USER MOD reduce.3.24.130724 H: found=0, std=0, add=832, rem=0, adj=20 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 50 SER OG : rot -149:sc= 1.9 USER MOD Set 1.2: A 69 TYR OH : rot -17:sc= 1.03 USER MOD Set 2.1: A 40 TYR OH : rot 0:sc= 0.559 USER MOD Set 2.2: A 122 SER OG : rot 114:sc= 1.04 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 HIS : no HD1:sc= -0.11 X(o=-0.11,f=-0.12) USER MOD Single : A 37 GLN : amide:sc= 1.11 K(o=1.1,f=-0.72) USER MOD Single : A 51 HIS : no HD1:sc=-0.00686 X(o=-0.0069,f=-0.47) USER MOD Single : A 54 GLN : amide:sc= 0 K(o=0,f=-0.82) USER MOD Single : A 59 GLN :FLIP amide:sc= -0.64 F(o=-2.6!,f=-0.64) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 ASN : amide:sc= -0.204 K(o=-0.2,f=-2!) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 MET CE :methyl -167:sc= -0.522 (180deg=-0.925) USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 TYR OH : rot 87:sc= 1.26 USER MOD Single : A 91 GLN : amide:sc= -2.92! C(o=-2.9!,f=-5.3!) USER MOD Single : A 94 LYS NZ :NH3+ -177:sc= 1.31 (180deg=1.17) USER MOD Single : A 97 ASN : amide:sc= -0.426 X(o=-0.43,f=0) USER MOD Single : A 100 GLN : amide:sc= 0.57! C(o=0.57!,f=-7.9!) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 108 ASN : amide:sc= 0 K(o=0,f=-0.65) USER MOD Single : A 112 ASN : amide:sc= 1.05 K(o=1,f=0) USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ -131:sc= 0.532 (180deg=-0.00613) USER MOD Single : A 124 TYR OH : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot 180:sc= -0.284 USER MOD Single : A 127 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 128 GLN : amide:sc= -0.081 X(o=-0.081,f=-0.55) USER MOD Single : A 137 THR OG1 : rot -84:sc= 1.18 USER MOD Single : A 139 MET CE :methyl -144:sc= -0.195 (180deg=-2.72!) USER MOD Single : A 141 TYR OH : rot 180:sc= 0 USER MOD Single : A 142 CYS SG : rot -31:sc= 1.13 USER MOD Single : A 145 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 540 N LYS A 34 -9.383 1.480 -8.711 1.00 0.00 N ATOM 541 CA LYS A 34 -9.181 0.255 -7.938 1.00 0.00 C ATOM 542 C LYS A 34 -8.234 -0.705 -8.660 1.00 0.00 C ATOM 543 O LYS A 34 -7.836 -0.460 -9.799 1.00 0.00 O ATOM 544 CB LYS A 34 -10.519 -0.439 -7.670 1.00 0.00 C ATOM 545 CG LYS A 34 -11.305 -0.765 -8.929 1.00 0.00 C ATOM 546 CD LYS A 34 -12.594 -1.489 -8.602 1.00 0.00 C ATOM 547 CE LYS A 34 -13.486 -1.602 -9.825 1.00 0.00 C ATOM 548 NZ LYS A 34 -14.735 -2.351 -9.536 1.00 0.00 N ATOM 0 HA LYS A 34 -8.728 0.535 -6.987 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -10.335 -1.361 -7.119 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -11.127 0.200 -7.029 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -11.529 0.155 -9.469 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -10.697 -1.382 -9.590 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -12.368 -2.485 -8.220 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -13.123 -0.957 -7.811 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -13.737 -0.604 -10.184 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -12.941 -2.101 -10.626 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -15.315 -2.405 -10.398 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -14.498 -3.312 -9.218 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -15.269 -1.861 -8.790 1.00 0.00 H new ATOM 562 N HIS A 35 -7.879 -1.792 -7.981 1.00 0.00 N ATOM 563 CA HIS A 35 -6.952 -2.789 -8.517 1.00 0.00 C ATOM 564 C HIS A 35 -7.302 -4.174 -7.969 1.00 0.00 C ATOM 565 O HIS A 35 -8.409 -4.377 -7.465 1.00 0.00 O ATOM 566 CB HIS A 35 -5.502 -2.430 -8.156 1.00 0.00 C ATOM 567 CG HIS A 35 -4.977 -1.218 -8.870 1.00 0.00 C ATOM 568 ND1 HIS A 35 -4.892 0.029 -8.282 1.00 0.00 N ATOM 569 CD2 HIS A 35 -4.503 -1.067 -10.131 1.00 0.00 C ATOM 570 CE1 HIS A 35 -4.393 0.889 -9.152 1.00 0.00 C ATOM 571 NE2 HIS A 35 -4.150 0.251 -10.278 1.00 0.00 N ATOM 0 H HIS A 35 -8.224 -2.008 -7.046 1.00 0.00 H new ATOM 0 HA HIS A 35 -7.044 -2.800 -9.603 1.00 0.00 H new ATOM 0 HB2 HIS A 35 -5.437 -2.262 -7.081 1.00 0.00 H new ATOM 0 HB3 HIS A 35 -4.860 -3.281 -8.385 1.00 0.00 H new ATOM 0 HD2 HIS A 35 -4.419 -1.840 -10.880 1.00 0.00 H new ATOM 0 HE1 HIS A 35 -4.214 1.939 -8.970 1.00 0.00 H new ATOM 0 HE2 HIS A 35 -3.762 0.669 -11.123 1.00 0.00 H new ATOM 580 N GLY A 36 -6.370 -5.120 -8.087 1.00 0.00 N ATOM 581 CA GLY A 36 -6.590 -6.472 -7.588 1.00 0.00 C ATOM 582 C GLY A 36 -6.612 -6.562 -6.071 1.00 0.00 C ATOM 583 O GLY A 36 -6.729 -5.550 -5.382 1.00 0.00 O ATOM 0 H GLY A 36 -5.459 -4.973 -8.523 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -7.536 -6.846 -7.980 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -5.806 -7.124 -7.971 1.00 0.00 H new ATOM 587 N GLN A 37 -6.478 -7.780 -5.552 1.00 0.00 N ATOM 588 CA GLN A 37 -6.602 -8.019 -4.117 1.00 0.00 C ATOM 589 C GLN A 37 -5.287 -7.755 -3.389 1.00 0.00 C ATOM 590 O GLN A 37 -5.232 -6.935 -2.478 1.00 0.00 O ATOM 591 CB GLN A 37 -7.068 -9.451 -3.841 1.00 0.00 C ATOM 592 CG GLN A 37 -7.221 -9.753 -2.358 1.00 0.00 C ATOM 593 CD GLN A 37 -7.732 -11.150 -2.089 1.00 0.00 C ATOM 594 OE1 GLN A 37 -8.464 -11.724 -2.892 1.00 0.00 O ATOM 595 NE2 GLN A 37 -7.347 -11.709 -0.954 1.00 0.00 N ATOM 0 H GLN A 37 -6.284 -8.616 -6.103 1.00 0.00 H new ATOM 0 HA GLN A 37 -7.350 -7.322 -3.738 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -8.022 -9.619 -4.340 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -6.353 -10.150 -4.276 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -6.257 -9.623 -1.865 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -7.906 -9.030 -1.914 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -6.738 -11.198 -0.315 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -7.659 -12.651 -0.718 1.00 0.00 H new ATOM 604 N PHE A 38 -4.239 -8.470 -3.775 1.00 0.00 N ATOM 605 CA PHE A 38 -2.932 -8.288 -3.162 1.00 0.00 C ATOM 606 C PHE A 38 -2.059 -7.422 -4.051 1.00 0.00 C ATOM 607 O PHE A 38 -1.381 -7.918 -4.953 1.00 0.00 O ATOM 608 CB PHE A 38 -2.248 -9.633 -2.908 1.00 0.00 C ATOM 609 CG PHE A 38 -2.931 -10.483 -1.871 1.00 0.00 C ATOM 610 CD1 PHE A 38 -2.944 -10.096 -0.539 1.00 0.00 C ATOM 611 CD2 PHE A 38 -3.548 -11.672 -2.223 1.00 0.00 C ATOM 612 CE1 PHE A 38 -3.562 -10.880 0.418 1.00 0.00 C ATOM 613 CE2 PHE A 38 -4.167 -12.459 -1.270 1.00 0.00 C ATOM 614 CZ PHE A 38 -4.174 -12.063 0.052 1.00 0.00 C ATOM 0 H PHE A 38 -4.269 -9.179 -4.508 1.00 0.00 H new ATOM 0 HA PHE A 38 -3.074 -7.793 -2.201 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -2.203 -10.188 -3.845 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -1.220 -9.452 -2.594 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -2.466 -9.173 -0.246 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -3.545 -11.988 -3.256 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -3.566 -10.567 1.452 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -4.645 -13.383 -1.560 1.00 0.00 H new ATOM 0 HZ PHE A 38 -4.657 -12.676 0.798 1.00 0.00 H new ATOM 624 N ILE A 39 -2.091 -6.126 -3.803 1.00 0.00 N ATOM 625 CA ILE A 39 -1.374 -5.181 -4.637 1.00 0.00 C ATOM 626 C ILE A 39 -0.380 -4.375 -3.814 1.00 0.00 C ATOM 627 O ILE A 39 -0.736 -3.765 -2.805 1.00 0.00 O ATOM 628 CB ILE A 39 -2.343 -4.212 -5.356 1.00 0.00 C ATOM 629 CG1 ILE A 39 -3.331 -4.987 -6.233 1.00 0.00 C ATOM 630 CG2 ILE A 39 -1.571 -3.203 -6.196 1.00 0.00 C ATOM 631 CD1 ILE A 39 -2.676 -5.778 -7.349 1.00 0.00 C ATOM 0 H ILE A 39 -2.606 -5.704 -3.030 1.00 0.00 H new ATOM 0 HA ILE A 39 -0.836 -5.761 -5.387 1.00 0.00 H new ATOM 0 HB ILE A 39 -2.906 -3.670 -4.596 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -3.901 -5.670 -5.604 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -4.043 -4.285 -6.668 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -2.271 -2.532 -6.693 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -0.908 -2.625 -5.552 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -0.980 -3.730 -6.945 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -3.442 -6.298 -7.924 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -2.129 -5.099 -8.004 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -1.986 -6.506 -6.922 1.00 0.00 H new ATOM 643 N TYR A 40 0.868 -4.401 -4.236 1.00 0.00 N ATOM 644 CA TYR A 40 1.883 -3.549 -3.665 1.00 0.00 C ATOM 645 C TYR A 40 2.205 -2.430 -4.639 1.00 0.00 C ATOM 646 O TYR A 40 2.496 -2.679 -5.810 1.00 0.00 O ATOM 647 CB TYR A 40 3.148 -4.349 -3.344 1.00 0.00 C ATOM 648 CG TYR A 40 4.367 -3.480 -3.147 1.00 0.00 C ATOM 649 CD1 TYR A 40 4.510 -2.692 -2.012 1.00 0.00 C ATOM 650 CD2 TYR A 40 5.367 -3.438 -4.108 1.00 0.00 C ATOM 651 CE1 TYR A 40 5.616 -1.883 -1.845 1.00 0.00 C ATOM 652 CE2 TYR A 40 6.475 -2.636 -3.946 1.00 0.00 C ATOM 653 CZ TYR A 40 6.594 -1.860 -2.815 1.00 0.00 C ATOM 654 OH TYR A 40 7.700 -1.058 -2.659 1.00 0.00 O ATOM 0 H TYR A 40 1.203 -5.012 -4.981 1.00 0.00 H new ATOM 0 HA TYR A 40 1.506 -3.126 -2.734 1.00 0.00 H new ATOM 0 HB2 TYR A 40 2.979 -4.937 -2.442 1.00 0.00 H new ATOM 0 HB3 TYR A 40 3.339 -5.054 -4.153 1.00 0.00 H new ATOM 0 HD1 TYR A 40 3.745 -2.713 -1.250 1.00 0.00 H new ATOM 0 HD2 TYR A 40 5.275 -4.044 -4.997 1.00 0.00 H new ATOM 0 HE1 TYR A 40 5.714 -1.272 -0.960 1.00 0.00 H new ATOM 0 HE2 TYR A 40 7.246 -2.616 -4.702 1.00 0.00 H new ATOM 0 HH TYR A 40 7.635 -0.573 -1.810 1.00 0.00 H new ATOM 664 N VAL A 41 2.130 -1.206 -4.162 1.00 0.00 N ATOM 665 CA VAL A 41 2.437 -0.053 -4.981 1.00 0.00 C ATOM 666 C VAL A 41 3.575 0.751 -4.367 1.00 0.00 C ATOM 667 O VAL A 41 3.643 0.927 -3.152 1.00 0.00 O ATOM 668 CB VAL A 41 1.203 0.859 -5.174 1.00 0.00 C ATOM 669 CG1 VAL A 41 0.132 0.149 -5.986 1.00 0.00 C ATOM 670 CG2 VAL A 41 0.630 1.311 -3.836 1.00 0.00 C ATOM 0 H VAL A 41 1.857 -0.983 -3.205 1.00 0.00 H new ATOM 0 HA VAL A 41 2.741 -0.425 -5.959 1.00 0.00 H new ATOM 0 HB VAL A 41 1.532 1.744 -5.719 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -0.727 0.808 -6.110 1.00 0.00 H new ATOM 0 HG12 VAL A 41 0.532 -0.114 -6.965 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -0.178 -0.757 -5.466 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -0.236 1.950 -4.008 1.00 0.00 H new ATOM 0 HG22 VAL A 41 0.328 0.439 -3.256 1.00 0.00 H new ATOM 0 HG23 VAL A 41 1.388 1.868 -3.285 1.00 0.00 H new ATOM 680 N TRP A 42 4.489 1.205 -5.201 1.00 0.00 N ATOM 681 CA TRP A 42 5.554 2.075 -4.740 1.00 0.00 C ATOM 682 C TRP A 42 5.554 3.354 -5.552 1.00 0.00 C ATOM 683 O TRP A 42 5.240 3.345 -6.744 1.00 0.00 O ATOM 684 CB TRP A 42 6.924 1.379 -4.810 1.00 0.00 C ATOM 685 CG TRP A 42 7.367 0.999 -6.193 1.00 0.00 C ATOM 686 CD1 TRP A 42 7.082 -0.160 -6.855 1.00 0.00 C ATOM 687 CD2 TRP A 42 8.195 1.772 -7.074 1.00 0.00 C ATOM 688 NE1 TRP A 42 7.679 -0.154 -8.092 1.00 0.00 N ATOM 689 CE2 TRP A 42 8.367 1.021 -8.250 1.00 0.00 C ATOM 690 CE3 TRP A 42 8.808 3.027 -6.980 1.00 0.00 C ATOM 691 CZ2 TRP A 42 9.120 1.486 -9.327 1.00 0.00 C ATOM 692 CZ3 TRP A 42 9.554 3.487 -8.048 1.00 0.00 C ATOM 693 CH2 TRP A 42 9.706 2.716 -9.206 1.00 0.00 C ATOM 0 H TRP A 42 4.517 0.988 -6.197 1.00 0.00 H new ATOM 0 HA TRP A 42 5.372 2.317 -3.693 1.00 0.00 H new ATOM 0 HB2 TRP A 42 7.673 2.038 -4.372 1.00 0.00 H new ATOM 0 HB3 TRP A 42 6.891 0.480 -4.194 1.00 0.00 H new ATOM 0 HD1 TRP A 42 6.476 -0.964 -6.464 1.00 0.00 H new ATOM 0 HE1 TRP A 42 7.620 -0.903 -8.782 1.00 0.00 H new ATOM 0 HE3 TRP A 42 8.700 3.626 -6.088 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 9.236 0.896 -10.224 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 10.027 4.456 -7.988 1.00 0.00 H new ATOM 0 HH2 TRP A 42 10.299 3.101 -10.022 1.00 0.00 H new ATOM 787 N SER A 50 -0.518 8.591 0.815 1.00 0.00 N ATOM 788 CA SER A 50 -1.355 7.398 0.696 1.00 0.00 C ATOM 789 C SER A 50 -2.733 7.702 0.087 1.00 0.00 C ATOM 790 O SER A 50 -3.736 7.071 0.432 1.00 0.00 O ATOM 791 CB SER A 50 -1.509 6.799 2.090 1.00 0.00 C ATOM 792 OG SER A 50 -1.477 7.820 3.078 1.00 0.00 O ATOM 0 HA SER A 50 -0.873 6.694 0.017 1.00 0.00 H new ATOM 0 HB2 SER A 50 -2.449 6.252 2.155 1.00 0.00 H new ATOM 0 HB3 SER A 50 -0.709 6.082 2.274 1.00 0.00 H new ATOM 0 HG SER A 50 -1.086 7.465 3.903 1.00 0.00 H new ATOM 798 N HIS A 51 -2.760 8.633 -0.862 1.00 0.00 N ATOM 799 CA HIS A 51 -4.003 9.077 -1.486 1.00 0.00 C ATOM 800 C HIS A 51 -4.690 7.939 -2.242 1.00 0.00 C ATOM 801 O HIS A 51 -5.914 7.861 -2.275 1.00 0.00 O ATOM 802 CB HIS A 51 -3.744 10.279 -2.417 1.00 0.00 C ATOM 803 CG HIS A 51 -2.932 9.984 -3.654 1.00 0.00 C ATOM 804 ND1 HIS A 51 -1.587 9.672 -3.629 1.00 0.00 N ATOM 805 CD2 HIS A 51 -3.285 9.990 -4.963 1.00 0.00 C ATOM 806 CE1 HIS A 51 -1.154 9.506 -4.865 1.00 0.00 C ATOM 807 NE2 HIS A 51 -2.161 9.693 -5.695 1.00 0.00 N ATOM 0 H HIS A 51 -1.926 9.099 -1.219 1.00 0.00 H new ATOM 0 HA HIS A 51 -4.678 9.395 -0.692 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -4.705 10.690 -2.725 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -3.234 11.054 -1.846 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -4.270 10.191 -5.358 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -0.142 9.258 -5.149 1.00 0.00 H new ATOM 0 HE2 HIS A 51 -2.114 9.628 -6.712 1.00 0.00 H new ATOM 816 N LEU A 52 -3.900 7.047 -2.826 1.00 0.00 N ATOM 817 CA LEU A 52 -4.439 5.954 -3.604 1.00 0.00 C ATOM 818 C LEU A 52 -5.106 4.923 -2.694 1.00 0.00 C ATOM 819 O LEU A 52 -6.199 4.435 -2.982 1.00 0.00 O ATOM 820 CB LEU A 52 -3.320 5.310 -4.421 1.00 0.00 C ATOM 821 CG LEU A 52 -3.683 3.977 -5.061 1.00 0.00 C ATOM 822 CD1 LEU A 52 -4.761 4.158 -6.119 1.00 0.00 C ATOM 823 CD2 LEU A 52 -2.454 3.311 -5.655 1.00 0.00 C ATOM 0 H LEU A 52 -2.882 7.065 -2.772 1.00 0.00 H new ATOM 0 HA LEU A 52 -5.198 6.340 -4.284 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -3.017 6.003 -5.206 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -2.455 5.163 -3.774 1.00 0.00 H new ATOM 0 HG LEU A 52 -4.080 3.326 -4.281 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -5.003 3.192 -6.561 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -5.655 4.580 -5.659 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -4.399 4.832 -6.895 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -2.738 2.360 -6.107 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -2.021 3.960 -6.417 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -1.720 3.134 -4.869 1.00 0.00 H new ATOM 835 N LEU A 53 -4.448 4.615 -1.583 1.00 0.00 N ATOM 836 CA LEU A 53 -4.961 3.625 -0.646 1.00 0.00 C ATOM 837 C LEU A 53 -6.203 4.149 0.064 1.00 0.00 C ATOM 838 O LEU A 53 -7.148 3.401 0.309 1.00 0.00 O ATOM 839 CB LEU A 53 -3.890 3.233 0.380 1.00 0.00 C ATOM 840 CG LEU A 53 -2.767 2.327 -0.144 1.00 0.00 C ATOM 841 CD1 LEU A 53 -1.873 3.062 -1.130 1.00 0.00 C ATOM 842 CD2 LEU A 53 -1.947 1.783 1.009 1.00 0.00 C ATOM 0 H LEU A 53 -3.560 5.036 -1.310 1.00 0.00 H new ATOM 0 HA LEU A 53 -5.233 2.736 -1.215 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -3.442 4.144 0.776 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -4.379 2.729 1.214 1.00 0.00 H new ATOM 0 HG LEU A 53 -3.230 1.494 -0.673 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -1.089 2.391 -1.481 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -2.468 3.400 -1.979 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -1.420 3.923 -0.639 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -1.155 1.142 0.622 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -1.506 2.611 1.564 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -2.590 1.204 1.672 1.00 0.00 H new ATOM 854 N GLN A 54 -6.204 5.443 0.372 1.00 0.00 N ATOM 855 CA GLN A 54 -7.333 6.066 1.056 1.00 0.00 C ATOM 856 C GLN A 54 -8.589 5.984 0.195 1.00 0.00 C ATOM 857 O GLN A 54 -9.682 5.721 0.698 1.00 0.00 O ATOM 858 CB GLN A 54 -7.017 7.525 1.389 1.00 0.00 C ATOM 859 CG GLN A 54 -8.059 8.185 2.284 1.00 0.00 C ATOM 860 CD GLN A 54 -7.681 9.597 2.678 1.00 0.00 C ATOM 861 OE1 GLN A 54 -6.502 9.934 2.784 1.00 0.00 O ATOM 862 NE2 GLN A 54 -8.680 10.430 2.922 1.00 0.00 N ATOM 0 H GLN A 54 -5.436 6.080 0.159 1.00 0.00 H new ATOM 0 HA GLN A 54 -7.511 5.526 1.986 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -6.045 7.575 1.879 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -6.936 8.091 0.461 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -9.018 8.201 1.767 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -8.192 7.584 3.184 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -9.644 10.113 2.823 1.00 0.00 H new ATOM 0 HE22 GLN A 54 -8.486 11.389 3.209 1.00 0.00 H new ATOM 871 N ALA A 55 -8.424 6.203 -1.104 1.00 0.00 N ATOM 872 CA ALA A 55 -9.532 6.104 -2.046 1.00 0.00 C ATOM 873 C ALA A 55 -10.083 4.689 -2.076 1.00 0.00 C ATOM 874 O ALA A 55 -11.295 4.481 -2.067 1.00 0.00 O ATOM 875 CB ALA A 55 -9.085 6.510 -3.439 1.00 0.00 C ATOM 0 H ALA A 55 -7.531 6.451 -1.530 1.00 0.00 H new ATOM 0 HA ALA A 55 -10.319 6.782 -1.715 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -9.925 6.430 -4.129 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -8.728 7.540 -3.421 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -8.281 5.853 -3.769 1.00 0.00 H new ATOM 881 N TRP A 56 -9.178 3.726 -2.103 1.00 0.00 N ATOM 882 CA TRP A 56 -9.549 2.322 -2.146 1.00 0.00 C ATOM 883 C TRP A 56 -10.303 1.927 -0.878 1.00 0.00 C ATOM 884 O TRP A 56 -11.303 1.207 -0.938 1.00 0.00 O ATOM 885 CB TRP A 56 -8.293 1.467 -2.331 1.00 0.00 C ATOM 886 CG TRP A 56 -8.558 -0.003 -2.406 1.00 0.00 C ATOM 887 CD1 TRP A 56 -9.030 -0.703 -3.478 1.00 0.00 C ATOM 888 CD2 TRP A 56 -8.336 -0.955 -1.367 1.00 0.00 C ATOM 889 NE1 TRP A 56 -9.129 -2.036 -3.159 1.00 0.00 N ATOM 890 CE2 TRP A 56 -8.706 -2.214 -1.867 1.00 0.00 C ATOM 891 CE3 TRP A 56 -7.869 -0.858 -0.053 1.00 0.00 C ATOM 892 CZ2 TRP A 56 -8.612 -3.372 -1.107 1.00 0.00 C ATOM 893 CZ3 TRP A 56 -7.775 -2.009 0.702 1.00 0.00 C ATOM 894 CH2 TRP A 56 -8.147 -3.251 0.175 1.00 0.00 C ATOM 0 H TRP A 56 -8.172 3.893 -2.096 1.00 0.00 H new ATOM 0 HA TRP A 56 -10.215 2.151 -2.992 1.00 0.00 H new ATOM 0 HB2 TRP A 56 -7.785 1.780 -3.243 1.00 0.00 H new ATOM 0 HB3 TRP A 56 -7.610 1.660 -1.503 1.00 0.00 H new ATOM 0 HD1 TRP A 56 -9.287 -0.273 -4.435 1.00 0.00 H new ATOM 0 HE1 TRP A 56 -9.462 -2.772 -3.781 1.00 0.00 H new ATOM 0 HE3 TRP A 56 -7.588 0.098 0.363 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 -8.895 -4.332 -1.512 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 -7.408 -1.951 1.716 1.00 0.00 H new ATOM 0 HH2 TRP A 56 -8.065 -4.133 0.793 1.00 0.00 H new ATOM 905 N VAL A 57 -9.827 2.416 0.264 1.00 0.00 N ATOM 906 CA VAL A 57 -10.486 2.170 1.541 1.00 0.00 C ATOM 907 C VAL A 57 -11.876 2.800 1.559 1.00 0.00 C ATOM 908 O VAL A 57 -12.854 2.153 1.934 1.00 0.00 O ATOM 909 CB VAL A 57 -9.655 2.723 2.726 1.00 0.00 C ATOM 910 CG1 VAL A 57 -10.423 2.620 4.036 1.00 0.00 C ATOM 911 CG2 VAL A 57 -8.326 1.991 2.838 1.00 0.00 C ATOM 0 H VAL A 57 -8.984 2.987 0.330 1.00 0.00 H new ATOM 0 HA VAL A 57 -10.575 1.090 1.655 1.00 0.00 H new ATOM 0 HB VAL A 57 -9.460 3.777 2.529 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -9.813 3.016 4.848 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -11.346 3.194 3.963 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -10.661 1.575 4.237 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -7.758 2.395 3.676 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -8.508 0.929 3.001 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -7.758 2.125 1.917 1.00 0.00 H new ATOM 921 N ALA A 58 -11.964 4.058 1.136 1.00 0.00 N ATOM 922 CA ALA A 58 -13.239 4.767 1.095 1.00 0.00 C ATOM 923 C ALA A 58 -14.227 4.055 0.178 1.00 0.00 C ATOM 924 O ALA A 58 -15.399 3.903 0.517 1.00 0.00 O ATOM 925 CB ALA A 58 -13.033 6.206 0.642 1.00 0.00 C ATOM 0 H ALA A 58 -11.166 4.608 0.816 1.00 0.00 H new ATOM 0 HA ALA A 58 -13.656 4.776 2.102 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -13.994 6.721 0.617 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -12.367 6.715 1.339 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -12.591 6.214 -0.354 1.00 0.00 H new ATOM 931 N GLN A 59 -13.736 3.610 -0.973 1.00 0.00 N ATOM 932 CA GLN A 59 -14.550 2.879 -1.936 1.00 0.00 C ATOM 933 C GLN A 59 -15.146 1.621 -1.298 1.00 0.00 C ATOM 934 O GLN A 59 -16.295 1.263 -1.560 1.00 0.00 O ATOM 935 CB GLN A 59 -13.696 2.534 -3.164 1.00 0.00 C ATOM 936 CG GLN A 59 -14.426 1.780 -4.269 1.00 0.00 C ATOM 937 CD GLN A 59 -14.416 0.271 -4.076 1.00 0.00 C ATOM 938 OE1 GLN A 59 -13.371 -0.243 -3.442 1.00 0.00 O flip ATOM 939 NE2 GLN A 59 -15.336 -0.429 -4.499 1.00 0.00 N flip ATOM 0 H GLN A 59 -12.768 3.745 -1.264 1.00 0.00 H new ATOM 0 HA GLN A 59 -15.384 3.505 -2.255 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -13.296 3.459 -3.580 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -12.845 1.936 -2.839 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -15.458 2.127 -4.315 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -13.966 2.020 -5.228 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -16.124 0.002 -4.982 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -15.310 -1.440 -4.366 1.00 0.00 H new ATOM 948 N ALA A 60 -14.365 0.969 -0.450 1.00 0.00 N ATOM 949 CA ALA A 60 -14.818 -0.225 0.250 1.00 0.00 C ATOM 950 C ALA A 60 -15.785 0.132 1.378 1.00 0.00 C ATOM 951 O ALA A 60 -16.785 -0.554 1.596 1.00 0.00 O ATOM 952 CB ALA A 60 -13.623 -0.995 0.789 1.00 0.00 C ATOM 0 H ALA A 60 -13.409 1.248 -0.229 1.00 0.00 H new ATOM 0 HA ALA A 60 -15.355 -0.857 -0.457 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -13.970 -1.887 1.311 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -12.976 -1.288 -0.038 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -13.065 -0.364 1.481 1.00 0.00 H new ATOM 958 N LEU A 61 -15.481 1.217 2.083 1.00 0.00 N ATOM 959 CA LEU A 61 -16.321 1.688 3.181 1.00 0.00 C ATOM 960 C LEU A 61 -17.704 2.087 2.684 1.00 0.00 C ATOM 961 O LEU A 61 -18.718 1.670 3.246 1.00 0.00 O ATOM 962 CB LEU A 61 -15.658 2.876 3.888 1.00 0.00 C ATOM 963 CG LEU A 61 -14.418 2.534 4.715 1.00 0.00 C ATOM 964 CD1 LEU A 61 -13.812 3.797 5.311 1.00 0.00 C ATOM 965 CD2 LEU A 61 -14.772 1.544 5.815 1.00 0.00 C ATOM 0 H LEU A 61 -14.655 1.790 1.913 1.00 0.00 H new ATOM 0 HA LEU A 61 -16.435 0.868 3.890 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -15.381 3.616 3.137 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -16.393 3.345 4.542 1.00 0.00 H new ATOM 0 HG LEU A 61 -13.680 2.073 4.059 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -12.930 3.536 5.897 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -13.526 4.477 4.509 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -14.545 4.283 5.955 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -13.879 1.310 6.395 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -15.526 1.982 6.470 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -15.165 0.630 5.369 1.00 0.00 H new ATOM 977 N GLU A 62 -17.745 2.873 1.616 1.00 0.00 N ATOM 978 CA GLU A 62 -19.008 3.355 1.071 1.00 0.00 C ATOM 979 C GLU A 62 -19.795 2.224 0.421 1.00 0.00 C ATOM 980 O GLU A 62 -20.986 2.364 0.138 1.00 0.00 O ATOM 981 CB GLU A 62 -18.765 4.471 0.061 1.00 0.00 C ATOM 982 CG GLU A 62 -18.053 5.672 0.654 1.00 0.00 C ATOM 983 CD GLU A 62 -17.909 6.805 -0.333 1.00 0.00 C ATOM 984 OE1 GLU A 62 -16.991 6.764 -1.174 1.00 0.00 O ATOM 985 OE2 GLU A 62 -18.725 7.748 -0.275 1.00 0.00 O ATOM 0 H GLU A 62 -16.918 3.190 1.110 1.00 0.00 H new ATOM 0 HA GLU A 62 -19.597 3.750 1.899 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -18.174 4.080 -0.767 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -19.721 4.792 -0.353 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -18.604 6.023 1.527 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -17.065 5.369 1.001 1.00 0.00 H new ATOM 992 N ALA A 63 -19.125 1.101 0.191 1.00 0.00 N ATOM 993 CA ALA A 63 -19.778 -0.075 -0.367 1.00 0.00 C ATOM 994 C ALA A 63 -20.545 -0.827 0.715 1.00 0.00 C ATOM 995 O ALA A 63 -21.303 -1.753 0.427 1.00 0.00 O ATOM 996 CB ALA A 63 -18.758 -0.990 -1.027 1.00 0.00 C ATOM 0 H ALA A 63 -18.130 0.981 0.382 1.00 0.00 H new ATOM 0 HA ALA A 63 -20.487 0.256 -1.126 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -19.265 -1.863 -1.438 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -18.253 -0.453 -1.829 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -18.025 -1.311 -0.287 1.00 0.00 H new ATOM 1002 N GLY A 64 -20.339 -0.426 1.962 1.00 0.00 N ATOM 1003 CA GLY A 64 -21.031 -1.053 3.068 1.00 0.00 C ATOM 1004 C GLY A 64 -20.212 -2.153 3.706 1.00 0.00 C ATOM 1005 O GLY A 64 -20.746 -2.996 4.427 1.00 0.00 O ATOM 0 H GLY A 64 -19.702 0.325 2.227 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -21.271 -0.299 3.818 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -21.977 -1.465 2.716 1.00 0.00 H new ATOM 1009 N LYS A 65 -18.915 -2.152 3.432 1.00 0.00 N ATOM 1010 CA LYS A 65 -18.015 -3.138 3.998 1.00 0.00 C ATOM 1011 C LYS A 65 -16.974 -2.446 4.865 1.00 0.00 C ATOM 1012 O LYS A 65 -16.914 -1.219 4.908 1.00 0.00 O ATOM 1013 CB LYS A 65 -17.335 -3.938 2.887 1.00 0.00 C ATOM 1014 CG LYS A 65 -18.311 -4.659 1.966 1.00 0.00 C ATOM 1015 CD LYS A 65 -19.203 -5.617 2.738 1.00 0.00 C ATOM 1016 CE LYS A 65 -20.270 -6.227 1.845 1.00 0.00 C ATOM 1017 NZ LYS A 65 -21.181 -7.130 2.598 1.00 0.00 N ATOM 0 H LYS A 65 -18.464 -1.474 2.818 1.00 0.00 H new ATOM 0 HA LYS A 65 -18.589 -3.828 4.616 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -16.718 -3.265 2.292 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -16.665 -4.671 3.337 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -18.928 -3.928 1.444 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -17.756 -5.209 1.206 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -18.595 -6.410 3.174 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -19.678 -5.088 3.564 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -20.852 -5.431 1.381 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -19.792 -6.784 1.039 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -21.893 -7.524 1.950 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -20.631 -7.905 3.020 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -21.657 -6.593 3.351 1.00 0.00 H new ATOM 1031 N ASN A 66 -16.149 -3.224 5.542 1.00 0.00 N ATOM 1032 CA ASN A 66 -15.175 -2.650 6.459 1.00 0.00 C ATOM 1033 C ASN A 66 -13.791 -2.637 5.846 1.00 0.00 C ATOM 1034 O ASN A 66 -13.337 -3.632 5.278 1.00 0.00 O ATOM 1035 CB ASN A 66 -15.135 -3.420 7.776 1.00 0.00 C ATOM 1036 CG ASN A 66 -14.582 -2.574 8.910 1.00 0.00 C ATOM 1037 OD1 ASN A 66 -14.666 -1.349 8.884 1.00 0.00 O ATOM 1038 ND2 ASN A 66 -14.034 -3.218 9.925 1.00 0.00 N ATOM 0 H ASN A 66 -16.131 -4.242 5.478 1.00 0.00 H new ATOM 0 HA ASN A 66 -15.488 -1.625 6.657 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -16.140 -3.756 8.031 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -14.521 -4.313 7.656 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -13.664 -2.697 10.720 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -13.981 -4.237 9.914 1.00 0.00 H new ATOM 1045 N ALA A 67 -13.124 -1.511 5.991 1.00 0.00 N ATOM 1046 CA ALA A 67 -11.772 -1.341 5.497 1.00 0.00 C ATOM 1047 C ALA A 67 -11.007 -0.416 6.427 1.00 0.00 C ATOM 1048 O ALA A 67 -11.601 0.442 7.081 1.00 0.00 O ATOM 1049 CB ALA A 67 -11.785 -0.789 4.078 1.00 0.00 C ATOM 0 H ALA A 67 -13.504 -0.686 6.455 1.00 0.00 H new ATOM 0 HA ALA A 67 -11.275 -2.311 5.473 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -10.761 -0.668 3.725 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -12.315 -1.481 3.423 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -12.288 0.178 4.068 1.00 0.00 H new ATOM 1055 N ALA A 68 -9.703 -0.581 6.491 1.00 0.00 N ATOM 1056 CA ALA A 68 -8.896 0.207 7.403 1.00 0.00 C ATOM 1057 C ALA A 68 -7.765 0.913 6.677 1.00 0.00 C ATOM 1058 O ALA A 68 -6.995 0.292 5.944 1.00 0.00 O ATOM 1059 CB ALA A 68 -8.349 -0.667 8.521 1.00 0.00 C ATOM 0 H ALA A 68 -9.179 -1.250 5.926 1.00 0.00 H new ATOM 0 HA ALA A 68 -9.539 0.972 7.839 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -7.746 -0.059 9.196 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -9.177 -1.111 9.074 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -7.732 -1.458 8.095 1.00 0.00 H new ATOM 1065 N TYR A 69 -7.695 2.216 6.879 1.00 0.00 N ATOM 1066 CA TYR A 69 -6.634 3.036 6.321 1.00 0.00 C ATOM 1067 C TYR A 69 -5.580 3.304 7.391 1.00 0.00 C ATOM 1068 O TYR A 69 -5.860 3.960 8.397 1.00 0.00 O ATOM 1069 CB TYR A 69 -7.227 4.349 5.784 1.00 0.00 C ATOM 1070 CG TYR A 69 -6.216 5.447 5.556 1.00 0.00 C ATOM 1071 CD1 TYR A 69 -5.423 5.473 4.417 1.00 0.00 C ATOM 1072 CD2 TYR A 69 -6.052 6.455 6.497 1.00 0.00 C ATOM 1073 CE1 TYR A 69 -4.495 6.479 4.223 1.00 0.00 C ATOM 1074 CE2 TYR A 69 -5.128 7.456 6.312 1.00 0.00 C ATOM 1075 CZ TYR A 69 -4.352 7.464 5.177 1.00 0.00 C ATOM 1076 OH TYR A 69 -3.427 8.464 5.002 1.00 0.00 O ATOM 0 H TYR A 69 -8.373 2.737 7.435 1.00 0.00 H new ATOM 0 HA TYR A 69 -6.156 2.513 5.493 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -7.739 4.144 4.844 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -7.980 4.706 6.486 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -5.532 4.698 3.673 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -6.661 6.453 7.389 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -3.887 6.493 3.331 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -5.012 8.232 7.054 1.00 0.00 H new ATOM 0 HH TYR A 69 -2.781 8.196 4.315 1.00 0.00 H new ATOM 1086 N ILE A 70 -4.382 2.768 7.196 1.00 0.00 N ATOM 1087 CA ILE A 70 -3.314 2.919 8.175 1.00 0.00 C ATOM 1088 C ILE A 70 -2.019 3.387 7.512 1.00 0.00 C ATOM 1089 O ILE A 70 -1.665 2.933 6.422 1.00 0.00 O ATOM 1090 CB ILE A 70 -3.056 1.590 8.931 1.00 0.00 C ATOM 1091 CG1 ILE A 70 -4.347 1.097 9.596 1.00 0.00 C ATOM 1092 CG2 ILE A 70 -1.948 1.757 9.967 1.00 0.00 C ATOM 1093 CD1 ILE A 70 -4.214 -0.253 10.267 1.00 0.00 C ATOM 0 H ILE A 70 -4.126 2.226 6.371 1.00 0.00 H new ATOM 0 HA ILE A 70 -3.638 3.675 8.890 1.00 0.00 H new ATOM 0 HB ILE A 70 -2.729 0.843 8.207 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -4.665 1.830 10.337 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -5.134 1.042 8.844 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -1.787 0.811 10.483 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -1.027 2.060 9.469 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -2.238 2.520 10.690 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -5.168 -0.533 10.714 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -3.927 -1.000 9.527 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -3.451 -0.200 11.044 1.00 0.00 H new ATOM 1105 N ASP A 71 -1.321 4.302 8.174 1.00 0.00 N ATOM 1106 CA ASP A 71 -0.031 4.789 7.696 1.00 0.00 C ATOM 1107 C ASP A 71 1.064 4.236 8.587 1.00 0.00 C ATOM 1108 O ASP A 71 1.192 4.659 9.728 1.00 0.00 O ATOM 1109 CB ASP A 71 0.039 6.322 7.725 1.00 0.00 C ATOM 1110 CG ASP A 71 -0.956 7.004 6.809 1.00 0.00 C ATOM 1111 OD1 ASP A 71 -2.104 7.228 7.240 1.00 0.00 O ATOM 1112 OD2 ASP A 71 -0.579 7.367 5.675 1.00 0.00 O ATOM 0 H ASP A 71 -1.629 4.725 9.050 1.00 0.00 H new ATOM 0 HA ASP A 71 0.097 4.458 6.666 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -0.130 6.663 8.746 1.00 0.00 H new ATOM 0 HB3 ASP A 71 1.046 6.634 7.447 1.00 0.00 H new ATOM 1117 N ALA A 72 1.853 3.305 8.071 1.00 0.00 N ATOM 1118 CA ALA A 72 2.866 2.617 8.877 1.00 0.00 C ATOM 1119 C ALA A 72 3.905 3.581 9.453 1.00 0.00 C ATOM 1120 O ALA A 72 4.549 3.283 10.458 1.00 0.00 O ATOM 1121 CB ALA A 72 3.549 1.536 8.056 1.00 0.00 C ATOM 0 H ALA A 72 1.816 3.004 7.097 1.00 0.00 H new ATOM 0 HA ALA A 72 2.349 2.159 9.720 1.00 0.00 H new ATOM 0 HB1 ALA A 72 4.299 1.034 8.667 1.00 0.00 H new ATOM 0 HB2 ALA A 72 2.808 0.810 7.722 1.00 0.00 H new ATOM 0 HB3 ALA A 72 4.031 1.988 7.189 1.00 0.00 H new ATOM 1127 N ALA A 73 4.057 4.740 8.824 1.00 0.00 N ATOM 1128 CA ALA A 73 5.042 5.724 9.262 1.00 0.00 C ATOM 1129 C ALA A 73 4.385 6.881 10.009 1.00 0.00 C ATOM 1130 O ALA A 73 4.980 7.944 10.186 1.00 0.00 O ATOM 1131 CB ALA A 73 5.824 6.243 8.071 1.00 0.00 C ATOM 0 H ALA A 73 3.512 5.022 8.010 1.00 0.00 H new ATOM 0 HA ALA A 73 5.725 5.230 9.953 1.00 0.00 H new ATOM 0 HB1 ALA A 73 6.556 6.977 8.408 1.00 0.00 H new ATOM 0 HB2 ALA A 73 6.338 5.414 7.584 1.00 0.00 H new ATOM 0 HB3 ALA A 73 5.140 6.712 7.363 1.00 0.00 H new ATOM 1137 N SER A 74 3.161 6.664 10.449 1.00 0.00 N ATOM 1138 CA SER A 74 2.432 7.669 11.206 1.00 0.00 C ATOM 1139 C SER A 74 1.682 7.006 12.353 1.00 0.00 C ATOM 1140 O SER A 74 1.623 7.527 13.465 1.00 0.00 O ATOM 1141 CB SER A 74 1.469 8.422 10.277 1.00 0.00 C ATOM 1142 OG SER A 74 0.691 9.380 10.977 1.00 0.00 O ATOM 0 H SER A 74 2.646 5.797 10.295 1.00 0.00 H new ATOM 0 HA SER A 74 3.133 8.390 11.628 1.00 0.00 H new ATOM 0 HB2 SER A 74 2.039 8.921 9.493 1.00 0.00 H new ATOM 0 HB3 SER A 74 0.808 7.708 9.785 1.00 0.00 H new ATOM 0 HG SER A 74 0.093 9.837 10.350 1.00 0.00 H new ATOM 1148 N MET A 75 1.148 5.831 12.078 1.00 0.00 N ATOM 1149 CA MET A 75 0.385 5.079 13.053 1.00 0.00 C ATOM 1150 C MET A 75 0.905 3.648 13.112 1.00 0.00 C ATOM 1151 O MET A 75 1.286 3.084 12.087 1.00 0.00 O ATOM 1152 CB MET A 75 -1.099 5.077 12.662 1.00 0.00 C ATOM 1153 CG MET A 75 -1.753 6.451 12.714 1.00 0.00 C ATOM 1154 SD MET A 75 -3.524 6.400 12.376 1.00 0.00 S ATOM 1155 CE MET A 75 -3.549 5.650 10.748 1.00 0.00 C ATOM 0 H MET A 75 1.232 5.372 11.171 1.00 0.00 H new ATOM 0 HA MET A 75 0.494 5.543 14.033 1.00 0.00 H new ATOM 0 HB2 MET A 75 -1.198 4.676 11.653 1.00 0.00 H new ATOM 0 HB3 MET A 75 -1.639 4.403 13.327 1.00 0.00 H new ATOM 0 HG2 MET A 75 -1.589 6.889 13.699 1.00 0.00 H new ATOM 0 HG3 MET A 75 -1.269 7.106 11.989 1.00 0.00 H new ATOM 0 HE1 MET A 75 -4.541 5.762 10.311 1.00 0.00 H new ATOM 0 HE2 MET A 75 -2.814 6.141 10.110 1.00 0.00 H new ATOM 0 HE3 MET A 75 -3.307 4.590 10.832 1.00 0.00 H new ATOM 1165 N PRO A 76 0.939 3.046 14.304 1.00 0.00 N ATOM 1166 CA PRO A 76 1.349 1.654 14.463 1.00 0.00 C ATOM 1167 C PRO A 76 0.248 0.696 14.037 1.00 0.00 C ATOM 1168 O PRO A 76 -0.936 1.045 14.059 1.00 0.00 O ATOM 1169 CB PRO A 76 1.618 1.529 15.960 1.00 0.00 C ATOM 1170 CG PRO A 76 0.740 2.553 16.593 1.00 0.00 C ATOM 1171 CD PRO A 76 0.602 3.674 15.594 1.00 0.00 C ATOM 0 HA PRO A 76 2.212 1.402 13.847 1.00 0.00 H new ATOM 0 HB2 PRO A 76 1.382 0.528 16.322 1.00 0.00 H new ATOM 0 HB3 PRO A 76 2.668 1.712 16.190 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -0.234 2.130 16.839 1.00 0.00 H new ATOM 0 HG3 PRO A 76 1.175 2.915 17.525 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -0.409 4.081 15.588 1.00 0.00 H new ATOM 0 HD3 PRO A 76 1.276 4.499 15.824 1.00 0.00 H new ATOM 1179 N LEU A 77 0.635 -0.504 13.642 1.00 0.00 N ATOM 1180 CA LEU A 77 -0.336 -1.506 13.241 1.00 0.00 C ATOM 1181 C LEU A 77 -0.979 -2.097 14.489 1.00 0.00 C ATOM 1182 O LEU A 77 -0.312 -2.304 15.503 1.00 0.00 O ATOM 1183 CB LEU A 77 0.331 -2.598 12.397 1.00 0.00 C ATOM 1184 CG LEU A 77 -0.626 -3.596 11.739 1.00 0.00 C ATOM 1185 CD1 LEU A 77 -1.653 -2.872 10.885 1.00 0.00 C ATOM 1186 CD2 LEU A 77 0.147 -4.593 10.890 1.00 0.00 C ATOM 0 H LEU A 77 1.608 -0.807 13.590 1.00 0.00 H new ATOM 0 HA LEU A 77 -1.107 -1.042 12.625 1.00 0.00 H new ATOM 0 HB2 LEU A 77 0.923 -2.120 11.617 1.00 0.00 H new ATOM 0 HB3 LEU A 77 1.025 -3.150 13.031 1.00 0.00 H new ATOM 0 HG LEU A 77 -1.149 -4.136 12.528 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -2.323 -3.599 10.427 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -2.230 -2.190 11.510 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -1.144 -2.306 10.105 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -0.548 -5.295 10.430 1.00 0.00 H new ATOM 0 HD22 LEU A 77 0.694 -4.061 10.112 1.00 0.00 H new ATOM 0 HD23 LEU A 77 0.850 -5.139 11.519 1.00 0.00 H new ATOM 1198 N THR A 78 -2.268 -2.376 14.412 1.00 0.00 N ATOM 1199 CA THR A 78 -3.023 -2.761 15.584 1.00 0.00 C ATOM 1200 C THR A 78 -3.917 -3.962 15.302 1.00 0.00 C ATOM 1201 O THR A 78 -4.057 -4.398 14.158 1.00 0.00 O ATOM 1202 CB THR A 78 -3.891 -1.583 16.076 1.00 0.00 C ATOM 1203 OG1 THR A 78 -4.729 -1.112 15.008 1.00 0.00 O ATOM 1204 CG2 THR A 78 -3.025 -0.438 16.589 1.00 0.00 C ATOM 0 H THR A 78 -2.811 -2.342 13.549 1.00 0.00 H new ATOM 0 HA THR A 78 -2.306 -3.036 16.358 1.00 0.00 H new ATOM 0 HB THR A 78 -4.511 -1.941 16.898 1.00 0.00 H new ATOM 0 HG1 THR A 78 -5.278 -0.366 15.328 1.00 0.00 H new ATOM 0 HG21 THR A 78 -3.664 0.377 16.929 1.00 0.00 H new ATOM 0 HG22 THR A 78 -2.412 -0.789 17.419 1.00 0.00 H new ATOM 0 HG23 THR A 78 -2.379 -0.082 15.786 1.00 0.00 H new ATOM 1212 N ASP A 79 -4.533 -4.476 16.358 1.00 0.00 N ATOM 1213 CA ASP A 79 -5.445 -5.610 16.257 1.00 0.00 C ATOM 1214 C ASP A 79 -6.707 -5.231 15.488 1.00 0.00 C ATOM 1215 O ASP A 79 -7.454 -6.101 15.038 1.00 0.00 O ATOM 1216 CB ASP A 79 -5.820 -6.110 17.655 1.00 0.00 C ATOM 1217 CG ASP A 79 -6.532 -5.052 18.476 1.00 0.00 C ATOM 1218 OD1 ASP A 79 -5.848 -4.184 19.055 1.00 0.00 O ATOM 1219 OD2 ASP A 79 -7.778 -5.080 18.539 1.00 0.00 O ATOM 0 H ASP A 79 -4.416 -4.121 17.307 1.00 0.00 H new ATOM 0 HA ASP A 79 -4.936 -6.406 15.713 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -6.460 -6.987 17.564 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -4.918 -6.426 18.179 1.00 0.00 H new ATOM 1224 N ALA A 80 -6.925 -3.929 15.330 1.00 0.00 N ATOM 1225 CA ALA A 80 -8.077 -3.407 14.601 1.00 0.00 C ATOM 1226 C ALA A 80 -8.084 -3.901 13.157 1.00 0.00 C ATOM 1227 O ALA A 80 -9.134 -3.983 12.522 1.00 0.00 O ATOM 1228 CB ALA A 80 -8.080 -1.886 14.648 1.00 0.00 C ATOM 0 H ALA A 80 -6.309 -3.207 15.703 1.00 0.00 H new ATOM 0 HA ALA A 80 -8.983 -3.775 15.082 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -8.943 -1.507 14.101 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -8.133 -1.554 15.685 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -7.166 -1.506 14.192 1.00 0.00 H new ATOM 1234 N ALA A 81 -6.904 -4.237 12.649 1.00 0.00 N ATOM 1235 CA ALA A 81 -6.758 -4.712 11.278 1.00 0.00 C ATOM 1236 C ALA A 81 -7.522 -6.018 11.041 1.00 0.00 C ATOM 1237 O ALA A 81 -7.874 -6.339 9.908 1.00 0.00 O ATOM 1238 CB ALA A 81 -5.286 -4.890 10.938 1.00 0.00 C ATOM 0 H ALA A 81 -6.029 -4.189 13.170 1.00 0.00 H new ATOM 0 HA ALA A 81 -7.190 -3.958 10.620 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -5.190 -5.245 9.912 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -4.771 -3.935 11.041 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -4.841 -5.618 11.617 1.00 0.00 H new ATOM 1244 N PHE A 82 -7.785 -6.761 12.112 1.00 0.00 N ATOM 1245 CA PHE A 82 -8.520 -8.017 12.005 1.00 0.00 C ATOM 1246 C PHE A 82 -10.021 -7.766 11.880 1.00 0.00 C ATOM 1247 O PHE A 82 -10.787 -8.665 11.531 1.00 0.00 O ATOM 1248 CB PHE A 82 -8.246 -8.899 13.221 1.00 0.00 C ATOM 1249 CG PHE A 82 -6.842 -9.436 13.286 1.00 0.00 C ATOM 1250 CD1 PHE A 82 -6.483 -10.563 12.562 1.00 0.00 C ATOM 1251 CD2 PHE A 82 -5.885 -8.822 14.079 1.00 0.00 C ATOM 1252 CE1 PHE A 82 -5.196 -11.065 12.627 1.00 0.00 C ATOM 1253 CE2 PHE A 82 -4.596 -9.319 14.147 1.00 0.00 C ATOM 1254 CZ PHE A 82 -4.253 -10.442 13.420 1.00 0.00 C ATOM 0 H PHE A 82 -7.501 -6.516 13.061 1.00 0.00 H new ATOM 0 HA PHE A 82 -8.178 -8.528 11.105 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -8.446 -8.325 14.126 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -8.944 -9.736 13.214 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -7.217 -11.054 11.940 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -6.149 -7.945 14.651 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -4.929 -11.943 12.058 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -3.859 -8.830 14.767 1.00 0.00 H new ATOM 0 HZ PHE A 82 -3.247 -10.833 13.472 1.00 0.00 H new ATOM 1264 N GLU A 83 -10.432 -6.542 12.171 1.00 0.00 N ATOM 1265 CA GLU A 83 -11.837 -6.165 12.119 1.00 0.00 C ATOM 1266 C GLU A 83 -12.258 -5.801 10.700 1.00 0.00 C ATOM 1267 O GLU A 83 -13.431 -5.909 10.334 1.00 0.00 O ATOM 1268 CB GLU A 83 -12.085 -4.981 13.047 1.00 0.00 C ATOM 1269 CG GLU A 83 -11.693 -5.258 14.482 1.00 0.00 C ATOM 1270 CD GLU A 83 -11.957 -4.084 15.402 1.00 0.00 C ATOM 1271 OE1 GLU A 83 -13.133 -3.698 15.565 1.00 0.00 O ATOM 1272 OE2 GLU A 83 -10.991 -3.554 15.992 1.00 0.00 O ATOM 0 H GLU A 83 -9.806 -5.786 12.448 1.00 0.00 H new ATOM 0 HA GLU A 83 -12.432 -7.019 12.443 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -11.525 -4.119 12.684 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -13.141 -4.714 13.010 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -12.244 -6.127 14.843 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -10.634 -5.513 14.521 1.00 0.00 H new ATOM 1279 N ALA A 84 -11.296 -5.366 9.910 1.00 0.00 N ATOM 1280 CA ALA A 84 -11.558 -4.924 8.552 1.00 0.00 C ATOM 1281 C ALA A 84 -11.545 -6.099 7.588 1.00 0.00 C ATOM 1282 O ALA A 84 -10.800 -7.062 7.772 1.00 0.00 O ATOM 1283 CB ALA A 84 -10.539 -3.879 8.129 1.00 0.00 C ATOM 0 H ALA A 84 -10.316 -5.309 10.188 1.00 0.00 H new ATOM 0 HA ALA A 84 -12.550 -4.474 8.526 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -10.749 -3.558 7.109 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -10.598 -3.021 8.799 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -9.538 -4.307 8.176 1.00 0.00 H new ATOM 1289 N GLU A 85 -12.391 -6.023 6.576 1.00 0.00 N ATOM 1290 CA GLU A 85 -12.426 -7.042 5.535 1.00 0.00 C ATOM 1291 C GLU A 85 -11.385 -6.740 4.466 1.00 0.00 C ATOM 1292 O GLU A 85 -10.935 -7.632 3.751 1.00 0.00 O ATOM 1293 CB GLU A 85 -13.812 -7.114 4.899 1.00 0.00 C ATOM 1294 CG GLU A 85 -14.027 -8.375 4.073 1.00 0.00 C ATOM 1295 CD GLU A 85 -15.444 -8.522 3.555 1.00 0.00 C ATOM 1296 OE1 GLU A 85 -16.363 -8.721 4.372 1.00 0.00 O ATOM 1297 OE2 GLU A 85 -15.639 -8.462 2.324 1.00 0.00 O ATOM 0 H GLU A 85 -13.064 -5.267 6.450 1.00 0.00 H new ATOM 0 HA GLU A 85 -12.200 -8.005 5.993 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -14.568 -7.068 5.683 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -13.959 -6.241 4.263 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -13.338 -8.369 3.228 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -13.778 -9.245 4.681 1.00 0.00 H new ATOM 1304 N TYR A 86 -11.038 -5.471 4.350 1.00 0.00 N ATOM 1305 CA TYR A 86 -10.017 -5.028 3.402 1.00 0.00 C ATOM 1306 C TYR A 86 -9.002 -4.143 4.131 1.00 0.00 C ATOM 1307 O TYR A 86 -9.389 -3.197 4.821 1.00 0.00 O ATOM 1308 CB TYR A 86 -10.669 -4.246 2.257 1.00 0.00 C ATOM 1309 CG TYR A 86 -11.954 -4.869 1.750 1.00 0.00 C ATOM 1310 CD1 TYR A 86 -11.949 -6.098 1.110 1.00 0.00 C ATOM 1311 CD2 TYR A 86 -13.173 -4.230 1.928 1.00 0.00 C ATOM 1312 CE1 TYR A 86 -13.120 -6.678 0.667 1.00 0.00 C ATOM 1313 CE2 TYR A 86 -14.349 -4.800 1.483 1.00 0.00 C ATOM 1314 CZ TYR A 86 -14.318 -6.026 0.855 1.00 0.00 C ATOM 1315 OH TYR A 86 -15.491 -6.607 0.426 1.00 0.00 O ATOM 0 H TYR A 86 -11.449 -4.719 4.903 1.00 0.00 H new ATOM 0 HA TYR A 86 -9.507 -5.896 2.985 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -10.876 -3.230 2.594 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -9.962 -4.170 1.431 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -11.011 -6.611 0.955 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -13.202 -3.271 2.423 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -13.097 -7.639 0.175 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -15.289 -4.287 1.626 1.00 0.00 H new ATOM 0 HH TYR A 86 -15.836 -7.202 1.124 1.00 0.00 H new ATOM 1325 N LEU A 87 -7.716 -4.444 3.990 1.00 0.00 N ATOM 1326 CA LEU A 87 -6.685 -3.759 4.768 1.00 0.00 C ATOM 1327 C LEU A 87 -5.673 -3.037 3.868 1.00 0.00 C ATOM 1328 O LEU A 87 -5.053 -3.648 2.996 1.00 0.00 O ATOM 1329 CB LEU A 87 -5.966 -4.780 5.654 1.00 0.00 C ATOM 1330 CG LEU A 87 -5.604 -4.301 7.064 1.00 0.00 C ATOM 1331 CD1 LEU A 87 -4.570 -3.189 7.022 1.00 0.00 C ATOM 1332 CD2 LEU A 87 -6.852 -3.839 7.798 1.00 0.00 C ATOM 0 H LEU A 87 -7.362 -5.153 3.348 1.00 0.00 H new ATOM 0 HA LEU A 87 -7.168 -3.001 5.384 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -6.597 -5.665 5.742 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -5.051 -5.090 5.150 1.00 0.00 H new ATOM 0 HG LEU A 87 -5.167 -5.141 7.604 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -4.335 -2.872 8.038 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -3.664 -3.553 6.537 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -4.968 -2.343 6.461 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -6.582 -3.501 8.798 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -7.313 -3.017 7.250 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -7.557 -4.667 7.873 1.00 0.00 H new ATOM 1344 N ALA A 88 -5.491 -1.739 4.100 1.00 0.00 N ATOM 1345 CA ALA A 88 -4.533 -0.951 3.334 1.00 0.00 C ATOM 1346 C ALA A 88 -3.546 -0.237 4.256 1.00 0.00 C ATOM 1347 O ALA A 88 -3.945 0.501 5.159 1.00 0.00 O ATOM 1348 CB ALA A 88 -5.258 0.055 2.453 1.00 0.00 C ATOM 0 H ALA A 88 -5.995 -1.212 4.813 1.00 0.00 H new ATOM 0 HA ALA A 88 -3.968 -1.632 2.697 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -4.529 0.635 1.888 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -5.915 -0.473 1.762 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -5.850 0.725 3.077 1.00 0.00 H new ATOM 1354 N VAL A 89 -2.257 -0.461 4.026 1.00 0.00 N ATOM 1355 CA VAL A 89 -1.210 0.161 4.829 1.00 0.00 C ATOM 1356 C VAL A 89 -0.162 0.803 3.926 1.00 0.00 C ATOM 1357 O VAL A 89 0.471 0.123 3.115 1.00 0.00 O ATOM 1358 CB VAL A 89 -0.511 -0.859 5.761 1.00 0.00 C ATOM 1359 CG1 VAL A 89 0.601 -0.194 6.560 1.00 0.00 C ATOM 1360 CG2 VAL A 89 -1.510 -1.517 6.700 1.00 0.00 C ATOM 0 H VAL A 89 -1.911 -1.072 3.286 1.00 0.00 H new ATOM 0 HA VAL A 89 -1.691 0.920 5.447 1.00 0.00 H new ATOM 0 HB VAL A 89 -0.071 -1.632 5.131 1.00 0.00 H new ATOM 0 HG11 VAL A 89 1.076 -0.932 7.207 1.00 0.00 H new ATOM 0 HG12 VAL A 89 1.342 0.220 5.877 1.00 0.00 H new ATOM 0 HG13 VAL A 89 0.182 0.607 7.170 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -0.991 -2.228 7.343 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -1.988 -0.754 7.315 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -2.267 -2.040 6.117 1.00 0.00 H new ATOM 1370 N ASP A 90 0.013 2.109 4.059 1.00 0.00 N ATOM 1371 CA ASP A 90 1.012 2.821 3.272 1.00 0.00 C ATOM 1372 C ASP A 90 2.214 3.154 4.148 1.00 0.00 C ATOM 1373 O ASP A 90 2.191 2.921 5.360 1.00 0.00 O ATOM 1374 CB ASP A 90 0.423 4.108 2.690 1.00 0.00 C ATOM 1375 CG ASP A 90 1.090 4.548 1.392 1.00 0.00 C ATOM 1376 OD1 ASP A 90 2.327 4.722 1.372 1.00 0.00 O ATOM 1377 OD2 ASP A 90 0.364 4.741 0.394 1.00 0.00 O ATOM 0 H ASP A 90 -0.520 2.696 4.701 1.00 0.00 H new ATOM 0 HA ASP A 90 1.328 2.181 2.448 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -0.642 3.962 2.511 1.00 0.00 H new ATOM 0 HB3 ASP A 90 0.516 4.906 3.426 1.00 0.00 H new ATOM 1382 N GLN A 91 3.247 3.717 3.529 1.00 0.00 N ATOM 1383 CA GLN A 91 4.483 4.095 4.209 1.00 0.00 C ATOM 1384 C GLN A 91 5.106 2.893 4.917 1.00 0.00 C ATOM 1385 O GLN A 91 5.733 3.032 5.971 1.00 0.00 O ATOM 1386 CB GLN A 91 4.228 5.231 5.201 1.00 0.00 C ATOM 1387 CG GLN A 91 3.386 6.361 4.625 1.00 0.00 C ATOM 1388 CD GLN A 91 3.456 7.641 5.439 1.00 0.00 C ATOM 1389 OE1 GLN A 91 4.492 7.978 6.012 1.00 0.00 O ATOM 1390 NE2 GLN A 91 2.340 8.338 5.530 1.00 0.00 N ATOM 0 H GLN A 91 3.250 3.926 2.531 1.00 0.00 H new ATOM 0 HA GLN A 91 5.188 4.448 3.456 1.00 0.00 H new ATOM 0 HB2 GLN A 91 3.728 4.828 6.082 1.00 0.00 H new ATOM 0 HB3 GLN A 91 5.185 5.634 5.534 1.00 0.00 H new ATOM 0 HG2 GLN A 91 3.717 6.568 3.607 1.00 0.00 H new ATOM 0 HG3 GLN A 91 2.348 6.035 4.563 1.00 0.00 H new ATOM 0 HE21 GLN A 91 1.502 8.025 5.040 1.00 0.00 H new ATOM 0 HE22 GLN A 91 2.315 9.190 6.091 1.00 0.00 H new ATOM 1399 N VAL A 92 4.959 1.720 4.301 1.00 0.00 N ATOM 1400 CA VAL A 92 5.502 0.466 4.829 1.00 0.00 C ATOM 1401 C VAL A 92 7.033 0.522 4.887 1.00 0.00 C ATOM 1402 O VAL A 92 7.683 -0.292 5.542 1.00 0.00 O ATOM 1403 CB VAL A 92 5.049 -0.731 3.951 1.00 0.00 C ATOM 1404 CG1 VAL A 92 5.565 -2.057 4.489 1.00 0.00 C ATOM 1405 CG2 VAL A 92 3.533 -0.768 3.842 1.00 0.00 C ATOM 0 H VAL A 92 4.459 1.611 3.419 1.00 0.00 H new ATOM 0 HA VAL A 92 5.119 0.328 5.840 1.00 0.00 H new ATOM 0 HB VAL A 92 5.477 -0.585 2.959 1.00 0.00 H new ATOM 0 HG11 VAL A 92 5.225 -2.868 3.845 1.00 0.00 H new ATOM 0 HG12 VAL A 92 6.655 -2.042 4.509 1.00 0.00 H new ATOM 0 HG13 VAL A 92 5.186 -2.212 5.499 1.00 0.00 H new ATOM 0 HG21 VAL A 92 3.233 -1.614 3.223 1.00 0.00 H new ATOM 0 HG22 VAL A 92 3.099 -0.874 4.836 1.00 0.00 H new ATOM 0 HG23 VAL A 92 3.178 0.158 3.389 1.00 0.00 H new ATOM 1415 N GLU A 93 7.587 1.526 4.227 1.00 0.00 N ATOM 1416 CA GLU A 93 9.025 1.728 4.159 1.00 0.00 C ATOM 1417 C GLU A 93 9.619 1.965 5.554 1.00 0.00 C ATOM 1418 O GLU A 93 10.817 1.787 5.766 1.00 0.00 O ATOM 1419 CB GLU A 93 9.312 2.934 3.263 1.00 0.00 C ATOM 1420 CG GLU A 93 10.692 2.935 2.636 1.00 0.00 C ATOM 1421 CD GLU A 93 10.837 1.892 1.546 1.00 0.00 C ATOM 1422 OE1 GLU A 93 10.093 1.973 0.541 1.00 0.00 O ATOM 1423 OE2 GLU A 93 11.700 1.003 1.684 1.00 0.00 O ATOM 0 H GLU A 93 7.048 2.228 3.720 1.00 0.00 H new ATOM 0 HA GLU A 93 9.487 0.831 3.746 1.00 0.00 H new ATOM 0 HB2 GLU A 93 8.566 2.967 2.469 1.00 0.00 H new ATOM 0 HB3 GLU A 93 9.193 3.844 3.851 1.00 0.00 H new ATOM 0 HG2 GLU A 93 10.897 3.921 2.220 1.00 0.00 H new ATOM 0 HG3 GLU A 93 11.439 2.754 3.409 1.00 0.00 H new ATOM 1430 N LYS A 94 8.772 2.360 6.505 1.00 0.00 N ATOM 1431 CA LYS A 94 9.239 2.727 7.839 1.00 0.00 C ATOM 1432 C LYS A 94 8.783 1.739 8.924 1.00 0.00 C ATOM 1433 O LYS A 94 8.600 2.135 10.075 1.00 0.00 O ATOM 1434 CB LYS A 94 8.749 4.129 8.206 1.00 0.00 C ATOM 1435 CG LYS A 94 9.813 5.199 8.043 1.00 0.00 C ATOM 1436 CD LYS A 94 9.992 5.628 6.598 1.00 0.00 C ATOM 1437 CE LYS A 94 8.898 6.598 6.171 1.00 0.00 C ATOM 1438 NZ LYS A 94 9.275 7.397 4.973 1.00 0.00 N ATOM 0 H LYS A 94 7.763 2.433 6.376 1.00 0.00 H new ATOM 0 HA LYS A 94 10.328 2.701 7.801 1.00 0.00 H new ATOM 0 HB2 LYS A 94 7.891 4.381 7.582 1.00 0.00 H new ATOM 0 HB3 LYS A 94 8.402 4.126 9.239 1.00 0.00 H new ATOM 0 HG2 LYS A 94 9.545 6.067 8.645 1.00 0.00 H new ATOM 0 HG3 LYS A 94 10.762 4.824 8.427 1.00 0.00 H new ATOM 0 HD2 LYS A 94 10.967 6.099 6.474 1.00 0.00 H new ATOM 0 HD3 LYS A 94 9.977 4.751 5.951 1.00 0.00 H new ATOM 0 HE2 LYS A 94 7.986 6.040 5.958 1.00 0.00 H new ATOM 0 HE3 LYS A 94 8.674 7.273 6.997 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 8.517 8.076 4.756 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 10.158 7.913 5.163 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 9.414 6.762 4.161 1.00 0.00 H new ATOM 1452 N LEU A 95 8.612 0.465 8.575 1.00 0.00 N ATOM 1453 CA LEU A 95 8.197 -0.544 9.563 1.00 0.00 C ATOM 1454 C LEU A 95 9.219 -0.685 10.696 1.00 0.00 C ATOM 1455 O LEU A 95 10.426 -0.764 10.452 1.00 0.00 O ATOM 1456 CB LEU A 95 7.992 -1.906 8.898 1.00 0.00 C ATOM 1457 CG LEU A 95 6.757 -2.029 8.007 1.00 0.00 C ATOM 1458 CD1 LEU A 95 6.626 -3.450 7.481 1.00 0.00 C ATOM 1459 CD2 LEU A 95 5.503 -1.627 8.769 1.00 0.00 C ATOM 0 H LEU A 95 8.751 0.105 7.631 1.00 0.00 H new ATOM 0 HA LEU A 95 7.254 -0.200 9.987 1.00 0.00 H new ATOM 0 HB2 LEU A 95 8.874 -2.134 8.299 1.00 0.00 H new ATOM 0 HB3 LEU A 95 7.932 -2.665 9.678 1.00 0.00 H new ATOM 0 HG LEU A 95 6.874 -1.353 7.160 1.00 0.00 H new ATOM 0 HD11 LEU A 95 5.742 -3.523 6.848 1.00 0.00 H new ATOM 0 HD12 LEU A 95 7.512 -3.706 6.899 1.00 0.00 H new ATOM 0 HD13 LEU A 95 6.531 -4.141 8.319 1.00 0.00 H new ATOM 0 HD21 LEU A 95 4.635 -1.722 8.117 1.00 0.00 H new ATOM 0 HD22 LEU A 95 5.379 -2.278 9.635 1.00 0.00 H new ATOM 0 HD23 LEU A 95 5.595 -0.593 9.102 1.00 0.00 H new ATOM 1471 N GLY A 96 8.724 -0.724 11.932 1.00 0.00 N ATOM 1472 CA GLY A 96 9.591 -0.865 13.087 1.00 0.00 C ATOM 1473 C GLY A 96 9.648 -2.291 13.613 1.00 0.00 C ATOM 1474 O GLY A 96 10.319 -3.143 13.035 1.00 0.00 O ATOM 0 H GLY A 96 7.730 -0.660 12.153 1.00 0.00 H new ATOM 0 HA2 GLY A 96 10.597 -0.540 12.822 1.00 0.00 H new ATOM 0 HA3 GLY A 96 9.242 -0.204 13.880 1.00 0.00 H new ATOM 1478 N ASN A 97 8.937 -2.557 14.703 1.00 0.00 N ATOM 1479 CA ASN A 97 9.014 -3.863 15.369 1.00 0.00 C ATOM 1480 C ASN A 97 7.633 -4.488 15.542 1.00 0.00 C ATOM 1481 O ASN A 97 7.345 -5.537 14.968 1.00 0.00 O ATOM 1482 CB ASN A 97 9.698 -3.728 16.737 1.00 0.00 C ATOM 1483 CG ASN A 97 9.745 -5.032 17.523 1.00 0.00 C ATOM 1484 OD1 ASN A 97 9.632 -5.029 18.747 1.00 0.00 O ATOM 1485 ND2 ASN A 97 9.947 -6.148 16.841 1.00 0.00 N ATOM 0 H ASN A 97 8.302 -1.893 15.147 1.00 0.00 H new ATOM 0 HA ASN A 97 9.606 -4.520 14.732 1.00 0.00 H new ATOM 0 HB2 ASN A 97 10.715 -3.363 16.592 1.00 0.00 H new ATOM 0 HB3 ASN A 97 9.171 -2.977 17.325 1.00 0.00 H new ATOM 0 HD21 ASN A 97 10.013 -7.040 17.331 1.00 0.00 H new ATOM 0 HD22 ASN A 97 10.036 -6.116 15.825 1.00 0.00 H new ATOM 1492 N GLU A 98 6.782 -3.832 16.325 1.00 0.00 N ATOM 1493 CA GLU A 98 5.455 -4.358 16.645 1.00 0.00 C ATOM 1494 C GLU A 98 4.646 -4.587 15.377 1.00 0.00 C ATOM 1495 O GLU A 98 3.895 -5.557 15.263 1.00 0.00 O ATOM 1496 CB GLU A 98 4.711 -3.380 17.552 1.00 0.00 C ATOM 1497 CG GLU A 98 5.466 -3.038 18.823 1.00 0.00 C ATOM 1498 CD GLU A 98 4.792 -1.947 19.620 1.00 0.00 C ATOM 1499 OE1 GLU A 98 5.032 -0.760 19.319 1.00 0.00 O ATOM 1500 OE2 GLU A 98 4.029 -2.268 20.559 1.00 0.00 O ATOM 0 H GLU A 98 6.988 -2.929 16.753 1.00 0.00 H new ATOM 0 HA GLU A 98 5.580 -5.311 17.159 1.00 0.00 H new ATOM 0 HB2 GLU A 98 4.513 -2.462 16.998 1.00 0.00 H new ATOM 0 HB3 GLU A 98 3.744 -3.807 17.817 1.00 0.00 H new ATOM 0 HG2 GLU A 98 5.556 -3.932 19.440 1.00 0.00 H new ATOM 0 HG3 GLU A 98 6.478 -2.724 18.567 1.00 0.00 H new ATOM 1507 N GLU A 99 4.818 -3.681 14.426 1.00 0.00 N ATOM 1508 CA GLU A 99 4.123 -3.754 13.154 1.00 0.00 C ATOM 1509 C GLU A 99 4.474 -5.041 12.419 1.00 0.00 C ATOM 1510 O GLU A 99 3.614 -5.653 11.796 1.00 0.00 O ATOM 1511 CB GLU A 99 4.459 -2.546 12.272 1.00 0.00 C ATOM 1512 CG GLU A 99 4.356 -1.212 12.995 1.00 0.00 C ATOM 1513 CD GLU A 99 5.650 -0.817 13.680 1.00 0.00 C ATOM 1514 OE1 GLU A 99 5.925 -1.318 14.794 1.00 0.00 O ATOM 1515 OE2 GLU A 99 6.400 -0.012 13.099 1.00 0.00 O ATOM 0 H GLU A 99 5.441 -2.878 14.516 1.00 0.00 H new ATOM 0 HA GLU A 99 3.053 -3.746 13.363 1.00 0.00 H new ATOM 0 HB2 GLU A 99 5.471 -2.661 11.884 1.00 0.00 H new ATOM 0 HB3 GLU A 99 3.787 -2.536 11.413 1.00 0.00 H new ATOM 0 HG2 GLU A 99 4.076 -0.437 12.281 1.00 0.00 H new ATOM 0 HG3 GLU A 99 3.559 -1.266 13.736 1.00 0.00 H new ATOM 1522 N GLN A 100 5.735 -5.458 12.516 1.00 0.00 N ATOM 1523 CA GLN A 100 6.194 -6.676 11.855 1.00 0.00 C ATOM 1524 C GLN A 100 5.501 -7.905 12.435 1.00 0.00 C ATOM 1525 O GLN A 100 5.061 -8.787 11.700 1.00 0.00 O ATOM 1526 CB GLN A 100 7.712 -6.832 11.981 1.00 0.00 C ATOM 1527 CG GLN A 100 8.507 -5.919 11.063 1.00 0.00 C ATOM 1528 CD GLN A 100 9.983 -6.268 11.045 1.00 0.00 C ATOM 1529 OE1 GLN A 100 10.414 -7.124 10.277 1.00 0.00 O ATOM 1530 NE2 GLN A 100 10.774 -5.592 11.862 1.00 0.00 N ATOM 0 H GLN A 100 6.457 -4.970 13.046 1.00 0.00 H new ATOM 0 HA GLN A 100 5.937 -6.592 10.799 1.00 0.00 H new ATOM 0 HB2 GLN A 100 8.002 -6.634 13.013 1.00 0.00 H new ATOM 0 HB3 GLN A 100 7.979 -7.867 11.767 1.00 0.00 H new ATOM 0 HG2 GLN A 100 8.107 -5.987 10.051 1.00 0.00 H new ATOM 0 HG3 GLN A 100 8.384 -4.885 11.386 1.00 0.00 H new ATOM 0 HE21 GLN A 100 10.380 -4.888 12.486 1.00 0.00 H new ATOM 0 HE22 GLN A 100 11.777 -5.775 11.868 1.00 0.00 H new ATOM 1539 N ALA A 101 5.394 -7.947 13.754 1.00 0.00 N ATOM 1540 CA ALA A 101 4.772 -9.077 14.431 1.00 0.00 C ATOM 1541 C ALA A 101 3.288 -9.170 14.086 1.00 0.00 C ATOM 1542 O ALA A 101 2.750 -10.260 13.878 1.00 0.00 O ATOM 1543 CB ALA A 101 4.962 -8.955 15.933 1.00 0.00 C ATOM 0 H ALA A 101 5.729 -7.213 14.378 1.00 0.00 H new ATOM 0 HA ALA A 101 5.255 -9.992 14.088 1.00 0.00 H new ATOM 0 HB1 ALA A 101 4.493 -9.805 16.429 1.00 0.00 H new ATOM 0 HB2 ALA A 101 6.027 -8.941 16.165 1.00 0.00 H new ATOM 0 HB3 ALA A 101 4.502 -8.031 16.284 1.00 0.00 H new ATOM 1549 N LEU A 102 2.637 -8.018 14.020 1.00 0.00 N ATOM 1550 CA LEU A 102 1.221 -7.957 13.685 1.00 0.00 C ATOM 1551 C LEU A 102 1.024 -8.289 12.206 1.00 0.00 C ATOM 1552 O LEU A 102 0.191 -9.124 11.853 1.00 0.00 O ATOM 1553 CB LEU A 102 0.678 -6.559 13.998 1.00 0.00 C ATOM 1554 CG LEU A 102 -0.790 -6.481 14.437 1.00 0.00 C ATOM 1555 CD1 LEU A 102 -1.725 -6.980 13.348 1.00 0.00 C ATOM 1556 CD2 LEU A 102 -1.001 -7.260 15.727 1.00 0.00 C ATOM 0 H LEU A 102 3.068 -7.110 14.194 1.00 0.00 H new ATOM 0 HA LEU A 102 0.674 -8.688 14.281 1.00 0.00 H new ATOM 0 HB2 LEU A 102 1.294 -6.121 14.784 1.00 0.00 H new ATOM 0 HB3 LEU A 102 0.803 -5.937 13.112 1.00 0.00 H new ATOM 0 HG LEU A 102 -1.029 -5.433 14.619 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -2.756 -6.910 13.694 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -1.600 -6.370 12.453 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -1.490 -8.018 13.114 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -2.048 -7.194 16.025 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -0.733 -8.305 15.569 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -0.373 -6.840 16.513 1.00 0.00 H new ATOM 1568 N LEU A 103 1.810 -7.634 11.355 1.00 0.00 N ATOM 1569 CA LEU A 103 1.755 -7.836 9.905 1.00 0.00 C ATOM 1570 C LEU A 103 1.937 -9.312 9.558 1.00 0.00 C ATOM 1571 O LEU A 103 1.203 -9.852 8.733 1.00 0.00 O ATOM 1572 CB LEU A 103 2.840 -6.981 9.223 1.00 0.00 C ATOM 1573 CG LEU A 103 2.697 -6.758 7.709 1.00 0.00 C ATOM 1574 CD1 LEU A 103 3.057 -8.009 6.919 1.00 0.00 C ATOM 1575 CD2 LEU A 103 1.286 -6.295 7.365 1.00 0.00 C ATOM 0 H LEU A 103 2.504 -6.947 11.649 1.00 0.00 H new ATOM 0 HA LEU A 103 0.776 -7.525 9.541 1.00 0.00 H new ATOM 0 HB2 LEU A 103 2.860 -6.006 9.710 1.00 0.00 H new ATOM 0 HB3 LEU A 103 3.807 -7.449 9.408 1.00 0.00 H new ATOM 0 HG LEU A 103 3.401 -5.976 7.425 1.00 0.00 H new ATOM 0 HD11 LEU A 103 2.943 -7.811 5.853 1.00 0.00 H new ATOM 0 HD12 LEU A 103 4.090 -8.287 7.128 1.00 0.00 H new ATOM 0 HD13 LEU A 103 2.396 -8.825 7.209 1.00 0.00 H new ATOM 0 HD21 LEU A 103 1.205 -6.143 6.289 1.00 0.00 H new ATOM 0 HD22 LEU A 103 0.568 -7.052 7.679 1.00 0.00 H new ATOM 0 HD23 LEU A 103 1.075 -5.358 7.881 1.00 0.00 H new ATOM 1587 N PHE A 104 2.915 -9.951 10.192 1.00 0.00 N ATOM 1588 CA PHE A 104 3.172 -11.375 9.989 1.00 0.00 C ATOM 1589 C PHE A 104 1.899 -12.193 10.203 1.00 0.00 C ATOM 1590 O PHE A 104 1.570 -13.073 9.404 1.00 0.00 O ATOM 1591 CB PHE A 104 4.273 -11.853 10.939 1.00 0.00 C ATOM 1592 CG PHE A 104 4.675 -13.285 10.732 1.00 0.00 C ATOM 1593 CD1 PHE A 104 5.471 -13.642 9.655 1.00 0.00 C ATOM 1594 CD2 PHE A 104 4.263 -14.272 11.613 1.00 0.00 C ATOM 1595 CE1 PHE A 104 5.848 -14.958 9.461 1.00 0.00 C ATOM 1596 CE2 PHE A 104 4.635 -15.590 11.424 1.00 0.00 C ATOM 1597 CZ PHE A 104 5.430 -15.933 10.348 1.00 0.00 C ATOM 0 H PHE A 104 3.547 -9.503 10.855 1.00 0.00 H new ATOM 0 HA PHE A 104 3.503 -11.520 8.961 1.00 0.00 H new ATOM 0 HB2 PHE A 104 5.150 -11.218 10.813 1.00 0.00 H new ATOM 0 HB3 PHE A 104 3.933 -11.726 11.967 1.00 0.00 H new ATOM 0 HD1 PHE A 104 5.800 -12.884 8.960 1.00 0.00 H new ATOM 0 HD2 PHE A 104 3.644 -14.008 12.458 1.00 0.00 H new ATOM 0 HE1 PHE A 104 6.468 -15.224 8.618 1.00 0.00 H new ATOM 0 HE2 PHE A 104 4.305 -16.350 12.116 1.00 0.00 H new ATOM 0 HZ PHE A 104 5.725 -16.961 10.200 1.00 0.00 H new ATOM 1607 N SER A 105 1.181 -11.882 11.272 1.00 0.00 N ATOM 1608 CA SER A 105 -0.068 -12.558 11.574 1.00 0.00 C ATOM 1609 C SER A 105 -1.134 -12.185 10.544 1.00 0.00 C ATOM 1610 O SER A 105 -1.898 -13.040 10.093 1.00 0.00 O ATOM 1611 CB SER A 105 -0.538 -12.197 12.984 1.00 0.00 C ATOM 1612 OG SER A 105 -1.586 -13.049 13.414 1.00 0.00 O ATOM 0 H SER A 105 1.445 -11.163 11.946 1.00 0.00 H new ATOM 0 HA SER A 105 0.096 -13.635 11.528 1.00 0.00 H new ATOM 0 HB2 SER A 105 0.299 -12.269 13.678 1.00 0.00 H new ATOM 0 HB3 SER A 105 -0.878 -11.162 13.002 1.00 0.00 H new ATOM 0 HG SER A 105 -1.864 -12.795 14.319 1.00 0.00 H new ATOM 1618 N ILE A 106 -1.172 -10.907 10.171 1.00 0.00 N ATOM 1619 CA ILE A 106 -2.088 -10.430 9.140 1.00 0.00 C ATOM 1620 C ILE A 106 -1.896 -11.212 7.842 1.00 0.00 C ATOM 1621 O ILE A 106 -2.852 -11.742 7.279 1.00 0.00 O ATOM 1622 CB ILE A 106 -1.888 -8.922 8.861 1.00 0.00 C ATOM 1623 CG1 ILE A 106 -2.286 -8.091 10.082 1.00 0.00 C ATOM 1624 CG2 ILE A 106 -2.673 -8.477 7.635 1.00 0.00 C ATOM 1625 CD1 ILE A 106 -3.731 -8.270 10.505 1.00 0.00 C ATOM 0 H ILE A 106 -0.576 -10.182 10.570 1.00 0.00 H new ATOM 0 HA ILE A 106 -3.101 -10.586 9.511 1.00 0.00 H new ATOM 0 HB ILE A 106 -0.829 -8.759 8.658 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -1.638 -8.357 10.917 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -2.109 -7.038 9.865 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -2.511 -7.412 7.466 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -2.336 -9.038 6.764 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -3.735 -8.661 7.796 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -3.935 -7.648 11.377 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -4.389 -7.975 9.687 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -3.910 -9.316 10.756 1.00 0.00 H new ATOM 1637 N PHE A 107 -0.650 -11.301 7.395 1.00 0.00 N ATOM 1638 CA PHE A 107 -0.324 -11.997 6.159 1.00 0.00 C ATOM 1639 C PHE A 107 -0.707 -13.471 6.251 1.00 0.00 C ATOM 1640 O PHE A 107 -1.265 -14.034 5.313 1.00 0.00 O ATOM 1641 CB PHE A 107 1.169 -11.866 5.860 1.00 0.00 C ATOM 1642 CG PHE A 107 1.464 -11.392 4.465 1.00 0.00 C ATOM 1643 CD1 PHE A 107 1.359 -12.255 3.384 1.00 0.00 C ATOM 1644 CD2 PHE A 107 1.847 -10.079 4.235 1.00 0.00 C ATOM 1645 CE1 PHE A 107 1.632 -11.816 2.102 1.00 0.00 C ATOM 1646 CE2 PHE A 107 2.122 -9.636 2.956 1.00 0.00 C ATOM 1647 CZ PHE A 107 2.014 -10.505 1.888 1.00 0.00 C ATOM 0 H PHE A 107 0.155 -10.897 7.874 1.00 0.00 H new ATOM 0 HA PHE A 107 -0.893 -11.541 5.349 1.00 0.00 H new ATOM 0 HB2 PHE A 107 1.614 -11.171 6.572 1.00 0.00 H new ATOM 0 HB3 PHE A 107 1.648 -12.833 6.015 1.00 0.00 H new ATOM 0 HD1 PHE A 107 1.061 -13.280 3.546 1.00 0.00 H new ATOM 0 HD2 PHE A 107 1.931 -9.395 5.066 1.00 0.00 H new ATOM 0 HE1 PHE A 107 1.547 -12.497 1.268 1.00 0.00 H new ATOM 0 HE2 PHE A 107 2.421 -8.611 2.791 1.00 0.00 H new ATOM 0 HZ PHE A 107 2.228 -10.161 0.887 1.00 0.00 H new ATOM 1657 N ASN A 108 -0.411 -14.085 7.390 1.00 0.00 N ATOM 1658 CA ASN A 108 -0.733 -15.492 7.612 1.00 0.00 C ATOM 1659 C ASN A 108 -2.244 -15.717 7.564 1.00 0.00 C ATOM 1660 O ASN A 108 -2.733 -16.625 6.886 1.00 0.00 O ATOM 1661 CB ASN A 108 -0.186 -15.949 8.969 1.00 0.00 C ATOM 1662 CG ASN A 108 -0.486 -17.407 9.261 1.00 0.00 C ATOM 1663 OD1 ASN A 108 -0.522 -18.241 8.357 1.00 0.00 O ATOM 1664 ND2 ASN A 108 -0.720 -17.719 10.526 1.00 0.00 N ATOM 0 H ASN A 108 0.053 -13.631 8.177 1.00 0.00 H new ATOM 0 HA ASN A 108 -0.268 -16.078 6.819 1.00 0.00 H new ATOM 0 HB2 ASN A 108 0.892 -15.793 8.993 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -0.615 -15.329 9.756 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -0.940 -18.682 10.782 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -0.680 -16.997 11.245 1.00 0.00 H new ATOM 1671 N ARG A 109 -2.979 -14.871 8.269 1.00 0.00 N ATOM 1672 CA ARG A 109 -4.429 -14.992 8.350 1.00 0.00 C ATOM 1673 C ARG A 109 -5.068 -14.699 6.993 1.00 0.00 C ATOM 1674 O ARG A 109 -5.999 -15.387 6.579 1.00 0.00 O ATOM 1675 CB ARG A 109 -4.967 -14.036 9.430 1.00 0.00 C ATOM 1676 CG ARG A 109 -6.434 -14.234 9.797 1.00 0.00 C ATOM 1677 CD ARG A 109 -7.371 -13.495 8.854 1.00 0.00 C ATOM 1678 NE ARG A 109 -8.770 -13.656 9.245 1.00 0.00 N ATOM 1679 CZ ARG A 109 -9.706 -12.722 9.083 1.00 0.00 C ATOM 1680 NH1 ARG A 109 -9.403 -11.566 8.508 1.00 0.00 N ATOM 1681 NH2 ARG A 109 -10.952 -12.948 9.490 1.00 0.00 N ATOM 0 H ARG A 109 -2.593 -14.088 8.797 1.00 0.00 H new ATOM 0 HA ARG A 109 -4.688 -16.014 8.626 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -4.364 -14.154 10.330 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -4.830 -13.011 9.087 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -6.670 -15.298 9.780 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -6.601 -13.887 10.817 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -7.116 -12.435 8.844 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -7.232 -13.866 7.839 1.00 0.00 H new ATOM 0 HE ARG A 109 -9.048 -14.541 9.669 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -8.451 -11.390 8.188 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -10.122 -10.853 8.386 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -11.192 -13.838 9.927 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -11.667 -12.232 9.365 1.00 0.00 H new ATOM 1695 N PHE A 110 -4.557 -13.693 6.295 1.00 0.00 N ATOM 1696 CA PHE A 110 -5.092 -13.322 4.987 1.00 0.00 C ATOM 1697 C PHE A 110 -4.837 -14.418 3.958 1.00 0.00 C ATOM 1698 O PHE A 110 -5.660 -14.652 3.078 1.00 0.00 O ATOM 1699 CB PHE A 110 -4.495 -11.998 4.510 1.00 0.00 C ATOM 1700 CG PHE A 110 -5.099 -10.781 5.166 1.00 0.00 C ATOM 1701 CD1 PHE A 110 -5.864 -10.896 6.319 1.00 0.00 C ATOM 1702 CD2 PHE A 110 -4.897 -9.524 4.625 1.00 0.00 C ATOM 1703 CE1 PHE A 110 -6.414 -9.780 6.918 1.00 0.00 C ATOM 1704 CE2 PHE A 110 -5.447 -8.403 5.220 1.00 0.00 C ATOM 1705 CZ PHE A 110 -6.206 -8.532 6.368 1.00 0.00 C ATOM 0 H PHE A 110 -3.775 -13.119 6.610 1.00 0.00 H new ATOM 0 HA PHE A 110 -6.170 -13.198 5.094 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -3.422 -12.006 4.700 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -4.627 -11.920 3.431 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -6.031 -11.871 6.753 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -4.304 -9.417 3.729 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -7.006 -9.884 7.815 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -5.283 -7.427 4.788 1.00 0.00 H new ATOM 0 HZ PHE A 110 -6.635 -7.657 6.834 1.00 0.00 H new ATOM 1715 N ARG A 111 -3.701 -15.094 4.077 1.00 0.00 N ATOM 1716 CA ARG A 111 -3.377 -16.199 3.181 1.00 0.00 C ATOM 1717 C ARG A 111 -4.225 -17.429 3.491 1.00 0.00 C ATOM 1718 O ARG A 111 -4.547 -18.217 2.603 1.00 0.00 O ATOM 1719 CB ARG A 111 -1.906 -16.542 3.267 1.00 0.00 C ATOM 1720 CG ARG A 111 -1.056 -15.481 2.619 1.00 0.00 C ATOM 1721 CD ARG A 111 0.282 -16.025 2.208 1.00 0.00 C ATOM 1722 NE ARG A 111 1.079 -16.448 3.358 1.00 0.00 N ATOM 1723 CZ ARG A 111 1.615 -17.665 3.476 1.00 0.00 C ATOM 1724 NH1 ARG A 111 1.506 -18.534 2.481 1.00 0.00 N ATOM 1725 NH2 ARG A 111 2.261 -18.010 4.586 1.00 0.00 N ATOM 0 H ARG A 111 -2.990 -14.898 4.782 1.00 0.00 H new ATOM 0 HA ARG A 111 -3.603 -15.878 2.164 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -1.617 -16.654 4.312 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -1.726 -17.501 2.782 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -1.572 -15.083 1.746 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -0.916 -14.652 3.312 1.00 0.00 H new ATOM 0 HD2 ARG A 111 0.138 -16.871 1.536 1.00 0.00 H new ATOM 0 HD3 ARG A 111 0.827 -15.264 1.650 1.00 0.00 H new ATOM 0 HE ARG A 111 1.234 -15.777 4.111 1.00 0.00 H new ATOM 0 HH11 ARG A 111 1.013 -18.272 1.627 1.00 0.00 H new ATOM 0 HH12 ARG A 111 1.915 -19.464 2.569 1.00 0.00 H new ATOM 0 HH21 ARG A 111 2.349 -17.343 5.353 1.00 0.00 H new ATOM 0 HH22 ARG A 111 2.668 -18.941 4.670 1.00 0.00 H new ATOM 1739 N ASN A 112 -4.586 -17.575 4.759 1.00 0.00 N ATOM 1740 CA ASN A 112 -5.421 -18.685 5.202 1.00 0.00 C ATOM 1741 C ASN A 112 -6.880 -18.448 4.840 1.00 0.00 C ATOM 1742 O ASN A 112 -7.565 -19.345 4.342 1.00 0.00 O ATOM 1743 CB ASN A 112 -5.280 -18.882 6.713 1.00 0.00 C ATOM 1744 CG ASN A 112 -4.214 -19.898 7.070 1.00 0.00 C ATOM 1745 OD1 ASN A 112 -4.493 -21.094 7.176 1.00 0.00 O ATOM 1746 ND2 ASN A 112 -2.989 -19.435 7.262 1.00 0.00 N ATOM 0 H ASN A 112 -4.312 -16.934 5.504 1.00 0.00 H new ATOM 0 HA ASN A 112 -5.085 -19.588 4.692 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -5.038 -17.927 7.179 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -6.236 -19.204 7.125 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -2.234 -20.076 7.507 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -2.800 -18.437 7.165 1.00 0.00 H new ATOM 1753 N SER A 113 -7.350 -17.236 5.095 1.00 0.00 N ATOM 1754 CA SER A 113 -8.717 -16.858 4.774 1.00 0.00 C ATOM 1755 C SER A 113 -8.899 -16.735 3.264 1.00 0.00 C ATOM 1756 O SER A 113 -9.956 -17.067 2.722 1.00 0.00 O ATOM 1757 CB SER A 113 -9.064 -15.533 5.460 1.00 0.00 C ATOM 1758 OG SER A 113 -10.385 -15.122 5.153 1.00 0.00 O ATOM 0 H SER A 113 -6.800 -16.493 5.526 1.00 0.00 H new ATOM 0 HA SER A 113 -9.390 -17.634 5.138 1.00 0.00 H new ATOM 0 HB2 SER A 113 -8.957 -15.641 6.539 1.00 0.00 H new ATOM 0 HB3 SER A 113 -8.359 -14.763 5.145 1.00 0.00 H new ATOM 0 HG SER A 113 -10.578 -14.275 5.606 1.00 0.00 H new ATOM 1764 N GLY A 114 -7.865 -16.257 2.590 1.00 0.00 N ATOM 1765 CA GLY A 114 -7.938 -16.055 1.160 1.00 0.00 C ATOM 1766 C GLY A 114 -8.441 -14.669 0.825 1.00 0.00 C ATOM 1767 O GLY A 114 -8.327 -14.208 -0.311 1.00 0.00 O ATOM 0 H GLY A 114 -6.971 -16.004 3.012 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -6.952 -16.203 0.719 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -8.599 -16.801 0.719 1.00 0.00 H new ATOM 1771 N LYS A 115 -8.989 -13.999 1.827 1.00 0.00 N ATOM 1772 CA LYS A 115 -9.527 -12.673 1.666 1.00 0.00 C ATOM 1773 C LYS A 115 -8.889 -11.741 2.693 1.00 0.00 C ATOM 1774 O LYS A 115 -8.114 -12.180 3.542 1.00 0.00 O ATOM 1775 CB LYS A 115 -11.048 -12.720 1.836 1.00 0.00 C ATOM 1776 CG LYS A 115 -11.772 -11.516 1.268 1.00 0.00 C ATOM 1777 CD LYS A 115 -13.279 -11.711 1.273 1.00 0.00 C ATOM 1778 CE LYS A 115 -13.983 -10.585 0.535 1.00 0.00 C ATOM 1779 NZ LYS A 115 -15.458 -10.760 0.520 1.00 0.00 N ATOM 0 H LYS A 115 -9.069 -14.368 2.775 1.00 0.00 H new ATOM 0 HA LYS A 115 -9.302 -12.293 0.669 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -11.429 -13.620 1.354 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -11.282 -12.804 2.897 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -11.518 -10.631 1.851 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -11.432 -11.335 0.248 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -13.526 -12.665 0.807 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -13.639 -11.756 2.301 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -13.736 -9.634 1.007 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -13.614 -10.538 -0.490 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -15.812 -10.637 -0.450 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -15.698 -11.714 0.858 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -15.898 -10.052 1.142 1.00 0.00 H new ATOM 1793 N GLY A 116 -9.210 -10.466 2.601 1.00 0.00 N ATOM 1794 CA GLY A 116 -8.651 -9.480 3.506 1.00 0.00 C ATOM 1795 C GLY A 116 -8.104 -8.291 2.754 1.00 0.00 C ATOM 1796 O GLY A 116 -7.875 -7.236 3.329 1.00 0.00 O ATOM 0 H GLY A 116 -9.856 -10.087 1.908 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -9.419 -9.149 4.205 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -7.857 -9.935 4.097 1.00 0.00 H new ATOM 1800 N PHE A 117 -7.913 -8.504 1.458 1.00 0.00 N ATOM 1801 CA PHE A 117 -7.471 -7.478 0.509 1.00 0.00 C ATOM 1802 C PHE A 117 -6.361 -6.603 1.069 1.00 0.00 C ATOM 1803 O PHE A 117 -6.624 -5.549 1.639 1.00 0.00 O ATOM 1804 CB PHE A 117 -8.651 -6.623 0.050 1.00 0.00 C ATOM 1805 CG PHE A 117 -9.511 -7.291 -0.983 1.00 0.00 C ATOM 1806 CD1 PHE A 117 -10.264 -8.413 -0.665 1.00 0.00 C ATOM 1807 CD2 PHE A 117 -9.565 -6.800 -2.279 1.00 0.00 C ATOM 1808 CE1 PHE A 117 -11.052 -9.028 -1.616 1.00 0.00 C ATOM 1809 CE2 PHE A 117 -10.351 -7.412 -3.235 1.00 0.00 C ATOM 1810 CZ PHE A 117 -11.095 -8.528 -2.902 1.00 0.00 C ATOM 0 H PHE A 117 -8.063 -9.414 1.023 1.00 0.00 H new ATOM 0 HA PHE A 117 -7.057 -8.002 -0.352 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -9.265 -6.372 0.915 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -8.273 -5.685 -0.356 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -10.233 -8.809 0.339 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -8.985 -5.928 -2.544 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -11.634 -9.899 -1.355 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -10.384 -7.020 -4.241 1.00 0.00 H new ATOM 0 HZ PHE A 117 -11.710 -9.009 -3.648 1.00 0.00 H new ATOM 1820 N LEU A 118 -5.124 -7.038 0.912 1.00 0.00 N ATOM 1821 CA LEU A 118 -4.009 -6.289 1.452 1.00 0.00 C ATOM 1822 C LEU A 118 -3.419 -5.378 0.393 1.00 0.00 C ATOM 1823 O LEU A 118 -3.011 -5.820 -0.684 1.00 0.00 O ATOM 1824 CB LEU A 118 -2.927 -7.214 1.986 1.00 0.00 C ATOM 1825 CG LEU A 118 -1.961 -6.572 2.983 1.00 0.00 C ATOM 1826 CD1 LEU A 118 -2.712 -6.027 4.189 1.00 0.00 C ATOM 1827 CD2 LEU A 118 -0.909 -7.575 3.426 1.00 0.00 C ATOM 0 H LEU A 118 -4.870 -7.895 0.421 1.00 0.00 H new ATOM 0 HA LEU A 118 -4.388 -5.687 2.278 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -3.405 -8.069 2.465 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -2.353 -7.600 1.144 1.00 0.00 H new ATOM 0 HG LEU A 118 -1.462 -5.740 2.485 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -2.005 -5.575 4.884 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -3.430 -5.275 3.861 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -3.241 -6.840 4.686 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -0.230 -7.101 4.135 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -1.396 -8.426 3.903 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -0.346 -7.918 2.558 1.00 0.00 H new ATOM 1839 N LEU A 119 -3.377 -4.114 0.723 1.00 0.00 N ATOM 1840 CA LEU A 119 -2.832 -3.097 -0.154 1.00 0.00 C ATOM 1841 C LEU A 119 -1.650 -2.436 0.537 1.00 0.00 C ATOM 1842 O LEU A 119 -1.802 -1.812 1.589 1.00 0.00 O ATOM 1843 CB LEU A 119 -3.913 -2.065 -0.499 1.00 0.00 C ATOM 1844 CG LEU A 119 -3.516 -1.014 -1.539 1.00 0.00 C ATOM 1845 CD1 LEU A 119 -3.153 -1.670 -2.861 1.00 0.00 C ATOM 1846 CD2 LEU A 119 -4.649 -0.024 -1.743 1.00 0.00 C ATOM 0 H LEU A 119 -3.721 -3.753 1.613 1.00 0.00 H new ATOM 0 HA LEU A 119 -2.493 -3.550 -1.086 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -4.793 -2.595 -0.862 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -4.205 -1.552 0.417 1.00 0.00 H new ATOM 0 HG LEU A 119 -2.640 -0.482 -1.168 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -2.875 -0.903 -3.584 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -2.314 -2.349 -2.712 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -4.010 -2.229 -3.237 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -4.354 0.718 -2.485 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -5.536 -0.553 -2.091 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -4.871 0.474 -0.799 1.00 0.00 H new ATOM 1858 N LEU A 120 -0.472 -2.601 -0.040 1.00 0.00 N ATOM 1859 CA LEU A 120 0.756 -2.133 0.585 1.00 0.00 C ATOM 1860 C LEU A 120 1.420 -1.056 -0.261 1.00 0.00 C ATOM 1861 O LEU A 120 1.427 -1.146 -1.490 1.00 0.00 O ATOM 1862 CB LEU A 120 1.723 -3.306 0.782 1.00 0.00 C ATOM 1863 CG LEU A 120 1.170 -4.480 1.598 1.00 0.00 C ATOM 1864 CD1 LEU A 120 2.125 -5.661 1.547 1.00 0.00 C ATOM 1865 CD2 LEU A 120 0.923 -4.066 3.040 1.00 0.00 C ATOM 0 H LEU A 120 -0.339 -3.057 -0.943 1.00 0.00 H new ATOM 0 HA LEU A 120 0.503 -1.704 1.555 1.00 0.00 H new ATOM 0 HB2 LEU A 120 2.024 -3.676 -0.198 1.00 0.00 H new ATOM 0 HB3 LEU A 120 2.623 -2.935 1.273 1.00 0.00 H new ATOM 0 HG LEU A 120 0.219 -4.780 1.158 1.00 0.00 H new ATOM 0 HD11 LEU A 120 1.716 -6.485 2.132 1.00 0.00 H new ATOM 0 HD12 LEU A 120 2.255 -5.979 0.513 1.00 0.00 H new ATOM 0 HD13 LEU A 120 3.090 -5.367 1.960 1.00 0.00 H new ATOM 0 HD21 LEU A 120 0.531 -4.915 3.600 1.00 0.00 H new ATOM 0 HD22 LEU A 120 1.860 -3.736 3.489 1.00 0.00 H new ATOM 0 HD23 LEU A 120 0.201 -3.250 3.066 1.00 0.00 H new ATOM 1877 N GLY A 121 1.972 -0.046 0.394 1.00 0.00 N ATOM 1878 CA GLY A 121 2.659 1.014 -0.319 1.00 0.00 C ATOM 1879 C GLY A 121 3.920 1.471 0.387 1.00 0.00 C ATOM 1880 O GLY A 121 3.973 1.507 1.619 1.00 0.00 O ATOM 0 H GLY A 121 1.957 0.060 1.408 1.00 0.00 H new ATOM 0 HA2 GLY A 121 2.913 0.667 -1.321 1.00 0.00 H new ATOM 0 HA3 GLY A 121 1.986 1.863 -0.437 1.00 0.00 H new ATOM 1884 N SER A 122 4.947 1.799 -0.388 1.00 0.00 N ATOM 1885 CA SER A 122 6.178 2.348 0.159 1.00 0.00 C ATOM 1886 C SER A 122 6.830 3.275 -0.874 1.00 0.00 C ATOM 1887 O SER A 122 6.177 3.681 -1.839 1.00 0.00 O ATOM 1888 CB SER A 122 7.128 1.226 0.598 1.00 0.00 C ATOM 1889 OG SER A 122 7.603 0.474 -0.502 1.00 0.00 O ATOM 0 H SER A 122 4.949 1.693 -1.402 1.00 0.00 H new ATOM 0 HA SER A 122 5.947 2.935 1.048 1.00 0.00 H new ATOM 0 HB2 SER A 122 7.973 1.656 1.135 1.00 0.00 H new ATOM 0 HB3 SER A 122 6.611 0.565 1.293 1.00 0.00 H new ATOM 0 HG SER A 122 8.568 0.613 -0.601 1.00 0.00 H new ATOM 1895 N GLU A 123 8.102 3.608 -0.692 1.00 0.00 N ATOM 1896 CA GLU A 123 8.721 4.641 -1.515 1.00 0.00 C ATOM 1897 C GLU A 123 9.915 4.121 -2.318 1.00 0.00 C ATOM 1898 O GLU A 123 10.283 4.711 -3.334 1.00 0.00 O ATOM 1899 CB GLU A 123 9.138 5.821 -0.637 1.00 0.00 C ATOM 1900 CG GLU A 123 10.170 5.466 0.413 1.00 0.00 C ATOM 1901 CD GLU A 123 10.306 6.533 1.470 1.00 0.00 C ATOM 1902 OE1 GLU A 123 10.820 7.621 1.160 1.00 0.00 O ATOM 1903 OE2 GLU A 123 9.892 6.287 2.623 1.00 0.00 O ATOM 0 H GLU A 123 8.716 3.187 0.005 1.00 0.00 H new ATOM 0 HA GLU A 123 7.977 4.968 -2.241 1.00 0.00 H new ATOM 0 HB2 GLU A 123 9.537 6.612 -1.272 1.00 0.00 H new ATOM 0 HB3 GLU A 123 8.254 6.224 -0.143 1.00 0.00 H new ATOM 0 HG2 GLU A 123 9.894 4.523 0.886 1.00 0.00 H new ATOM 0 HG3 GLU A 123 11.135 5.310 -0.068 1.00 0.00 H new ATOM 1910 N TYR A 124 10.535 3.038 -1.868 1.00 0.00 N ATOM 1911 CA TYR A 124 11.653 2.468 -2.605 1.00 0.00 C ATOM 1912 C TYR A 124 11.234 1.196 -3.329 1.00 0.00 C ATOM 1913 O TYR A 124 10.857 1.244 -4.498 1.00 0.00 O ATOM 1914 CB TYR A 124 12.842 2.187 -1.678 1.00 0.00 C ATOM 1915 CG TYR A 124 13.386 3.416 -0.991 1.00 0.00 C ATOM 1916 CD1 TYR A 124 13.684 4.565 -1.713 1.00 0.00 C ATOM 1917 CD2 TYR A 124 13.611 3.423 0.378 1.00 0.00 C ATOM 1918 CE1 TYR A 124 14.185 5.687 -1.089 1.00 0.00 C ATOM 1919 CE2 TYR A 124 14.112 4.542 1.011 1.00 0.00 C ATOM 1920 CZ TYR A 124 14.398 5.670 0.273 1.00 0.00 C ATOM 1921 OH TYR A 124 14.903 6.784 0.899 1.00 0.00 O ATOM 0 H TYR A 124 10.288 2.544 -1.011 1.00 0.00 H new ATOM 0 HA TYR A 124 11.967 3.201 -3.348 1.00 0.00 H new ATOM 0 HB2 TYR A 124 12.537 1.465 -0.921 1.00 0.00 H new ATOM 0 HB3 TYR A 124 13.640 1.723 -2.258 1.00 0.00 H new ATOM 0 HD1 TYR A 124 13.520 4.579 -2.780 1.00 0.00 H new ATOM 0 HD2 TYR A 124 13.391 2.539 0.957 1.00 0.00 H new ATOM 0 HE1 TYR A 124 14.409 6.574 -1.663 1.00 0.00 H new ATOM 0 HE2 TYR A 124 14.279 4.534 2.078 1.00 0.00 H new ATOM 0 HH TYR A 124 14.992 6.608 1.859 1.00 0.00 H new ATOM 1931 N THR A 125 11.289 0.071 -2.624 1.00 0.00 N ATOM 1932 CA THR A 125 10.911 -1.234 -3.167 1.00 0.00 C ATOM 1933 C THR A 125 10.917 -2.277 -2.053 1.00 0.00 C ATOM 1934 O THR A 125 11.566 -2.081 -1.023 1.00 0.00 O ATOM 1935 CB THR A 125 11.855 -1.702 -4.303 1.00 0.00 C ATOM 1936 OG1 THR A 125 13.130 -1.056 -4.196 1.00 0.00 O ATOM 1937 CG2 THR A 125 11.249 -1.440 -5.677 1.00 0.00 C ATOM 0 H THR A 125 11.599 0.036 -1.653 1.00 0.00 H new ATOM 0 HA THR A 125 9.912 -1.127 -3.589 1.00 0.00 H new ATOM 0 HB THR A 125 11.991 -2.778 -4.194 1.00 0.00 H new ATOM 0 HG1 THR A 125 13.714 -1.364 -4.920 1.00 0.00 H new ATOM 0 HG21 THR A 125 11.938 -1.781 -6.450 1.00 0.00 H new ATOM 0 HG22 THR A 125 10.306 -1.980 -5.768 1.00 0.00 H new ATOM 0 HG23 THR A 125 11.068 -0.372 -5.797 1.00 0.00 H new ATOM 1945 N PRO A 126 10.217 -3.411 -2.241 1.00 0.00 N ATOM 1946 CA PRO A 126 10.074 -4.434 -1.198 1.00 0.00 C ATOM 1947 C PRO A 126 11.402 -5.093 -0.844 1.00 0.00 C ATOM 1948 O PRO A 126 11.604 -5.549 0.278 1.00 0.00 O ATOM 1949 CB PRO A 126 9.120 -5.457 -1.820 1.00 0.00 C ATOM 1950 CG PRO A 126 9.247 -5.258 -3.290 1.00 0.00 C ATOM 1951 CD PRO A 126 9.518 -3.794 -3.482 1.00 0.00 C ATOM 0 HA PRO A 126 9.709 -4.008 -0.264 1.00 0.00 H new ATOM 0 HB2 PRO A 126 9.391 -6.474 -1.534 1.00 0.00 H new ATOM 0 HB3 PRO A 126 8.095 -5.294 -1.487 1.00 0.00 H new ATOM 0 HG2 PRO A 126 10.057 -5.863 -3.698 1.00 0.00 H new ATOM 0 HG3 PRO A 126 8.335 -5.558 -3.806 1.00 0.00 H new ATOM 0 HD2 PRO A 126 10.134 -3.611 -4.363 1.00 0.00 H new ATOM 0 HD3 PRO A 126 8.596 -3.228 -3.615 1.00 0.00 H new ATOM 1959 N GLN A 127 12.310 -5.118 -1.805 1.00 0.00 N ATOM 1960 CA GLN A 127 13.601 -5.769 -1.626 1.00 0.00 C ATOM 1961 C GLN A 127 14.602 -4.830 -0.967 1.00 0.00 C ATOM 1962 O GLN A 127 15.726 -5.226 -0.661 1.00 0.00 O ATOM 1963 CB GLN A 127 14.144 -6.248 -2.969 1.00 0.00 C ATOM 1964 CG GLN A 127 13.253 -7.262 -3.662 1.00 0.00 C ATOM 1965 CD GLN A 127 13.788 -7.668 -5.022 1.00 0.00 C ATOM 1966 OE1 GLN A 127 14.558 -8.622 -5.142 1.00 0.00 O ATOM 1967 NE2 GLN A 127 13.385 -6.946 -6.055 1.00 0.00 N ATOM 0 H GLN A 127 12.178 -4.693 -2.723 1.00 0.00 H new ATOM 0 HA GLN A 127 13.455 -6.629 -0.972 1.00 0.00 H new ATOM 0 HB2 GLN A 127 14.278 -5.387 -3.624 1.00 0.00 H new ATOM 0 HB3 GLN A 127 15.129 -6.688 -2.816 1.00 0.00 H new ATOM 0 HG2 GLN A 127 13.157 -8.147 -3.033 1.00 0.00 H new ATOM 0 HG3 GLN A 127 12.253 -6.844 -3.778 1.00 0.00 H new ATOM 0 HE21 GLN A 127 12.746 -6.164 -5.912 1.00 0.00 H new ATOM 0 HE22 GLN A 127 13.713 -7.172 -6.994 1.00 0.00 H new ATOM 1976 N GLN A 128 14.195 -3.583 -0.766 1.00 0.00 N ATOM 1977 CA GLN A 128 15.046 -2.609 -0.095 1.00 0.00 C ATOM 1978 C GLN A 128 14.548 -2.379 1.327 1.00 0.00 C ATOM 1979 O GLN A 128 15.144 -1.618 2.092 1.00 0.00 O ATOM 1980 CB GLN A 128 15.066 -1.282 -0.862 1.00 0.00 C ATOM 1981 CG GLN A 128 15.542 -1.414 -2.301 1.00 0.00 C ATOM 1982 CD GLN A 128 16.936 -1.997 -2.415 1.00 0.00 C ATOM 1983 OE1 GLN A 128 17.784 -1.798 -1.546 1.00 0.00 O ATOM 1984 NE2 GLN A 128 17.178 -2.726 -3.492 1.00 0.00 N ATOM 0 H GLN A 128 13.286 -3.224 -1.056 1.00 0.00 H new ATOM 0 HA GLN A 128 16.062 -3.003 -0.063 1.00 0.00 H new ATOM 0 HB2 GLN A 128 14.063 -0.855 -0.858 1.00 0.00 H new ATOM 0 HB3 GLN A 128 15.713 -0.579 -0.338 1.00 0.00 H new ATOM 0 HG2 GLN A 128 14.845 -2.045 -2.852 1.00 0.00 H new ATOM 0 HG3 GLN A 128 15.525 -0.432 -2.774 1.00 0.00 H new ATOM 0 HE21 GLN A 128 16.446 -2.866 -4.188 1.00 0.00 H new ATOM 0 HE22 GLN A 128 18.097 -3.148 -3.626 1.00 0.00 H new ATOM 1993 N LEU A 129 13.445 -3.041 1.670 1.00 0.00 N ATOM 1994 CA LEU A 129 12.868 -2.931 3.002 1.00 0.00 C ATOM 1995 C LEU A 129 13.773 -3.596 4.029 1.00 0.00 C ATOM 1996 O LEU A 129 14.246 -4.718 3.825 1.00 0.00 O ATOM 1997 CB LEU A 129 11.484 -3.588 3.035 1.00 0.00 C ATOM 1998 CG LEU A 129 10.402 -2.883 2.216 1.00 0.00 C ATOM 1999 CD1 LEU A 129 9.127 -3.709 2.209 1.00 0.00 C ATOM 2000 CD2 LEU A 129 10.128 -1.498 2.776 1.00 0.00 C ATOM 0 H LEU A 129 12.934 -3.660 1.040 1.00 0.00 H new ATOM 0 HA LEU A 129 12.769 -1.874 3.248 1.00 0.00 H new ATOM 0 HB2 LEU A 129 11.578 -4.612 2.675 1.00 0.00 H new ATOM 0 HB3 LEU A 129 11.152 -3.644 4.072 1.00 0.00 H new ATOM 0 HG LEU A 129 10.758 -2.777 1.191 1.00 0.00 H new ATOM 0 HD11 LEU A 129 8.365 -3.196 1.623 1.00 0.00 H new ATOM 0 HD12 LEU A 129 9.328 -4.685 1.768 1.00 0.00 H new ATOM 0 HD13 LEU A 129 8.772 -3.839 3.231 1.00 0.00 H new ATOM 0 HD21 LEU A 129 9.356 -1.011 2.181 1.00 0.00 H new ATOM 0 HD22 LEU A 129 9.790 -1.583 3.809 1.00 0.00 H new ATOM 0 HD23 LEU A 129 11.041 -0.904 2.741 1.00 0.00 H new ATOM 2012 N VAL A 130 14.011 -2.907 5.134 1.00 0.00 N ATOM 2013 CA VAL A 130 14.812 -3.460 6.211 1.00 0.00 C ATOM 2014 C VAL A 130 13.904 -4.054 7.278 1.00 0.00 C ATOM 2015 O VAL A 130 13.525 -3.387 8.241 1.00 0.00 O ATOM 2016 CB VAL A 130 15.745 -2.405 6.844 1.00 0.00 C ATOM 2017 CG1 VAL A 130 16.669 -3.045 7.872 1.00 0.00 C ATOM 2018 CG2 VAL A 130 16.553 -1.689 5.773 1.00 0.00 C ATOM 0 H VAL A 130 13.661 -1.965 5.307 1.00 0.00 H new ATOM 0 HA VAL A 130 15.442 -4.240 5.784 1.00 0.00 H new ATOM 0 HB VAL A 130 15.124 -1.669 7.355 1.00 0.00 H new ATOM 0 HG11 VAL A 130 17.317 -2.282 8.304 1.00 0.00 H new ATOM 0 HG12 VAL A 130 16.073 -3.504 8.661 1.00 0.00 H new ATOM 0 HG13 VAL A 130 17.279 -3.807 7.388 1.00 0.00 H new ATOM 0 HG21 VAL A 130 17.203 -0.950 6.241 1.00 0.00 H new ATOM 0 HG22 VAL A 130 17.159 -2.414 5.229 1.00 0.00 H new ATOM 0 HG23 VAL A 130 15.876 -1.189 5.080 1.00 0.00 H new ATOM 2028 N ILE A 131 13.518 -5.300 7.062 1.00 0.00 N ATOM 2029 CA ILE A 131 12.649 -6.023 7.977 1.00 0.00 C ATOM 2030 C ILE A 131 13.090 -7.475 8.045 1.00 0.00 C ATOM 2031 O ILE A 131 14.117 -7.837 7.462 1.00 0.00 O ATOM 2032 CB ILE A 131 11.167 -5.964 7.534 1.00 0.00 C ATOM 2033 CG1 ILE A 131 11.013 -6.471 6.095 1.00 0.00 C ATOM 2034 CG2 ILE A 131 10.616 -4.550 7.678 1.00 0.00 C ATOM 2035 CD1 ILE A 131 9.576 -6.533 5.623 1.00 0.00 C ATOM 0 H ILE A 131 13.799 -5.841 6.244 1.00 0.00 H new ATOM 0 HA ILE A 131 12.727 -5.550 8.956 1.00 0.00 H new ATOM 0 HB ILE A 131 10.588 -6.617 8.186 1.00 0.00 H new ATOM 0 HG12 ILE A 131 11.578 -5.820 5.427 1.00 0.00 H new ATOM 0 HG13 ILE A 131 11.454 -7.465 6.020 1.00 0.00 H new ATOM 0 HG21 ILE A 131 9.573 -4.532 7.361 1.00 0.00 H new ATOM 0 HG22 ILE A 131 10.684 -4.237 8.720 1.00 0.00 H new ATOM 0 HG23 ILE A 131 11.196 -3.868 7.056 1.00 0.00 H new ATOM 0 HD11 ILE A 131 9.545 -6.900 4.597 1.00 0.00 H new ATOM 0 HD12 ILE A 131 9.010 -7.207 6.267 1.00 0.00 H new ATOM 0 HD13 ILE A 131 9.136 -5.537 5.665 1.00 0.00 H new ATOM 2047 N ARG A 132 12.329 -8.300 8.754 1.00 0.00 N ATOM 2048 CA ARG A 132 12.605 -9.729 8.809 1.00 0.00 C ATOM 2049 C ARG A 132 12.635 -10.322 7.417 1.00 0.00 C ATOM 2050 O ARG A 132 11.722 -10.115 6.614 1.00 0.00 O ATOM 2051 CB ARG A 132 11.577 -10.465 9.666 1.00 0.00 C ATOM 2052 CG ARG A 132 12.003 -10.603 11.115 1.00 0.00 C ATOM 2053 CD ARG A 132 13.259 -11.450 11.214 1.00 0.00 C ATOM 2054 NE ARG A 132 13.853 -11.437 12.545 1.00 0.00 N ATOM 2055 CZ ARG A 132 15.141 -11.673 12.766 1.00 0.00 C ATOM 2056 NH1 ARG A 132 15.956 -11.920 11.747 1.00 0.00 N ATOM 2057 NH2 ARG A 132 15.622 -11.668 14.001 1.00 0.00 N ATOM 0 H ARG A 132 11.518 -8.004 9.297 1.00 0.00 H new ATOM 0 HA ARG A 132 13.585 -9.854 9.270 1.00 0.00 H new ATOM 0 HB2 ARG A 132 10.627 -9.932 9.622 1.00 0.00 H new ATOM 0 HB3 ARG A 132 11.406 -11.457 9.247 1.00 0.00 H new ATOM 0 HG2 ARG A 132 12.186 -9.617 11.543 1.00 0.00 H new ATOM 0 HG3 ARG A 132 11.201 -11.059 11.695 1.00 0.00 H new ATOM 0 HD2 ARG A 132 13.020 -12.477 10.939 1.00 0.00 H new ATOM 0 HD3 ARG A 132 13.991 -11.089 10.492 1.00 0.00 H new ATOM 0 HE ARG A 132 13.251 -11.237 13.344 1.00 0.00 H new ATOM 0 HH11 ARG A 132 15.593 -11.928 10.794 1.00 0.00 H new ATOM 0 HH12 ARG A 132 16.945 -12.101 11.917 1.00 0.00 H new ATOM 0 HH21 ARG A 132 15.002 -11.482 14.789 1.00 0.00 H new ATOM 0 HH22 ARG A 132 16.612 -11.850 14.163 1.00 0.00 H new ATOM 2071 N GLU A 133 13.681 -11.073 7.146 1.00 0.00 N ATOM 2072 CA GLU A 133 13.912 -11.626 5.825 1.00 0.00 C ATOM 2073 C GLU A 133 12.897 -12.711 5.504 1.00 0.00 C ATOM 2074 O GLU A 133 12.519 -12.894 4.347 1.00 0.00 O ATOM 2075 CB GLU A 133 15.347 -12.161 5.691 1.00 0.00 C ATOM 2076 CG GLU A 133 15.810 -13.061 6.834 1.00 0.00 C ATOM 2077 CD GLU A 133 16.160 -12.299 8.102 1.00 0.00 C ATOM 2078 OE1 GLU A 133 17.294 -11.786 8.199 1.00 0.00 O ATOM 2079 OE2 GLU A 133 15.300 -12.211 9.004 1.00 0.00 O ATOM 0 H GLU A 133 14.395 -11.318 7.832 1.00 0.00 H new ATOM 0 HA GLU A 133 13.786 -10.821 5.101 1.00 0.00 H new ATOM 0 HB2 GLU A 133 15.426 -12.717 4.757 1.00 0.00 H new ATOM 0 HB3 GLU A 133 16.029 -11.314 5.617 1.00 0.00 H new ATOM 0 HG2 GLU A 133 15.025 -13.783 7.058 1.00 0.00 H new ATOM 0 HG3 GLU A 133 16.682 -13.629 6.509 1.00 0.00 H new ATOM 2086 N ASP A 134 12.424 -13.401 6.534 1.00 0.00 N ATOM 2087 CA ASP A 134 11.428 -14.447 6.345 1.00 0.00 C ATOM 2088 C ASP A 134 10.072 -13.833 6.037 1.00 0.00 C ATOM 2089 O ASP A 134 9.249 -14.434 5.357 1.00 0.00 O ATOM 2090 CB ASP A 134 11.328 -15.341 7.582 1.00 0.00 C ATOM 2091 CG ASP A 134 10.789 -14.612 8.795 1.00 0.00 C ATOM 2092 OD1 ASP A 134 11.577 -13.904 9.461 1.00 0.00 O ATOM 2093 OD2 ASP A 134 9.580 -14.737 9.084 1.00 0.00 O ATOM 0 H ASP A 134 12.712 -13.257 7.502 1.00 0.00 H new ATOM 0 HA ASP A 134 11.742 -15.063 5.502 1.00 0.00 H new ATOM 0 HB2 ASP A 134 10.683 -16.191 7.359 1.00 0.00 H new ATOM 0 HB3 ASP A 134 12.314 -15.742 7.814 1.00 0.00 H new ATOM 2098 N LEU A 135 9.843 -12.634 6.549 1.00 0.00 N ATOM 2099 CA LEU A 135 8.605 -11.917 6.290 1.00 0.00 C ATOM 2100 C LEU A 135 8.695 -11.231 4.931 1.00 0.00 C ATOM 2101 O LEU A 135 7.753 -11.252 4.142 1.00 0.00 O ATOM 2102 CB LEU A 135 8.360 -10.889 7.406 1.00 0.00 C ATOM 2103 CG LEU A 135 6.921 -10.366 7.554 1.00 0.00 C ATOM 2104 CD1 LEU A 135 6.749 -9.669 8.894 1.00 0.00 C ATOM 2105 CD2 LEU A 135 6.559 -9.404 6.431 1.00 0.00 C ATOM 0 H LEU A 135 10.501 -12.136 7.148 1.00 0.00 H new ATOM 0 HA LEU A 135 7.767 -12.614 6.275 1.00 0.00 H new ATOM 0 HB2 LEU A 135 8.659 -11.337 8.354 1.00 0.00 H new ATOM 0 HB3 LEU A 135 9.017 -10.036 7.235 1.00 0.00 H new ATOM 0 HG LEU A 135 6.252 -11.225 7.500 1.00 0.00 H new ATOM 0 HD11 LEU A 135 5.726 -9.304 8.986 1.00 0.00 H new ATOM 0 HD12 LEU A 135 6.956 -10.373 9.700 1.00 0.00 H new ATOM 0 HD13 LEU A 135 7.441 -8.829 8.959 1.00 0.00 H new ATOM 0 HD21 LEU A 135 5.536 -9.054 6.567 1.00 0.00 H new ATOM 0 HD22 LEU A 135 7.239 -8.552 6.448 1.00 0.00 H new ATOM 0 HD23 LEU A 135 6.643 -9.916 5.472 1.00 0.00 H new ATOM 2117 N ARG A 136 9.859 -10.658 4.655 1.00 0.00 N ATOM 2118 CA ARG A 136 10.077 -9.895 3.434 1.00 0.00 C ATOM 2119 C ARG A 136 10.019 -10.800 2.200 1.00 0.00 C ATOM 2120 O ARG A 136 9.754 -10.335 1.094 1.00 0.00 O ATOM 2121 CB ARG A 136 11.422 -9.159 3.520 1.00 0.00 C ATOM 2122 CG ARG A 136 11.559 -8.000 2.545 1.00 0.00 C ATOM 2123 CD ARG A 136 12.179 -8.434 1.228 1.00 0.00 C ATOM 2124 NE ARG A 136 13.622 -8.639 1.341 1.00 0.00 N ATOM 2125 CZ ARG A 136 14.369 -9.176 0.378 1.00 0.00 C ATOM 2126 NH1 ARG A 136 13.798 -9.633 -0.730 1.00 0.00 N ATOM 2127 NH2 ARG A 136 15.681 -9.262 0.530 1.00 0.00 N ATOM 0 H ARG A 136 10.674 -10.708 5.267 1.00 0.00 H new ATOM 0 HA ARG A 136 9.280 -9.159 3.331 1.00 0.00 H new ATOM 0 HB2 ARG A 136 11.554 -8.784 4.535 1.00 0.00 H new ATOM 0 HB3 ARG A 136 12.226 -9.871 3.336 1.00 0.00 H new ATOM 0 HG2 ARG A 136 10.577 -7.566 2.358 1.00 0.00 H new ATOM 0 HG3 ARG A 136 12.172 -7.219 2.994 1.00 0.00 H new ATOM 0 HD2 ARG A 136 11.707 -9.358 0.893 1.00 0.00 H new ATOM 0 HD3 ARG A 136 11.979 -7.679 0.467 1.00 0.00 H new ATOM 0 HE ARG A 136 14.082 -8.355 2.206 1.00 0.00 H new ATOM 0 HH11 ARG A 136 12.786 -9.573 -0.844 1.00 0.00 H new ATOM 0 HH12 ARG A 136 14.371 -10.044 -1.467 1.00 0.00 H new ATOM 0 HH21 ARG A 136 16.119 -8.917 1.384 1.00 0.00 H new ATOM 0 HH22 ARG A 136 16.254 -9.673 -0.207 1.00 0.00 H new ATOM 2141 N THR A 137 10.255 -12.090 2.386 1.00 0.00 N ATOM 2142 CA THR A 137 10.149 -13.038 1.287 1.00 0.00 C ATOM 2143 C THR A 137 8.686 -13.389 1.001 1.00 0.00 C ATOM 2144 O THR A 137 8.322 -13.679 -0.138 1.00 0.00 O ATOM 2145 CB THR A 137 10.962 -14.315 1.567 1.00 0.00 C ATOM 2146 OG1 THR A 137 10.887 -14.650 2.957 1.00 0.00 O ATOM 2147 CG2 THR A 137 12.416 -14.132 1.164 1.00 0.00 C ATOM 0 H THR A 137 10.519 -12.502 3.281 1.00 0.00 H new ATOM 0 HA THR A 137 10.567 -12.558 0.402 1.00 0.00 H new ATOM 0 HB THR A 137 10.536 -15.125 0.974 1.00 0.00 H new ATOM 0 HG1 THR A 137 11.562 -14.142 3.453 1.00 0.00 H new ATOM 0 HG21 THR A 137 12.969 -15.048 1.372 1.00 0.00 H new ATOM 0 HG22 THR A 137 12.473 -13.907 0.099 1.00 0.00 H new ATOM 0 HG23 THR A 137 12.850 -13.309 1.732 1.00 0.00 H new ATOM 2155 N ARG A 138 7.842 -13.327 2.034 1.00 0.00 N ATOM 2156 CA ARG A 138 6.408 -13.579 1.874 1.00 0.00 C ATOM 2157 C ARG A 138 5.750 -12.411 1.142 1.00 0.00 C ATOM 2158 O ARG A 138 4.628 -12.517 0.653 1.00 0.00 O ATOM 2159 CB ARG A 138 5.734 -13.760 3.235 1.00 0.00 C ATOM 2160 CG ARG A 138 6.489 -14.667 4.191 1.00 0.00 C ATOM 2161 CD ARG A 138 6.510 -16.118 3.734 1.00 0.00 C ATOM 2162 NE ARG A 138 7.115 -16.983 4.751 1.00 0.00 N ATOM 2163 CZ ARG A 138 7.465 -18.254 4.556 1.00 0.00 C ATOM 2164 NH1 ARG A 138 7.300 -18.829 3.369 1.00 0.00 N ATOM 2165 NH2 ARG A 138 7.999 -18.941 5.559 1.00 0.00 N ATOM 0 H ARG A 138 8.126 -13.105 2.988 1.00 0.00 H new ATOM 0 HA ARG A 138 6.288 -14.493 1.293 1.00 0.00 H new ATOM 0 HB2 ARG A 138 5.613 -12.782 3.700 1.00 0.00 H new ATOM 0 HB3 ARG A 138 4.734 -14.166 3.081 1.00 0.00 H new ATOM 0 HG2 ARG A 138 7.513 -14.308 4.293 1.00 0.00 H new ATOM 0 HG3 ARG A 138 6.031 -14.608 5.178 1.00 0.00 H new ATOM 0 HD2 ARG A 138 5.493 -16.452 3.526 1.00 0.00 H new ATOM 0 HD3 ARG A 138 7.069 -16.201 2.802 1.00 0.00 H new ATOM 0 HE ARG A 138 7.280 -16.583 5.675 1.00 0.00 H new ATOM 0 HH11 ARG A 138 6.902 -18.297 2.595 1.00 0.00 H new ATOM 0 HH12 ARG A 138 7.572 -19.803 3.232 1.00 0.00 H new ATOM 0 HH21 ARG A 138 8.137 -18.495 6.466 1.00 0.00 H new ATOM 0 HH22 ARG A 138 8.271 -19.915 5.423 1.00 0.00 H new ATOM 2179 N MET A 139 6.472 -11.300 1.074 1.00 0.00 N ATOM 2180 CA MET A 139 6.007 -10.097 0.391 1.00 0.00 C ATOM 2181 C MET A 139 5.808 -10.357 -1.100 1.00 0.00 C ATOM 2182 O MET A 139 5.140 -9.592 -1.793 1.00 0.00 O ATOM 2183 CB MET A 139 7.010 -8.957 0.591 1.00 0.00 C ATOM 2184 CG MET A 139 7.129 -8.485 2.032 1.00 0.00 C ATOM 2185 SD MET A 139 5.678 -7.575 2.592 1.00 0.00 S ATOM 2186 CE MET A 139 5.755 -6.132 1.530 1.00 0.00 C ATOM 0 H MET A 139 7.398 -11.206 1.491 1.00 0.00 H new ATOM 0 HA MET A 139 5.047 -9.812 0.822 1.00 0.00 H new ATOM 0 HB2 MET A 139 7.990 -9.284 0.244 1.00 0.00 H new ATOM 0 HB3 MET A 139 6.716 -8.114 -0.034 1.00 0.00 H new ATOM 0 HG2 MET A 139 7.284 -9.348 2.680 1.00 0.00 H new ATOM 0 HG3 MET A 139 8.010 -7.851 2.130 1.00 0.00 H new ATOM 0 HE1 MET A 139 5.420 -5.255 2.083 1.00 0.00 H new ATOM 0 HE2 MET A 139 6.781 -5.980 1.196 1.00 0.00 H new ATOM 0 HE3 MET A 139 5.110 -6.283 0.664 1.00 0.00 H new ATOM 2196 N ALA A 140 6.399 -11.440 -1.590 1.00 0.00 N ATOM 2197 CA ALA A 140 6.314 -11.792 -3.004 1.00 0.00 C ATOM 2198 C ALA A 140 4.949 -12.380 -3.375 1.00 0.00 C ATOM 2199 O ALA A 140 4.736 -12.796 -4.515 1.00 0.00 O ATOM 2200 CB ALA A 140 7.424 -12.769 -3.364 1.00 0.00 C ATOM 0 H ALA A 140 6.945 -12.093 -1.027 1.00 0.00 H new ATOM 0 HA ALA A 140 6.435 -10.873 -3.578 1.00 0.00 H new ATOM 0 HB1 ALA A 140 7.353 -13.027 -4.421 1.00 0.00 H new ATOM 0 HB2 ALA A 140 8.392 -12.309 -3.167 1.00 0.00 H new ATOM 0 HB3 ALA A 140 7.323 -13.673 -2.763 1.00 0.00 H new ATOM 2206 N TYR A 141 4.024 -12.410 -2.422 1.00 0.00 N ATOM 2207 CA TYR A 141 2.683 -12.927 -2.679 1.00 0.00 C ATOM 2208 C TYR A 141 1.752 -11.840 -3.214 1.00 0.00 C ATOM 2209 O TYR A 141 0.538 -12.036 -3.281 1.00 0.00 O ATOM 2210 CB TYR A 141 2.079 -13.534 -1.408 1.00 0.00 C ATOM 2211 CG TYR A 141 2.608 -14.908 -1.064 1.00 0.00 C ATOM 2212 CD1 TYR A 141 2.443 -15.974 -1.940 1.00 0.00 C ATOM 2213 CD2 TYR A 141 3.248 -15.144 0.144 1.00 0.00 C ATOM 2214 CE1 TYR A 141 2.907 -17.236 -1.621 1.00 0.00 C ATOM 2215 CE2 TYR A 141 3.718 -16.401 0.468 1.00 0.00 C ATOM 2216 CZ TYR A 141 3.545 -17.443 -0.416 1.00 0.00 C ATOM 2217 OH TYR A 141 4.003 -18.697 -0.089 1.00 0.00 O ATOM 0 H TYR A 141 4.176 -12.084 -1.468 1.00 0.00 H new ATOM 0 HA TYR A 141 2.781 -13.703 -3.438 1.00 0.00 H new ATOM 0 HB2 TYR A 141 2.272 -12.863 -0.571 1.00 0.00 H new ATOM 0 HB3 TYR A 141 0.997 -13.593 -1.526 1.00 0.00 H new ATOM 0 HD1 TYR A 141 1.945 -15.814 -2.885 1.00 0.00 H new ATOM 0 HD2 TYR A 141 3.381 -14.331 0.842 1.00 0.00 H new ATOM 0 HE1 TYR A 141 2.771 -18.055 -2.311 1.00 0.00 H new ATOM 0 HE2 TYR A 141 4.219 -16.567 1.410 1.00 0.00 H new ATOM 0 HH TYR A 141 4.429 -18.670 0.793 1.00 0.00 H new ATOM 2227 N CYS A 142 2.309 -10.703 -3.605 1.00 0.00 N ATOM 2228 CA CYS A 142 1.505 -9.615 -4.126 1.00 0.00 C ATOM 2229 C CYS A 142 2.112 -9.082 -5.417 1.00 0.00 C ATOM 2230 O CYS A 142 3.292 -9.309 -5.699 1.00 0.00 O ATOM 2231 CB CYS A 142 1.372 -8.494 -3.089 1.00 0.00 C ATOM 2232 SG CYS A 142 2.947 -7.798 -2.541 1.00 0.00 S ATOM 0 H CYS A 142 3.311 -10.513 -3.570 1.00 0.00 H new ATOM 0 HA CYS A 142 0.507 -9.996 -4.343 1.00 0.00 H new ATOM 0 HB2 CYS A 142 0.762 -7.695 -3.511 1.00 0.00 H new ATOM 0 HB3 CYS A 142 0.837 -8.879 -2.221 1.00 0.00 H new ATOM 0 HG CYS A 142 3.866 -8.717 -2.584 1.00 0.00 H new ATOM 2238 N LEU A 143 1.296 -8.398 -6.203 1.00 0.00 N ATOM 2239 CA LEU A 143 1.744 -7.816 -7.467 1.00 0.00 C ATOM 2240 C LEU A 143 2.439 -6.488 -7.211 1.00 0.00 C ATOM 2241 O LEU A 143 2.162 -5.824 -6.213 1.00 0.00 O ATOM 2242 CB LEU A 143 0.566 -7.601 -8.431 1.00 0.00 C ATOM 2243 CG LEU A 143 -0.114 -8.864 -8.954 1.00 0.00 C ATOM 2244 CD1 LEU A 143 -0.969 -9.517 -7.877 1.00 0.00 C ATOM 2245 CD2 LEU A 143 -0.955 -8.546 -10.181 1.00 0.00 C ATOM 0 H LEU A 143 0.313 -8.229 -5.990 1.00 0.00 H new ATOM 0 HA LEU A 143 2.443 -8.514 -7.928 1.00 0.00 H new ATOM 0 HB2 LEU A 143 -0.184 -6.992 -7.926 1.00 0.00 H new ATOM 0 HB3 LEU A 143 0.922 -7.025 -9.285 1.00 0.00 H new ATOM 0 HG LEU A 143 0.665 -9.571 -9.238 1.00 0.00 H new ATOM 0 HD11 LEU A 143 -1.440 -10.414 -8.280 1.00 0.00 H new ATOM 0 HD12 LEU A 143 -0.341 -9.787 -7.028 1.00 0.00 H new ATOM 0 HD13 LEU A 143 -1.739 -8.818 -7.551 1.00 0.00 H new ATOM 0 HD21 LEU A 143 -1.433 -9.457 -10.541 1.00 0.00 H new ATOM 0 HD22 LEU A 143 -1.720 -7.815 -9.918 1.00 0.00 H new ATOM 0 HD23 LEU A 143 -0.316 -8.138 -10.964 1.00 0.00 H new ATOM 2257 N VAL A 144 3.325 -6.092 -8.113 1.00 0.00 N ATOM 2258 CA VAL A 144 4.073 -4.862 -7.938 1.00 0.00 C ATOM 2259 C VAL A 144 3.654 -3.825 -8.973 1.00 0.00 C ATOM 2260 O VAL A 144 3.867 -4.000 -10.173 1.00 0.00 O ATOM 2261 CB VAL A 144 5.593 -5.103 -8.050 1.00 0.00 C ATOM 2262 CG1 VAL A 144 6.364 -3.816 -7.799 1.00 0.00 C ATOM 2263 CG2 VAL A 144 6.041 -6.185 -7.079 1.00 0.00 C ATOM 0 H VAL A 144 3.541 -6.604 -8.969 1.00 0.00 H new ATOM 0 HA VAL A 144 3.850 -4.491 -6.938 1.00 0.00 H new ATOM 0 HB VAL A 144 5.806 -5.440 -9.064 1.00 0.00 H new ATOM 0 HG11 VAL A 144 7.433 -4.010 -7.883 1.00 0.00 H new ATOM 0 HG12 VAL A 144 6.072 -3.067 -8.536 1.00 0.00 H new ATOM 0 HG13 VAL A 144 6.140 -3.447 -6.798 1.00 0.00 H new ATOM 0 HG21 VAL A 144 7.116 -6.338 -7.175 1.00 0.00 H new ATOM 0 HG22 VAL A 144 5.808 -5.878 -6.059 1.00 0.00 H new ATOM 0 HG23 VAL A 144 5.520 -7.115 -7.305 1.00 0.00 H new ATOM 2273 N TYR A 145 3.068 -2.746 -8.492 1.00 0.00 N ATOM 2274 CA TYR A 145 2.663 -1.638 -9.341 1.00 0.00 C ATOM 2275 C TYR A 145 3.408 -0.374 -8.943 1.00 0.00 C ATOM 2276 O TYR A 145 3.676 -0.145 -7.766 1.00 0.00 O ATOM 2277 CB TYR A 145 1.154 -1.396 -9.242 1.00 0.00 C ATOM 2278 CG TYR A 145 0.312 -2.349 -10.061 1.00 0.00 C ATOM 2279 CD1 TYR A 145 0.075 -3.649 -9.637 1.00 0.00 C ATOM 2280 CD2 TYR A 145 -0.255 -1.937 -11.262 1.00 0.00 C ATOM 2281 CE1 TYR A 145 -0.701 -4.512 -10.386 1.00 0.00 C ATOM 2282 CE2 TYR A 145 -1.034 -2.793 -12.014 1.00 0.00 C ATOM 2283 CZ TYR A 145 -1.255 -4.080 -11.572 1.00 0.00 C ATOM 2284 OH TYR A 145 -2.032 -4.935 -12.318 1.00 0.00 O ATOM 0 H TYR A 145 2.859 -2.611 -7.503 1.00 0.00 H new ATOM 0 HA TYR A 145 2.908 -1.895 -10.371 1.00 0.00 H new ATOM 0 HB2 TYR A 145 0.854 -1.472 -8.197 1.00 0.00 H new ATOM 0 HB3 TYR A 145 0.940 -0.376 -9.561 1.00 0.00 H new ATOM 0 HD1 TYR A 145 0.504 -3.991 -8.707 1.00 0.00 H new ATOM 0 HD2 TYR A 145 -0.083 -0.930 -11.612 1.00 0.00 H new ATOM 0 HE1 TYR A 145 -0.873 -5.522 -10.044 1.00 0.00 H new ATOM 0 HE2 TYR A 145 -1.468 -2.456 -12.944 1.00 0.00 H new ATOM 0 HH TYR A 145 -2.346 -4.473 -13.123 1.00 0.00 H new ATOM 2294 N GLU A 146 3.740 0.445 -9.925 1.00 0.00 N ATOM 2295 CA GLU A 146 4.454 1.680 -9.665 1.00 0.00 C ATOM 2296 C GLU A 146 3.527 2.883 -9.827 1.00 0.00 C ATOM 2297 O GLU A 146 2.984 3.133 -10.907 1.00 0.00 O ATOM 2298 CB GLU A 146 5.676 1.802 -10.585 1.00 0.00 C ATOM 2299 CG GLU A 146 5.357 1.685 -12.067 1.00 0.00 C ATOM 2300 CD GLU A 146 6.597 1.736 -12.933 1.00 0.00 C ATOM 2301 OE1 GLU A 146 7.194 2.823 -13.064 1.00 0.00 O ATOM 2302 OE2 GLU A 146 6.976 0.687 -13.499 1.00 0.00 O ATOM 0 H GLU A 146 3.527 0.277 -10.908 1.00 0.00 H new ATOM 0 HA GLU A 146 4.807 1.662 -8.634 1.00 0.00 H new ATOM 0 HB2 GLU A 146 6.158 2.763 -10.404 1.00 0.00 H new ATOM 0 HB3 GLU A 146 6.396 1.028 -10.318 1.00 0.00 H new ATOM 0 HG2 GLU A 146 4.829 0.749 -12.249 1.00 0.00 H new ATOM 0 HG3 GLU A 146 4.683 2.492 -12.355 1.00 0.00 H new