG GLN A 127 11.744 -10.545 -1.299 1.00 0.00 C ATOM 1965 CD GLN A 127 11.999 -11.658 -2.301 1.00 0.00 C ATOM 1966 OE1 GLN A 127 13.025 -11.500 -3.121 1.00 0.00 O flip ATOM 1967 NE2 GLN A 127 11.276 -12.654 -2.338 1.00 0.00 N flip ATOM 0 H GLN A 127 11.955 -7.525 -1.362 1.00 0.00 H new ATOM 0 HA GLN A 127 12.362 -9.153 1.048 1.00 0.00 H new ATOM 0 HB2 GLN A 127 13.484 -9.393 -1.771 1.00 0.00 H new ATOM 0 HB3 GLN A 127 13.719 -10.551 -0.476 1.00 0.00 H new ATOM 0 HG2 GLN A 127 11.263 -10.962 -0.414 1.00 0.00 H new ATOM 0 HG3 GLN A 127 11.048 -9.826 -1.731 1.00 0.00 H new ATOM 0 HE21 GLN A 127 10.494 -12.741 -1.689 1.00 0.00 H new ATOM 0 HE22 GLN A 127 11.459 -13.392 -3.017 1.00 0.00 H new ATOM 1976 N GLN A 128 14.239 -6.779 0.224 1.00 0.00 N ATOM 1977 CA GLN A 128 15.469 -6.055 0.509 1.00 0.00 C ATOM 1978 C GLN A 128 15.302 -5.237 1.785 1.00 0.00 C ATOM 1979 O GLN A 128 16.249 -4.623 2.281 1.00 0.00 O ATOM 1980 CB GLN A 128 15.833 -5.148 -0.666 1.00 0.00 C ATOM 1981 CG GLN A 128 17.304 -4.770 -0.722 1.00 0.00 C ATOM 1982 CD GLN A 128 17.637 -3.905 -1.921 1.00 0.00 C ATOM 1983 OE1 GLN A 128 17.927 -4.415 -3.004 1.00 0.00 O ATOM 1984 NE2 GLN A 128 17.615 -2.596 -1.735 1.00 0.00 N ATOM 0 H GLN A 128 13.503 -6.216 -0.202 1.00 0.00 H new ATOM 0 HA GLN A 128 16.279 -6.770 0.654 1.00 0.00 H new ATOM 0 HB2 GLN A 128 15.561 -5.648 -1.596 1.00 0.00 H new ATOM 0 HB3 GLN A 128 15.236 -4.238 -0.608 1.00 0.00 H new ATOM 0 HG2 GLN A 128 17.574 -4.239 0.191 1.00 0.00 H new ATOM 0 HG3 GLN A 128 17.908 -5.677 -0.754 1.00 0.00 H new ATOM 0 HE21 GLN A 128 17.369 -2.215 -0.821 1.00 0.00 H new ATOM 0 HE22 GLN A 128 17.844 -1.968 -2.505 1.00 0.00 H new ATOM 1993 N LEU A 129 14.082 -5.228 2.306 1.00 0.00 N ATOM 1994 CA LEU A 129 13.795 -4.561 3.562 1.00 0.00 C ATOM 1995 C LEU A 129 14.407 -5.335 4.719 1.00 0.00 C ATOM 1996 O LEU A 129 14.358 -6.567 4.746 1.00 0.00 O ATOM 1997 CB LEU A 129 12.285 -4.437 3.766 1.00 0.00 C ATOM 1998 CG LEU A 129 11.553 -3.594 2.723 1.00 0.00 C ATOM 1999 CD1 LEU A 129 10.061 -3.575 3.010 1.00 0.00 C ATOM 2000 CD2 LEU A 129 12.112 -2.179 2.696 1.00 0.00 C ATOM 0 H LEU A 129 13.275 -5.678 1.874 1.00 0.00 H new ATOM 0 HA LEU A 129 14.231 -3.562 3.530 1.00 0.00 H new ATOM 0 HB2 LEU A 129 11.852 -5.437 3.770 1.00 0.00 H new ATOM 0 HB3 LEU A 129 12.102 -4.007 4.751 1.00 0.00 H new ATOM 0 HG LEU A 129 11.709 -4.043 1.742 1.00 0.00 H new ATOM 0 HD11 LEU A 129 9.554 -2.970 2.258 1.00 0.00 H new ATOM 0 HD12 LEU A 129 9.672 -4.593 2.980 1.00 0.00 H new ATOM 0 HD13 LEU A 129 9.886 -3.148 3.998 1.00 0.00 H new ATOM 0 HD21 LEU A 129 11.580 -1.592 1.948 1.00 0.00 H new ATOM 0 HD22 LEU A 129 11.985 -1.719 3.676 1.00 0.00 H new ATOM 0 HD23 LEU A 129 13.172 -2.211 2.445 1.00 0.00 H new ATOM 2012 N VAL A 130 14.979 -4.621 5.676 1.00 0.00 N ATOM 2013 CA VAL A 130 15.582 -5.271 6.825 1.00 0.00 C ATOM 2014 C VAL A 130 14.502 -5.599 7.851 1.00 0.00 C ATOM 2015 O VAL A 130 14.283 -4.863 8.816 1.00 0.00 O ATOM 2016 CB VAL A 130 16.685 -4.409 7.472 1.00 0.00 C ATOM 2017 CG1 VAL A 130 17.402 -5.178 8.572 1.00 0.00 C ATOM 2018 CG2 VAL A 130 17.675 -3.929 6.423 1.00 0.00 C ATOM 0 H VAL A 130 15.038 -3.603 5.679 1.00 0.00 H new ATOM 0 HA VAL A 130 16.055 -6.189 6.477 1.00 0.00 H new ATOM 0 HB VAL A 130 16.211 -3.537 7.922 1.00 0.00 H new ATOM 0 HG11 VAL A 130 18.175 -4.548 9.012 1.00 0.00 H new ATOM 0 HG12 VAL A 130 16.686 -5.465 9.342 1.00 0.00 H new ATOM 0 HG13 VAL A 130 17.860 -6.073 8.151 1.00 0.00 H new ATOM 0 HG21 VAL A 130 18.445 -3.323 6.900 1.00 0.00 H new ATOM 0 HG22 VAL A 130 18.138 -4.789 5.939 1.00 0.00 H new ATOM 0 HG23 VAL A 130 17.153 -3.331 5.677 1.00 0.00 H new ATOM 2028 N ILE A 131 13.799 -6.689 7.590 1.00 0.00 N ATOM 2029 CA ILE A 131 12.711 -7.152 8.440 1.00 0.00 C ATOM 2030 C ILE A 131 12.881 -8.638 8.720 1.00 0.00 C ATOM 2031 O ILE A 131 13.902 -9.221 8.349 1.00 0.00 O ATOM 2032 CB ILE A 131 11.332 -6.920 7.783 1.00 0.00 C ATOM 2033 CG1 ILE A 131 11.276 -7.594 6.408 1.00 0.00 C ATOM 2034 CG2 ILE A 131 11.049 -5.430 7.661 1.00 0.00 C ATOM 2035 CD1 ILE A 131 9.918 -7.521 5.744 1.00 0.00 C ATOM 0 H ILE A 131 13.967 -7.282 6.777 1.00 0.00 H new ATOM 0 HA ILE A 131 12.749 -6.580 9.367 1.00 0.00 H new ATOM 0 HB ILE A 131 10.565 -7.366 8.416 1.00 0.00 H new ATOM 0 HG12 ILE A 131 12.014 -7.128 5.755 1.00 0.00 H new ATOM 0 HG13 ILE A 131 11.561 -8.641 6.515 1.00 0.00 H new ATOM 0 HG21 ILE A 131 10.074 -5.282 7.196 1.00 0.00 H new ATOM 0 HG22 ILE A 131 11.051 -4.977 8.652 1.00 0.00 H new ATOM 0 HG23 ILE A 131 11.819 -4.963 7.047 1.00 0.00 H new ATOM 0 HD11 ILE A 131 9.959 -8.020 4.776 1.00 0.00 H new ATOM 0 HD12 ILE A 131 9.178 -8.013 6.375 1.00 0.00 H new ATOM 0 HD13 ILE A 131 9.638 -6.477 5.603 1.00 0.00 H new ATOM 2047 N ARG A 132 11.888 -9.237 9.379 1.00 0.00 N ATOM 2048 CA ARG A 132 11.892 -10.676 9.655 1.00 0.00 C ATOM 2049 C ARG A 132 12.241 -11.462 8.390 1.00 0.00 C ATOM 2050 O ARG A 132 11.659 -11.231 7.324 1.00 0.00 O ATOM 2051 CB ARG A 132 10.524 -11.130 10.173 1.00 0.00 C ATOM 2052 CG ARG A 132 10.079 -10.472 11.474 1.00 0.00 C ATOM 2053 CD ARG A 132 10.843 -10.998 12.685 1.00 0.00 C ATOM 2054 NE ARG A 132 12.087 -10.269 12.930 1.00 0.00 N ATOM 2055 CZ ARG A 132 12.831 -10.413 14.030 1.00 0.00 C ATOM 2056 NH1 ARG A 132 12.473 -11.275 14.977 1.00 0.00 N ATOM 2057 NH2 ARG A 132 13.930 -9.689 14.190 1.00 0.00 N ATOM 0 H ARG A 132 11.067 -8.746 9.733 1.00 0.00 H new ATOM 0 HA ARG A 132 12.645 -10.870 10.419 1.00 0.00 H new ATOM 0 HB2 ARG A 132 9.776 -10.928 9.406 1.00 0.00 H new ATOM 0 HB3 ARG A 132 10.547 -12.210 10.319 1.00 0.00 H new ATOM 0 HG2 ARG A 132 10.221 -9.394 11.399 1.00 0.00 H new ATOM 0 HG3 ARG A 132 9.012 -10.644 11.618 1.00 0.00 H new ATOM 0 HD2 ARG A 132 10.207 -10.930 13.568 1.00 0.00 H new ATOM 0 HD3 ARG A 132 11.069 -12.054 12.536 1.00 0.00 H new ATOM 0 HE ARG A 132 12.406 -9.611 12.218 1.00 0.00 H new ATOM 0 HH11 ARG A 132 11.625 -11.832 14.866 1.00 0.00 H new ATOM 0 HH12 ARG A 132 13.046 -11.380 15.814 1.00 0.00 H new ATOM 0 HH21 ARG A 132 14.209 -9.020 13.472 1.00 0.00 H new ATOM 0 HH22 ARG A 132 14.496 -9.801 15.031 1.00 0.00 H new ATOM 2071 N GLU A 133 13.186 -12.384 8.510 1.00 0.00 N ATOM 2072 CA GLU A 133 13.683 -13.129 7.360 1.00 0.00 C ATOM 2073 C GLU A 133 12.591 -14.018 6.765 1.00 0.00 C ATOM 2074 O GLU A 133 12.532 -14.214 5.552 1.00 0.00 O ATOM 2075 CB GLU A 133 14.909 -13.963 7.745 1.00 0.00 C ATOM 2076 CG GLU A 133 15.602 -14.605 6.556 1.00 0.00 C ATOM 2077 CD GLU A 133 16.887 -15.304 6.939 1.00 0.00 C ATOM 2078 OE1 GLU A 133 16.837 -16.508 7.266 1.00 0.00 O ATOM 2079 OE2 GLU A 133 17.953 -14.653 6.909 1.00 0.00 O ATOM 0 H GLU A 133 13.626 -12.635 9.395 1.00 0.00 H new ATOM 0 HA GLU A 133 13.982 -12.409 6.598 1.00 0.00 H new ATOM 0 HB2 GLU A 133 15.621 -13.327 8.270 1.00 0.00 H new ATOM 0 HB3 GLU A 133 14.604 -14.743 8.442 1.00 0.00 H new ATOM 0 HG2 GLU A 133 14.927 -15.323 6.091 1.00 0.00 H new ATOM 0 HG3 GLU A 133 15.817 -13.841 5.809 1.00 0.00 H new ATOM 2086 N ASP A 134 11.720 -14.542 7.615 1.00 0.00 N ATOM 2087 CA ASP A 134 10.596 -15.342 7.139 1.00 0.00 C ATOM 2088 C ASP A 134 9.568 -14.440 6.466 1.00 0.00 C ATOM 2089 O ASP A 134 9.054 -14.755 5.394 1.00 0.00 O ATOM 2090 CB ASP A 134 9.941 -16.105 8.295 1.00 0.00 C ATOM 2091 CG ASP A 134 8.812 -17.015 7.834 1.00 0.00 C ATOM 2092 OD1 ASP A 134 7.707 -16.511 7.560 1.00 0.00 O ATOM 2093 OD2 ASP A 134 9.022 -18.248 7.761 1.00 0.00 O ATOM 0 H ASP A 134 11.767 -14.431 8.628 1.00 0.00 H new ATOM 0 HA ASP A 134 10.971 -16.067 6.417 1.00 0.00 H new ATOM 0 HB2 ASP A 134 10.697 -16.701 8.806 1.00 0.00 H new ATOM 0 HB3 ASP A 134 9.553 -15.392 9.022 1.00 0.00 H new ATOM 2098 N LEU A 135 9.313 -13.292 7.085 1.00 0.00 N ATOM 2099 CA LEU A 135 8.290 -12.364 6.613 1.00 0.00 C ATOM 2100 C LEU A 135 8.616 -11.854 5.207 1.00 0.00 C ATOM 2101 O LEU A 135 7.727 -11.717 4.371 1.00 0.00 O ATOM 2102 CB LEU A 135 8.161 -11.191 7.597 1.00 0.00 C ATOM 2103 CG LEU A 135 6.801 -10.476 7.634 1.00 0.00 C ATOM 2104 CD1 LEU A 135 6.712 -9.585 8.862 1.00 0.00 C ATOM 2105 CD2 LEU A 135 6.572 -9.646 6.380 1.00 0.00 C ATOM 0 H LEU A 135 9.805 -12.980 7.922 1.00 0.00 H new ATOM 0 HA LEU A 135 7.338 -12.893 6.561 1.00 0.00 H new ATOM 0 HB2 LEU A 135 8.380 -11.560 8.599 1.00 0.00 H new ATOM 0 HB3 LEU A 135 8.927 -10.455 7.354 1.00 0.00 H new ATOM 0 HG LEU A 135 6.026 -11.241 7.680 1.00 0.00 H new ATOM 0 HD11 LEU A 135 5.744 -9.083 8.878 1.00 0.00 H new ATOM 0 HD12 LEU A 135 6.821 -10.192 9.761 1.00 0.00 H new ATOM 0 HD13 LEU A 135 7.507 -8.840 8.829 1.00 0.00 H new ATOM 0 HD21 LEU A 135 5.601 -9.155 6.441 1.00 0.00 H new ATOM 0 HD22 LEU A 135 7.355 -8.892 6.294 1.00 0.00 H new ATOM 0 HD23 LEU A 135 6.596 -10.295 5.505 1.00 0.00 H new ATOM 2117 N ARG A 136 9.893 -11.596 4.940 1.00 0.00 N ATOM 2118 CA ARG A 136 10.305 -11.051 3.655 1.00 0.00 C ATOM 2119 C ARG A 136 10.039 -12.033 2.510 1.00 0.00 C ATOM 2120 O ARG A 136 9.927 -11.623 1.358 1.00 0.00 O ATOM 2121 CB ARG A 136 11.782 -10.646 3.696 1.00 0.00 C ATOM 2122 CG ARG A 136 12.749 -11.816 3.746 1.00 0.00 C ATOM 2123 CD ARG A 136 14.195 -11.348 3.823 1.00 0.00 C ATOM 2124 NE ARG A 136 14.507 -10.694 5.096 1.00 0.00 N ATOM 2125 CZ ARG A 136 15.722 -10.243 5.420 1.00 0.00 C ATOM 2126 NH1 ARG A 136 16.721 -10.325 4.549 1.00 0.00 N ATOM 2127 NH2 ARG A 136 15.939 -9.704 6.613 1.00 0.00 N ATOM 0 H ARG A 136 10.657 -11.756 5.596 1.00 0.00 H new ATOM 0 HA ARG A 136 9.705 -10.162 3.463 1.00 0.00 H new ATOM 0 HB2 ARG A 136 12.006 -10.042 2.817 1.00 0.00 H new ATOM 0 HB3 ARG A 136 11.949 -10.014 4.568 1.00 0.00 H new ATOM 0 HG2 ARG A 136 12.522 -12.439 4.611 1.00 0.00 H new ATOM 0 HG3 ARG A 136 12.614 -12.438 2.861 1.00 0.00 H new ATOM 0 HD2 ARG A 136 14.858 -12.202 3.685 1.00 0.00 H new ATOM 0 HD3 ARG A 136 14.393 -10.656 3.005 1.00 0.00 H new ATOM 0 HE ARG A 136 13.754 -10.576 5.774 1.00 0.00 H new ATOM 0 HH11 ARG A 136 16.562 -10.734 3.628 1.00 0.00 H new ATOM 0 HH12 ARG A 136 17.647 -9.979 4.801 1.00 0.00 H new ATOM 0 HH21 ARG A 136 15.177 -9.633 7.287 1.00 0.00 H new ATOM 0 HH22 ARG A 136 16.868 -9.361 6.856 1.00 0.00 H new ATOM 2141 N THR A 137 9.927 -13.324 2.819 1.00 0.00 N ATOM 2142 CA THR A 137 9.598 -14.312 1.797 1.00 0.00 C ATOM 2143 C THR A 137 8.095 -14.307 1.536 1.00 0.00 C ATOM 2144 O THR A 137 7.640 -14.562 0.421 1.00 0.00 O ATOM 2145 CB THR A 137 10.046 -15.741 2.184 1.00 0.00 C ATOM 2146 OG1 THR A 137 9.237 -16.256 3.252 1.00 0.00 O ATOM 2147 CG2 THR A 137 11.511 -15.755 2.598 1.00 0.00 C ATOM 0 H THR A 137 10.057 -13.705 3.756 1.00 0.00 H new ATOM 0 HA THR A 137 10.142 -14.030 0.895 1.00 0.00 H new ATOM 0 HB THR A 137 9.921 -16.377 1.308 1.00 0.00 H new ATOM 0 HG1 THR A 137 9.225 -15.614 3.992 1.00 0.00 H new ATOM 0 HG21 THR A 137 11.804 -16.770 2.866 1.00 0.00 H new ATOM 0 HG22 THR A 137 12.127 -15.407 1.769 1.00 0.00 H new ATOM 0 HG23 THR A 137 11.653 -15.098 3.456 1.00 0.00 H new ATOM 2155 N ARG A 138 7.326 -13.980 2.575 1.00 0.00 N ATOM 2156 CA ARG A 138 5.872 -13.897 2.472 1.00 0.00 C ATOM 2157 C ARG A 138 5.484 -12.725 1.578 1.00 0.00 C ATOM 2158 O ARG A 138 4.377 -12.659 1.053 1.00 0.00 O ATOM 2159 CB ARG A 138 5.256 -13.714 3.857 1.00 0.00 C ATOM 2160 CG ARG A 138 5.807 -14.676 4.895 1.00 0.00 C ATOM 2161 CD ARG A 138 5.462 -16.120 4.571 1.00 0.00 C ATOM 2162 NE ARG A 138 6.088 -17.053 5.505 1.00 0.00 N ATOM 2163 CZ ARG A 138 5.913 -18.371 5.480 1.00 0.00 C ATOM 2164 NH1 ARG A 138 5.122 -18.925 4.563 1.00 0.00 N ATOM 2165 NH2 ARG A 138 6.546 -19.130 6.363 1.00 0.00 N ATOM 0 H ARG A 138 7.691 -13.767 3.503 1.00 0.00 H new ATOM 0 HA ARG A 138 5.496 -14.823 2.037 1.00 0.00 H new ATOM 0 HB2 ARG A 138 5.430 -12.691 4.192 1.00 0.00 H new ATOM 0 HB3 ARG A 138 4.176 -13.847 3.787 1.00 0.00 H new ATOM 0 HG2 ARG A 138 6.890 -14.566 4.953 1.00 0.00 H new ATOM 0 HG3 ARG A 138 5.408 -14.419 5.876 1.00 0.00 H new ATOM 0 HD2 ARG A 138 4.380 -16.250 4.599 1.00 0.00 H new ATOM 0 HD3 ARG A 138 5.785 -16.351 3.556 1.00 0.00 H new ATOM 0 HE ARG A 138 6.700 -16.668 6.224 1.00 0.00 H new ATOM 0 HH11 ARG A 138 4.648 -18.338 3.877 1.00 0.00 H new ATOM 0 HH12 ARG A 138 4.990 -19.936 4.547 1.00 0.00 H new ATOM 0 HH21 ARG A 138 7.162 -18.702 7.055 1.00 0.00 H new ATOM 0 HH22 ARG A 138 6.417 -20.142 6.351 1.00 0.00 H new ATOM 2179 N MET A 139 6.426 -11.808 1.415 1.00 0.00 N ATOM 2180 CA MET A 139 6.248 -10.636 0.566 1.00 0.00 C ATOM 2181 C MET A 139 6.070 -11.036 -0.899 1.00 0.00 C ATOM 2182 O MET A 139 5.555 -10.265 -1.709 1.00 0.00 O ATOM 2183 CB MET A 139 7.453 -9.708 0.717 1.00 0.00 C ATOM 2184 CG MET A 139 7.518 -8.996 2.060 1.00 0.00 C ATOM 2185 SD MET A 139 6.256 -7.718 2.223 1.00 0.00 S ATOM 2186 CE MET A 139 6.674 -7.028 3.820 1.00 0.00 C ATOM 0 H MET A 139 7.338 -11.854 1.868 1.00 0.00 H new ATOM 0 HA MET A 139 5.344 -10.115 0.881 1.00 0.00 H new ATOM 0 HB2 MET A 139 8.366 -10.288 0.580 1.00 0.00 H new ATOM 0 HB3 MET A 139 7.427 -8.962 -0.078 1.00 0.00 H new ATOM 0 HG2 MET A 139 7.398 -9.725 2.861 1.00 0.00 H new ATOM 0 HG3 MET A 139 8.504 -8.547 2.183 1.00 0.00 H new ATOM 0 HE1 MET A 139 5.779 -6.978 4.440 1.00 0.00 H new ATOM 0 HE2 MET A 139 7.418 -7.660 4.306 1.00 0.00 H new ATOM 0 HE3 MET A 139 7.080 -6.025 3.688 1.00 0.00 H new ATOM 2196 N ALA A 140 6.481 -12.254 -1.233 1.00 0.00 N ATOM 2197 CA ALA A 140 6.378 -12.748 -2.597 1.00 0.00 C ATOM 2198 C ALA A 140 4.945 -13.158 -2.942 1.00 0.00 C ATOM 2199 O ALA A 140 4.654 -13.516 -4.083 1.00 0.00 O ATOM 2200 CB ALA A 140 7.322 -13.921 -2.810 1.00 0.00 C ATOM 0 H ALA A 140 6.889 -12.917 -0.575 1.00 0.00 H new ATOM 0 HA ALA A 140 6.663 -11.934 -3.263 1.00 0.00 H new ATOM 0 HB1 ALA A 140 7.232 -14.279 -3.836 1.00 0.00 H new ATOM 0 HB2 ALA A 140 8.347 -13.601 -2.626 1.00 0.00 H new ATOM 0 HB3 ALA A 140 7.064 -14.726 -2.121 1.00 0.00 H new ATOM 2206 N TYR A 141 4.048 -13.111 -1.955 1.00 0.00 N ATOM 2207 CA TYR A 141 2.646 -13.440 -2.187 1.00 0.00 C ATOM 2208 C TYR A 141 1.943 -12.309 -2.935 1.00 0.00 C ATOM 2209 O TYR A 141 0.961 -12.537 -3.647 1.00 0.00 O ATOM 2210 CB TYR A 141 1.911 -13.705 -0.868 1.00 0.00 C ATOM 2211 CG TYR A 141 2.403 -14.911 -0.094 1.00 0.00 C ATOM 2212 CD1 TYR A 141 2.840 -16.058 -0.745 1.00 0.00 C ATOM 2213 CD2 TYR A 141 2.418 -14.901 1.296 1.00 0.00 C ATOM 2214 CE1 TYR A 141 3.282 -17.158 -0.032 1.00 0.00 C ATOM 2215 CE2 TYR A 141 2.858 -15.994 2.013 1.00 0.00 C ATOM 2216 CZ TYR A 141 3.288 -17.119 1.346 1.00 0.00 C ATOM 2217 OH TYR A 141 3.732 -18.206 2.060 1.00 0.00 O ATOM 0 H TYR A 141 4.268 -12.850 -0.994 1.00 0.00 H new ATOM 0 HA TYR A 141 2.621 -14.346 -2.792 1.00 0.00 H new ATOM 0 HB2 TYR A 141 2.003 -12.823 -0.234 1.00 0.00 H new ATOM 0 HB3 TYR A 141 0.850 -13.836 -1.080 1.00 0.00 H new ATOM 0 HD1 TYR A 141 2.835 -16.091 -1.824 1.00 0.00 H new ATOM 0 HD2 TYR A 141 2.079 -14.022 1.824 1.00 0.00 H new ATOM 0 HE1 TYR A 141 3.620 -18.042 -0.552 1.00 0.00 H new ATOM 0 HE2 TYR A 141 2.865 -15.967 3.093 1.00 0.00 H new ATOM 0 HH TYR A 141 4.411 -18.684 1.539 1.00 0.00 H new ATOM 2227 N CYS A 142 2.455 -11.094 -2.780 1.00 0.00 N ATOM 2228 CA CYS A 142 1.831 -9.922 -3.361 1.00 0.00 C ATOM 2229 C CYS A 142 2.587 -9.471 -4.601 1.00 0.00 C ATOM 2230 O CYS A 142 3.733 -9.862 -4.823 1.00 0.00 O ATOM 2231 CB CYS A 142 1.759 -8.787 -2.334 1.00 0.00 C ATOM 2232 SG CYS A 142 3.349 -8.332 -1.601 1.00 0.00 S ATOM 0 H CYS A 142 3.306 -10.899 -2.253 1.00 0.00 H new ATOM 0 HA CYS A 142 0.815 -10.186 -3.656 1.00 0.00 H new ATOM 0 HB2 CYS A 142 1.330 -7.907 -2.814 1.00 0.00 H new ATOM 0 HB3 CYS A 142 1.076 -9.080 -1.536 1.00 0.00 H new ATOM 0 HG CYS A 142 4.226 -9.257 -1.857 1.00 0.00 H new ATOM 2238 N LEU A 143 1.930 -8.662 -5.405 1.00 0.00 N ATOM 2239 CA LEU A 143 2.522 -8.157 -6.633 1.00 0.00 C ATOM 2240 C LEU A 143 3.388 -6.943 -6.330 1.00 0.00 C ATOM 2241 O LEU A 143 3.152 -6.233 -5.358 1.00 0.00 O ATOM 2242 CB LEU A 143 1.435 -7.777 -7.652 1.00 0.00 C ATOM 2243 CG LEU A 143 0.612 -8.930 -8.236 1.00 0.00 C ATOM 2244 CD1 LEU A 143 -0.358 -9.502 -7.210 1.00 0.00 C ATOM 2245 CD2 LEU A 143 -0.137 -8.465 -9.475 1.00 0.00 C ATOM 0 H LEU A 143 0.979 -8.336 -5.231 1.00 0.00 H new ATOM 0 HA LEU A 143 3.138 -8.946 -7.064 1.00 0.00 H new ATOM 0 HB2 LEU A 143 0.750 -7.076 -7.175 1.00 0.00 H new ATOM 0 HB3 LEU A 143 1.911 -7.246 -8.476 1.00 0.00 H new ATOM 0 HG LEU A 143 1.302 -9.726 -8.516 1.00 0.00 H new ATOM 0 HD11 LEU A 143 -0.924 -10.317 -7.660 1.00 0.00 H new ATOM 0 HD12 LEU A 143 0.200 -9.878 -6.352 1.00 0.00 H new ATOM 0 HD13 LEU A 143 -1.044 -8.721 -6.883 1.00 0.00 H new ATOM 0 HD21 LEU A 143 -0.718 -9.293 -9.881 1.00 0.00 H new ATOM 0 HD22 LEU A 143 -0.807 -7.647 -9.210 1.00 0.00 H new ATOM 0 HD23 LEU A 143 0.577 -8.121 -10.224 1.00 0.00 H new ATOM 2257 N VAL A 144 4.376 -6.700 -7.172 1.00 0.00 N ATOM 2258 CA VAL A 144 5.283 -5.584 -6.982 1.00 0.00 C ATOM 2259 C VAL A 144 5.181 -4.630 -8.161 1.00 0.00 C ATOM 2260 O VAL A 144 5.471 -4.996 -9.303 1.00 0.00 O ATOM 2261 CB VAL A 144 6.745 -6.054 -6.820 1.00 0.00 C ATOM 2262 CG1 VAL A 144 7.656 -4.873 -6.538 1.00 0.00 C ATOM 2263 CG2 VAL A 144 6.855 -7.095 -5.711 1.00 0.00 C ATOM 0 H VAL A 144 4.571 -7.265 -7.999 1.00 0.00 H new ATOM 0 HA VAL A 144 4.992 -5.073 -6.064 1.00 0.00 H new ATOM 0 HB VAL A 144 7.062 -6.516 -7.755 1.00 0.00 H new ATOM 0 HG11 VAL A 144 8.682 -5.223 -6.427 1.00 0.00 H new ATOM 0 HG12 VAL A 144 7.602 -4.166 -7.366 1.00 0.00 H new ATOM 0 HG13 VAL A 144 7.339 -4.380 -5.619 1.00 0.00 H new ATOM 0 HG21 VAL A 144 7.893 -7.413 -5.613 1.00 0.00 H new ATOM 0 HG22 VAL A 144 6.518 -6.661 -4.770 1.00 0.00 H new ATOM 0 HG23 VAL A 144 6.233 -7.956 -5.957 1.00 0.00 H new ATOM 2273 N TYR A 145 4.741 -3.417 -7.880 1.00 0.00 N ATOM 2274 CA TYR A 145 4.573 -2.405 -8.912 1.00 0.00 C ATOM 2275 C TYR A 145 5.423 -1.175 -8.629 1.00 0.00 C ATOM 2276 O TYR A 145 5.404 -0.628 -7.523 1.00 0.00 O ATOM 2277 CB TYR A 145 3.100 -1.997 -9.034 1.00 0.00 C ATOM 2278 CG TYR A 145 2.251 -2.989 -9.798 1.00 0.00 C ATOM 2279 CD1 TYR A 145 2.159 -2.918 -11.180 1.00 0.00 C ATOM 2280 CD2 TYR A 145 1.542 -3.989 -9.143 1.00 0.00 C ATOM 2281 CE1 TYR A 145 1.388 -3.815 -11.889 1.00 0.00 C ATOM 2282 CE2 TYR A 145 0.767 -4.890 -9.848 1.00 0.00 C ATOM 2283 CZ TYR A 145 0.691 -4.796 -11.220 1.00 0.00 C ATOM 2284 OH TYR A 145 -0.079 -5.689 -11.932 1.00 0.00 O ATOM 0 H TYR A 145 4.492 -3.106 -6.941 1.00 0.00 H new ATOM 0 HA TYR A 145 4.904 -2.843 -9.854 1.00 0.00 H new ATOM 0 HB2 TYR A 145 2.684 -1.871 -8.034 1.00 0.00 H new ATOM 0 HB3 TYR A 145 3.041 -1.027 -9.528 1.00 0.00 H new ATOM 0 HD1 TYR A 145 2.700 -2.148 -11.710 1.00 0.00 H new ATOM 0 HD2 TYR A 145 1.598 -4.063 -8.067 1.00 0.00 H new ATOM 0 HE1 TYR A 145 1.331 -3.748 -12.965 1.00 0.00 H new ATOM 0 HE2 TYR A 145 0.224 -5.664 -9.326 1.00 0.00 H new ATOM 0 HH TYR A 145 -0.505 -6.319 -11.314 1.00 0.00 H new ATOM 2294 N GLU A 146 6.173 -0.753 -9.632 1.00 0.00 N ATOM 2295 CA GLU A 146 6.927 0.482 -9.555 1.00 0.00 C ATOM 2296 C GLU A 146 6.179 1.557 -10.339 1.00 0.00 C ATOM 2297 O GLU A 146 5.839 1.357 -11.508 1.00 0.00 O ATOM 2298 CB GLU A 146 8.348 0.278 -10.099 1.00 0.00 C ATOM 2299 CG GLU A 146 9.257 1.490 -9.946 1.00 0.00 C ATOM 2300 CD GLU A 146 9.389 2.291 -11.226 1.00 0.00 C ATOM 2301 OE1 GLU A 146 8.524 3.146 -11.494 1.00 0.00 O ATOM 2302 OE2 GLU A 146 10.359 2.062 -11.978 1.00 0.00 O ATOM 0 H GLU A 146 6.275 -1.253 -10.515 1.00 0.00 H new ATOM 0 HA GLU A 146 7.023 0.799 -8.516 1.00 0.00 H new ATOM 0 HB2 GLU A 146 8.803 -0.570 -9.586 1.00 0.00 H new ATOM 0 HB3 GLU A 146 8.286 0.016 -11.155 1.00 0.00 H new ATOM 0 HG2 GLU A 146 8.866 2.134 -9.158 1.00 0.00 H new ATOM 0 HG3 GLU A 146 10.245 1.159 -9.626 1.00 0.00 H new