data_7mlc-assembly-1 # loop_ _atom_site.group_PDB _atom_site.id _atom_site.type_symbol _atom_site.label_atom_id _atom_site.label_alt_id _atom_site.label_comp_id _atom_site.label_asym_id _atom_site.label_entity_id _atom_site.label_seq_id _atom_site.pdbx_PDB_ins_code _atom_site.Cartn_x _atom_site.Cartn_y _atom_site.Cartn_z _atom_site.occupancy _atom_site.B_iso_or_equiv _atom_site.pdbx_formal_charge _atom_site.auth_seq_id _atom_site.auth_comp_id _atom_site.auth_asym_id _atom_site.auth_atom_id _atom_site.pdbx_PDB_model_num _atom_site.pdbe_label_seq_id _atom_site.orig_label_asym_id _atom_site.orig_auth_asym_id ATOM 1 N N . SER A 1 1 ? 4.044 14.626 5.178 1.0 30.66321 ? 25 SER A N 1 1 . A ATOM 2 C CA . SER A 1 1 ? 4.653 13.307 5.246 1.0 25.10949 ? 25 SER A CA 1 1 . A ATOM 3 C C . SER A 1 1 ? 3.587 12.235 5.376 1.0 24.97887 ? 25 SER A C 1 1 . A ATOM 4 O O . SER A 1 1 ? 2.412 12.539 5.555 1.0 25.14546 ? 25 SER A O 1 1 . A ATOM 5 C CB . SER A 1 1 ? 5.643 13.226 6.408 1.0 38.56746 ? 25 SER A CB 1 1 . A ATOM 6 O OG . SER A 1 1 ? 5.003 13.427 7.653 1.0 45.45246 ? 25 SER A OG 1 1 . A ATOM 7 N N . GLN A 1 2 ? 4.011 10.979 5.278 1.0 20.42078 ? 26 GLN A N 1 2 . A ATOM 8 C CA . GLN A 1 2 ? 3.111 9.841 5.313 1.0 19.88184 ? 26 GLN A CA 1 2 . A ATOM 9 C C . GLN A 1 2 ? 3.638 8.807 6.288 1.0 24.24194 ? 26 GLN A C 1 2 . A ATOM 10 O O . GLN A 1 2 ? 4.837 8.752 6.571 1.0 25.21556 ? 26 GLN A O 1 2 . A ATOM 11 C CB . GLN A 1 2 ? 2.983 9.180 3.945 1.0 25.01414 ? 26 GLN A CB 1 2 . A ATOM 12 C CG . GLN A 1 2 ? 2.308 9.998 2.900 1.0 22.67295 ? 26 GLN A CG 1 2 . A ATOM 13 C CD . GLN A 1 2 ? 2.328 9.277 1.557 1.0 27.70759 ? 26 GLN A CD 1 2 . A ATOM 14 O OE1 . GLN A 1 2 ? 3.123 8.343 1.342 1.0 25.05404 ? 26 GLN A OE1 1 2 . A ATOM 15 N NE2 . GLN A 1 2 ? 1.443 9.683 0.663 1.0 24.72487 ? 26 GLN A NE2 1 2 . A ATOM 16 N N . CYS A 1 3 ? 2.728 7.967 6.786 1.0 21.62867 ? 27 CYS A N 1 3 . A ATOM 17 C CA . CYS A 1 3 ? 3.102 6.686 7.365 1.0 24.12858 ? 27 CYS A CA 1 3 . A ATOM 18 C C . CYS A 1 3 ? 2.635 5.576 6.435 1.0 22.73767 ? 27 CYS A C 1 3 . A ATOM 19 O O . CYS A 1 3 ? 1.495 5.599 5.947 1.0 21.98264 ? 27 CYS A O 1 3 . A ATOM 20 C CB . CYS A 1 3 ? 2.506 6.475 8.755 1.0 23.46703 ? 27 CYS A CB 1 3 . A ATOM 21 S SG . CYS A 1 3 ? 3.032 4.856 9.446 1.0 26.52248 ? 27 CYS A SG 1 3 . A ATOM 22 N N . SER A 1 4 ? 3.520 4.615 6.173 1.0 20.65579 ? 28 SER A N 1 4 . A ATOM 23 C CA . SER A 1 4 ? 3.185 3.417 5.416 1.0 21.43191 ? 28 SER A CA 1 4 . A ATOM 24 C C . SER A 1 4 ? 3.686 2.224 6.207 1.0 23.42445 ? 28 SER A C 1 4 . A ATOM 25 O O . SER A 1 4 ? 4.825 2.233 6.676 1.0 22.88021 ? 28 SER A O 1 4 . A ATOM 26 C CB . SER A 1 4 ? 3.818 3.436 4.020 1.0 24.49856 ? 28 SER A CB 1 4 . A ATOM 27 O OG . SER A 1 4 ? 5.165 3.899 4.077 1.0 26.25914 ? 28 SER A OG 1 4 . A ATOM 28 N N . SER A 1 5 ? 2.847 1.204 6.370 1.0 20.82338 ? 29 SER A N 1 5 . A ATOM 29 C CA . SER A 1 5 ? 3.262 0.062 7.176 1.0 20.2338 ? 29 SER A CA 1 5 . A ATOM 30 C C . SER A 1 5 ? 2.464 -1.161 6.759 1.0 22.39827 ? 29 SER A C 1 5 . A ATOM 31 O O . SER A 1 5 ? 1.436 -1.059 6.087 1.0 22.14897 ? 29 SER A O 1 5 . A ATOM 32 C CB . SER A 1 5 ? 3.083 0.341 8.673 1.0 27.11251 ? 29 SER A CB 1 5 . A ATOM 33 O OG . SER A 1 5 ? 3.771 -0.639 9.428 1.0 40.13378 ? 29 SER A OG 1 5 . A ATOM 34 N N . THR A 1 6 ? 2.942 -2.322 7.194 1.0 18.52138 ? 30 THR A N 1 6 . A ATOM 35 C CA . THR A 1 6 ? 2.291 -3.593 6.918 1.0 22.18457 ? 30 THR A CA 1 6 . A ATOM 36 C C . THR A 1 6 ? 2.209 -4.391 8.207 1.0 20.82857 ? 30 THR A C 1 6 . A ATOM 37 O O . THR A 1 6 ? 3.186 -4.469 8.962 1.0 23.2967 ? 30 THR A O 1 6 . A ATOM 38 C CB . THR A 1 6 ? 3.060 -4.402 5.864 1.0 26.68242 ? 30 THR A CB 1 6 . A ATOM 39 O OG1 . THR A 1 6 ? 3.077 -3.690 4.616 1.0 25.68605 ? 30 THR A OG1 1 6 . A ATOM 40 C CG2 . THR A 1 6 ? 2.424 -5.769 5.652 1.0 26.03348 ? 30 THR A CG2 1 6 . A ATOM 41 N N . LEU A 1 7 ? 1.053 -5.010 8.434 1.0 20.15039 ? 31 LEU A N 1 7 . A ATOM 42 C CA . LEU A 1 7 ? 0.845 -5.886 9.571 1.0 22.23469 ? 31 LEU A CA 1 7 . A ATOM 43 C C . LEU A 1 7 ? 0.472 -7.280 9.075 1.0 26.62729 ? 31 LEU A C 1 7 . A ATOM 44 O O . LEU A 1 7 ? -0.144 -7.443 8.017 1.0 22.11125 ? 31 LEU A O 1 7 . A ATOM 45 C CB . LEU A 1 7 ? -0.251 -5.339 10.501 1.0 21.66818 ? 31 LEU A CB 1 7 . A ATOM 46 C CG . LEU A 1 7 ? 0.036 -4.033 11.253 1.0 28.74195 ? 31 LEU A CG 1 7 . A ATOM 47 C CD1 . LEU A 1 7 ? -0.364 -2.842 10.393 1.0 29.59762 ? 31 LEU A CD1 1 7 . A ATOM 48 C CD2 . LEU A 1 7 ? -0.707 -4.003 12.568 1.0 29.97622 ? 31 LEU A CD2 1 7 . A ATOM 49 N N . VAL A 1 8 ? 0.857 -8.279 9.858 1.0 22.33897 ? 32 VAL A N 1 8 . A ATOM 50 C CA . VAL A 1 8 ? 0.663 -9.682 9.529 1.0 24.21352 ? 32 VAL A CA 1 8 . A ATOM 51 C C . VAL A 1 8 ? -0.083 -10.340 10.685 1.0 24.84686 ? 32 VAL A C 1 8 . A ATOM 52 O O . VAL A 1 8 ? 0.196 -10.047 11.854 1.0 27.75037 ? 32 VAL A O 1 8 . A ATOM 53 C CB . VAL A 1 8 ? 2.030 -10.351 9.270 1.0 28.10071 ? 32 VAL A CB 1 8 . A ATOM 54 C CG1 . VAL A 1 8 ? 1.957 -11.837 9.390 1.0 36.93259 ? 32 VAL A CG1 1 8 . A ATOM 55 C CG2 . VAL A 1 8 ? 2.556 -9.928 7.900 1.0 32.9497 ? 32 VAL A CG2 1 8 . A ATOM 56 N N . LYS A 1 9 ? -1.035 -11.216 10.362 1.0 22.47836 ? 33 LYS A N 1 9 . A ATOM 57 C CA . LYS A 1 9 ? -1.764 -11.968 11.377 1.0 24.50873 ? 33 LYS A CA 1 9 . A ATOM 58 C C . LYS A 1 9 ? -1.923 -13.415 10.934 1.0 29.37875 ? 33 LYS A C 1 9 . A ATOM 59 O O . LYS A 1 9 ? -2.377 -13.679 9.818 1.0 26.33216 ? 33 LYS A O 1 9 . A ATOM 60 C CB . LYS A 1 9 ? -3.143 -11.344 11.636 1.0 24.31918 ? 33 LYS A CB 1 9 . A ATOM 61 C CG . LYS A 1 9 ? -3.958 -12.058 12.725 1.0 26.24329 ? 33 LYS A CG 1 9 . A ATOM 62 C CD . LYS A 1 9 ? -3.393 -11.793 14.113 1.0 25.93055 ? 33 LYS A CD 1 9 . A ATOM 63 C CE . LYS A 1 9 ? -4.031 -12.696 15.169 1.0 33.29037 ? 33 LYS A CE 1 9 . A ATOM 64 N NZ . LYS A 1 9 ? -3.375 -12.473 16.493 1.0 32.34857 ? 33 LYS A NZ 1 9 . A ATOM 65 N N . HIS A 1 10 ? -1.565 -14.349 11.809 1.0 21.94444 ? 34 HIS A N 1 10 . A ATOM 66 C CA . HIS A 1 10 ? -1.775 -15.768 11.556 1.0 28.26134 ? 34 HIS A CA 1 10 . A ATOM 67 C C . HIS A 1 10 ? -3.080 -16.199 12.216 1.0 28.37403 ? 34 HIS A C 1 10 . A ATOM 68 O O . HIS A 1 10 ? -3.258 -16.017 13.425 1.0 29.71259 ? 34 HIS A O 1 10 . A ATOM 69 C CB . HIS A 1 10 ? -0.594 -16.580 12.075 1.0 31.01678 ? 34 HIS A CB 1 10 . A ATOM 70 C CG . HIS A 1 10 ? 0.689 -16.248 11.385 1.0 34.44981 ? 34 HIS A CG 1 10 . A ATOM 71 N ND1 . HIS A 1 10 ? 1.023 -16.770 10.155 1.0 32.61159 ? 34 HIS A ND1 1 10 . A ATOM 72 C CD2 . HIS A 1 10 ? 1.698 -15.413 11.727 1.0 38.50103 ? 34 HIS A CD2 1 10 . A ATOM 73 C CE1 . HIS A 1 10 ? 2.195 -16.289 9.779 1.0 34.61931 ? 34 HIS A CE1 1 10 . A ATOM 74 N NE2 . HIS A 1 10 ? 2.626 -15.462 10.714 1.0 34.79969 ? 34 HIS A NE2 1 10 . A ATOM 75 N N . ILE A 1 11 ? -3.984 -16.771 11.419 1.0 24.36162 ? 35 ILE A N 1 11 . A ATOM 76 C CA . ILE A 1 11 ? -5.344 -17.093 11.840 1.0 25.94265 ? 35 ILE A CA 1 11 . A ATOM 77 C C . ILE A 1 11 ? -5.552 -18.591 11.695 1.0 27.2072 ? 35 ILE A C 1 11 . A ATOM 78 O O . ILE A 1 11 ? -5.250 -19.163 10.641 1.0 26.8222 ? 35 ILE A O 1 11 . A ATOM 79 C CB . ILE A 1 11 ? -6.389 -16.315 11.016 1.0 26.31711 ? 35 ILE A CB 1 11 . A ATOM 80 C CG1 . ILE A 1 11 ? -6.114 -14.809 11.078 1.0 22.13047 ? 35 ILE A CG1 1 11 . A ATOM 81 C CG2 . ILE A 1 11 ? -7.796 -16.638 11.502 1.0 26.64511 ? 35 ILE A CG2 1 11 . A ATOM 82 C CD1 . ILE A 1 11 ? -6.922 -13.971 10.084 1.0 24.34415 ? 35 ILE A CD1 1 11 . A ATOM 83 N N . LYS A 1 12 ? -6.080 -19.221 12.749 1.0 27.24108 ? 36 LYS A N 1 12 . A ATOM 84 C CA . LYS A 1 12 ? -6.278 -20.675 12.772 1.0 26.43828 ? 36 LYS A CA 1 12 . A ATOM 85 C C . LYS A 1 12 ? -7.687 -21.034 12.293 1.0 29.94878 ? 36 LYS A C 1 12 . A ATOM 86 O O . LYS A 1 12 ? -8.504 -21.616 13.014 1.0 31.47794 ? 36 LYS A O 1 12 . A ATOM 87 C CB . LYS A 1 12 ? -6.013 -21.218 14.169 1.0 28.17857 ? 36 LYS A CB 1 12 . A ATOM 88 C CG . LYS A 1 12 ? -4.629 -20.893 14.709 1.0 32.05902 ? 36 LYS A CG 1 12 . A ATOM 89 C CD . LYS A 1 12 ? -4.477 -21.421 16.129 1.0 49.24931 ? 36 LYS A CD 1 12 . A ATOM 90 C CE . LYS A 1 12 ? -3.202 -20.916 16.777 1.0 67.22772 ? 36 LYS A CE 1 12 . A ATOM 91 N NZ . LYS A 1 12 ? -3.167 -21.231 18.234 1.0 77.63946 ? 36 LYS A NZ 1 12 . A ATOM 92 N N . ALA A 1 13 ? -7.961 -20.662 11.045 1.0 27.304 ? 37 ALA A N 1 13 . A ATOM 93 C CA . ALA A 1 13 ? -9.222 -20.948 10.372 1.0 30.62482 ? 37 ALA A CA 1 13 . A ATOM 94 C C . ALA A 1 13 ? -8.934 -21.043 8.882 1.0 30.98707 ? 37 ALA A C 1 13 . A ATOM 95 O O . ALA A 1 13 ? -7.961 -20.441 8.407 1.0 28.43878 ? 37 ALA A O 1 13 . A ATOM 96 C CB . ALA A 1 13 ? -10.270 -19.858 10.651 1.0 24.92231 ? 37 ALA A CB 1 13 . A ATOM 97 N N . PRO A 1 14 ? -9.735 -21.792 8.119 1.0 25.93431 ? 38 PRO A N 1 14 . A ATOM 98 C CA . PRO A 1 14 ? -9.444 -21.950 6.688 1.0 27.10206 ? 38 PRO A CA 1 14 . A ATOM 99 C C . PRO A 1 14 ? -9.745 -20.683 5.902 1.0 26.15991 ? 38 PRO A C 1 14 . A ATOM 100 O O . PRO A 1 14 ? -10.636 -19.907 6.250 1.0 27.76727 ? 38 PRO A O 1 14 . A ATOM 101 C CB . PRO A 1 14 ? -10.367 -23.094 6.256 1.0 31.32784 ? 38 PRO A CB 1 14 . A ATOM 102 C CG . PRO A 1 14 ? -11.504 -23.041 7.232 1.0 34.50088 ? 38 PRO A CG 1 14 . A ATOM 103 C CD . PRO A 1 14 ? -10.905 -22.590 8.541 1.0 24.57622 ? 38 PRO A CD 1 14 . A ATOM 104 N N . LEU A 1 15 ? -8.991 -20.496 4.813 1.0 26.03482 ? 39 LEU A N 1 15 . A ATOM 105 C CA . LEU A 1 15 ? -9.082 -19.256 4.040 1.0 22.22359 ? 39 LEU A CA 1 15 . A ATOM 106 C C . LEU A 1 15 ? -10.512 -18.964 3.594 1.0 23.20804 ? 39 LEU A C 1 15 . A ATOM 107 O O . LEU A 1 15 ? -10.966 -17.817 3.659 1.0 22.17849 ? 39 LEU A O 1 15 . A ATOM 108 C CB . LEU A 1 15 ? -8.148 -19.318 2.827 1.0 28.43475 ? 39 LEU A CB 1 15 . A ATOM 109 C CG . LEU A 1 15 ? -8.120 -18.017 2.008 1.0 32.0783 ? 39 LEU A CG 1 15 . A ATOM 110 C CD1 . LEU A 1 15 ? -6.713 -17.695 1.528 1.0 35.20802 ? 39 LEU A CD1 1 15 . A ATOM 111 C CD2 . LEU A 1 15 ? -9.068 -18.079 0.814 1.0 32.168 ? 39 LEU A CD2 1 15 . A ATOM 112 N N . HIS A 1 16 ? -11.239 -19.978 3.124 1.0 28.18001 ? 40 HIS A N 1 16 . A ATOM 113 C CA . HIS A 1 16 ? -12.573 -19.688 2.610 1.0 26.1131 ? 40 HIS A CA 1 16 . A ATOM 114 C C . HIS A 1 16 ? -13.470 -19.096 3.690 1.0 25.91432 ? 40 HIS A C 1 16 . A ATOM 115 O O . HIS A 1 16 ? -14.283 -18.216 3.394 1.0 27.60028 ? 40 HIS A O 1 16 . A ATOM 116 C CB . HIS A 1 16 ? -13.204 -20.938 1.990 1.0 26.84244 ? 40 HIS A CB 1 16 . A ATOM 117 C CG . HIS A 1 16 ? -13.589 -21.993 2.982 1.0 24.59108 ? 40 HIS A CG 1 16 . A ATOM 118 N ND1 . HIS A 1 16 ? -12.761 -23.045 3.305 1.0 29.69205 ? 40 HIS A ND1 1 16 . A ATOM 119 C CD2 . HIS A 1 16 ? -14.716 -22.163 3.715 1.0 24.85589 ? 40 HIS A CD2 1 16 . A ATOM 120 C CE1 . HIS A 1 16 ? -13.359 -23.820 4.194 1.0 29.02176 ? 40 HIS A CE1 1 16 . A ATOM 121 N NE2 . HIS A 1 16 ? -14.547 -23.306 4.460 1.0 35.98834 ? 40 HIS A NE2 1 16 . A ATOM 122 N N . LEU A 1 17 ? -13.301 -19.518 4.949 1.0 24.32668 ? 41 LEU A N 1 17 . A ATOM 123 C CA . LEU A 1 17 ? -14.089 -18.937 6.032 1.0 23.18775 ? 41 LEU A CA 1 17 . A ATOM 124 C C . LEU A 1 17 ? -13.643 -17.510 6.324 1.0 29.41788 ? 41 LEU A C 1 17 . A ATOM 125 O O . LEU A 1 17 ? -14.473 -16.605 6.453 1.0 28.94188 ? 41 LEU A O 1 17 . A ATOM 126 C CB . LEU A 1 17 ? -13.984 -19.788 7.292 1.0 25.66191 ? 41 LEU A CB 1 17 . A ATOM 127 C CG . LEU A 1 17 ? -14.715 -19.255 8.526 1.0 31.61902 ? 41 LEU A CG 1 17 . A ATOM 128 C CD1 . LEU A 1 17 ? -16.165 -18.961 8.187 1.0 31.90894 ? 41 LEU A CD1 1 17 . A ATOM 129 C CD2 . LEU A 1 17 ? -14.643 -20.272 9.650 1.0 31.71408 ? 41 LEU A CD2 1 17 . A ATOM 130 N N . VAL A 1 18 ? -12.334 -17.288 6.433 1.0 26.70206 ? 42 VAL A N 1 18 . A ATOM 131 C CA . VAL A 1 18 ? -11.849 -15.938 6.717 1.0 22.73727 ? 42 VAL A CA 1 18 . A ATOM 132 C C . VAL A 1 18 ? -12.225 -14.986 5.587 1.0 23.52112 ? 42 VAL A C 1 18 . A ATOM 133 O O . VAL A 1 18 ? -12.664 -13.855 5.830 1.0 23.54918 ? 42 VAL A O 1 18 . A ATOM 134 C CB . VAL A 1 18 ? -10.328 -15.952 6.955 1.0 23.68522 ? 42 VAL A CB 1 18 . A ATOM 135 C CG1 . VAL A 1 18 ? -9.853 -14.553 7.306 1.0 22.56092 ? 42 VAL A CG1 1 18 . A ATOM 136 C CG2 . VAL A 1 18 ? -9.961 -16.940 8.059 1.0 21.04162 ? 42 VAL A CG2 1 18 . A ATOM 137 N N . TRP A 1 19 ? -12.058 -15.421 4.331 1.0 23.45358 ? 43 TRP A N 1 19 . A ATOM 138 C CA . TRP A 1 19 ? -12.356 -14.537 3.205 1.0 21.8332 ? 43 TRP A CA 1 19 . A ATOM 139 C C . TRP A 1 19 ? -13.841 -14.200 3.148 1.0 23.52972 ? 43 TRP A C 1 19 . A ATOM 140 O O . TRP A 1 19 ? -14.215 -13.077 2.791 1.0 23.2978 ? 43 TRP A O 1 19 . A ATOM 141 C CB . TRP A 1 19 ? -11.897 -15.170 1.884 1.0 23.45516 ? 43 TRP A CB 1 19 . A ATOM 142 C CG . TRP A 1 19 ? -12.189 -14.310 0.656 1.0 24.10994 ? 43 TRP A CG 1 19 . A ATOM 143 C CD1 . TRP A 1 19 ? -12.970 -14.641 -0.417 1.0 27.96824 ? 43 TRP A CD1 1 19 . A ATOM 144 C CD2 . TRP A 1 19 ? -11.699 -12.981 0.394 1.0 25.20721 ? 43 TRP A CD2 1 19 . A ATOM 145 N NE1 . TRP A 1 19 ? -12.993 -13.605 -1.330 1.0 26.27336 ? 43 TRP A NE1 1 19 . A ATOM 146 C CE2 . TRP A 1 19 ? -12.225 -12.578 -0.855 1.0 27.3973 ? 43 TRP A CE2 1 19 . A ATOM 147 C CE3 . TRP A 1 19 ? -10.873 -12.099 1.094 1.0 21.42826 ? 43 TRP A CE3 1 19 . A ATOM 148 C CZ2 . TRP A 1 19 ? -11.943 -11.330 -1.419 1.0 22.04545 ? 43 TRP A CZ2 1 19 . A ATOM 149 C CZ3 . TRP A 1 19 ? -10.593 -10.854 0.521 1.0 23.51058 ? 43 TRP A CZ3 1 19 . A ATOM 150 C CH2 . TRP A 1 19 ? -11.135 -10.490 -0.714 1.0 21.86837 ? 43 TRP A CH2 1 19 . A ATOM 151 N N . SER A 1 20 ? -14.704 -15.156 3.503 1.0 23.6207 ? 44 SER A N 1 20 . A ATOM 152 C CA . SER A 1 20 ? -16.142 -14.885 3.481 1.0 23.36986 ? 44 SER A CA 1 20 . A ATOM 153 C C . SER A 1 20 ? -16.501 -13.739 4.412 1.0 28.36559 ? 44 SER A C 1 20 . A ATOM 154 O O . SER A 1 20 ? -17.518 -13.066 4.202 1.0 28.1755 ? 44 SER A O 1 20 . A ATOM 155 C CB . SER A 1 20 ? -16.938 -16.141 3.848 1.0 22.85282 ? 44 SER A CB 1 20 . A ATOM 156 O OG . SER A 1 20 ? -16.968 -16.354 5.255 1.0 27.54336 ? 44 SER A OG 1 20 . A ATOM 157 N N . ILE A 1 21 ? -15.682 -13.497 5.434 1.0 24.38044 ? 45 ILE A N 1 21 . A ATOM 158 C CA . ILE A 1 21 ? -15.878 -12.353 6.322 1.0 23.21822 ? 45 ILE A CA 1 21 . A ATOM 159 C C . ILE A 1 21 ? -15.214 -11.102 5.759 1.0 26.4002 ? 45 ILE A C 1 21 . A ATOM 160 O O . ILE A 1 21 ? -15.832 -10.037 5.672 1.0 24.97965 ? 45 ILE A O 1 21 . A ATOM 161 C CB . ILE A 1 21 ? -15.342 -12.682 7.737 1.0 24.53272 ? 45 ILE A CB 1 21 . A ATOM 162 C CG1 . ILE A 1 21 ? -16.111 -13.856 8.370 1.0 27.17484 ? 45 ILE A CG1 1 21 . A ATOM 163 C CG2 . ILE A 1 21 ? -15.413 -11.451 8.626 1.0 26.15222 ? 45 ILE A CG2 1 21 . A ATOM 164 C CD1 . ILE A 1 21 ? -17.555 -13.583 8.581 1.0 30.36399 ? 45 ILE A CD1 1 21 . A ATOM 165 N N . VAL A 1 22 ? -13.942 -11.212 5.371 1.0 21.80476 ? 46 VAL A N 1 22 . A ATOM 166 C CA . VAL A 1 22 ? -13.184 -10.040 4.940 1.0 18.33137 ? 46 VAL A CA 1 22 . A ATOM 167 C C . VAL A 1 22 ? -13.786 -9.433 3.676 1.0 24.53262 ? 46 VAL A C 1 22 . A ATOM 168 O O . VAL A 1 22 ? -13.785 -8.206 3.508 1.0 25.9862 ? 46 VAL A O 1 22 . A ATOM 169 C CB . VAL A 1 22 ? -11.703 -10.421 4.733 1.0 17.75749 ? 46 VAL A CB 1 22 . A ATOM 170 C CG1 . VAL A 1 22 ? -10.927 -9.292 4.033 1.0 19.91148 ? 46 VAL A CG1 1 22 . A ATOM 171 C CG2 . VAL A 1 22 ? -11.030 -10.780 6.046 1.0 20.5982 ? 46 VAL A CG2 1 22 . A ATOM 172 N N . ARG A 1 23 ? -14.331 -10.263 2.778 1.0 25.46433 ? 47 ARG A N 1 23 . A ATOM 173 C CA . ARG A 1 23 ? -14.802 -9.746 1.497 1.0 22.22244 ? 47 ARG A CA 1 23 . A ATOM 174 C C . ARG A 1 23 ? -16.065 -8.906 1.622 1.0 25.3697 ? 47 ARG A C 1 23 . A ATOM 175 O O . ARG A 1 23 ? -16.407 -8.208 0.662 1.0 24.35655 ? 47 ARG A O 1 23 . A ATOM 176 C CB . ARG A 1 23 ? -15.065 -10.882 0.507 1.0 22.92297 ? 47 ARG A CB 1 23 . A ATOM 177 C CG . ARG A 1 23 ? -16.305 -11.706 0.846 1.0 25.81114 ? 47 ARG A CG 1 23 . A ATOM 178 C CD . ARG A 1 23 ? -16.491 -12.872 -0.121 1.0 26.42612 ? 47 ARG A CD 1 23 . A ATOM 179 N NE . ARG A 1 23 ? -16.744 -12.392 -1.476 1.0 32.67134 ? 47 ARG A NE 1 23 . A ATOM 180 C CZ . ARG A 1 23 ? -17.948 -12.088 -1.951 1.0 45.3205 ? 47 ARG A CZ 1 23 . A ATOM 181 N NH1 . ARG A 1 23 ? -19.023 -12.219 -1.179 1.0 42.02112 ? 47 ARG A NH1 1 23 . A ATOM 182 N NH2 . ARG A 1 23 ? -18.080 -11.650 -3.198 1.0 42.53633 ? 47 ARG A NH2 1 23 . A ATOM 183 N N . ARG A 1 24 ? -16.761 -8.950 2.760 1.0 22.6495 ? 48 ARG A N 1 24 . A ATOM 184 C CA . ARG A 1 24 ? -18.046 -8.256 2.893 1.0 22.60414 ? 48 ARG A CA 1 24 . A ATOM 185 C C . ARG A 1 24 ? -17.782 -6.775 3.144 1.0 23.85788 ? 48 ARG A C 1 24 . A ATOM 186 O O . ARG A 1 24 ? -17.864 -6.273 4.270 1.0 23.96443 ? 48 ARG A O 1 24 . A ATOM 187 C CB . ARG A 1 24 ? -18.892 -8.867 4.001 1.0 24.47933 ? 48 ARG A CB 1 24 . A ATOM 188 C CG . ARG A 1 24 ? -19.348 -10.284 3.705 1.0 32.06895 ? 48 ARG A CG 1 24 . A ATOM 189 C CD . ARG A 1 24 ? -20.137 -10.359 2.399 1.0 35.65784 ? 48 ARG A CD 1 24 . A ATOM 190 N NE . ARG A 1 24 ? -21.343 -9.533 2.426 1.0 36.96235 ? 48 ARG A NE 1 24 . A ATOM 191 C CZ . ARG A 1 24 ? -22.539 -9.970 2.809 1.0 51.61748 ? 48 ARG A CZ 1 24 . A ATOM 192 N NH1 . ARG A 1 24 ? -22.697 -11.229 3.198 1.0 46.92553 ? 48 ARG A NH1 1 24 . A ATOM 193 N NH2 . ARG A 1 24 ? -23.580 -9.147 2.804 1.0 54.21416 ? 48 ARG A NH2 1 24 . A ATOM 194 N N . PHE A 1 25 ? -17.468 -6.072 2.048 1.0 25.60595 ? 49 PHE A N 1 25 . A ATOM 195 C CA . PHE A 1 25 ? -17.271 -4.620 2.082 1.0 25.14342 ? 49 PHE A CA 1 25 . A ATOM 196 C C . PHE A 1 25 ? -18.448 -3.898 2.731 1.0 27.96323 ? 49 PHE A C 1 25 . A ATOM 197 O O . PHE A 1 25 ? -18.281 -2.809 3.297 1.0 25.1329 ? 49 PHE A O 1 25 . A ATOM 198 C CB . PHE A 1 25 ? -17.048 -4.129 0.643 1.0 23.8338 ? 49 PHE A CB 1 25 . A ATOM 199 C CG . PHE A 1 25 ? -16.902 -2.625 0.493 1.0 26.83515 ? 49 PHE A CG 1 25 . A ATOM 200 C CD1 . PHE A 1 25 ? -17.924 -1.870 -0.057 1.0 23.77307 ? 49 PHE A CD1 1 25 . A ATOM 201 C CD2 . PHE A 1 25 ? -15.720 -1.989 0.843 1.0 29.46797 ? 49 PHE A CD2 1 25 . A ATOM 202 C CE1 . PHE A 1 25 ? -17.787 -0.503 -0.222 1.0 23.51578 ? 49 PHE A CE1 1 25 . A ATOM 203 C CE2 . PHE A 1 25 ? -15.571 -0.612 0.684 1.0 25.21466 ? 49 PHE A CE2 1 25 . A ATOM 204 C CZ . PHE A 1 25 ? -16.599 0.126 0.152 1.0 20.09019 ? 49 PHE A CZ 1 25 . A ATOM 205 N N . ASP A 1 26 ? -19.635 -4.496 2.686 1.0 27.50889 ? 50 ASP A N 1 26 . A ATOM 206 C CA . ASP A 1 26 ? -20.833 -3.896 3.250 1.0 27.86576 ? 50 ASP A CA 1 26 . A ATOM 207 C C . ASP A 1 26 ? -21.042 -4.219 4.727 1.0 27.92393 ? 50 ASP A C 1 26 . A ATOM 208 O O . ASP A 1 26 ? -21.951 -3.649 5.344 1.0 30.99868 ? 50 ASP A O 1 26 . A ATOM 209 C CB . ASP A 1 26 ? -22.060 -4.334 2.448 1.0 33.45744 ? 50 ASP A CB 1 26 . A ATOM 210 C CG . ASP A 1 26 ? -22.253 -5.843 2.440 1.0 40.07538 ? 50 ASP A CG 1 26 . A ATOM 211 O OD1 . ASP A 1 26 ? -21.256 -6.592 2.343 1.0 33.06467 ? 50 ASP A OD1 1 26 . A ATOM 212 O OD2 . ASP A 1 26 ? -23.416 -6.280 2.528 1.0 41.66856 ? 50 ASP A OD2 1 26 . A ATOM 213 N N . GLU A 1 27 ? -20.235 -5.101 5.320 1.0 25.94122 ? 51 GLU A N 1 27 . A ATOM 214 C CA . GLU A 1 27 ? -20.414 -5.506 6.719 1.0 26.53353 ? 51 GLU A CA 1 27 . A ATOM 215 C C . GLU A 1 27 ? -19.088 -5.525 7.477 1.0 26.76971 ? 51 GLU A C 1 27 . A ATOM 216 O O . GLU A 1 27 ? -18.706 -6.547 8.062 1.0 24.16441 ? 51 GLU A O 1 27 . A ATOM 217 C CB . GLU A 1 27 ? -21.095 -6.875 6.797 1.0 30.53661 ? 51 GLU A CB 1 27 . A ATOM 218 C CG . GLU A 1 27 ? -22.555 -6.886 6.371 1.0 44.13441 ? 51 GLU A CG 1 27 . A ATOM 219 C CD . GLU A 1 27 ? -23.217 -8.238 6.581 1.0 45.02504 ? 51 GLU A CD 1 27 . A ATOM 220 O OE1 . GLU A 1 27 ? -22.493 -9.245 6.727 1.0 42.44966 ? 51 GLU A OE1 1 27 . A ATOM 221 O OE2 . GLU A 1 27 ? -24.462 -8.296 6.608 1.0 43.32272 ? 51 GLU A OE2 1 27 . A ATOM 222 N N . PRO A 1 28 ? -18.363 -4.400 7.517 1.0 26.23041 ? 52 PRO A N 1 28 . A ATOM 223 C CA . PRO A 1 28 ? -17.113 -4.390 8.293 1.0 23.93534 ? 52 PRO A CA 1 28 . A ATOM 224 C C . PRO A 1 28 ? -17.341 -4.598 9.774 1.0 25.32679 ? 52 PRO A C 1 28 . A ATOM 225 O O . PRO A 1 28 ? -16.449 -5.114 10.457 1.0 24.7009 ? 52 PRO A O 1 28 . A ATOM 226 C CB . PRO A 1 28 ? -16.517 -3.001 7.991 1.0 23.20112 ? 52 PRO A CB 1 28 . A ATOM 227 C CG . PRO A 1 28 ? -17.712 -2.162 7.634 1.0 22.17832 ? 52 PRO A CG 1 28 . A ATOM 228 C CD . PRO A 1 28 ? -18.604 -3.097 6.868 1.0 28.19096 ? 52 PRO A CD 1 28 . A ATOM 229 N N . GLN A 1 29 ? -18.528 -4.249 10.287 1.0 23.49528 ? 53 GLN A N 1 29 . A ATOM 230 C CA . GLN A 1 29 ? -18.798 -4.377 11.714 1.0 29.37289 ? 53 GLN A CA 1 29 . A ATOM 231 C C . GLN A 1 29 ? -18.799 -5.821 12.192 1.0 32.81703 ? 53 GLN A C 1 29 . A ATOM 232 O O . GLN A 1 29 ? -18.782 -6.051 13.405 1.0 29.371 ? 53 GLN A O 1 29 . A ATOM 233 C CB . GLN A 1 29 ? -20.141 -3.729 12.063 1.0 28.48217 ? 53 GLN A CB 1 29 . A ATOM 234 C CG . GLN A 1 29 ? -21.362 -4.461 11.520 1.0 33.23971 ? 53 GLN A CG 1 29 . A ATOM 235 C CD . GLN A 1 29 ? -21.709 -4.068 10.096 1.0 32.38214 ? 53 GLN A CD 1 29 . A ATOM 236 O OE1 . GLN A 1 29 ? -20.922 -3.425 9.404 1.0 30.50694 ? 53 GLN A OE1 1 29 . A ATOM 237 N NE2 . GLN A 1 29 ? -22.908 -4.443 9.655 1.0 37.98588 ? 53 GLN A NE2 1 29 . A ATOM 238 N N . LYS A 1 30 ? -18.815 -6.794 11.280 1.0 30.52671 ? 54 LYS A N 1 30 . A ATOM 239 C CA . LYS A 1 30 ? -18.785 -8.187 11.708 1.0 29.52767 ? 54 LYS A CA 1 30 . A ATOM 240 C C . LYS A 1 30 ? -17.496 -8.534 12.436 1.0 35.66288 ? 54 LYS A C 1 30 . A ATOM 241 O O . LYS A 1 30 ? -17.489 -9.475 13.236 1.0 32.88357 ? 54 LYS A O 1 30 . A ATOM 242 C CB . LYS A 1 30 ? -18.980 -9.115 10.509 1.0 34.4149 ? 54 LYS A CB 1 30 . A ATOM 243 C CG . LYS A 1 30 ? -20.317 -8.929 9.803 1.0 55.23861 ? 54 LYS A CG 1 30 . A ATOM 244 C CD . LYS A 1 30 ? -21.495 -9.048 10.767 1.0 78.27271 ? 54 LYS A CD 1 30 . A ATOM 245 C CE . LYS A 1 30 ? -21.607 -10.451 11.355 1.0 89.64248 ? 54 LYS A CE 1 30 . A ATOM 246 N NZ . LYS A 1 30 ? -22.760 -10.575 12.295 1.0 92.59038 ? 54 LYS A NZ 1 30 . A ATOM 247 N N . TYR A 1 31 ? -16.400 -7.810 12.182 1.0 22.98256 ? 55 TYR A N 1 31 . A ATOM 248 C CA . TYR A 1 31 ? -15.206 -8.035 12.991 1.0 26.37653 ? 55 TYR A CA 1 31 . A ATOM 249 C C . TYR A 1 31 ? -14.442 -6.785 13.402 1.0 23.75291 ? 55 TYR A C 1 31 . A ATOM 250 O O . TYR A 1 31 ? -13.556 -6.899 14.252 1.0 26.73337 ? 55 TYR A O 1 31 . A ATOM 251 C CB . TYR A 1 31 ? -14.235 -8.980 12.275 1.0 27.52818 ? 55 TYR A CB 1 31 . A ATOM 252 C CG . TYR A 1 31 ? -13.604 -8.416 11.031 1.0 29.43589 ? 55 TYR A CG 1 31 . A ATOM 253 C CD1 . TYR A 1 31 ? -12.313 -7.900 11.053 1.0 25.93968 ? 55 TYR A CD1 1 31 . A ATOM 254 C CD2 . TYR A 1 31 ? -14.288 -8.417 9.825 1.0 24.11087 ? 55 TYR A CD2 1 31 . A ATOM 255 C CE1 . TYR A 1 31 ? -11.714 -7.395 9.890 1.0 23.18158 ? 55 TYR A CE1 1 31 . A ATOM 256 C CE2 . TYR A 1 31 ? -13.695 -7.920 8.670 1.0 25.06875 ? 55 TYR A CE2 1 31 . A ATOM 257 C CZ . TYR A 1 31 ? -12.422 -7.411 8.714 1.0 25.63951 ? 55 TYR A CZ 1 31 . A ATOM 258 O OH . TYR A 1 31 ? -11.847 -6.917 7.566 1.0 37.04064 ? 55 TYR A OH 1 31 . A ATOM 259 N N . LYS A 1 32 ? -14.738 -5.604 12.865 1.0 28.21345 ? 56 LYS A N 1 32 . A ATOM 260 C CA . LYS A 1 32 ? -14.020 -4.406 13.282 1.0 20.73725 ? 56 LYS A CA 1 32 . A ATOM 261 C C . LYS A 1 32 ? -14.715 -3.814 14.504 1.0 26.48235 ? 56 LYS A C 1 32 . A ATOM 262 O O . LYS A 1 32 ? -15.826 -3.278 14.372 1.0 24.33991 ? 56 LYS A O 1 32 . A ATOM 263 C CB . LYS A 1 32 ? -13.948 -3.408 12.136 1.0 20.74128 ? 56 LYS A CB 1 32 . A ATOM 264 C CG . LYS A 1 32 ? -13.161 -3.987 10.952 1.0 22.26386 ? 56 LYS A CG 1 32 . A ATOM 265 C CD . LYS A 1 32 ? -12.879 -2.986 9.847 1.0 22.65869 ? 56 LYS A CD 1 32 . A ATOM 266 C CE . LYS A 1 32 ? -11.902 -3.596 8.852 1.0 35.7538 ? 56 LYS A CE 1 32 . A ATOM 267 N NZ . LYS A 1 32 ? -11.508 -2.632 7.784 1.0 34.38661 ? 56 LYS A NZ 1 32 . A ATOM 268 N N . PRO A 1 33 ? -14.122 -3.903 15.701 1.0 26.20172 ? 57 PRO A N 1 33 . A ATOM 269 C CA . PRO A 1 33 ? -14.875 -3.603 16.932 1.0 26.17952 ? 57 PRO A CA 1 33 . A ATOM 270 C C . PRO A 1 33 ? -15.326 -2.161 17.062 1.0 22.41573 ? 57 PRO A C 1 33 . A ATOM 271 O O . PRO A 1 33 ? -16.277 -1.897 17.805 1.0 26.11217 ? 57 PRO A O 1 33 . A ATOM 272 C CB . PRO A 1 33 ? -13.883 -3.962 18.047 1.0 25.50907 ? 57 PRO A CB 1 33 . A ATOM 273 C CG . PRO A 1 33 ? -12.849 -4.801 17.401 1.0 28.73884 ? 57 PRO A CG 1 33 . A ATOM 274 C CD . PRO A 1 33 ? -12.750 -4.357 15.990 1.0 20.93719 ? 57 PRO A CD 1 33 . A ATOM 275 N N . PHE A 1 34 ? -14.693 -1.213 16.383 1.0 21.55833 ? 58 PHE A N 1 34 . A ATOM 276 C CA . PHE A 1 34 ? -15.063 0.182 16.581 1.0 23.91256 ? 58 PHE A CA 1 34 . A ATOM 277 C C . PHE A 1 34 ? -16.139 0.659 15.615 1.0 31.49408 ? 58 PHE A C 1 34 . A ATOM 278 O O . PHE A 1 34 ? -16.529 1.832 15.669 1.0 29.90889 ? 58 PHE A O 1 34 . A ATOM 279 C CB . PHE A 1 34 ? -13.814 1.057 16.480 1.0 25.06873 ? 58 PHE A CB 1 34 . A ATOM 280 C CG . PHE A 1 34 ? -12.872 0.858 17.626 1.0 28.02411 ? 58 PHE A CG 1 34 . A ATOM 281 C CD1 . PHE A 1 34 ? -13.211 1.304 18.890 1.0 31.36176 ? 58 PHE A CD1 1 34 . A ATOM 282 C CD2 . PHE A 1 34 ? -11.669 0.199 17.452 1.0 24.91435 ? 58 PHE A CD2 1 34 . A ATOM 283 C CE1 . PHE A 1 34 ? -12.360 1.116 19.963 1.0 37.79673 ? 58 PHE A CE1 1 34 . A ATOM 284 C CE2 . PHE A 1 34 ? -10.815 0.007 18.518 1.0 28.72668 ? 58 PHE A CE2 1 34 . A ATOM 285 C CZ . PHE A 1 34 ? -11.157 0.468 19.774 1.0 32.60477 ? 58 PHE A CZ 1 34 . A ATOM 286 N N . ILE A 1 35 ? -16.653 -0.226 14.767 1.0 24.2291 ? 59 ILE A N 1 35 . A ATOM 287 C CA . ILE A 1 35 ? -17.655 0.119 13.767 1.0 21.58299 ? 59 ILE A CA 1 35 . A ATOM 288 C C . ILE A 1 35 ? -19.003 -0.435 14.200 1.0 28.00083 ? 59 ILE A C 1 35 . A ATOM 289 O O . ILE A 1 35 ? -19.100 -1.585 14.647 1.0 29.92758 ? 59 ILE A O 1 35 . A ATOM 290 C CB . ILE A 1 35 ? -17.248 -0.421 12.385 1.0 22.83689 ? 59 ILE A CB 1 35 . A ATOM 291 C CG1 . ILE A 1 35 ? -15.988 0.299 11.903 1.0 24.34041 ? 59 ILE A CG1 1 35 . A ATOM 292 C CG2 . ILE A 1 35 ? -18.401 -0.256 11.406 1.0 23.55045 ? 59 ILE A CG2 1 35 . A ATOM 293 C CD1 . ILE A 1 35 ? -15.369 -0.307 10.683 1.0 25.18094 ? 59 ILE A CD1 1 35 . A ATOM 294 N N . SER A 1 36 ? -20.047 0.392 14.076 1.0 25.36443 ? 60 SER A N 1 36 . A ATOM 295 C CA . SER A 1 36 ? -21.406 0.042 14.473 1.0 27.90947 ? 60 SER A CA 1 36 . A ATOM 296 C C . SER A 1 36 ? -22.260 -0.451 13.310 1.0 33.65453 ? 60 SER A C 1 36 . A ATOM 297 O O . SER A 1 36 ? -22.881 -1.516 13.398 1.0 29.25966 ? 60 SER A O 1 36 . A ATOM 298 C CB . SER A 1 36 ? -22.071 1.262 15.122 1.0 30.25103 ? 60 SER A CB 1 36 . A ATOM 299 O OG . SER A 1 36 ? -23.429 1.016 15.422 1.0 46.41094 ? 60 SER A OG 1 36 . A ATOM 300 N N . ARG A 1 37 ? -22.323 0.325 12.229 1.0 27.7337 ? 61 ARG A N 1 37 . A ATOM 301 C CA . ARG A 1 37 ? -23.218 0.080 11.108 1.0 25.40529 ? 61 ARG A CA 1 37 . A ATOM 302 C C . ARG A 1 37 ? -22.509 0.460 9.820 1.0 27.53838 ? 61 ARG A C 1 37 . A ATOM 303 O O . ARG A 1 37 ? -21.505 1.176 9.822 1.0 26.87045 ? 61 ARG A O 1 37 . A ATOM 304 C CB . ARG A 1 37 ? -24.517 0.894 11.232 1.0 25.34587 ? 61 ARG A CB 1 37 . A ATOM 305 C CG . ARG A 1 37 ? -25.496 0.408 12.287 1.0 59.32773 ? 61 ARG A CG 1 37 . A ATOM 306 C CD . ARG A 1 37 ? -26.590 1.440 12.504 1.0 54.07304 ? 61 ARG A CD 1 37 . A ATOM 307 N NE . ARG A 1 37 ? -26.015 2.729 12.872 1.0 65.76617 ? 61 ARG A NE 1 37 . A ATOM 308 C CZ . ARG A 1 37 ? -25.901 3.165 14.122 1.0 66.7787 ? 61 ARG A CZ 1 37 . A ATOM 309 N NH1 . ARG A 1 37 ? -25.352 4.349 14.367 1.0 65.25951 ? 61 ARG A NH1 1 37 . A ATOM 310 N NH2 . ARG A 1 37 ? -26.348 2.419 15.124 1.0 61.83755 ? 61 ARG A NH2 1 37 . A ATOM 311 N N . CYS A 1 38 ? -23.074 0.013 8.706 1.0 26.87166 ? 62 CYS A N 1 38 . A ATOM 312 C CA . CYS A 1 38 ? -22.488 0.284 7.400 1.0 21.87583 ? 62 CYS A CA 1 38 . A ATOM 313 C C . CYS A 1 38 ? -23.579 0.144 6.352 1.0 30.66621 ? 62 CYS A C 1 38 . A ATOM 314 O O . CYS A 1 38 ? -24.367 -0.807 6.412 1.0 29.99506 ? 62 CYS A O 1 38 . A ATOM 315 C CB . CYS A 1 38 ? -21.335 -0.687 7.133 1.0 26.29124 ? 62 CYS A CB 1 38 . A ATOM 316 S SG . CYS A 1 38 ? -20.521 -0.478 5.559 1.0 28.27512 ? 62 CYS A SG 1 38 . A ATOM 317 N N . VAL A 1 39 ? -23.645 1.091 5.411 1.0 26.73011 ? 63 VAL A N 1 39 . A ATOM 318 C CA . VAL A 1 39 ? -24.632 1.061 4.331 1.0 25.06016 ? 63 VAL A CA 1 39 . A ATOM 319 C C . VAL A 1 39 ? -23.921 1.255 2.997 1.0 30.80712 ? 63 VAL A C 1 39 . A ATOM 320 O O . VAL A 1 39 ? -23.082 2.153 2.859 1.0 31.47732 ? 63 VAL A O 1 39 . A ATOM 321 C CB . VAL A 1 39 ? -25.723 2.134 4.500 1.0 29.88864 ? 63 VAL A CB 1 39 . A ATOM 322 C CG1 . VAL A 1 39 ? -26.736 2.027 3.368 1.0 31.34414 ? 63 VAL A CG1 1 39 . A ATOM 323 C CG2 . VAL A 1 39 ? -26.424 1.978 5.839 1.0 36.48139 ? 63 VAL A CG2 1 39 . A ATOM 324 N N . VAL A 1 40 ? -24.260 0.412 2.021 1.0 29.89706 ? 64 VAL A N 1 40 . A ATOM 325 C CA . VAL A 1 40 ? -23.768 0.515 0.653 1.0 33.88505 ? 64 VAL A CA 1 40 . A ATOM 326 C C . VAL A 1 40 ? -24.971 0.552 -0.276 1.0 36.70788 ? 64 VAL A C 1 40 . A ATOM 327 O O . VAL A 1 40 ? -25.898 -0.253 -0.130 1.0 39.3716 ? 64 VAL A O 1 40 . A ATOM 328 C CB . VAL A 1 40 ? -22.847 -0.667 0.279 1.0 31.56029 ? 64 VAL A CB 1 40 . A ATOM 329 C CG1 . VAL A 1 40 ? -22.321 -0.490 -1.135 1.0 34.53649 ? 64 VAL A CG1 1 40 . A ATOM 330 C CG2 . VAL A 1 40 ? -21.707 -0.812 1.278 1.0 32.25862 ? 64 VAL A CG2 1 40 . A ATOM 331 N N . GLN A 1 41 ? -24.957 1.475 -1.232 1.0 36.93845 ? 65 GLN A N 1 41 . A ATOM 332 C CA . GLN A 1 41 ? -26.007 1.555 -2.239 1.0 47.53471 ? 65 GLN A CA 1 41 . A ATOM 333 C C . GLN A 1 41 ? -25.663 0.701 -3.456 1.0 50.36115 ? 65 GLN A C 1 41 . A ATOM 334 O O . GLN A 1 41 ? -24.492 0.475 -3.771 1.0 47.91757 ? 65 GLN A O 1 41 . A ATOM 335 C CB . GLN A 1 41 ? -26.224 3.004 -2.681 1.0 48.68295 ? 65 GLN A CB 1 41 . A ATOM 336 C CG . GLN A 1 41 ? -26.604 3.960 -1.564 1.0 44.45059 ? 65 GLN A CG 1 41 . A ATOM 337 C CD . GLN A 1 41 ? -27.966 3.646 -0.972 1.0 43.78225 ? 65 GLN A CD 1 41 . A ATOM 338 O OE1 . GLN A 1 41 ? -28.893 3.249 -1.683 1.0 43.35406 ? 65 GLN A OE1 1 41 . A ATOM 339 N NE2 . GLN A 1 41 ? -28.092 3.819 0.339 1.0 44.21644 ? 65 GLN A NE2 1 41 . A ATOM 340 N N . GLY A 1 42 ? -26.705 0.232 -4.142 1.0 51.68375 ? 66 GLY A N 1 42 . A ATOM 341 C CA . GLY A 1 42 ? -26.525 -0.416 -5.434 1.0 55.83175 ? 66 GLY A CA 1 42 . A ATOM 342 C C . GLY A 1 42 ? -25.956 -1.817 -5.314 1.0 64.68275 ? 66 GLY A C 1 42 . A ATOM 343 O O . GLY A 1 42 ? -26.282 -2.576 -4.394 1.0 60.15442 ? 66 GLY A O 1 42 . A ATOM 344 N N . LYS A 1 43 ? -25.112 -2.177 -6.283 1.0 77.92076 ? 67 LYS A N 1 43 . A ATOM 345 C CA . LYS A 1 43 ? -24.350 -3.421 -6.228 1.0 84.03992 ? 67 LYS A CA 1 43 . A ATOM 346 C C . LYS A 1 43 ? -23.248 -3.263 -5.189 1.0 81.42622 ? 67 LYS A C 1 43 . A ATOM 347 O O . LYS A 1 43 ? -22.242 -2.589 -5.432 1.0 84.10958 ? 67 LYS A O 1 43 . A ATOM 348 C CB . LYS A 1 43 ? -23.771 -3.752 -7.601 1.0 87.99283 ? 67 LYS A CB 1 43 . A ATOM 349 C CG . LYS A 1 43 ? -24.783 -3.685 -8.736 1.0 89.2144 ? 67 LYS A CG 1 43 . A ATOM 350 C CD . LYS A 1 43 ? -25.092 -5.063 -9.300 1.0 92.9264 ? 67 LYS A CD 1 43 . A ATOM 351 C CE . LYS A 1 43 ? -26.108 -4.978 -10.436 1.0 94.33792 ? 67 LYS A CE 1 43 . A ATOM 352 N NZ . LYS A 1 43 ? -26.385 -6.304 -11.060 1.0 92.01265 ? 67 LYS A NZ 1 43 . A ATOM 353 N N . LYS A 1 44 ? -23.436 -3.891 -4.028 1.0 74.60205 ? 68 LYS A N 1 44 . A ATOM 354 C CA . LYS A 1 44 ? -22.651 -3.545 -2.851 1.0 64.67498 ? 68 LYS A CA 1 44 . A ATOM 355 C C . LYS A 1 44 ? -21.185 -3.951 -2.953 1.0 59.95135 ? 68 LYS A C 1 44 . A ATOM 356 O O . LYS A 1 44 ? -20.364 -3.434 -2.186 1.0 53.94561 ? 68 LYS A O 1 44 . A ATOM 357 C CB . LYS A 1 44 ? -23.274 -4.182 -1.610 1.0 59.30362 ? 68 LYS A CB 1 44 . A ATOM 358 C CG . LYS A 1 44 ? -24.701 -3.742 -1.348 1.0 59.83817 ? 68 LYS A CG 1 44 . A ATOM 359 C CD . LYS A 1 44 ? -25.136 -4.137 0.051 1.0 62.38099 ? 68 LYS A CD 1 44 . A ATOM 360 C CE . LYS A 1 44 ? -26.476 -3.523 0.402 1.0 69.66538 ? 68 LYS A CE 1 44 . A ATOM 361 N NZ . LYS A 1 44 ? -26.827 -3.786 1.822 1.0 72.59134 ? 68 LYS A NZ 1 44 . A ATOM 362 N N . LEU A 1 45 ? -20.830 -4.849 -3.866 1.0 49.08918 ? 69 LEU A N 1 45 . A ATOM 363 C CA . LEU A 1 45 ? -19.486 -5.408 -3.899 1.0 48.91944 ? 69 LEU A CA 1 45 . A ATOM 364 C C . LEU A 1 45 ? -18.824 -5.181 -5.254 1.0 54.90947 ? 69 LEU A C 1 45 . A ATOM 365 O O . LEU A 1 45 ? -18.156 -6.061 -5.799 1.0 61.19794 ? 69 LEU A O 1 45 . A ATOM 366 C CB . LEU A 1 45 ? -19.514 -6.892 -3.547 1.0 51.85308 ? 69 LEU A CB 1 45 . A ATOM 367 C CG . LEU A 1 45 ? -20.099 -7.261 -2.180 1.0 55.29959 ? 69 LEU A CG 1 45 . A ATOM 368 C CD1 . LEU A 1 45 ? -20.107 -8.774 -2.001 1.0 64.50691 ? 69 LEU A CD1 1 45 . A ATOM 369 C CD2 . LEU A 1 45 ? -19.333 -6.592 -1.049 1.0 37.75125 ? 69 LEU A CD2 1 45 . A ATOM 370 N N . GLU A 1 46 ? -18.988 -3.985 -5.801 1.0 46.53411 ? 70 GLU A N 1 46 . A ATOM 371 C CA . GLU A 1 46 ? -18.420 -3.612 -7.087 1.0 44.35552 ? 70 GLU A CA 1 46 . A ATOM 372 C C . GLU A 1 46 ? -17.384 -2.509 -6.892 1.0 39.75184 ? 70 GLU A C 1 46 . A ATOM 373 O O . GLU A 1 46 ? -17.551 -1.642 -6.033 1.0 39.02084 ? 70 GLU A O 1 46 . A ATOM 374 C CB . GLU A 1 46 ? -19.538 -3.154 -8.018 1.0 47.44623 ? 70 GLU A CB 1 46 . A ATOM 375 C CG . GLU A 1 46 ? -19.125 -2.677 -9.372 1.0 58.28272 ? 70 GLU A CG 1 46 . A ATOM 376 C CD . GLU A 1 46 ? -20.308 -2.098 -10.111 1.0 69.81112 ? 70 GLU A CD 1 46 . A ATOM 377 O OE1 . GLU A 1 46 ? -20.460 -0.858 -10.117 1.0 72.94078 ? 70 GLU A OE1 1 46 . A ATOM 378 O OE2 . GLU A 1 46 ? -21.107 -2.888 -10.652 1.0 73.04162 ? 70 GLU A OE2 1 46 . A ATOM 379 N N . VAL A 1 47 ? -16.301 -2.556 -7.675 1.0 36.19287 ? 71 VAL A N 1 47 . A ATOM 380 C CA . VAL A 1 47 ? -15.276 -1.518 -7.593 1.0 32.85128 ? 71 VAL A CA 1 47 . A ATOM 381 C C . VAL A 1 47 ? -15.915 -0.159 -7.823 1.0 36.64987 ? 71 VAL A C 1 47 . A ATOM 382 O O . VAL A 1 47 ? -16.710 0.025 -8.753 1.0 33.45267 ? 71 VAL A O 1 47 . A ATOM 383 C CB . VAL A 1 47 ? -14.157 -1.780 -8.609 1.0 33.46642 ? 71 VAL A CB 1 47 . A ATOM 384 C CG1 . VAL A 1 47 ? -13.262 -0.563 -8.734 1.0 31.20547 ? 71 VAL A CG1 1 47 . A ATOM 385 C CG2 . VAL A 1 47 ? -13.350 -3.005 -8.196 1.0 39.89221 ? 71 VAL A CG2 1 47 . A ATOM 386 N N . GLY A 1 48 ? -15.569 0.803 -6.971 1.0 27.88531 ? 72 GLY A N 1 48 . A ATOM 387 C CA . GLY A 1 48 ? -16.234 2.084 -6.968 1.0 25.87988 ? 72 GLY A CA 1 48 . A ATOM 388 C C . GLY A 1 48 ? -17.397 2.185 -6.001 1.0 32.22661 ? 72 GLY A C 1 48 . A ATOM 389 O O . GLY A 1 48 ? -17.869 3.301 -5.748 1.0 29.34431 ? 72 GLY A O 1 48 . A ATOM 390 N N . SER A 1 49 ? -17.878 1.058 -5.463 1.0 28.5281 ? 73 SER A N 1 49 . A ATOM 391 C CA . SER A 1 49 ? -18.887 1.094 -4.409 1.0 31.30618 ? 73 SER A CA 1 49 . A ATOM 392 C C . SER A 1 49 ? -18.433 2.000 -3.275 1.0 26.93728 ? 73 SER A C 1 49 . A ATOM 393 O O . SER A 1 49 ? -17.260 2.006 -2.893 1.0 23.41879 ? 73 SER A O 1 49 . A ATOM 394 C CB . SER A 1 49 ? -19.161 -0.308 -3.850 1.0 32.12477 ? 73 SER A CB 1 49 . A ATOM 395 O OG . SER A 1 49 ? -19.860 -1.130 -4.773 1.0 44.67541 ? 73 SER A OG 1 49 . A ATOM 396 N N . VAL A 1 50 ? -19.378 2.750 -2.720 1.0 25.68091 ? 74 VAL A N 1 50 . A ATOM 397 C CA . VAL A 1 50 ? -19.123 3.629 -1.588 1.0 21.4117 ? 74 VAL A CA 1 50 . A ATOM 398 C C . VAL A 1 50 ? -19.863 3.070 -0.379 1.0 23.68487 ? 74 VAL A C 1 50 . A ATOM 399 O O . VAL A 1 50 ? -21.068 2.801 -0.456 1.0 26.72707 ? 74 VAL A O 1 50 . A ATOM 400 C CB . VAL A 1 50 ? -19.582 5.066 -1.897 1.0 24.6429 ? 74 VAL A CB 1 50 . A ATOM 401 C CG1 . VAL A 1 50 ? -19.291 5.991 -0.733 1.0 24.77406 ? 74 VAL A CG1 1 50 . A ATOM 402 C CG2 . VAL A 1 50 ? -18.931 5.573 -3.180 1.0 26.15302 ? 74 VAL A CG2 1 50 . A ATOM 403 N N . ARG A 1 51 ? -19.161 2.911 0.737 1.0 22.01126 ? 75 ARG A N 1 51 . A ATOM 404 C CA . ARG A 1 51 ? -19.817 2.558 1.988 1.0 25.79841 ? 75 ARG A CA 1 51 . A ATOM 405 C C . ARG A 1 51 ? -19.816 3.757 2.926 1.0 24.18258 ? 75 ARG A C 1 51 . A ATOM 406 O O . ARG A 1 51 ? -18.817 4.476 3.042 1.0 24.60431 ? 75 ARG A O 1 51 . A ATOM 407 C CB . ARG A 1 51 ? -19.157 1.349 2.660 1.0 21.12072 ? 75 ARG A CB 1 51 . A ATOM 408 C CG . ARG A 1 51 ? -17.735 1.540 3.173 1.0 20.05271 ? 75 ARG A CG 1 51 . A ATOM 409 C CD . ARG A 1 51 ? -17.229 0.201 3.718 1.0 22.49218 ? 75 ARG A CD 1 51 . A ATOM 410 N NE . ARG A 1 51 ? -15.850 0.251 4.193 1.0 24.60392 ? 75 ARG A NE 1 51 . A ATOM 411 C CZ . ARG A 1 51 ? -15.132 -0.829 4.507 1.0 29.21651 ? 75 ARG A CZ 1 51 . A ATOM 412 N NH1 . ARG A 1 51 ? -15.653 -2.046 4.375 1.0 25.05737 ? 75 ARG A NH1 1 51 . A ATOM 413 N NH2 . ARG A 1 51 ? -13.888 -0.693 4.940 1.0 29.38337 ? 75 ARG A NH2 1 51 . A ATOM 414 N N . GLU A 1 52 ? -20.952 3.985 3.575 1.0 21.70969 ? 76 GLU A N 1 52 . A ATOM 415 C CA . GLU A 1 52 ? -21.060 4.962 4.649 1.0 25.01939 ? 76 GLU A CA 1 52 . A ATOM 416 C C . GLU A 1 52 ? -21.021 4.208 5.973 1.0 29.21755 ? 76 GLU A C 1 52 . A ATOM 417 O O . GLU A 1 52 ? -21.907 3.392 6.254 1.0 27.01552 ? 76 GLU A O 1 52 . A ATOM 418 C CB . GLU A 1 52 ? -22.342 5.783 4.515 1.0 24.09049 ? 76 GLU A CB 1 52 . A ATOM 419 C CG . GLU A 1 52 ? -22.527 6.470 3.159 1.0 29.30927 ? 76 GLU A CG 1 52 . A ATOM 420 C CD . GLU A 1 52 ? -21.476 7.543 2.870 1.0 33.28744 ? 76 GLU A CD 1 52 . A ATOM 421 O OE1 . GLU A 1 52 ? -20.755 7.955 3.801 1.0 28.76708 ? 76 GLU A OE1 1 52 . A ATOM 422 O OE2 . GLU A 1 52 ? -21.371 7.973 1.699 1.0 34.91978 ? 76 GLU A OE2 1 52 . A ATOM 423 N N . VAL A 1 53 ? -19.995 4.476 6.775 1.0 22.79676 ? 77 VAL A N 1 53 . A ATOM 424 C CA . VAL A 1 53 ? -19.688 3.712 7.979 1.0 23.33951 ? 77 VAL A CA 1 53 . A ATOM 425 C C . VAL A 1 53 ? -20.052 4.550 9.195 1.0 29.63965 ? 77 VAL A C 1 53 . A ATOM 426 O O . VAL A 1 53 ? -19.665 5.720 9.283 1.0 28.77663 ? 77 VAL A O 1 53 . A ATOM 427 C CB . VAL A 1 53 ? -18.203 3.316 8.013 1.0 25.98706 ? 77 VAL A CB 1 53 . A ATOM 428 C CG1 . VAL A 1 53 ? -17.823 2.743 9.370 1.0 29.63266 ? 77 VAL A CG1 1 53 . A ATOM 429 C CG2 . VAL A 1 53 ? -17.889 2.325 6.896 1.0 34.46682 ? 77 VAL A CG2 1 53 . A ATOM 430 N N . ASP A 1 54 ? -20.808 3.962 10.124 1.0 25.20599 ? 78 ASP A N 1 54 . A ATOM 431 C CA . ASP A 1 54 ? -21.104 4.586 11.412 1.0 23.56071 ? 78 ASP A CA 1 54 . A ATOM 432 C C . ASP A 1 54 ? -20.182 3.994 12.468 1.0 26.2441 ? 78 ASP A C 1 54 . A ATOM 433 O O . ASP A 1 54 ? -20.154 2.771 12.656 1.0 25.14533 ? 78 ASP A O 1 54 . A ATOM 434 C CB . ASP A 1 54 ? -22.552 4.361 11.844 1.0 23.19953 ? 78 ASP A CB 1 54 . A ATOM 435 C CG . ASP A 1 54 ? -23.550 5.166 11.042 1.0 38.39926 ? 78 ASP A CG 1 54 . A ATOM 436 O OD1 . ASP A 1 54 ? -23.175 6.189 10.443 1.0 39.06417 ? 78 ASP A OD1 1 54 . A ATOM 437 O OD2 . ASP A 1 54 ? -24.735 4.779 11.044 1.0 48.27738 ? 78 ASP A OD2 1 54 . A ATOM 438 N N . LEU A 1 55 ? -19.460 4.854 13.174 1.0 23.7641 ? 79 LEU A N 1 55 . A ATOM 439 C CA . LEU A 1 55 ? -18.617 4.373 14.252 1.0 26.6902 ? 79 LEU A CA 1 55 . A ATOM 440 C C . LEU A 1 55 ? -19.451 4.174 15.513 1.0 28.87518 ? 79 LEU A C 1 55 . A ATOM 441 O O . LEU A 1 55 ? -20.550 4.713 15.651 1.0 26.32237 ? 79 LEU A O 1 55 . A ATOM 442 C CB . LEU A 1 55 ? -17.476 5.350 14.525 1.0 24.62688 ? 79 LEU A CB 1 55 . A ATOM 443 C CG . LEU A 1 55 ? -16.543 5.608 13.344 1.0 24.75597 ? 79 LEU A CG 1 55 . A ATOM 444 C CD1 . LEU A 1 55 ? -15.386 6.471 13.789 1.0 35.58713 ? 79 LEU A CD1 1 55 . A ATOM 445 C CD2 . LEU A 1 55 ? -16.034 4.308 12.739 1.0 20.01104 ? 79 LEU A CD2 1 55 . A ATOM 446 N N . LYS A 1 56 ? -18.920 3.375 16.434 1.0 28.57593 ? 80 LYS A N 1 56 . A ATOM 447 C CA . LYS A 1 56 ? -19.581 3.215 17.717 1.0 32.4225 ? 80 LYS A CA 1 56 . A ATOM 448 C C . LYS A 1 56 ? -19.641 4.552 18.442 1.0 28.71929 ? 80 LYS A C 1 56 . A ATOM 449 O O . LYS A 1 56 ? -18.760 5.405 18.289 1.0 28.81202 ? 80 LYS A O 1 56 . A ATOM 450 C CB . LYS A 1 56 ? -18.851 2.174 18.566 1.0 36.33118 ? 80 LYS A CB 1 56 . A ATOM 451 C CG . LYS A 1 56 ? -19.043 0.768 18.037 1.0 39.4884 ? 80 LYS A CG 1 56 . A ATOM 452 C CD . LYS A 1 56 ? -19.119 -0.265 19.132 1.0 38.61067 ? 80 LYS A CD 1 56 . A ATOM 453 C CE . LYS A 1 56 ? -19.420 -1.627 18.530 1.0 41.88279 ? 80 LYS A CE 1 56 . A ATOM 454 N NZ . LYS A 1 56 ? -18.683 -2.724 19.222 1.0 50.98987 ? 80 LYS A NZ 1 56 . A ATOM 455 N N . SER A 1 57 ? -20.702 4.729 19.231 1.0 27.33225 ? 81 SER A N 1 57 . A ATOM 456 C CA . SER A 1 57 ? -20.892 5.956 19.995 1.0 33.64475 ? 81 SER A CA 1 57 . A ATOM 457 C C . SER A 1 57 ? -19.771 6.129 21.007 1.0 29.54416 ? 81 SER A C 1 57 . A ATOM 458 O O . SER A 1 57 ? -19.266 5.162 21.581 1.0 36.8347 ? 81 SER A O 1 57 . A ATOM 459 C CB . SER A 1 57 ? -22.237 5.936 20.731 1.0 40.10386 ? 81 SER A CB 1 57 . A ATOM 460 O OG . SER A 1 57 ? -23.319 5.722 19.846 1.0 49.3589 ? 81 SER A OG 1 57 . A ATOM 461 N N . GLY A 1 58 ? -19.393 7.376 21.245 1.0 30.25453 ? 82 GLY A N 1 58 . A ATOM 462 C CA . GLY A 1 58 ? -18.403 7.656 22.259 1.0 33.81789 ? 82 GLY A CA 1 58 . A ATOM 463 C C . GLY A 1 58 ? -16.992 7.766 21.749 1.0 30.70483 ? 82 GLY A C 1 58 . A ATOM 464 O O . GLY A 1 58 ? -16.054 7.697 22.551 1.0 34.3846 ? 82 GLY A O 1 58 . A ATOM 465 N N . LEU A 1 59 ? -16.813 7.939 20.445 1.0 29.91459 ? 83 LEU A N 1 59 . A ATOM 466 C CA . LEU A 1 59 ? -15.531 8.167 19.802 1.0 29.55026 ? 83 LEU A CA 1 59 . A ATOM 467 C C . LEU A 1 59 ? -15.426 9.614 19.338 1.0 35.02094 ? 83 LEU A C 1 59 . A ATOM 468 O O . LEU A 1 59 ? -16.437 10.314 19.229 1.0 30.21835 ? 83 LEU A O 1 59 . A ATOM 469 C CB . LEU A 1 59 ? -15.374 7.225 18.602 1.0 28.45751 ? 83 LEU A CB 1 59 . A ATOM 470 C CG . LEU A 1 59 ? -15.158 5.771 19.030 1.0 32.19903 ? 83 LEU A CG 1 59 . A ATOM 471 C CD1 . LEU A 1 59 ? -15.332 4.799 17.872 1.0 29.04584 ? 83 LEU A CD1 1 59 . A ATOM 472 C CD2 . LEU A 1 59 ? -13.772 5.636 19.637 1.0 34.29541 ? 83 LEU A CD2 1 59 . A ATOM 473 N N . PRO A 1 60 ? -14.213 10.106 19.058 1.0 36.42138 ? 84 PRO A N 1 60 . A ATOM 474 C CA . PRO A 1 60 ? -14.110 11.490 18.565 1.0 41.13523 ? 84 PRO A CA 1 60 . A ATOM 475 C C . PRO A 1 60 ? -14.760 11.699 17.202 1.0 38.79998 ? 84 PRO A C 1 60 . A ATOM 476 O O . PRO A 1 60 ? -15.388 12.743 16.982 1.0 46.29375 ? 84 PRO A O 1 60 . A ATOM 477 C CB . PRO A 1 60 ? -12.594 11.754 18.551 1.0 39.55579 ? 84 PRO A CB 1 60 . A ATOM 478 C CG . PRO A 1 60 ? -11.942 10.451 18.760 1.0 41.47957 ? 84 PRO A CG 1 60 . A ATOM 479 C CD . PRO A 1 60 ? -12.901 9.533 19.407 1.0 37.01515 ? 84 PRO A CD 1 60 . A ATOM 480 N N . ALA A 1 61 ? -14.657 10.740 16.289 1.0 31.52543 ? 85 ALA A N 1 61 . A ATOM 481 C CA . ALA A 1 61 ? -15.391 10.796 15.032 1.0 29.21438 ? 85 ALA A CA 1 61 . A ATOM 482 C C . ALA A 1 61 ? -16.664 9.954 15.127 1.0 31.89913 ? 85 ALA A C 1 61 . A ATOM 483 O O . ALA A 1 61 ? -16.868 9.186 16.074 1.0 29.77853 ? 85 ALA A O 1 61 . A ATOM 484 C CB . ALA A 1 61 ? -14.512 10.322 13.870 1.0 25.32376 ? 85 ALA A CB 1 61 . A ATOM 485 N N . THR A 1 62 ? -17.547 10.130 14.139 1.0 23.09783 ? 86 THR A N 1 62 . A ATOM 486 C CA . THR A 1 62 ? -18.796 9.376 14.081 1.0 23.60359 ? 86 THR A CA 1 62 . A ATOM 487 C C . THR A 1 62 ? -19.021 8.643 12.769 1.0 27.32876 ? 86 THR A C 1 62 . A ATOM 488 O O . THR A 1 62 ? -19.838 7.717 12.743 1.0 24.27554 ? 86 THR A O 1 62 . A ATOM 489 C CB . THR A 1 62 ? -20.014 10.280 14.323 1.0 28.36434 ? 86 THR A CB 1 62 . A ATOM 490 O OG1 . THR A 1 62 ? -20.126 11.240 13.263 1.0 28.89615 ? 86 THR A OG1 1 62 . A ATOM 491 C CG2 . THR A 1 62 ? -19.907 10.985 15.670 1.0 26.68086 ? 86 THR A CG2 1 62 . A ATOM 492 N N . LYS A 1 63 ? -18.351 9.022 11.684 1.0 28.33602 ? 87 LYS A N 1 63 . A ATOM 493 C CA . LYS A 1 63 ? -18.657 8.428 10.393 1.0 22.96538 ? 87 LYS A CA 1 63 . A ATOM 494 C C . LYS A 1 63 ? -17.439 8.487 9.488 1.0 24.1421 ? 87 LYS A C 1 63 . A ATOM 495 O O . LYS A 1 63 ? -16.600 9.383 9.605 1.0 23.0608 ? 87 LYS A O 1 63 . A ATOM 496 C CB . LYS A 1 63 ? -19.835 9.143 9.721 1.0 28.4651 ? 87 LYS A CB 1 63 . A ATOM 497 C CG . LYS A 1 63 ? -19.624 10.626 9.562 1.0 38.20672 ? 87 LYS A CG 1 63 . A ATOM 498 C CD . LYS A 1 63 ? -20.940 11.376 9.441 1.0 45.16585 ? 87 LYS A CD 1 63 . A ATOM 499 C CE . LYS A 1 63 ? -20.695 12.879 9.523 1.0 52.93339 ? 87 LYS A CE 1 63 . A ATOM 500 N NZ . LYS A 1 63 ? -21.950 13.678 9.478 1.0 53.867 ? 87 LYS A NZ 1 63 . A ATOM 501 N N . SER A 1 64 ? -17.363 7.513 8.580 1.0 23.75468 ? 88 SER A N 1 64 . A ATOM 502 C CA . SER A 1 64 ? -16.352 7.459 7.535 1.0 22.92606 ? 88 SER A CA 1 64 . A ATOM 503 C C . SER A 1 64 ? -17.046 7.127 6.224 1.0 26.23912 ? 88 SER A C 1 64 . A ATOM 504 O O . SER A 1 64 ? -18.032 6.384 6.208 1.0 27.27311 ? 88 SER A O 1 64 . A ATOM 505 C CB . SER A 1 64 ? -15.274 6.399 7.835 1.0 24.06449 ? 88 SER A CB 1 64 . A ATOM 506 O OG . SER A 1 64 ? -14.197 6.505 6.916 1.0 29.78522 ? 88 SER A OG 1 64 . A ATOM 507 N N . THR A 1 65 ? -16.536 7.684 5.133 1.0 20.68842 ? 89 THR A N 1 65 . A ATOM 508 C CA . THR A 1 65 ? -16.998 7.376 3.784 1.0 23.36818 ? 89 THR A CA 1 65 . A ATOM 509 C C . THR A 1 65 ? -15.824 6.742 3.060 1.0 24.16753 ? 89 THR A C 1 65 . A ATOM 510 O O . THR A 1 65 ? -14.740 7.330 3.022 1.0 24.13459 ? 89 THR A O 1 65 . A ATOM 511 C CB . THR A 1 65 ? -17.466 8.639 3.064 1.0 21.82516 ? 89 THR A CB 1 65 . A ATOM 512 O OG1 . THR A 1 65 ? -18.552 9.222 3.792 1.0 26.1024 ? 89 THR A OG1 1 65 . A ATOM 513 C CG2 . THR A 1 65 ? -17.941 8.311 1.649 1.0 26.89889 ? 89 THR A CG2 1 65 . A ATOM 514 N N . GLU A 1 66 ? -16.015 5.531 2.525 1.0 20.2584 ? 90 GLU A N 1 66 . A ATOM 515 C CA . GLU A 1 66 ? -14.892 4.747 2.017 1.0 23.82388 ? 90 GLU A CA 1 66 . A ATOM 516 C C . GLU A 1 66 ? -15.281 4.140 0.677 1.0 22.70328 ? 90 GLU A C 1 66 . A ATOM 517 O O . GLU A 1 66 ? -16.446 3.795 0.453 1.0 22.99583 ? 90 GLU A O 1 66 . A ATOM 518 C CB . GLU A 1 66 ? -14.477 3.666 3.035 1.0 25.35713 ? 90 GLU A CB 1 66 . A ATOM 519 C CG . GLU A 1 66 ? -14.331 4.251 4.445 1.0 28.00925 ? 90 GLU A CG 1 66 . A ATOM 520 C CD . GLU A 1 66 ? -13.985 3.247 5.519 1.0 24.63626 ? 90 GLU A CD 1 66 . A ATOM 521 O OE1 . GLU A 1 66 ? -13.667 3.706 6.643 1.0 25.48762 ? 90 GLU A OE1 1 66 . A ATOM 522 O OE2 . GLU A 1 66 ? -14.039 2.020 5.259 1.0 24.48648 ? 90 GLU A OE2 1 66 . A ATOM 523 N N A VAL A 1 67 ? -14.303 4.027 -0.221 0.522 19.08511 ? 91 VAL A N 1 67 . A ATOM 524 N N B VAL A 1 67 ? -14.308 4.022 -0.222 0.478 19.261 ? 91 VAL A N 1 67 . A ATOM 525 C CA A VAL A 1 67 ? -14.533 3.553 -1.582 0.522 22.23239 ? 91 VAL A CA 1 67 . A ATOM 526 C CA B VAL A 1 67 ? -14.562 3.551 -1.578 0.478 22.08809 ? 91 VAL A CA 1 67 . A ATOM 527 C C A VAL A 1 67 ? -13.856 2.202 -1.762 0.522 22.3612 ? 91 VAL A C 1 67 . A ATOM 528 C C B VAL A 1 67 ? -13.853 2.219 -1.789 0.478 22.13225 ? 91 VAL A C 1 67 . A ATOM 529 O O A VAL A 1 67 ? -12.740 1.981 -1.275 0.522 20.72008 ? 91 VAL A O 1 67 . A ATOM 530 O O B VAL A 1 67 ? -12.719 2.023 -1.334 0.478 21.2745 ? 91 VAL A O 1 67 . A ATOM 531 C CB A VAL A 1 67 ? -14.026 4.574 -2.624 0.522 23.62668 ? 91 VAL A CB 1 67 . A ATOM 532 C CB B VAL A 1 67 ? -14.132 4.602 -2.627 0.478 23.64267 ? 91 VAL A CB 1 67 . A ATOM 533 C CG1 A VAL A 1 67 ? -13.988 3.961 -4.008 0.522 27.68998 ? 91 VAL A CG1 1 67 . A ATOM 534 C CG1 B VAL A 1 67 ? -12.657 4.944 -2.492 0.478 20.89905 ? 91 VAL A CG1 1 67 . A ATOM 535 C CG2 A VAL A 1 67 ? -14.918 5.798 -2.632 0.522 18.62308 ? 91 VAL A CG2 1 67 . A ATOM 536 C CG2 B VAL A 1 67 ? -14.464 4.131 -4.030 0.478 24.16111 ? 91 VAL A CG2 1 67 . A ATOM 537 N N . LEU A 1 68 ? -14.544 1.291 -2.448 1.0 21.8415 ? 92 LEU A N 1 68 . A ATOM 538 C CA . LEU A 1 68 ? -13.977 -0.009 -2.785 1.0 23.23205 ? 92 LEU A CA 1 68 . A ATOM 539 C C . LEU A 1 68 ? -13.048 0.169 -3.983 1.0 19.83419 ? 92 LEU A C 1 68 . A ATOM 540 O O . LEU A 1 68 ? -13.502 0.493 -5.088 1.0 24.91006 ? 92 LEU A O 1 68 . A ATOM 541 C CB . LEU A 1 68 ? -15.096 -1.000 -3.085 1.0 26.44999 ? 92 LEU A CB 1 68 . A ATOM 542 C CG . LEU A 1 68 ? -14.730 -2.459 -3.328 1.0 25.6234 ? 92 LEU A CG 1 68 . A ATOM 543 C CD1 . LEU A 1 68 ? -13.939 -2.966 -2.159 1.0 27.76312 ? 92 LEU A CD1 1 68 . A ATOM 544 C CD2 . LEU A 1 68 ? -15.991 -3.308 -3.532 1.0 25.56177 ? 92 LEU A CD2 1 68 . A ATOM 545 N N . GLU A 1 69 ? -11.740 -0.019 -3.772 1.0 21.39871 ? 93 GLU A N 1 69 . A ATOM 546 C CA . GLU A 1 69 ? -10.797 0.118 -4.881 1.0 22.73283 ? 93 GLU A CA 1 69 . A ATOM 547 C C . GLU A 1 69 ? -10.483 -1.213 -5.547 1.0 21.82522 ? 93 GLU A C 1 69 . A ATOM 548 O O . GLU A 1 69 ? -10.269 -1.267 -6.768 1.0 26.53966 ? 93 GLU A O 1 69 . A ATOM 549 C CB . GLU A 1 69 ? -9.493 0.756 -4.395 1.0 21.6195 ? 93 GLU A CB 1 69 . A ATOM 550 C CG . GLU A 1 69 ? -9.632 2.232 -4.059 1.0 25.2738 ? 93 GLU A CG 1 69 . A ATOM 551 C CD . GLU A 1 69 ? -8.290 2.917 -3.905 1.0 29.47825 ? 93 GLU A CD 1 69 . A ATOM 552 O OE1 . GLU A 1 69 ? -7.312 2.250 -3.485 1.0 27.529 ? 93 GLU A OE1 1 69 . A ATOM 553 O OE2 . GLU A 1 69 ? -8.214 4.123 -4.214 1.0 26.82034 ? 93 GLU A OE2 1 69 . A ATOM 554 N N . ILE A 1 70 ? -10.438 -2.284 -4.765 1.0 21.85837 ? 94 ILE A N 1 70 . A ATOM 555 C CA . ILE A 1 70 ? -10.106 -3.615 -5.270 1.0 24.98166 ? 94 ILE A CA 1 70 . A ATOM 556 C C . ILE A 1 70 ? -10.945 -4.641 -4.527 1.0 20.24309 ? 94 ILE A C 1 70 . A ATOM 557 O O . ILE A 1 70 ? -11.028 -4.609 -3.291 1.0 20.7078 ? 94 ILE A O 1 70 . A ATOM 558 C CB . ILE A 1 70 ? -8.607 -3.936 -5.103 1.0 25.97744 ? 94 ILE A CB 1 70 . A ATOM 559 C CG1 . ILE A 1 70 ? -7.750 -2.965 -5.904 1.0 29.67098 ? 94 ILE A CG1 1 70 . A ATOM 560 C CG2 . ILE A 1 70 ? -8.309 -5.366 -5.576 1.0 27.67716 ? 94 ILE A CG2 1 70 . A ATOM 561 C CD1 . ILE A 1 70 ? -6.292 -3.043 -5.556 1.0 32.11855 ? 94 ILE A CD1 1 70 . A ATOM 562 N N . LEU A 1 71 ? -11.580 -5.548 -5.275 1.0 27.05478 ? 95 LEU A N 1 71 . A ATOM 563 C CA . LEU A 1 71 ? -12.163 -6.763 -4.702 1.0 21.83074 ? 95 LEU A CA 1 71 . A ATOM 564 C C . LEU A 1 71 ? -11.847 -7.919 -5.648 1.0 29.0452 ? 95 LEU A C 1 71 . A ATOM 565 O O . LEU A 1 71 ? -12.491 -8.071 -6.688 1.0 33.11601 ? 95 LEU A O 1 71 . A ATOM 566 C CB . LEU A 1 71 ? -13.666 -6.621 -4.468 1.0 26.39253 ? 95 LEU A CB 1 71 . A ATOM 567 C CG . LEU A 1 71 ? -14.349 -7.821 -3.806 1.0 35.03262 ? 95 LEU A CG 1 71 . A ATOM 568 C CD1 . LEU A 1 71 ? -13.711 -8.152 -2.468 1.0 33.51543 ? 95 LEU A CD1 1 71 . A ATOM 569 C CD2 . LEU A 1 71 ? -15.838 -7.570 -3.634 1.0 44.30691 ? 95 LEU A CD2 1 71 . A ATOM 570 N N . ASP A 1 72 ? -10.841 -8.720 -5.289 1.0 27.54168 ? 96 ASP A N 1 72 . A ATOM 571 C CA . ASP A 1 72 ? -10.363 -9.850 -6.090 1.0 24.93422 ? 96 ASP A CA 1 72 . A ATOM 572 C C . ASP A 1 72 ? -10.746 -11.123 -5.345 1.0 24.52097 ? 96 ASP A C 1 72 . A ATOM 573 O O . ASP A 1 72 ? -10.110 -11.485 -4.350 1.0 23.69585 ? 96 ASP A O 1 72 . A ATOM 574 C CB . ASP A 1 72 ? -8.851 -9.752 -6.304 1.0 22.98383 ? 96 ASP A CB 1 72 . A ATOM 575 C CG . ASP A 1 72 ? -8.324 -10.769 -7.299 1.0 29.54698 ? 96 ASP A CG 1 72 . A ATOM 576 O OD1 . ASP A 1 72 ? -8.940 -11.838 -7.450 1.0 32.58268 ? 96 ASP A OD1 1 72 . A ATOM 577 O OD2 . ASP A 1 72 ? -7.276 -10.497 -7.932 1.0 31.83118 ? 96 ASP A OD2 1 72 . A ATOM 578 N N . ASP A 1 73 ? -11.805 -11.789 -5.809 1.0 24.58596 ? 97 ASP A N 1 73 . A ATOM 579 C CA . ASP A 1 73 ? -12.271 -13.001 -5.145 1.0 28.08507 ? 97 ASP A CA 1 73 . A ATOM 580 C C . ASP A 1 73 ? -11.437 -14.213 -5.511 1.0 30.02462 ? 97 ASP A C 1 73 . A ATOM 581 O O . ASP A 1 73 ? -11.633 -15.287 -4.920 1.0 31.0064 ? 97 ASP A O 1 73 . A ATOM 582 C CB . ASP A 1 73 ? -13.738 -13.279 -5.490 1.0 30.25051 ? 97 ASP A CB 1 73 . A ATOM 583 C CG . ASP A 1 73 ? -14.701 -12.530 -4.603 1.0 38.12974 ? 97 ASP A CG 1 73 . A ATOM 584 O OD1 . ASP A 1 73 ? -14.423 -12.392 -3.391 1.0 34.28099 ? 97 ASP A OD1 1 73 . A ATOM 585 O OD2 . ASP A 1 73 ? -15.752 -12.096 -5.120 1.0 37.60404 ? 97 ASP A OD2 1 73 . A ATOM 586 N N . ASN A 1 74 ? -10.544 -14.078 -6.491 1.0 27.68365 ? 98 ASN A N 1 74 . A ATOM 587 C CA . ASN A 1 74 ? -9.675 -15.178 -6.884 1.0 30.87619 ? 98 ASN A CA 1 74 . A ATOM 588 C C . ASN A 1 74 ? -8.384 -15.188 -6.087 1.0 34.56599 ? 98 ASN A C 1 74 . A ATOM 589 O O . ASN A 1 74 ? -7.954 -16.253 -5.630 1.0 30.14437 ? 98 ASN A O 1 74 . A ATOM 590 C CB . ASN A 1 74 ? -9.358 -15.101 -8.375 1.0 31.03394 ? 98 ASN A CB 1 74 . A ATOM 591 C CG . ASN A 1 74 ? -10.580 -15.310 -9.231 1.0 38.3168 ? 98 ASN A CG 1 74 . A ATOM 592 O OD1 . ASN A 1 74 ? -11.450 -16.108 -8.894 1.0 43.16564 ? 98 ASN A OD1 1 74 . A ATOM 593 N ND2 . ASN A 1 74 ? -10.662 -14.583 -10.337 1.0 47.51661 ? 98 ASN A ND2 1 74 . A ATOM 594 N N . GLU A 1 75 ? -7.761 -14.024 -5.902 1.0 29.21476 ? 99 GLU A N 1 75 . A ATOM 595 C CA . GLU A 1 75 ? -6.538 -13.937 -5.117 1.0 29.85674 ? 99 GLU A CA 1 75 . A ATOM 596 C C . GLU A 1 75 ? -6.766 -13.373 -3.719 1.0 23.74536 ? 99 GLU A C 1 75 . A ATOM 597 O O . GLU A 1 75 ? -5.804 -13.248 -2.959 1.0 27.32997 ? 99 GLU A O 1 75 . A ATOM 598 C CB . GLU A 1 75 ? -5.479 -13.108 -5.857 1.0 32.44465 ? 99 GLU A CB 1 75 . A ATOM 599 C CG . GLU A 1 75 ? -5.006 -13.700 -7.209 1.0 34.06907 ? 99 GLU A CG 1 75 . A ATOM 600 C CD . GLU A 1 75 ? -4.578 -15.163 -7.130 1.0 48.92203 ? 99 GLU A CD 1 75 . A ATOM 601 O OE1 . GLU A 1 75 ? -4.098 -15.617 -6.064 1.0 48.49628 ? 99 GLU A OE1 1 75 . A ATOM 602 O OE2 . GLU A 1 75 ? -4.729 -15.869 -8.149 1.0 46.73422 ? 99 GLU A OE2 1 75 . A ATOM 603 N N . HIS A 1 76 ? -8.011 -13.051 -3.358 1.0 24.63049 ? 100 HIS A N 1 76 . A ATOM 604 C CA . HIS A 1 76 ? -8.380 -12.686 -1.987 1.0 24.44445 ? 100 HIS A CA 1 76 . A ATOM 605 C C . HIS A 1 76 ? -7.692 -11.392 -1.555 1.0 21.67459 ? 100 HIS A C 1 76 . A ATOM 606 O O . HIS A 1 76 ? -6.970 -11.322 -0.556 1.0 22.63527 ? 100 HIS A O 1 76 . A ATOM 607 C CB . HIS A 1 76 ? -8.086 -13.853 -1.046 1.0 24.11867 ? 100 HIS A CB 1 76 . A ATOM 608 C CG . HIS A 1 76 ? -8.611 -15.148 -1.570 1.0 23.87485 ? 100 HIS A CG 1 76 . A ATOM 609 N ND1 . HIS A 1 76 ? -7.791 -16.141 -2.062 1.0 27.69528 ? 100 HIS A ND1 1 76 . A ATOM 610 C CD2 . HIS A 1 76 ? -9.880 -15.578 -1.763 1.0 27.09349 ? 100 HIS A CD2 1 76 . A ATOM 611 C CE1 . HIS A 1 76 ? -8.532 -17.148 -2.492 1.0 31.44045 ? 100 HIS A CE1 1 76 . A ATOM 612 N NE2 . HIS A 1 76 ? -9.803 -16.834 -2.319 1.0 26.45025 ? 100 HIS A NE2 1 76 . A ATOM 613 N N . ILE A 1 77 ? -7.958 -10.345 -2.335 1.0 21.28804 ? 101 ILE A N 1 77 . A ATOM 614 C CA . ILE A 1 77 ? -7.415 -9.016 -2.104 1.0 21.1175 ? 101 ILE A CA 1 77 . A ATOM 615 C C . ILE A 1 77 ? -8.584 -8.052 -1.966 1.0 22.27198 ? 101 ILE A C 1 77 . A ATOM 616 O O . ILE A 1 77 ? -9.481 -8.032 -2.821 1.0 22.33558 ? 101 ILE A O 1 77 . A ATOM 617 C CB . ILE A 1 77 ? -6.491 -8.564 -3.246 1.0 22.0453 ? 101 ILE A CB 1 77 . A ATOM 618 C CG1 . ILE A 1 77 ? -5.365 -9.580 -3.472 1.0 24.74816 ? 101 ILE A CG1 1 77 . A ATOM 619 C CG2 . ILE A 1 77 ? -5.941 -7.178 -2.933 1.0 22.54463 ? 101 ILE A CG2 1 77 . A ATOM 620 C CD1 . ILE A 1 77 ? -4.635 -9.414 -4.791 1.0 24.02372 ? 101 ILE A CD1 1 77 . A ATOM 621 N N . LEU A 1 78 ? -8.573 -7.268 -0.893 1.0 21.35228 ? 102 LEU A N 1 78 . A ATOM 622 C CA . LEU A 1 78 ? -9.532 -6.188 -0.685 1.0 20.5763 ? 102 LEU A CA 1 78 . A ATOM 623 C C . LEU A 1 78 ? -8.762 -4.888 -0.498 1.0 21.74676 ? 102 LEU A C 1 78 . A ATOM 624 O O . LEU A 1 78 ? -7.902 -4.796 0.385 1.0 23.25789 ? 102 LEU A O 1 78 . A ATOM 625 C CB . LEU A 1 78 ? -10.423 -6.456 0.531 1.0 20.94196 ? 102 LEU A CB 1 78 . A ATOM 626 C CG . LEU A 1 78 ? -11.367 -5.304 0.934 1.0 25.36003 ? 102 LEU A CG 1 78 . A ATOM 627 C CD1 . LEU A 1 78 ? -12.490 -5.195 -0.046 1.0 23.97663 ? 102 LEU A CD1 1 78 . A ATOM 628 C CD2 . LEU A 1 78 ? -11.948 -5.505 2.323 1.0 27.60697 ? 102 LEU A CD2 1 78 . A ATOM 629 N N . GLY A 1 79 ? -9.072 -3.887 -1.319 1.0 19.76368 ? 103 GLY A N 1 79 . A ATOM 630 C CA . GLY A 1 79 ? -8.441 -2.584 -1.172 1.0 19.3901 ? 103 GLY A CA 1 79 . A ATOM 631 C C . GLY A 1 79 ? -9.495 -1.506 -1.027 1.0 18.80949 ? 103 GLY A C 1 79 . A ATOM 632 O O . GLY A 1 79 ? -10.487 -1.520 -1.762 1.0 22.26726 ? 103 GLY A O 1 79 . A ATOM 633 N N . ILE A 1 80 ? -9.316 -0.588 -0.075 1.0 17.3807 ? 104 ILE A N 1 80 . A ATOM 634 C CA . ILE A 1 80 ? -10.283 0.480 0.175 1.0 17.00572 ? 104 ILE A CA 1 80 . A ATOM 635 C C . ILE A 1 80 ? -9.541 1.803 0.299 1.0 24.02369 ? 104 ILE A C 1 80 . A ATOM 636 O O . ILE A 1 80 ? -8.336 1.845 0.551 1.0 21.09628 ? 104 ILE A O 1 80 . A ATOM 637 C CB . ILE A 1 80 ? -11.139 0.225 1.441 1.0 25.17633 ? 104 ILE A CB 1 80 . A ATOM 638 C CG1 . ILE A 1 80 ? -10.285 0.287 2.711 1.0 28.07994 ? 104 ILE A CG1 1 80 . A ATOM 639 C CG2 . ILE A 1 80 ? -11.872 -1.119 1.347 1.0 24.97529 ? 104 ILE A CG2 1 80 . A ATOM 640 C CD1 . ILE A 1 80 ? -10.249 1.664 3.373 1.0 28.72815 ? 104 ILE A CD1 1 80 . A ATOM 641 N N . ARG A 1 81 ? -10.287 2.899 0.155 1.0 19.21166 ? 105 ARG A N 1 81 . A ATOM 642 C CA . ARG A 1 81 ? -9.731 4.223 0.402 1.0 16.58937 ? 105 ARG A CA 1 81 . A ATOM 643 C C . ARG A 1 81 ? -10.774 5.051 1.136 1.0 20.03958 ? 105 ARG A C 1 81 . A ATOM 644 O O . ARG A 1 81 ? -11.957 5.006 0.795 1.0 21.43113 ? 105 ARG A O 1 81 . A ATOM 645 C CB . ARG A 1 81 ? -9.317 4.908 -0.914 1.0 19.01742 ? 105 ARG A CB 1 81 . A ATOM 646 C CG . ARG A 1 81 ? -8.948 6.394 -0.783 1.0 21.54977 ? 105 ARG A CG 1 81 . A ATOM 647 C CD . ARG A 1 81 ? -8.513 6.987 -2.118 1.0 23.18145 ? 105 ARG A CD 1 81 . A ATOM 648 N NE . ARG A 1 81 ? -7.233 6.437 -2.562 1.0 26.36895 ? 105 ARG A NE 1 81 . A ATOM 649 C CZ . ARG A 1 81 ? -6.055 6.938 -2.203 1.0 24.94109 ? 105 ARG A CZ 1 81 . A ATOM 650 N NH1 . ARG A 1 81 ? -6.000 8.010 -1.412 1.0 23.37782 ? 105 ARG A NH1 1 81 . A ATOM 651 N NH2 . ARG A 1 81 ? -4.933 6.371 -2.629 1.0 23.28835 ? 105 ARG A NH2 1 81 . A ATOM 652 N N . ILE A 1 82 ? -10.350 5.774 2.162 1.0 20.79926 ? 106 ILE A N 1 82 . A ATOM 653 C CA . ILE A 1 82 ? -11.258 6.648 2.912 1.0 19.85314 ? 106 ILE A CA 1 82 . A ATOM 654 C C . ILE A 1 82 ? -11.310 7.994 2.207 1.0 23.13077 ? 106 ILE A C 1 82 . A ATOM 655 O O . ILE A 1 82 ? -10.259 8.577 1.915 1.0 22.85043 ? 106 ILE A O 1 82 . A ATOM 656 C CB . ILE A 1 82 ? -10.798 6.804 4.369 1.0 23.70859 ? 106 ILE A CB 1 82 . A ATOM 657 C CG1 . ILE A 1 82 ? -10.777 5.443 5.079 1.0 25.97547 ? 106 ILE A CG1 1 82 . A ATOM 658 C CG2 . ILE A 1 82 ? -11.703 7.789 5.125 1.0 24.66628 ? 106 ILE A CG2 1 82 . A ATOM 659 C CD1 . ILE A 1 82 ? -10.371 5.518 6.550 1.0 23.65669 ? 106 ILE A CD1 1 82 . A ATOM 660 N N . VAL A 1 83 ? -12.523 8.495 1.937 1.0 20.81315 ? 107 VAL A N 1 83 . A ATOM 661 C CA . VAL A 1 83 ? -12.714 9.712 1.153 1.0 20.37128 ? 107 VAL A CA 1 83 . A ATOM 662 C C . VAL A 1 83 ? -13.569 10.754 1.860 1.0 24.03115 ? 107 VAL A C 1 83 . A ATOM 663 O O . VAL A 1 83 ? -13.851 11.804 1.282 1.0 23.67532 ? 107 VAL A O 1 83 . A ATOM 664 C CB . VAL A 1 83 ? -13.316 9.406 -0.235 1.0 23.41911 ? 107 VAL A CB 1 83 . A ATOM 665 C CG1 . VAL A 1 83 ? -12.370 8.530 -1.061 1.0 22.30109 ? 107 VAL A CG1 1 83 . A ATOM 666 C CG2 . VAL A 1 83 ? -14.682 8.745 -0.087 1.0 22.11387 ? 107 VAL A CG2 1 83 . A ATOM 667 N N . GLY A 1 84 ? -13.988 10.506 3.092 1.0 27.62684 ? 108 GLY A N 1 84 . A ATOM 668 C CA . GLY A 1 84 ? -14.743 11.509 3.825 1.0 24.35457 ? 108 GLY A CA 1 84 . A ATOM 669 C C . GLY A 1 84 ? -14.964 11.019 5.238 1.0 24.37359 ? 108 GLY A C 1 84 . A ATOM 670 O O . GLY A 1 84 ? -14.559 9.910 5.602 1.0 22.40082 ? 108 GLY A O 1 84 . A ATOM 671 N N . GLY A 1 85 ? -15.627 11.864 6.033 1.0 23.72711 ? 109 GLY A N 1 85 . A ATOM 672 C CA . GLY A 1 85 ? -15.894 11.534 7.424 1.0 23.60536 ? 109 GLY A CA 1 85 . A ATOM 673 C C . GLY A 1 85 ? -15.398 12.603 8.377 1.0 27.64262 ? 109 GLY A C 1 85 . A ATOM 674 O O . GLY A 1 85 ? -14.590 13.451 7.988 1.0 28.20616 ? 109 GLY A O 1 85 . A ATOM 675 N N . ASP A 1 86 ? -15.861 12.586 9.624 1.0 25.52391 ? 110 ASP A N 1 86 . A ATOM 676 C CA . ASP A 1 86 ? -15.524 13.659 10.562 1.0 24.02864 ? 110 ASP A CA 1 86 . A ATOM 677 C C . ASP A 1 86 ? -14.365 13.263 11.469 1.0 23.77031 ? 110 ASP A C 1 86 . A ATOM 678 O O . ASP A 1 86 ? -14.378 13.472 12.677 1.0 31.14571 ? 110 ASP A O 1 86 . A ATOM 679 C CB . ASP A 1 86 ? -16.752 14.072 11.369 1.0 24.17081 ? 110 ASP A CB 1 86 . A ATOM 680 C CG . ASP A 1 86 ? -17.392 12.913 12.125 1.0 27.16575 ? 110 ASP A CG 1 86 . A ATOM 681 O OD1 . ASP A 1 86 ? -16.973 11.751 11.939 1.0 24.96929 ? 110 ASP A OD1 1 86 . A ATOM 682 O OD2 . ASP A 1 86 ? -18.321 13.179 12.921 1.0 27.6212 ? 110 ASP A OD2 1 86 . A ATOM 683 N N . HIS A 1 87 ? -13.336 12.702 10.850 1.0 27.02534 ? 111 HIS A N 1 87 . A ATOM 684 C CA . HIS A 1 87 ? -12.091 12.261 11.454 1.0 30.24863 ? 111 HIS A CA 1 87 . A ATOM 685 C C . HIS A 1 87 ? -10.943 13.016 10.788 1.0 28.17645 ? 111 HIS A C 1 87 . A ATOM 686 O O . HIS A 1 87 ? -11.156 13.845 9.895 1.0 29.17786 ? 111 HIS A O 1 87 . A ATOM 687 C CB . HIS A 1 87 ? -11.924 10.757 11.252 1.0 20.51448 ? 111 HIS A CB 1 87 . A ATOM 688 C CG . HIS A 1 87 ? -12.005 10.368 9.809 1.0 26.87713 ? 111 HIS A CG 1 87 . A ATOM 689 N ND1 . HIS A 1 87 ? -10.934 10.481 8.946 1.0 24.84475 ? 111 HIS A ND1 1 87 . A ATOM 690 C CD2 . HIS A 1 87 ? -13.049 9.946 9.060 1.0 24.66204 ? 111 HIS A CD2 1 87 . A ATOM 691 C CE1 . HIS A 1 87 ? -11.307 10.115 7.734 1.0 25.9643 ? 111 HIS A CE1 1 87 . A ATOM 692 N NE2 . HIS A 1 87 ? -12.585 9.775 7.778 1.0 26.18017 ? 111 HIS A NE2 1 87 . A ATOM 693 N N . ARG A 1 88 ? -9.714 12.704 11.199 1.0 26.68956 ? 112 ARG A N 1 88 . A ATOM 694 C CA . ARG A 1 88 ? -8.533 13.413 10.721 1.0 28.17831 ? 112 ARG A CA 1 88 . A ATOM 695 C C . ARG A 1 88 ? -7.611 12.542 9.880 1.0 32.94703 ? 112 ARG A C 1 88 . A ATOM 696 O O . ARG A 1 88 ? -6.435 12.878 9.722 1.0 36.13223 ? 112 ARG A O 1 88 . A ATOM 697 C CB . ARG A 1 88 ? -7.746 13.999 11.896 1.0 28.29903 ? 112 ARG A CB 1 88 . A ATOM 698 C CG . ARG A 1 88 ? -8.609 14.662 12.935 1.0 39.43824 ? 112 ARG A CG 1 88 . A ATOM 699 C CD . ARG A 1 88 ? -7.781 15.389 13.977 1.0 47.21646 ? 112 ARG A CD 1 88 . A ATOM 700 N NE . ARG A 1 88 ? -7.171 14.506 14.969 1.0 40.21845 ? 112 ARG A NE 1 88 . A ATOM 701 C CZ . ARG A 1 88 ? -5.861 14.337 15.102 1.0 32.38023 ? 112 ARG A CZ 1 88 . A ATOM 702 N NH1 . ARG A 1 88 ? -5.378 13.528 16.041 1.0 35.49963 ? 112 ARG A NH1 1 88 . A ATOM 703 N NH2 . ARG A 1 88 ? -5.036 14.986 14.298 1.0 33.29455 ? 112 ARG A NH2 1 88 . A ATOM 704 N N . LEU A 1 89 ? -8.099 11.420 9.351 1.0 24.30463 ? 113 LEU A N 1 89 . A ATOM 705 C CA . LEU A 1 89 ? -7.297 10.591 8.458 1.0 24.8495 ? 113 LEU A CA 1 89 . A ATOM 706 C C . LEU A 1 89 ? -7.509 11.087 7.033 1.0 38.70884 ? 113 LEU A C 1 89 . A ATOM 707 O O . LEU A 1 89 ? -8.611 10.975 6.487 1.0 36.4575 ? 113 LEU A O 1 89 . A ATOM 708 C CB . LEU A 1 89 ? -7.667 9.118 8.600 1.0 30.81724 ? 113 LEU A CB 1 89 . A ATOM 709 C CG . LEU A 1 89 ? -7.390 8.536 9.983 1.0 29.61263 ? 113 LEU A CG 1 89 . A ATOM 710 C CD1 . LEU A 1 89 ? -8.052 7.179 10.129 1.0 34.4262 ? 113 LEU A CD1 1 89 . A ATOM 711 C CD2 . LEU A 1 89 ? -5.890 8.433 10.228 1.0 29.70875 ? 113 LEU A CD2 1 89 . A ATOM 712 N N . LYS A 1 90 ? -6.462 11.651 6.438 1.0 25.51962 ? 114 LYS A N 1 90 . A ATOM 713 C CA . LYS A 1 90 ? -6.506 12.129 5.065 1.0 22.82832 ? 114 LYS A CA 1 90 . A ATOM 714 C C . LYS A 1 90 ? -5.687 11.212 4.173 1.0 22.21663 ? 114 LYS A C 1 90 . A ATOM 715 O O . LYS A 1 90 ? -4.579 10.800 4.539 1.0 25.06077 ? 114 LYS A O 1 90 . A ATOM 716 C CB . LYS A 1 90 ? -5.960 13.557 4.940 1.0 28.70726 ? 114 LYS A CB 1 90 . A ATOM 717 C CG . LYS A 1 90 ? -6.542 14.544 5.914 1.0 38.87079 ? 114 LYS A CG 1 90 . A ATOM 718 C CD . LYS A 1 90 ? -7.983 14.877 5.591 1.0 46.18206 ? 114 LYS A CD 1 90 . A ATOM 719 C CE . LYS A 1 90 ? -8.520 15.904 6.588 1.0 47.20998 ? 114 LYS A CE 1 90 . A ATOM 720 N NZ . LYS A 1 90 ? -9.962 16.189 6.377 1.0 41.70371 ? 114 LYS A NZ 1 90 . A ATOM 721 N N . ASN A 1 91 ? -6.227 10.931 2.988 1.0 21.85469 ? 115 ASN A N 1 91 . A ATOM 722 C CA . ASN A 1 91 ? -5.558 10.088 2.000 1.0 22.98351 ? 115 ASN A CA 1 91 . A ATOM 723 C C . ASN A 1 91 ? -5.190 8.736 2.591 1.0 27.36936 ? 115 ASN A C 1 91 . A ATOM 724 O O . ASN A 1 91 ? -4.088 8.224 2.363 1.0 24.99614 ? 115 ASN A O 1 91 . A ATOM 725 C CB . ASN A 1 91 ? -4.315 10.776 1.434 1.0 24.28903 ? 115 ASN A CB 1 91 . A ATOM 726 C CG . ASN A 1 91 ? -4.653 12.041 0.671 1.0 33.99171 ? 115 ASN A CG 1 91 . A ATOM 727 O OD1 . ASN A 1 91 ? -5.504 12.030 -0.214 1.0 36.67925 ? 115 ASN A OD1 1 91 . A ATOM 728 N ND2 . ASN A 1 91 ? -4.001 13.140 1.028 1.0 33.95488 ? 115 ASN A ND2 1 91 . A ATOM 729 N N . TYR A 1 92 ? -6.107 8.158 3.362 1.0 20.96479 ? 116 TYR A N 1 92 . A ATOM 730 C CA . TYR A 1 92 ? -5.910 6.809 3.888 1.0 18.15119 ? 116 TYR A CA 1 92 . A ATOM 731 C C . TYR A 1 92 ? -6.318 5.770 2.848 1.0 19.71733 ? 116 TYR A C 1 92 . A ATOM 732 O O . TYR A 1 92 ? -7.415 5.830 2.286 1.0 21.05852 ? 116 TYR A O 1 92 . A ATOM 733 C CB . TYR A 1 92 ? -6.722 6.586 5.170 1.0 17.08816 ? 116 TYR A CB 1 92 . A ATOM 734 C CG . TYR A 1 92 ? -6.482 5.214 5.773 1.0 22.22477 ? 116 TYR A CG 1 92 . A ATOM 735 C CD1 . TYR A 1 92 ? -7.200 4.101 5.339 1.0 20.54935 ? 116 TYR A CD1 1 92 . A ATOM 736 C CD2 . TYR A 1 92 ? -5.520 5.026 6.762 1.0 21.16406 ? 116 TYR A CD2 1 92 . A ATOM 737 C CE1 . TYR A 1 92 ? -6.972 2.845 5.877 1.0 22.62495 ? 116 TYR A CE1 1 92 . A ATOM 738 C CE2 . TYR A 1 92 ? -5.286 3.769 7.312 1.0 18.87819 ? 116 TYR A CE2 1 92 . A ATOM 739 C CZ . TYR A 1 92 ? -6.018 2.689 6.864 1.0 21.80524 ? 116 TYR A CZ 1 92 . A ATOM 740 O OH . TYR A 1 92 ? -5.790 1.431 7.394 1.0 21.81177 ? 116 TYR A OH 1 92 . A ATOM 741 N N . SER A 1 93 ? -5.448 4.793 2.606 1.0 17.80921 ? 117 SER A N 1 93 . A ATOM 742 C CA . SER A 1 93 ? -5.865 3.674 1.780 1.0 17.18594 ? 117 SER A CA 1 93 . A ATOM 743 C C . SER A 1 93 ? -5.181 2.426 2.306 1.0 23.00655 ? 117 SER A C 1 93 . A ATOM 744 O O . SER A 1 93 ? -4.126 2.505 2.945 1.0 19.32616 ? 117 SER A O 1 93 . A ATOM 745 C CB . SER A 1 93 ? -5.559 3.896 0.292 1.0 21.37652 ? 117 SER A CB 1 93 . A ATOM 746 O OG . SER A 1 93 ? -4.165 3.920 0.018 1.0 23.51094 ? 117 SER A OG 1 93 . A ATOM 747 N N . SER A 1 94 ? -5.804 1.272 2.061 1.0 18.32429 ? 118 SER A N 1 94 . A ATOM 748 C CA . SER A 1 94 ? -5.243 0.039 2.591 1.0 16.93388 ? 118 SER A CA 1 94 . A ATOM 749 C C . SER A 1 94 ? -5.562 -1.129 1.676 1.0 22.23302 ? 118 SER A C 1 94 . A ATOM 750 O O . SER A 1 94 ? -6.491 -1.091 0.866 1.0 20.48062 ? 118 SER A O 1 94 . A ATOM 751 C CB . SER A 1 94 ? -5.768 -0.258 3.996 1.0 22.99677 ? 118 SER A CB 1 94 . A ATOM 752 O OG . SER A 1 94 ? -7.149 -0.555 3.952 1.0 30.97557 ? 118 SER A OG 1 94 . A ATOM 753 N N . THR A 1 95 ? -4.763 -2.174 1.820 1.0 19.40053 ? 119 THR A N 1 95 . A ATOM 754 C CA . THR A 1 95 ? -4.963 -3.417 1.099 1.0 22.40417 ? 119 THR A CA 1 95 . A ATOM 755 C C . THR A 1 95 ? -4.796 -4.550 2.087 1.0 25.24327 ? 119 THR A C 1 95 . A ATOM 756 O O . THR A 1 95 ? -3.798 -4.590 2.812 1.0 22.94757 ? 119 THR A O 1 95 . A ATOM 757 C CB . THR A 1 95 ? -3.945 -3.581 -0.026 1.0 25.2328 ? 119 THR A CB 1 95 . A ATOM 758 O OG1 . THR A 1 95 ? -3.943 -2.405 -0.843 1.0 31.79865 ? 119 THR A OG1 1 95 . A ATOM 759 C CG2 . THR A 1 95 ? -4.302 -4.780 -0.869 1.0 26.35867 ? 119 THR A CG2 1 95 . A ATOM 760 N N . ILE A 1 96 ? -5.743 -5.482 2.106 1.0 21.87379 ? 120 ILE A N 1 96 . A ATOM 761 C CA . ILE A 1 96 ? -5.551 -6.716 2.851 1.0 19.74651 ? 120 ILE A CA 1 96 . A ATOM 762 C C . ILE A 1 96 ? -5.637 -7.872 1.868 1.0 22.26872 ? 120 ILE A C 1 96 . A ATOM 763 O O . ILE A 1 96 ? -6.505 -7.881 0.990 1.0 23.43165 ? 120 ILE A O 1 96 . A ATOM 764 C CB . ILE A 1 96 ? -6.561 -6.870 4.003 1.0 18.19792 ? 120 ILE A CB 1 96 . A ATOM 765 C CG1 . ILE A 1 96 ? -6.355 -8.219 4.711 1.0 17.52599 ? 120 ILE A CG1 1 96 . A ATOM 766 C CG2 . ILE A 1 96 ? -8.003 -6.711 3.522 1.0 20.0813 ? 120 ILE A CG2 1 96 . A ATOM 767 C CD1 . ILE A 1 96 ? -7.125 -8.312 6.033 1.0 21.79237 ? 120 ILE A CD1 1 96 . A ATOM 768 N N . SER A 1 97 ? -4.706 -8.820 1.983 1.0 20.97383 ? 121 SER A N 1 97 . A ATOM 769 C CA . SER A 1 97 ? -4.808 -10.062 1.234 1.0 21.16559 ? 121 SER A CA 1 97 . A ATOM 770 C C . SER A 1 97 ? -4.705 -11.242 2.193 1.0 23.94338 ? 121 SER A C 1 97 . A ATOM 771 O O . SER A 1 97 ? -4.124 -11.133 3.279 1.0 22.76615 ? 121 SER A O 1 97 . A ATOM 772 C CB . SER A 1 97 ? -3.732 -10.152 0.127 1.0 22.69101 ? 121 SER A CB 1 97 . A ATOM 773 O OG . SER A 1 97 ? -2.423 -10.095 0.654 1.0 23.64248 ? 121 SER A OG 1 97 . A ATOM 774 N N . LEU A 1 98 ? -5.304 -12.366 1.790 1.0 21.14292 ? 122 LEU A N 1 98 . A ATOM 775 C CA . LEU A 1 98 ? -5.330 -13.587 2.583 1.0 21.75636 ? 122 LEU A CA 1 98 . A ATOM 776 C C . LEU A 1 98 ? -4.687 -14.718 1.802 1.0 24.78293 ? 122 LEU A C 1 98 . A ATOM 777 O O . LEU A 1 98 ? -4.830 -14.808 0.580 1.0 27.38195 ? 122 LEU A O 1 98 . A ATOM 778 C CB . LEU A 1 98 ? -6.765 -14.011 2.944 1.0 22.55636 ? 122 LEU A CB 1 98 . A ATOM 779 C CG . LEU A 1 98 ? -7.651 -12.969 3.622 1.0 23.24301 ? 122 LEU A CG 1 98 . A ATOM 780 C CD1 . LEU A 1 98 ? -8.993 -13.599 3.988 1.0 24.33275 ? 122 LEU A CD1 1 98 . A ATOM 781 C CD2 . LEU A 1 98 ? -6.966 -12.402 4.846 1.0 23.55104 ? 122 LEU A CD2 1 98 . A ATOM 782 N N . HIS A 1 99 ? -4.014 -15.607 2.528 1.0 24.24424 ? 123 HIS A N 1 99 . A ATOM 783 C CA . HIS A 1 99 ? -3.261 -16.686 1.911 1.0 23.12163 ? 123 HIS A CA 1 99 . A ATOM 784 C C . HIS A 1 99 ? -3.310 -17.904 2.810 1.0 25.17327 ? 123 HIS A C 1 99 . A ATOM 785 O O . HIS A 1 99 ? -3.190 -17.787 4.033 1.0 29.18819 ? 123 HIS A O 1 99 . A ATOM 786 C CB . HIS A 1 99 ? -1.811 -16.264 1.664 1.0 27.27733 ? 123 HIS A CB 1 99 . A ATOM 787 C CG . HIS A 1 99 ? -1.699 -14.937 0.991 1.0 31.5925 ? 123 HIS A CG 1 99 . A ATOM 788 N ND1 . HIS A 1 99 ? -1.683 -14.799 -0.380 1.0 32.18027 ? 123 HIS A ND1 1 99 . A ATOM 789 C CD2 . HIS A 1 99 ? -1.651 -13.682 1.498 1.0 31.76615 ? 123 HIS A CD2 1 99 . A ATOM 790 C CE1 . HIS A 1 99 ? -1.610 -13.516 -0.688 1.0 33.98739 ? 123 HIS A CE1 1 99 . A ATOM 791 N NE2 . HIS A 1 99 ? -1.589 -12.817 0.432 1.0 31.43893 ? 123 HIS A NE2 1 99 . A ATOM 792 N N . SER A 1 100 ? -3.503 -19.066 2.195 1.0 30.09325 ? 124 SER A N 1 100 . A ATOM 793 C CA . SER A 1 100 ? -3.502 -20.311 2.941 1.0 32.25755 ? 124 SER A CA 1 100 . A ATOM 794 C C . SER A 1 100 ? -2.104 -20.618 3.455 1.0 34.74595 ? 124 SER A C 1 100 . A ATOM 795 O O . SER A 1 100 ? -1.095 -20.283 2.826 1.0 33.92529 ? 124 SER A O 1 100 . A ATOM 796 C CB . SER A 1 100 ? -3.993 -21.463 2.063 1.0 40.30602 ? 124 SER A CB 1 100 . A ATOM 797 O OG . SER A 1 100 ? -5.312 -21.228 1.611 1.0 40.98747 ? 124 SER A OG 1 100 . A ATOM 798 N N . GLU A 1 101 ? -2.050 -21.262 4.616 1.0 37.59171 ? 125 GLU A N 1 101 . A ATOM 799 C CA . GLU A 1 101 ? -0.781 -21.657 5.209 1.0 39.45206 ? 125 GLU A CA 1 101 . A ATOM 800 C C . GLU A 1 101 ? -1.042 -22.804 6.169 1.0 37.29727 ? 125 GLU A C 1 101 . A ATOM 801 O O . GLU A 1 101 ? -2.190 -23.143 6.466 1.0 39.14314 ? 125 GLU A O 1 101 . A ATOM 802 C CB . GLU A 1 101 ? -0.103 -20.489 5.929 1.0 38.52563 ? 125 GLU A CB 1 101 . A ATOM 803 C CG . GLU A 1 101 ? -0.936 -19.894 7.049 1.0 34.50814 ? 125 GLU A CG 1 101 . A ATOM 804 C CD . GLU A 1 101 ? -0.144 -18.941 7.912 1.0 39.01343 ? 125 GLU A CD 1 101 . A ATOM 805 O OE1 . GLU A 1 101 ? 1.061 -18.750 7.635 1.0 39.96239 ? 125 GLU A OE1 1 101 . A ATOM 806 O OE2 . GLU A 1 101 ? -0.715 -18.389 8.873 1.0 37.82719 ? 125 GLU A OE2 1 101 . A ATOM 807 N N . THR A 1 102 ? 0.045 -23.399 6.651 1.0 40.07854 ? 126 THR A N 1 102 . A ATOM 808 C CA . THR A 1 102 ? -0.010 -24.529 7.574 1.0 38.94833 ? 126 THR A CA 1 102 . A ATOM 809 C C . THR A 1 102 ? 0.831 -24.176 8.793 1.0 52.04066 ? 126 THR A C 1 102 . A ATOM 810 O O . THR A 1 102 ? 2.051 -24.022 8.681 1.0 54.49783 ? 126 THR A O 1 102 . A ATOM 811 C CB . THR A 1 102 ? 0.501 -25.812 6.909 1.0 42.66735 ? 126 THR A CB 1 102 . A ATOM 812 O OG1 . THR A 1 102 ? -0.339 -26.149 5.797 1.0 47.60781 ? 126 THR A OG1 1 102 . A ATOM 813 C CG2 . THR A 1 102 ? 0.504 -26.967 7.899 1.0 45.47407 ? 126 THR A CG2 1 102 . A ATOM 814 N N . ILE A 1 103 ? 0.189 -24.039 9.953 1.0 49.70222 ? 127 ILE A N 1 103 . A ATOM 815 C CA . ILE A 1 103 ? 0.894 -23.825 11.213 1.0 57.09851 ? 127 ILE A CA 1 103 . A ATOM 816 C C . ILE A 1 103 ? 0.490 -24.921 12.190 1.0 57.37741 ? 127 ILE A C 1 103 . A ATOM 817 O O . ILE A 1 103 ? -0.700 -25.225 12.337 1.0 54.36004 ? 127 ILE A O 1 103 . A ATOM 818 C CB . ILE A 1 103 ? 0.627 -22.428 11.806 1.0 59.24958 ? 127 ILE A CB 1 103 . A ATOM 819 C CG1 . ILE A 1 103 ? -0.870 -22.183 12.017 1.0 58.06177 ? 127 ILE A CG1 1 103 . A ATOM 820 C CG2 . ILE A 1 103 ? 1.246 -21.349 10.921 1.0 59.81794 ? 127 ILE A CG2 1 103 . A ATOM 821 C CD1 . ILE A 1 103 ? -1.167 -21.030 12.965 1.0 62.0163 ? 127 ILE A CD1 1 103 . A ATOM 822 N N . ASP A 1 104 ? 1.489 -25.512 12.852 1.0 62.87669 ? 128 ASP A N 1 104 . A ATOM 823 C CA . ASP A 1 104 ? 1.292 -26.643 13.760 1.0 61.9573 ? 128 ASP A CA 1 104 . A ATOM 824 C C . ASP A 1 104 ? 0.541 -27.781 13.071 1.0 55.7297 ? 128 ASP A C 1 104 . A ATOM 825 O O . ASP A 1 104 ? -0.336 -28.422 13.656 1.0 53.59362 ? 128 ASP A O 1 104 . A ATOM 826 C CB . ASP A 1 104 ? 0.576 -26.210 15.041 1.0 67.64159 ? 128 ASP A CB 1 104 . A ATOM 827 C CG . ASP A 1 104 ? 1.265 -25.046 15.730 1.0 74.43512 ? 128 ASP A CG 1 104 . A ATOM 828 O OD1 . ASP A 1 104 ? 0.613 -23.999 15.913 1.0 75.51066 ? 128 ASP A OD1 1 104 . A ATOM 829 O OD2 . ASP A 1 104 ? 2.461 -25.170 16.073 1.0 79.33152 ? 128 ASP A OD2 1 104 . A ATOM 830 N N . GLY A 1 105 ? 0.885 -28.027 11.806 1.0 49.93169 ? 129 GLY A N 1 105 . A ATOM 831 C CA . GLY A 1 105 ? 0.303 -29.120 11.053 1.0 48.55918 ? 129 GLY A CA 1 105 . A ATOM 832 C C . GLY A 1 105 ? -1.143 -28.944 10.649 1.0 43.4058 ? 129 GLY A C 1 105 . A ATOM 833 O O . GLY A 1 105 ? -1.720 -29.870 10.066 1.0 48.76088 ? 129 GLY A O 1 105 . A ATOM 834 N N . LYS A 1 106 ? -1.745 -27.790 10.925 1.0 50.00721 ? 130 LYS A N 1 106 . A ATOM 835 C CA . LYS A 1 106 ? -3.143 -27.538 10.623 1.0 43.79878 ? 130 LYS A CA 1 106 . A ATOM 836 C C . LYS A 1 106 ? -3.271 -26.375 9.647 1.0 38.2744 ? 130 LYS A C 1 106 . A ATOM 837 O O . LYS A 1 106 ? -2.454 -25.447 9.642 1.0 37.86692 ? 130 LYS A O 1 106 . A ATOM 838 C CB . LYS A 1 106 ? -3.942 -27.251 11.905 1.0 44.92365 ? 130 LYS A CB 1 106 . A ATOM 839 C CG . LYS A 1 106 ? -3.956 -28.412 12.893 1.0 54.42476 ? 130 LYS A CG 1 106 . A ATOM 840 C CD . LYS A 1 106 ? -4.824 -28.109 14.101 1.0 60.82938 ? 130 LYS A CD 1 106 . A ATOM 841 C CE . LYS A 1 106 ? -4.796 -29.251 15.102 1.0 72.34309 ? 130 LYS A CE 1 106 . A ATOM 842 N NZ . LYS A 1 106 ? -5.656 -28.967 16.285 1.0 76.77069 ? 130 LYS A NZ 1 106 . A ATOM 843 N N . THR A 1 107 ? -4.301 -26.442 8.811 1.0 40.81766 ? 131 THR A N 1 107 . A ATOM 844 C CA . THR A 1 107 ? -4.535 -25.397 7.828 1.0 46.61754 ? 131 THR A CA 1 107 . A ATOM 845 C C . THR A 1 107 ? -5.004 -24.117 8.510 1.0 43.4023 ? 131 THR A C 1 107 . A ATOM 846 O O . THR A 1 107 ? -5.862 -24.146 9.400 1.0 42.24486 ? 131 THR A O 1 107 . A ATOM 847 C CB . THR A 1 107 ? -5.563 -25.862 6.798 1.0 60.0354 ? 131 THR A CB 1 107 . A ATOM 848 O OG1 . THR A 1 107 ? -4.912 -26.678 5.815 1.0 72.0903 ? 131 THR A OG1 1 107 . A ATOM 849 C CG2 . THR A 1 107 ? -6.230 -24.670 6.111 1.0 49.39556 ? 131 THR A CG2 1 107 . A ATOM 850 N N . GLY A 1 108 ? -4.419 -22.996 8.103 1.0 32.16622 ? 132 GLY A N 1 108 . A ATOM 851 C CA . GLY A 1 108 ? -4.829 -21.698 8.588 1.0 29.66818 ? 132 GLY A CA 1 108 . A ATOM 852 C C . GLY A 1 108 ? -4.755 -20.647 7.500 1.0 28.26547 ? 132 GLY A C 1 108 . A ATOM 853 O O . GLY A 1 108 ? -4.622 -20.975 6.317 1.0 29.66329 ? 132 GLY A O 1 108 . A ATOM 854 N N . THR A 1 109 ? -4.818 -19.379 7.895 1.0 24.80136 ? 133 THR A N 1 109 . A ATOM 855 C CA . THR A 1 109 ? -4.856 -18.258 6.966 1.0 23.08185 ? 133 THR A CA 1 109 . A ATOM 856 C C . THR A 1 109 ? -3.882 -17.193 7.424 1.0 26.55827 ? 133 THR A C 1 109 . A ATOM 857 O O . THR A 1 109 ? -3.886 -16.803 8.597 1.0 32.02683 ? 133 THR A O 1 109 . A ATOM 858 C CB . THR A 1 109 ? -6.259 -17.653 6.887 1.0 23.07271 ? 133 THR A CB 1 109 . A ATOM 859 O OG1 . THR A 1 109 ? -7.155 -18.641 6.392 1.0 23.92405 ? 133 THR A OG1 1 109 . A ATOM 860 C CG2 . THR A 1 109 ? -6.294 -16.464 5.951 1.0 23.72741 ? 133 THR A CG2 1 109 . A ATOM 861 N N . LEU A 1 110 ? -3.063 -16.728 6.492 1.0 23.79689 ? 134 LEU A N 1 110 . A ATOM 862 C CA . LEU A 1 110 ? -2.234 -15.551 6.690 1.0 24.2935 ? 134 LEU A CA 1 110 . A ATOM 863 C C . LEU A 1 110 ? -2.973 -14.334 6.156 1.0 24.94264 ? 134 LEU A C 1 110 . A ATOM 864 O O . LEU A 1 110 ? -3.388 -14.319 4.994 1.0 28.49488 ? 134 LEU A O 1 110 . A ATOM 865 C CB . LEU A 1 110 ? -0.907 -15.724 5.964 1.0 25.93152 ? 134 LEU A CB 1 110 . A ATOM 866 C CG . LEU A 1 110 ? -0.045 -14.468 5.899 1.0 27.83204 ? 134 LEU A CG 1 110 . A ATOM 867 C CD1 . LEU A 1 110 ? 0.342 -14.089 7.300 1.0 27.44822 ? 134 LEU A CD1 1 110 . A ATOM 868 C CD2 . LEU A 1 110 ? 1.177 -14.755 5.057 1.0 34.49932 ? 134 LEU A CD2 1 110 . A ATOM 869 N N . ALA A 1 111 ? -3.137 -13.319 6.999 1.0 25.75353 ? 135 ALA A N 1 111 . A ATOM 870 C CA . ALA A 1 111 ? -3.640 -12.023 6.568 1.0 22.31602 ? 135 ALA A CA 1 111 . A ATOM 871 C C . ALA A 1 111 ? -2.478 -11.043 6.530 1.0 21.3729 ? 135 ALA A C 1 111 . A ATOM 872 O O . ALA A 1 111 ? -1.686 -10.976 7.480 1.0 24.31778 ? 135 ALA A O 1 111 . A ATOM 873 C CB . ALA A 1 111 ? -4.745 -11.515 7.499 1.0 22.52251 ? 135 ALA A CB 1 111 . A ATOM 874 N N . ILE A 1 112 ? -2.352 -10.317 5.423 1.0 18.78223 ? 136 ILE A N 1 112 . A ATOM 875 C CA . ILE A 1 112 ? -1.352 -9.256 5.276 1.0 18.86199 ? 136 ILE A CA 1 112 . A ATOM 876 C C . ILE A 1 112 ? -2.122 -7.985 4.970 1.0 22.35082 ? 136 ILE A C 1 112 . A ATOM 877 O O . ILE A 1 112 ? -2.843 -7.929 3.967 1.0 21.62483 ? 136 ILE A O 1 112 . A ATOM 878 C CB . ILE A 1 112 ? -0.344 -9.544 4.152 1.0 19.86747 ? 136 ILE A CB 1 112 . A ATOM 879 C CG1 . ILE A 1 112 ? 0.444 -10.832 4.409 1.0 26.5118 ? 136 ILE A CG1 1 112 . A ATOM 880 C CG2 . ILE A 1 112 ? 0.607 -8.379 3.991 1.0 21.55169 ? 136 ILE A CG2 1 112 . A ATOM 881 C CD1 . ILE A 1 112 ? 1.413 -11.180 3.282 1.0 33.3914 ? 136 ILE A CD1 1 112 . A ATOM 882 N N . GLU A 1 113 ? -1.975 -6.968 5.816 1.0 21.88793 ? 137 GLU A N 1 113 . A ATOM 883 C CA . GLU A 1 113 ? -2.708 -5.717 5.632 1.0 20.68626 ? 137 GLU A CA 1 113 . A ATOM 884 C C . GLU A 1 113 ? -1.724 -4.553 5.643 1.0 22.83133 ? 137 GLU A C 1 113 . A ATOM 885 O O . GLU A 1 113 ? -0.951 -4.394 6.597 1.0 20.45117 ? 137 GLU A O 1 113 . A ATOM 886 C CB . GLU A 1 113 ? -3.791 -5.549 6.708 1.0 18.102 ? 137 GLU A CB 1 113 . A ATOM 887 C CG . GLU A 1 113 ? -4.569 -4.242 6.575 1.0 18.52929 ? 137 GLU A CG 1 113 . A ATOM 888 C CD . GLU A 1 113 ? -5.914 -4.261 7.315 1.0 25.70783 ? 137 GLU A CD 1 113 . A ATOM 889 O OE1 . GLU A 1 113 ? -6.265 -5.297 7.902 1.0 28.68571 ? 137 GLU A OE1 1 113 . A ATOM 890 O OE2 . GLU A 1 113 ? -6.619 -3.224 7.297 1.0 26.32032 ? 137 GLU A OE2 1 113 . A ATOM 891 N N . SER A 1 114 ? -1.739 -3.754 4.574 1.0 22.2905 ? 138 SER A N 1 114 . A ATOM 892 C CA . SER A 1 114 ? -0.836 -2.622 4.393 1.0 19.42216 ? 138 SER A CA 1 114 . A ATOM 893 C C . SER A 1 114 ? -1.648 -1.343 4.248 1.0 20.85392 ? 138 SER A C 1 114 . A ATOM 894 O O . SER A 1 114 ? -2.744 -1.352 3.684 1.0 23.36772 ? 138 SER A O 1 114 . A ATOM 895 C CB . SER A 1 114 ? 0.039 -2.803 3.152 1.0 23.22572 ? 138 SER A CB 1 114 . A ATOM 896 O OG . SER A 1 114 ? 0.777 -4.013 3.227 1.0 25.7863 ? 138 SER A OG 1 114 . A ATOM 897 N N . PHE A 1 115 ? -1.113 -0.236 4.755 1.0 18.75562 ? 139 PHE A N 1 115 . A ATOM 898 C CA . PHE A 1 115 ? -1.803 1.036 4.615 1.0 18.33478 ? 139 PHE A CA 1 115 . A ATOM 899 C C . PHE A 1 115 ? -0.813 2.140 4.272 1.0 20.94269 ? 139 PHE A C 1 115 . A ATOM 900 O O . PHE A 1 115 ? 0.398 2.009 4.462 1.0 19.58357 ? 139 PHE A O 1 115 . A ATOM 901 C CB . PHE A 1 115 ? -2.549 1.419 5.897 1.0 18.87425 ? 139 PHE A CB 1 115 . A ATOM 902 C CG . PHE A 1 115 ? -1.632 1.746 7.048 1.0 21.63525 ? 139 PHE A CG 1 115 . A ATOM 903 C CD1 . PHE A 1 115 ? -1.204 3.052 7.276 1.0 22.42996 ? 139 PHE A CD1 1 115 . A ATOM 904 C CD2 . PHE A 1 115 ? -1.189 0.751 7.895 1.0 22.8675 ? 139 PHE A CD2 1 115 . A ATOM 905 C CE1 . PHE A 1 115 ? -0.356 3.347 8.326 1.0 25.91172 ? 139 PHE A CE1 1 115 . A ATOM 906 C CE2 . PHE A 1 115 ? -0.353 1.038 8.952 1.0 27.67856 ? 139 PHE A CE2 1 115 . A ATOM 907 C CZ . PHE A 1 115 ? 0.077 2.343 9.165 1.0 26.00175 ? 139 PHE A CZ 1 115 . A ATOM 908 N N . VAL A 1 116 ? -1.362 3.244 3.773 1.0 19.61934 ? 140 VAL A N 1 116 . A ATOM 909 C CA . VAL A 1 116 ? -0.633 4.497 3.580 1.0 18.2656 ? 140 VAL A CA 1 116 . A ATOM 910 C C . VAL A 1 116 ? -1.586 5.607 4.002 1.0 22.84016 ? 140 VAL A C 1 116 . A ATOM 911 O O . VAL A 1 116 ? -2.761 5.585 3.625 1.0 19.36439 ? 140 VAL A O 1 116 . A ATOM 912 C CB . VAL A 1 116 ? -0.179 4.700 2.117 1.0 19.61127 ? 140 VAL A CB 1 116 . A ATOM 913 C CG1 . VAL A 1 116 ? 0.519 6.051 1.954 1.0 22.24096 ? 140 VAL A CG1 1 116 . A ATOM 914 C CG2 . VAL A 1 116 ? 0.734 3.553 1.653 1.0 20.71034 ? 140 VAL A CG2 1 116 . A ATOM 915 N N . VAL A 1 117 ? -1.104 6.557 4.803 1.0 21.78238 ? 141 VAL A N 1 117 . A ATOM 916 C CA . VAL A 1 117 ? -1.948 7.648 5.276 1.0 21.98879 ? 141 VAL A CA 1 117 . A ATOM 917 C C . VAL A 1 117 ? -1.080 8.882 5.445 1.0 23.35056 ? 141 VAL A C 1 117 . A ATOM 918 O O . VAL A 1 117 ? 0.120 8.786 5.718 1.0 21.77879 ? 141 VAL A O 1 117 . A ATOM 919 C CB . VAL A 1 117 ? -2.677 7.285 6.594 1.0 18.77485 ? 141 VAL A CB 1 117 . A ATOM 920 C CG1 . VAL A 1 117 ? -1.690 7.129 7.755 1.0 20.36765 ? 141 VAL A CG1 1 117 . A ATOM 921 C CG2 . VAL A 1 117 ? -3.770 8.306 6.923 1.0 20.6108 ? 141 VAL A CG2 1 117 . A ATOM 922 N N . ASP A 1 118 ? -1.691 10.051 5.272 1.0 21.83441 ? 142 ASP A N 1 118 . A ATOM 923 C CA . ASP A 1 118 ? -0.987 11.291 5.562 1.0 22.07769 ? 142 ASP A CA 1 118 . A ATOM 924 C C . ASP A 1 118 ? -0.831 11.482 7.066 1.0 21.33169 ? 142 ASP A C 1 118 . A ATOM 925 O O . ASP A 1 118 ? -1.701 11.106 7.858 1.0 23.07754 ? 142 ASP A O 1 118 . A ATOM 926 C CB . ASP A 1 118 ? -1.745 12.495 5.011 1.0 25.28831 ? 142 ASP A CB 1 118 . A ATOM 927 C CG . ASP A 1 118 ? -1.682 12.608 3.505 1.0 29.93232 ? 142 ASP A CG 1 118 . A ATOM 928 O OD1 . ASP A 1 118 ? -0.989 11.803 2.842 1.0 26.33607 ? 142 ASP A OD1 1 118 . A ATOM 929 O OD2 . ASP A 1 118 ? -2.348 13.535 2.989 1.0 35.12461 ? 142 ASP A OD2 1 118 . A ATOM 930 N N . VAL A 1 119 ? 0.276 12.104 7.454 1.0 24.87517 ? 143 VAL A N 1 119 . A ATOM 931 C CA . VAL A 1 119 ? 0.475 12.539 8.835 1.0 22.9765 ? 143 VAL A CA 1 119 . A ATOM 932 C C . VAL A 1 119 ? -0.318 13.828 9.027 1.0 27.83165 ? 143 VAL A C 1 119 . A ATOM 933 O O . VAL A 1 119 ? -0.018 14.838 8.371 1.0 27.9909 ? 143 VAL A O 1 119 . A ATOM 934 C CB . VAL A 1 119 ? 1.964 12.749 9.146 1.0 26.29349 ? 143 VAL A CB 1 119 . A ATOM 935 C CG1 . VAL A 1 119 ? 2.142 13.266 10.562 1.0 26.55795 ? 143 VAL A CG1 1 119 . A ATOM 936 C CG2 . VAL A 1 119 ? 2.735 11.440 8.953 1.0 26.75183 ? 143 VAL A CG2 1 119 . A ATOM 937 N N . PRO A 1 120 ? -1.324 13.846 9.897 1.0 28.56963 ? 144 PRO A N 1 120 . A ATOM 938 C CA . PRO A 1 120 ? -2.161 15.039 10.037 1.0 33.21464 ? 144 PRO A CA 1 120 . A ATOM 939 C C . PRO A 1 120 ? -1.470 16.131 10.829 1.0 31.27223 ? 144 PRO A C 1 120 . A ATOM 940 O O . PRO A 1 120 ? -0.612 15.877 11.675 1.0 31.38582 ? 144 PRO A O 1 120 . A ATOM 941 C CB . PRO A 1 120 ? -3.394 14.515 10.785 1.0 34.97856 ? 144 PRO A CB 1 120 . A ATOM 942 C CG . PRO A 1 120 ? -2.886 13.360 11.576 1.0 29.73058 ? 144 PRO A CG 1 120 . A ATOM 943 C CD . PRO A 1 120 ? -1.798 12.733 10.738 1.0 24.66742 ? 144 PRO A CD 1 120 . A ATOM 944 N N . GLU A 1 121 ? -1.857 17.370 10.532 1.0 38.35827 ? 145 GLU A N 1 121 . A ATOM 945 C CA . GLU A 1 121 ? -1.336 18.510 11.273 1.0 46.00013 ? 145 GLU A CA 1 121 . A ATOM 946 C C . GLU A 1 121 ? -1.547 18.302 12.767 1.0 38.12695 ? 145 GLU A C 1 121 . A ATOM 947 O O . GLU A 1 121 ? -2.642 17.934 13.208 1.0 39.28637 ? 145 GLU A O 1 121 . A ATOM 948 C CB . GLU A 1 121 ? -2.022 19.799 10.811 1.0 58.10542 ? 145 GLU A CB 1 121 . A ATOM 949 C CG . GLU A 1 121 ? -1.662 21.035 11.629 1.0 69.29488 ? 145 GLU A CG 1 121 . A ATOM 950 C CD . GLU A 1 121 ? -0.357 21.679 11.188 1.0 81.43022 ? 145 GLU A CD 1 121 . A ATOM 951 O OE1 . GLU A 1 121 ? -0.376 22.877 10.831 1.0 85.50049 ? 145 GLU A OE1 1 121 . A ATOM 952 O OE2 . GLU A 1 121 ? 0.686 20.990 11.192 1.0 83.80809 ? 145 GLU A OE2 1 121 . A ATOM 953 N N . GLY A 1 122 ? -0.482 18.508 13.540 1.0 33.87375 ? 146 GLY A N 1 122 . A ATOM 954 C CA . GLY A 1 122 ? -0.521 18.384 14.982 1.0 38.5857 ? 146 GLY A CA 1 122 . A ATOM 955 C C . GLY A 1 122 ? -0.034 17.057 15.521 1.0 44.74924 ? 146 GLY A C 1 122 . A ATOM 956 O O . GLY A 1 122 ? 0.097 16.915 16.743 1.0 40.32223 ? 146 GLY A O 1 122 . A ATOM 957 N N . ASN A 1 123 ? 0.229 16.082 14.656 1.0 34.18036 ? 147 ASN A N 1 123 . A ATOM 958 C CA . ASN A 1 123 ? 0.741 14.790 15.076 1.0 34.62151 ? 147 ASN A CA 1 123 . A ATOM 959 C C . ASN A 1 123 ? 2.069 14.516 14.384 1.0 33.01237 ? 147 ASN A C 1 123 . A ATOM 960 O O . ASN A 1 123 ? 2.347 15.051 13.305 1.0 29.05487 ? 147 ASN A O 1 123 . A ATOM 961 C CB . ASN A 1 123 ? -0.263 13.673 14.771 1.0 28.91248 ? 147 ASN A CB 1 123 . A ATOM 962 C CG . ASN A 1 123 ? -1.399 13.623 15.796 1.0 33.07074 ? 147 ASN A CG 1 123 . A ATOM 963 O OD1 . ASN A 1 123 ? -2.540 13.993 15.505 1.0 37.4086 ? 147 ASN A OD1 1 123 . A ATOM 964 N ND2 . ASN A 1 123 ? -1.080 13.178 17.006 1.0 33.03983 ? 147 ASN A ND2 1 123 . A ATOM 965 N N . THR A 1 124 ? 2.902 13.713 15.040 1.0 27.61952 ? 148 THR A N 1 124 . A ATOM 966 C CA . THR A 1 124 ? 4.140 13.236 14.446 1.0 27.84739 ? 148 THR A CA 1 124 . A ATOM 967 C C . THR A 1 124 ? 3.866 12.012 13.578 1.0 26.76343 ? 148 THR A C 1 124 . A ATOM 968 O O . THR A 1 124 ? 2.838 11.334 13.713 1.0 22.43527 ? 148 THR A O 1 124 . A ATOM 969 C CB . THR A 1 124 ? 5.161 12.873 15.523 1.0 28.09944 ? 148 THR A CB 1 124 . A ATOM 970 O OG1 . THR A 1 124 ? 4.703 11.715 16.230 1.0 26.78979 ? 148 THR A OG1 1 124 . A ATOM 971 C CG2 . THR A 1 124 ? 5.341 14.016 16.509 1.0 34.4289 ? 148 THR A CG2 1 124 . A ATOM 972 N N . LYS A 1 125 ? 4.802 11.738 12.667 1.0 25.85043 ? 149 LYS A N 1 125 . A ATOM 973 C CA . LYS A 1 125 ? 4.711 10.506 11.894 1.0 25.74011 ? 149 LYS A CA 1 125 . A ATOM 974 C C . LYS A 1 125 ? 4.669 9.296 12.820 1.0 23.41045 ? 149 LYS A C 1 125 . A ATOM 975 O O . LYS A 1 125 ? 3.896 8.358 12.597 1.0 21.20659 ? 149 LYS A O 1 125 . A ATOM 976 C CB . LYS A 1 125 ? 5.889 10.396 10.909 1.0 20.43182 ? 149 LYS A CB 1 125 . A ATOM 977 C CG . LYS A 1 125 ? 5.807 9.155 10.020 1.0 22.1041 ? 149 LYS A CG 1 125 . A ATOM 978 C CD . LYS A 1 125 ? 7.090 8.917 9.211 1.0 26.50497 ? 149 LYS A CD 1 125 . A ATOM 979 C CE . LYS A 1 125 ? 7.366 10.022 8.212 1.0 36.15951 ? 149 LYS A CE 1 125 . A ATOM 980 N NZ . LYS A 1 125 ? 8.566 9.703 7.369 1.0 34.54764 ? 149 LYS A NZ 1 125 . A ATOM 981 N N . GLU A 1 126 ? 5.484 9.303 13.877 1.0 23.25576 ? 150 GLU A N 1 126 . A ATOM 982 C CA . GLU A 1 126 ? 5.498 8.162 14.792 1.0 23.68031 ? 150 GLU A CA 1 126 . A ATOM 983 C C . GLU A 1 126 ? 4.138 7.955 15.445 1.0 21.42079 ? 150 GLU A C 1 126 . A ATOM 984 O O . GLU A 1 126 ? 3.675 6.815 15.593 1.0 22.02163 ? 150 GLU A O 1 126 . A ATOM 985 C CB . GLU A 1 126 ? 6.560 8.351 15.869 1.0 27.19105 ? 150 GLU A CB 1 126 . A ATOM 986 C CG . GLU A 1 126 ? 6.574 7.210 16.889 1.0 33.36709 ? 150 GLU A CG 1 126 . A ATOM 987 C CD . GLU A 1 126 ? 7.591 7.404 17.984 1.0 34.42259 ? 150 GLU A CD 1 126 . A ATOM 988 O OE1 . GLU A 1 126 ? 7.769 8.550 18.437 1.0 33.91551 ? 150 GLU A OE1 1 126 . A ATOM 989 O OE2 . GLU A 1 126 ? 8.203 6.398 18.400 1.0 42.96949 ? 150 GLU A OE2 1 126 . A ATOM 990 N N . GLU A 1 127 ? 3.501 9.046 15.874 1.0 22.03438 ? 151 GLU A N 1 127 . A ATOM 991 C CA . GLU A 1 127 ? 2.172 8.948 16.476 1.0 24.28728 ? 151 GLU A CA 1 127 . A ATOM 992 C C . GLU A 1 127 ? 1.160 8.405 15.483 1.0 22.11424 ? 151 GLU A C 1 127 . A ATOM 993 O O . GLU A 1 127 ? 0.254 7.645 15.855 1.0 22.61923 ? 151 GLU A O 1 127 . A ATOM 994 C CB . GLU A 1 127 ? 1.731 10.317 16.972 1.0 24.206 ? 151 GLU A CB 1 127 . A ATOM 995 C CG . GLU A 1 127 ? 2.419 10.755 18.248 1.0 30.0279 ? 151 GLU A CG 1 127 . A ATOM 996 C CD . GLU A 1 127 ? 2.346 12.252 18.478 1.0 36.94654 ? 151 GLU A CD 1 127 . A ATOM 997 O OE1 . GLU A 1 127 ? 2.903 12.704 19.496 1.0 32.99055 ? 151 GLU A OE1 1 127 . A ATOM 998 O OE2 . GLU A 1 127 ? 1.749 12.977 17.649 1.0 31.34521 ? 151 GLU A OE2 1 127 . A ATOM 999 N N . THR A 1 128 ? 1.273 8.827 14.223 1.0 19.99265 ? 152 THR A N 1 128 . A ATOM 1000 C CA . THR A 1 128 ? 0.326 8.410 13.201 1.0 19.89742 ? 152 THR A CA 1 128 . A ATOM 1001 C C . THR A 1 128 ? 0.468 6.917 12.914 1.0 19.97274 ? 152 THR A C 1 128 . A ATOM 1002 O O . THR A 1 128 ? -0.529 6.192 12.835 1.0 21.34316 ? 152 THR A O 1 128 . A ATOM 1003 C CB . THR A 1 128 ? 0.543 9.241 11.933 1.0 23.84906 ? 152 THR A CB 1 128 . A ATOM 1004 O OG1 . THR A 1 128 ? 0.429 10.633 12.250 1.0 24.88777 ? 152 THR A OG1 1 128 . A ATOM 1005 C CG2 . THR A 1 128 ? -0.486 8.911 10.866 1.0 20.71865 ? 152 THR A CG2 1 128 . A ATOM 1006 N N . CYS A 1 129 ? 1.705 6.447 12.737 1.0 21.91704 ? 153 CYS A N 1 129 . A ATOM 1007 C CA . CYS A 1 129 ? 1.939 5.013 12.564 1.0 21.23744 ? 153 CYS A CA 1 129 . A ATOM 1008 C C . CYS A 1 129 ? 1.394 4.222 13.741 1.0 26.37065 ? 153 CYS A C 1 129 . A ATOM 1009 O O . CYS A 1 129 ? 0.759 3.178 13.563 1.0 25.93622 ? 153 CYS A O 1 129 . A ATOM 1010 C CB . CYS A 1 129 ? 3.436 4.726 12.408 1.0 21.99714 ? 153 CYS A CB 1 129 . A ATOM 1011 S SG . CYS A 1 129 ? 4.270 5.394 10.957 1.0 25.24269 ? 153 CYS A SG 1 129 . A ATOM 1012 N N . PHE A 1 130 ? 1.668 4.684 14.960 1.0 20.33771 ? 154 PHE A N 1 130 . A ATOM 1013 C CA . PHE A 1 130 ? 1.231 3.952 16.140 1.0 17.41796 ? 154 PHE A CA 1 130 . A ATOM 1014 C C . PHE A 1 130 ? -0.291 3.872 16.214 1.0 28.30202 ? 154 PHE A C 1 130 . A ATOM 1015 O O . PHE A 1 130 ? -0.844 2.810 16.516 1.0 28.39752 ? 154 PHE A O 1 130 . A ATOM 1016 C CB . PHE A 1 130 ? 1.787 4.615 17.401 1.0 21.20706 ? 154 PHE A CB 1 130 . A ATOM 1017 C CG . PHE A 1 130 ? 1.696 3.748 18.627 1.0 26.73887 ? 154 PHE A CG 1 130 . A ATOM 1018 C CD1 . PHE A 1 130 ? 2.750 2.931 18.995 1.0 36.25919 ? 154 PHE A CD1 1 130 . A ATOM 1019 C CD2 . PHE A 1 130 ? 0.552 3.741 19.408 1.0 34.26561 ? 154 PHE A CD2 1 130 . A ATOM 1020 C CE1 . PHE A 1 130 ? 2.674 2.126 20.120 1.0 38.80138 ? 154 PHE A CE1 1 130 . A ATOM 1021 C CE2 . PHE A 1 130 ? 0.468 2.932 20.532 1.0 37.2194 ? 154 PHE A CE2 1 130 . A ATOM 1022 C CZ . PHE A 1 130 ? 1.532 2.124 20.885 1.0 29.39305 ? 154 PHE A CZ 1 130 . A ATOM 1023 N N . PHE A 1 131 ? -0.973 4.994 15.958 1.0 22.45763 ? 155 PHE A N 1 131 . A ATOM 1024 C CA . PHE A 1 131 ? -2.435 5.036 15.959 1.0 23.058 ? 155 PHE A CA 1 131 . A ATOM 1025 C C . PHE A 1 131 ? -3.023 4.029 14.973 1.0 26.17405 ? 155 PHE A C 1 131 . A ATOM 1026 O O . PHE A 1 131 ? -3.859 3.198 15.344 1.0 24.31079 ? 155 PHE A O 1 131 . A ATOM 1027 C CB . PHE A 1 131 ? -2.898 6.461 15.639 1.0 25.69018 ? 155 PHE A CB 1 131 . A ATOM 1028 C CG . PHE A 1 131 ? -4.390 6.623 15.528 1.0 29.51678 ? 155 PHE A CG 1 131 . A ATOM 1029 C CD1 . PHE A 1 131 ? -5.173 6.747 16.666 1.0 41.06963 ? 155 PHE A CD1 1 131 . A ATOM 1030 C CD2 . PHE A 1 131 ? -5.003 6.690 14.286 1.0 27.60121 ? 155 PHE A CD2 1 131 . A ATOM 1031 C CE1 . PHE A 1 131 ? -6.549 6.908 16.572 1.0 35.87424 ? 155 PHE A CE1 1 131 . A ATOM 1032 C CE2 . PHE A 1 131 ? -6.383 6.853 14.185 1.0 27.21441 ? 155 PHE A CE2 1 131 . A ATOM 1033 C CZ . PHE A 1 131 ? -7.150 6.962 15.333 1.0 27.44622 ? 155 PHE A CZ 1 131 . A ATOM 1034 N N . VAL A 1 132 ? -2.582 4.069 13.711 1.0 23.0586 ? 156 VAL A N 1 132 . A ATOM 1035 C CA . VAL A 1 132 ? -3.179 3.191 12.715 1.0 20.09253 ? 156 VAL A CA 1 132 . A ATOM 1036 C C . VAL A 1 132 ? -2.788 1.744 12.984 1.0 25.34022 ? 156 VAL A C 1 132 . A ATOM 1037 O O . VAL A 1 132 ? -3.621 0.836 12.894 1.0 21.18433 ? 156 VAL A O 1 132 . A ATOM 1038 C CB . VAL A 1 132 ? -2.787 3.631 11.293 1.0 20.28328 ? 156 VAL A CB 1 132 . A ATOM 1039 C CG1 . VAL A 1 132 ? -3.359 2.660 10.258 1.0 19.97046 ? 156 VAL A CG1 1 132 . A ATOM 1040 C CG2 . VAL A 1 132 ? -3.244 5.054 11.018 1.0 22.0599 ? 156 VAL A CG2 1 132 . A ATOM 1041 N N . GLU A 1 133 ? -1.523 1.508 13.339 1.0 21.65013 ? 157 GLU A N 1 133 . A ATOM 1042 C CA . GLU A 1 133 ? -1.073 0.138 13.563 1.0 22.8982 ? 157 GLU A CA 1 133 . A ATOM 1043 C C . GLU A 1 133 ? -1.819 -0.505 14.729 1.0 24.12479 ? 157 GLU A C 1 133 . A ATOM 1044 O O . GLU A 1 133 ? -2.181 -1.688 14.668 1.0 23.44176 ? 157 GLU A O 1 133 . A ATOM 1045 C CB . GLU A 1 133 ? 0.440 0.114 13.790 1.0 21.43821 ? 157 GLU A CB 1 133 . A ATOM 1046 C CG . GLU A 1 133 ? 1.241 0.382 12.518 1.0 21.54354 ? 157 GLU A CG 1 133 . A ATOM 1047 C CD . GLU A 1 133 ? 2.741 0.547 12.751 1.0 34.78251 ? 157 GLU A CD 1 133 . A ATOM 1048 O OE1 . GLU A 1 133 ? 3.237 0.314 13.872 1.0 35.28546 ? 157 GLU A OE1 1 133 . A ATOM 1049 O OE2 . GLU A 1 133 ? 3.430 0.926 11.797 1.0 29.99701 ? 157 GLU A OE2 1 133 . A ATOM 1050 N N . ALA A 1 134 ? -2.056 0.248 15.805 1.0 25.55192 ? 158 ALA A N 1 134 . A ATOM 1051 C CA . ALA A 1 134 ? -2.768 -0.332 16.939 1.0 23.35253 ? 158 ALA A CA 1 134 . A ATOM 1052 C C . ALA A 1 134 ? -4.189 -0.726 16.553 1.0 24.30473 ? 158 ALA A C 1 134 . A ATOM 1053 O O . ALA A 1 134 ? -4.698 -1.764 16.999 1.0 26.89704 ? 158 ALA A O 1 134 . A ATOM 1054 C CB . ALA A 1 134 ? -2.787 0.649 18.112 1.0 24.4774 ? 158 ALA A CB 1 134 . A ATOM 1055 N N . LEU A 1 135 ? -4.840 0.083 15.712 1.0 23.07137 ? 159 LEU A N 1 135 . A ATOM 1056 C CA . LEU A 1 135 ? -6.216 -0.202 15.314 1.0 23.66186 ? 159 LEU A CA 1 135 . A ATOM 1057 C C . LEU A 1 135 ? -6.286 -1.355 14.327 1.0 25.23732 ? 159 LEU A C 1 135 . A ATOM 1058 O O . LEU A 1 135 ? -7.183 -2.200 14.426 1.0 24.41623 ? 159 LEU A O 1 135 . A ATOM 1059 C CB . LEU A 1 135 ? -6.867 1.047 14.721 1.0 20.60302 ? 159 LEU A CB 1 135 . A ATOM 1060 C CG . LEU A 1 135 ? -7.135 2.137 15.764 1.0 28.98414 ? 159 LEU A CG 1 135 . A ATOM 1061 C CD1 . LEU A 1 135 ? -7.554 3.432 15.089 1.0 28.69526 ? 159 LEU A CD1 1 135 . A ATOM 1062 C CD2 . LEU A 1 135 ? -8.186 1.675 16.775 1.0 30.01164 ? 159 LEU A CD2 1 135 . A ATOM 1063 N N . ILE A 1 136 ? -5.358 -1.414 13.368 1.0 23.66655 ? 160 ILE A N 1 136 . A ATOM 1064 C CA . ILE A 1 136 ? -5.343 -2.554 12.457 1.0 23.72864 ? 160 ILE A CA 1 136 . A ATOM 1065 C C . ILE A 1 136 ? -5.033 -3.832 13.223 1.0 25.27784 ? 160 ILE A C 1 136 . A ATOM 1066 O O . ILE A 1 136 ? -5.653 -4.878 12.988 1.0 25.57424 ? 160 ILE A O 1 136 . A ATOM 1067 C CB . ILE A 1 136 ? -4.355 -2.325 11.299 1.0 27.71813 ? 160 ILE A CB 1 136 . A ATOM 1068 C CG1 . ILE A 1 136 ? -4.809 -1.134 10.454 1.0 23.67563 ? 160 ILE A CG1 1 136 . A ATOM 1069 C CG2 . ILE A 1 136 ? -4.265 -3.593 10.429 1.0 24.22992 ? 160 ILE A CG2 1 136 . A ATOM 1070 C CD1 . ILE A 1 136 ? -3.929 -0.903 9.244 1.0 20.69127 ? 160 ILE A CD1 1 136 . A ATOM 1071 N N . GLN A 1 137 ? -4.080 -3.771 14.166 1.0 24.47576 ? 161 GLN A N 1 137 . A ATOM 1072 C CA . GLN A 1 137 ? -3.813 -4.945 14.997 1.0 29.12899 ? 161 GLN A CA 1 137 . A ATOM 1073 C C . GLN A 1 137 ? -5.061 -5.371 15.769 1.0 26.25044 ? 161 GLN A C 1 137 . A ATOM 1074 O O . GLN A 1 137 ? -5.359 -6.567 15.881 1.0 27.83484 ? 161 GLN A O 1 137 . A ATOM 1075 C CB . GLN A 1 137 ? -2.659 -4.671 15.960 1.0 26.46267 ? 161 GLN A CB 1 137 . A ATOM 1076 C CG . GLN A 1 137 ? -2.207 -5.913 16.709 1.0 33.72101 ? 161 GLN A CG 1 137 . A ATOM 1077 C CD . GLN A 1 137 ? -1.497 -6.901 15.802 1.0 45.10258 ? 161 GLN A CD 1 137 . A ATOM 1078 O OE1 . GLN A 1 137 ? -0.504 -6.555 15.160 1.0 45.20522 ? 161 GLN A OE1 1 137 . A ATOM 1079 N NE2 . GLN A 1 137 ? -2.011 -8.137 15.735 1.0 33.19397 ? 161 GLN A NE2 1 137 . A ATOM 1080 N N . CYS A 1 138 ? -5.808 -4.406 16.300 1.0 25.37892 ? 162 CYS A N 1 138 . A ATOM 1081 C CA . CYS A 1 138 ? -7.052 -4.740 16.982 1.0 27.04921 ? 162 CYS A CA 1 138 . A ATOM 1082 C C . CYS A 1 138 ? -8.030 -5.434 16.036 1.0 26.40332 ? 162 CYS A C 1 138 . A ATOM 1083 O O . CYS A 1 138 ? -8.664 -6.436 16.407 1.0 25.70665 ? 162 CYS A O 1 138 . A ATOM 1084 C CB . CYS A 1 138 ? -7.652 -3.467 17.575 1.0 29.37178 ? 162 CYS A CB 1 138 . A ATOM 1085 S SG . CYS A 1 138 ? -9.299 -3.631 18.215 1.0 33.55261 ? 162 CYS A SG 1 138 . A ATOM 1086 N N . ASN A 1 139 ? -8.150 -4.929 14.803 1.0 24.26939 ? 163 ASN A N 1 139 . A ATOM 1087 C CA . ASN A 1 139 ? -9.047 -5.532 13.818 1.0 24.65788 ? 163 ASN A CA 1 139 . A ATOM 1088 C C . ASN A 1 139 ? -8.582 -6.930 13.410 1.0 29.64733 ? 163 ASN A C 1 139 . A ATOM 1089 O O . ASN A 1 139 ? -9.397 -7.850 13.295 1.0 27.01741 ? 163 ASN A O 1 139 . A ATOM 1090 C CB . ASN A 1 139 ? -9.158 -4.635 12.580 1.0 20.23873 ? 163 ASN A CB 1 139 . A ATOM 1091 C CG . ASN A 1 139 ? -9.936 -3.357 12.847 1.0 23.93572 ? 163 ASN A CG 1 139 . A ATOM 1092 O OD1 . ASN A 1 139 ? -10.751 -3.292 13.765 1.0 26.70428 ? 163 ASN A OD1 1 139 . A ATOM 1093 N ND2 . ASN A 1 139 ? -9.681 -2.331 12.039 1.0 22.89219 ? 163 ASN A ND2 1 139 . A ATOM 1094 N N . LEU A 1 140 ? -7.282 -7.112 13.171 1.0 21.52698 ? 164 LEU A N 1 140 . A ATOM 1095 C CA . LEU A 1 140 ? -6.792 -8.440 12.796 1.0 20.60621 ? 164 LEU A CA 1 140 . A ATOM 1096 C C . LEU A 1 140 ? -6.935 -9.426 13.950 1.0 24.73798 ? 164 LEU A C 1 140 . A ATOM 1097 O O . LEU A 1 140 ? -7.275 -10.596 13.735 1.0 25.98669 ? 164 LEU A O 1 140 . A ATOM 1098 C CB . LEU A 1 140 ? -5.333 -8.355 12.334 1.0 23.26351 ? 164 LEU A CB 1 140 . A ATOM 1099 C CG . LEU A 1 140 ? -5.097 -7.573 11.034 1.0 24.8947 ? 164 LEU A CG 1 140 . A ATOM 1100 C CD1 . LEU A 1 140 ? -3.608 -7.473 10.713 1.0 28.22675 ? 164 LEU A CD1 1 140 . A ATOM 1101 C CD2 . LEU A 1 140 ? -5.841 -8.201 9.872 1.0 29.79214 ? 164 LEU A CD2 1 140 . A ATOM 1102 N N . ASN A 1 141 ? -6.680 -8.979 15.183 1.0 25.54943 ? 165 ASN A N 1 141 . A ATOM 1103 C CA . ASN A 1 141 ? -6.942 -9.837 16.337 1.0 22.70577 ? 165 ASN A CA 1 141 . A ATOM 1104 C C . ASN A 1 141 ? -8.413 -10.220 16.406 1.0 24.58422 ? 165 ASN A C 1 141 . A ATOM 1105 O O . ASN A 1 141 ? -8.760 -11.361 16.738 1.0 23.84772 ? 165 ASN A O 1 141 . A ATOM 1106 C CB . ASN A 1 141 ? -6.530 -9.136 17.631 1.0 27.97209 ? 165 ASN A CB 1 141 . A ATOM 1107 C CG . ASN A 1 141 ? -5.032 -8.985 17.768 1.0 34.06019 ? 165 ASN A CG 1 141 . A ATOM 1108 O OD1 . ASN A 1 141 ? -4.266 -9.624 17.049 1.0 32.92377 ? 165 ASN A OD1 1 141 . A ATOM 1109 N ND2 . ASN A 1 141 ? -4.603 -8.135 18.709 1.0 32.14724 ? 165 ASN A ND2 1 141 . A ATOM 1110 N N . SER A 1 142 ? -9.296 -9.269 16.120 1.0 22.74309 ? 166 SER A N 1 142 . A ATOM 1111 C CA . SER A 1 142 ? -10.719 -9.556 16.197 1.0 24.7344 ? 166 SER A CA 1 142 . A ATOM 1112 C C . SER A 1 142 ? -11.146 -10.483 15.065 1.0 25.03342 ? 166 SER A C 1 142 . A ATOM 1113 O O . SER A 1 142 ? -11.959 -11.396 15.273 1.0 25.97286 ? 166 SER A O 1 142 . A ATOM 1114 C CB . SER A 1 142 ? -11.510 -8.255 16.169 1.0 24.33081 ? 166 SER A CB 1 142 . A ATOM 1115 O OG . SER A 1 142 ? -12.903 -8.523 16.172 1.0 27.8949 ? 166 SER A OG 1 142 . A ATOM 1116 N N . LEU A 1 143 ? -10.597 -10.274 13.865 1.0 21.89458 ? 167 LEU A N 1 143 . A ATOM 1117 C CA . LEU A 1 143 ? -10.885 -11.186 12.759 1.0 22.41155 ? 167 LEU A CA 1 143 . A ATOM 1118 C C . LEU A 1 143 ? -10.480 -12.615 13.103 1.0 25.50548 ? 167 LEU A C 1 143 . A ATOM 1119 O O . LEU A 1 143 ? -11.210 -13.567 12.796 1.0 23.48289 ? 167 LEU A O 1 143 . A ATOM 1120 C CB . LEU A 1 143 ? -10.168 -10.736 11.492 1.0 20.65245 ? 167 LEU A CB 1 143 . A ATOM 1121 C CG . LEU A 1 143 ? -10.334 -11.612 10.245 1.0 22.80641 ? 167 LEU A CG 1 143 . A ATOM 1122 C CD1 . LEU A 1 143 ? -11.763 -11.594 9.709 1.0 20.64655 ? 167 LEU A CD1 1 143 . A ATOM 1123 C CD2 . LEU A 1 143 ? -9.344 -11.140 9.185 1.0 23.36365 ? 167 LEU A CD2 1 143 . A ATOM 1124 N N . ALA A 1 144 ? -9.310 -12.788 13.727 1.0 25.22499 ? 168 ALA A N 1 144 . A ATOM 1125 C CA . ALA A 1 144 ? -8.902 -14.123 14.153 1.0 22.9209 ? 168 ALA A CA 1 144 . A ATOM 1126 C C . ALA A 1 144 ? -9.874 -14.682 15.177 1.0 25.87205 ? 168 ALA A C 1 144 . A ATOM 1127 O O . ALA A 1 144 ? -10.269 -15.848 15.088 1.0 27.73872 ? 168 ALA A O 1 144 . A ATOM 1128 C CB . ALA A 1 144 ? -7.482 -14.099 14.721 1.0 23.99661 ? 168 ALA A CB 1 144 . A ATOM 1129 N N . ASP A 1 145 ? -10.283 -13.865 16.158 1.0 26.89988 ? 169 ASP A N 1 145 . A ATOM 1130 C CA . ASP A 1 145 ? -11.216 -14.345 17.178 1.0 31.98879 ? 169 ASP A CA 1 145 . A ATOM 1131 C C . ASP A 1 145 ? -12.549 -14.753 16.560 1.0 25.65743 ? 169 ASP A C 1 145 . A ATOM 1132 O O . ASP A 1 145 ? -13.110 -15.803 16.904 1.0 30.51216 ? 169 ASP A O 1 145 . A ATOM 1133 C CB . ASP A 1 145 ? -11.434 -13.273 18.252 1.0 28.76646 ? 169 ASP A CB 1 145 . A ATOM 1134 C CG . ASP A 1 145 ? -10.221 -13.087 19.160 1.0 42.48046 ? 169 ASP A CG 1 145 . A ATOM 1135 O OD1 . ASP A 1 145 ? -9.362 -13.996 19.228 1.0 50.21161 ? 169 ASP A OD1 1 145 . A ATOM 1136 O OD2 . ASP A 1 145 ? -10.135 -12.031 19.823 1.0 48.03325 ? 169 ASP A OD2 1 145 . A ATOM 1137 N N . VAL A 1 146 ? -13.068 -13.941 15.642 1.0 22.70591 ? 170 VAL A N 1 146 . A ATOM 1138 C CA . VAL A 1 146 ? -14.371 -14.213 15.048 1.0 27.71209 ? 170 VAL A CA 1 146 . A ATOM 1139 C C . VAL A 1 146 ? -14.312 -15.475 14.201 1.0 31.44134 ? 170 VAL A C 1 146 . A ATOM 1140 O O . VAL A 1 146 ? -15.183 -16.346 14.299 1.0 28.0056 ? 170 VAL A O 1 146 . A ATOM 1141 C CB . VAL A 1 146 ? -14.849 -13.006 14.219 1.0 27.9298 ? 170 VAL A CB 1 146 . A ATOM 1142 C CG1 . VAL A 1 146 ? -16.042 -13.385 13.370 1.0 28.02461 ? 170 VAL A CG1 1 146 . A ATOM 1143 C CG2 . VAL A 1 146 ? -15.176 -11.837 15.117 1.0 26.47865 ? 170 VAL A CG2 1 146 . A ATOM 1144 N N . THR A 1 147 ? -13.286 -15.596 13.357 1.0 25.75384 ? 171 THR A N 1 147 . A ATOM 1145 C CA . THR A 1 147 ? -13.255 -16.735 12.447 1.0 25.42095 ? 171 THR A CA 1 147 . A ATOM 1146 C C . THR A 1 147 ? -12.821 -18.016 13.149 1.0 25.87568 ? 171 THR A C 1 147 . A ATOM 1147 O O . THR A 1 147 ? -13.306 -19.095 12.800 1.0 27.91992 ? 171 THR A O 1 147 . A ATOM 1148 C CB . THR A 1 147 ? -12.365 -16.438 11.235 1.0 26.69035 ? 171 THR A CB 1 147 . A ATOM 1149 O OG1 . THR A 1 147 ? -11.024 -16.103 11.643 1.0 23.89962 ? 171 THR A OG1 1 147 . A ATOM 1150 C CG2 . THR A 1 147 ? -12.954 -15.278 10.450 1.0 25.46893 ? 171 THR A CG2 1 147 . A ATOM 1151 N N . GLU A 1 148 ? -11.938 -17.928 14.144 1.0 23.86818 ? 172 GLU A N 1 148 . A ATOM 1152 C CA . GLU A 1 148 ? -11.586 -19.136 14.874 1.0 26.5969 ? 172 GLU A CA 1 148 . A ATOM 1153 C C . GLU A 1 148 ? -12.770 -19.639 15.683 1.0 26.73805 ? 172 GLU A C 1 148 . A ATOM 1154 O O . GLU A 1 148 ? -12.925 -20.854 15.868 1.0 27.06187 ? 172 GLU A O 1 148 . A ATOM 1155 C CB . GLU A 1 148 ? -10.361 -18.886 15.758 1.0 28.60682 ? 172 GLU A CB 1 148 . A ATOM 1156 C CG . GLU A 1 148 ? -9.092 -18.686 14.926 1.0 26.17281 ? 172 GLU A CG 1 148 . A ATOM 1157 C CD . GLU A 1 148 ? -7.921 -18.122 15.710 1.0 33.75605 ? 172 GLU A CD 1 148 . A ATOM 1158 O OE1 . GLU A 1 148 ? -6.878 -17.841 15.070 1.0 27.6522 ? 172 GLU A OE1 1 148 . A ATOM 1159 O OE2 . GLU A 1 148 ? -8.034 -17.976 16.949 1.0 30.89557 ? 172 GLU A OE2 1 148 . A ATOM 1160 N N . ARG A 1 149 ? -13.631 -18.727 16.140 1.0 25.95675 ? 173 ARG A N 1 149 . A ATOM 1161 C CA . ARG A 1 149 ? -14.831 -19.157 16.844 1.0 28.118 ? 173 ARG A CA 1 149 . A ATOM 1162 C C . ARG A 1 149 ? -15.826 -19.787 15.878 1.0 25.34047 ? 173 ARG A C 1 149 . A ATOM 1163 O O . ARG A 1 149 ? -16.427 -20.821 16.187 1.0 26.18293 ? 173 ARG A O 1 149 . A ATOM 1164 C CB . ARG A 1 149 ? -15.467 -17.986 17.592 1.0 24.65785 ? 173 ARG A CB 1 149 . A ATOM 1165 C CG . ARG A 1 149 ? -16.818 -18.358 18.205 1.0 28.03952 ? 173 ARG A CG 1 149 . A ATOM 1166 C CD . ARG A 1 149 ? -17.388 -17.238 19.039 1.0 35.71515 ? 173 ARG A CD 1 149 . A ATOM 1167 N NE . ARG A 1 149 ? -17.154 -15.945 18.412 1.0 56.26169 ? 173 ARG A NE 1 149 . A ATOM 1168 C CZ . ARG A 1 149 ? -17.947 -15.408 17.491 1.0 64.26637 ? 173 ARG A CZ 1 149 . A ATOM 1169 N NH1 . ARG A 1 149 ? -19.033 -16.055 17.089 1.0 66.97792 ? 173 ARG A NH1 1 149 . A ATOM 1170 N NH2 . ARG A 1 149 ? -17.653 -14.223 16.976 1.0 59.25303 ? 173 ARG A NH2 1 149 . A ATOM 1171 N N . LEU A 1 150 ? -16.015 -19.182 14.698 1.0 25.64647 ? 174 LEU A N 1 150 . A ATOM 1172 C CA . LEU A 1 150 ? -16.870 -19.815 13.696 1.0 26.0711 ? 174 LEU A CA 1 150 . A ATOM 1173 C C . LEU A 1 150 ? -16.338 -21.186 13.314 1.0 27.00357 ? 174 LEU A C 1 150 . A ATOM 1174 O O . LEU A 1 150 ? -17.112 -22.118 13.069 1.0 29.51963 ? 174 LEU A O 1 150 . A ATOM 1175 C CB . LEU A 1 150 ? -16.985 -18.938 12.454 1.0 25.42397 ? 174 LEU A CB 1 150 . A ATOM 1176 C CG . LEU A 1 150 ? -17.797 -17.663 12.660 1.0 35.97966 ? 174 LEU A CG 1 150 . A ATOM 1177 C CD1 . LEU A 1 150 ? -17.630 -16.738 11.470 1.0 30.16966 ? 174 LEU A CD1 1 150 . A ATOM 1178 C CD2 . LEU A 1 150 ? -19.260 -18.014 12.877 1.0 33.01293 ? 174 LEU A CD2 1 150 . A ATOM 1179 N N . GLN A 1 151 ? -15.019 -21.334 13.273 1.0 28.71242 ? 175 GLN A N 1 151 . A ATOM 1180 C CA . GLN A 1 151 ? -14.434 -22.634 12.962 1.0 28.97431 ? 175 GLN A CA 1 151 . A ATOM 1181 C C . GLN A 1 151 ? -14.772 -23.658 14.034 1.0 30.19296 ? 175 GLN A C 1 151 . A ATOM 1182 O O . GLN A 1 151 ? -15.239 -24.765 13.735 1.0 31.65304 ? 175 GLN A O 1 151 . A ATOM 1183 C CB . GLN A 1 151 ? -12.921 -22.480 12.813 1.0 27.68864 ? 175 GLN A CB 1 151 . A ATOM 1184 C CG . GLN A 1 151 ? -12.184 -23.780 12.595 1.0 29.34403 ? 175 GLN A CG 1 151 . A ATOM 1185 C CD . GLN A 1 151 ? -12.562 -24.452 11.293 1.0 34.69369 ? 175 GLN A CD 1 151 . A ATOM 1186 O OE1 . GLN A 1 151 ? -13.077 -23.816 10.371 1.0 36.5261 ? 175 GLN A OE1 1 151 . A ATOM 1187 N NE2 . GLN A 1 151 ? -12.312 -25.751 11.213 1.0 47.87587 ? 175 GLN A NE2 1 151 . A ATOM 1188 N N . ALA A 1 152 ? -14.546 -23.299 15.297 1.0 31.73259 ? 176 ALA A N 1 152 . A ATOM 1189 C CA . ALA A 1 152 ? -14.880 -24.190 16.401 1.0 30.94078 ? 176 ALA A CA 1 152 . A ATOM 1190 C C . ALA A 1 152 ? -16.357 -24.572 16.386 1.0 30.0555 ? 176 ALA A C 1 152 . A ATOM 1191 O O . ALA A 1 152 ? -16.707 -25.739 16.609 1.0 34.8252 ? 176 ALA A O 1 152 . A ATOM 1192 C CB . ALA A 1 152 ? -14.507 -23.524 17.724 1.0 30.40277 ? 176 ALA A CB 1 152 . A ATOM 1193 N N . GLU A 1 153 ? -17.236 -23.602 16.105 1.0 29.912 ? 177 GLU A N 1 153 . A ATOM 1194 C CA . GLU A 1 153 ? -18.677 -23.856 16.126 1.0 31.88091 ? 177 GLU A CA 1 153 . A ATOM 1195 C C . GLU A 1 153 ? -19.091 -24.826 15.026 1.0 30.61068 ? 177 GLU A C 1 153 . A ATOM 1196 O O . GLU A 1 153 ? -20.073 -25.557 15.184 1.0 31.99241 ? 177 GLU A O 1 153 . A ATOM 1197 C CB . GLU A 1 153 ? -19.449 -22.532 16.008 1.0 35.02539 ? 177 GLU A CB 1 153 . A ATOM 1198 C CG . GLU A 1 153 ? -19.291 -21.622 17.239 1.0 31.81048 ? 177 GLU A CG 1 153 . A ATOM 1199 C CD . GLU A 1 153 ? -19.947 -20.247 17.108 1.0 38.70636 ? 177 GLU A CD 1 153 . A ATOM 1200 O OE1 . GLU A 1 153 ? -20.449 -19.889 16.021 1.0 35.8435 ? 177 GLU A OE1 1 153 . A ATOM 1201 O OE2 . GLU A 1 153 ? -19.952 -19.512 18.114 1.0 38.858 ? 177 GLU A OE2 1 153 . A ATOM 1202 N N . SER A 1 154 ? -18.343 -24.862 13.922 1.0 36.77313 ? 178 SER A N 1 154 . A ATOM 1203 C CA . SER A 1 154 ? -18.648 -25.741 12.798 1.0 33.78599 ? 178 SER A CA 1 154 . A ATOM 1204 C C . SER A 1 154 ? -18.169 -27.169 13.009 1.0 38.63829 ? 178 SER A C 1 154 . A ATOM 1205 O O . SER A 1 154 ? -18.586 -28.060 12.264 1.0 45.98878 ? 178 SER A O 1 154 . A ATOM 1206 C CB . SER A 1 154 ? -18.010 -25.205 11.513 1.0 38.235 ? 178 SER A CB 1 154 . A ATOM 1207 O OG . SER A 1 154 ? -16.606 -25.453 11.508 1.0 39.19818 ? 178 SER A OG 1 154 . A ATOM 1208 N N . MET A 1 155 ? -17.296 -27.405 13.979 1.0 41.34521 ? 179 MET A N 1 155 . A ATOM 1209 C CA . MET A 1 155 ? -16.727 -28.727 14.184 1.0 45.68971 ? 179 MET A CA 1 155 . A ATOM 1210 C C . MET A 1 155 ? -17.631 -29.558 15.081 1.0 50.87013 ? 179 MET A C 1 155 . A ATOM 1211 O O . MET A 1 155 ? -18.319 -29.032 15.960 1.0 56.49368 ? 179 MET A O 1 155 . A ATOM 1212 C CB . MET A 1 155 ? -15.328 -28.623 14.796 1.0 51.22844 ? 179 MET A CB 1 155 . A ATOM 1213 C CG . MET A 1 155 ? -14.282 -27.965 13.891 1.0 62.87166 ? 179 MET A CG 1 155 . A ATOM 1214 S SD . MET A 1 155 ? -13.608 -29.057 12.615 1.0 77.36844 ? 179 MET A SD 1 155 . A ATOM 1215 C CE . MET A 1 155 ? -14.816 -28.915 11.292 1.0 69.54496 ? 179 MET A CE 1 155 . A ATOM 1216 N N . GLU A 1 156 ? -17.634 -30.864 14.847 1.0 51.0029 ? 180 GLU A N 1 156 . A ATOM 1217 C CA . GLU A 1 156 ? -18.454 -31.743 15.669 1.0 48.6668 ? 180 GLU A CA 1 156 . A ATOM 1218 C C . GLU A 1 156 ? -17.831 -31.922 17.050 1.0 52.03444 ? 180 GLU A C 1 156 . A ATOM 1219 O O . GLU A 1 156 ? -18.543 -32.021 18.055 1.0 55.46405 ? 180 GLU A O 1 156 . A ATOM 1220 C CB . GLU A 1 156 ? -18.652 -33.100 14.995 1.0 52.57254 ? 180 GLU A CB 1 156 . A ATOM 1221 C CG . GLU A 1 156 ? -19.691 -33.963 15.695 1.0 70.03859 ? 180 GLU A CG 1 156 . A ATOM 1222 C CD . GLU A 1 156 ? -20.027 -35.222 14.925 1.0 83.3477 ? 180 GLU A CD 1 156 . A ATOM 1223 O OE1 . GLU A 1 156 ? -19.274 -35.565 13.989 1.0 86.8739 ? 180 GLU A OE1 1 156 . A ATOM 1224 O OE2 . GLU A 1 156 ? -21.046 -35.867 15.256 1.0 89.19448 ? 180 GLU A OE2 1 156 . A HETATM 1225 C C1 . GOL B 2 . ? -3.954 -3.781 19.807 1.0 67.35986 ? 201 GOL B C1 1 201 . A HETATM 1226 O O1 . GOL B 2 . ? -4.379 -2.535 20.246 1.0 63.62201 ? 201 GOL B O1 1 201 . A HETATM 1227 C C2 . GOL B 2 . ? -2.544 -4.006 20.404 1.0 69.5899 ? 201 GOL B C2 1 201 . A HETATM 1228 O O2 . GOL B 2 . ? -2.099 -5.301 20.179 1.0 70.73444 ? 201 GOL B O2 1 201 . A HETATM 1229 C C3 . GOL B 2 . ? -1.637 -2.937 19.726 1.0 69.35195 ? 201 GOL B C3 1 201 . A HETATM 1230 O O3 . GOL B 2 . ? -0.613 -2.610 20.627 1.0 70.04865 ? 201 GOL B O3 1 201 . A HETATM 1231 C CAA . ZLA C 3 . ? -2.717 10.527 14.072 1.0 26.53945 ? 202 ZLA C CAA 1 202 . A HETATM 1232 C CAB . ZLA C 3 . ? -2.066 10.355 15.287 1.0 32.34279 ? 202 ZLA C CAB 1 202 . A HETATM 1233 C CAC . ZLA C 3 . ? -2.810 10.191 16.453 1.0 33.16321 ? 202 ZLA C CAC 1 202 . A HETATM 1234 C CAD . ZLA C 3 . ? -4.202 10.201 16.419 1.0 31.8439 ? 202 ZLA C CAD 1 202 . A HETATM 1235 C CAE . ZLA C 3 . ? -4.857 10.373 15.208 1.0 31.47046 ? 202 ZLA C CAE 1 202 . A HETATM 1236 C CAF . ZLA C 3 . ? -4.112 10.534 14.041 1.0 24.67326 ? 202 ZLA C CAF 1 202 . A HETATM 1237 C CAI . ZLA C 3 . ? -6.856 10.543 13.996 1.0 31.15645 ? 202 ZLA C CAI 1 202 . A HETATM 1238 C CAJ . ZLA C 3 . ? -6.137 10.707 12.828 1.0 31.94116 ? 202 ZLA C CAJ 1 202 . A HETATM 1239 C CAK . ZLA C 3 . ? -8.256 10.565 13.952 1.0 29.57457 ? 202 ZLA C CAK 1 202 . A HETATM 1240 C CAN . ZLA C 3 . ? -10.302 10.537 15.293 1.0 23.73804 ? 202 ZLA C CAN 1 202 . A HETATM 1241 C CAQ . ZLA C 3 . ? -11.013 9.191 15.091 1.0 26.77796 ? 202 ZLA C CAQ 1 202 . A HETATM 1242 C CAR . ZLA C 3 . ? -10.643 8.183 14.309 1.0 27.164 ? 202 ZLA C CAR 1 202 . A HETATM 1243 C CAT . ZLA C 3 . ? -11.801 6.028 13.980 1.0 21.3447 ? 202 ZLA C CAT 1 202 . A HETATM 1244 C CAU . ZLA C 3 . ? -11.752 4.928 14.846 1.0 23.45762 ? 202 ZLA C CAU 1 202 . A HETATM 1245 C CAV . ZLA C 3 . ? -12.074 5.825 12.612 1.0 17.67182 ? 202 ZLA C CAV 1 202 . A HETATM 1246 C CAW . ZLA C 3 . ? -12.290 4.527 12.125 1.0 24.058 ? 202 ZLA C CAW 1 202 . A HETATM 1247 C CAX . ZLA C 3 . ? -12.229 3.427 12.991 1.0 30.51673 ? 202 ZLA C CAX 1 202 . A HETATM 1248 C CAY . ZLA C 3 . ? -11.980 3.644 14.345 1.0 28.67036 ? 202 ZLA C CAY 1 202 . A HETATM 1249 C CAZ . ZLA C 3 . ? -11.523 5.115 16.233 1.0 31.46132 ? 202 ZLA C CAZ 1 202 . A HETATM 1250 C CBA . ZLA C 3 . ? -10.116 5.334 16.723 1.0 31.49121 ? 202 ZLA C CBA 1 202 . A HETATM 1251 C CBB . ZLA C 3 . ? -10.829 4.023 17.020 1.0 33.83158 ? 202 ZLA C CBB 1 202 . A HETATM 1252 C CBC . ZLA C 3 . ? -12.117 6.939 11.755 1.0 25.48705 ? 202 ZLA C CBC 1 202 . A HETATM 1253 C CBD . ZLA C 3 . ? -13.256 6.990 10.761 1.0 34.16649 ? 202 ZLA C CBD 1 202 . A HETATM 1254 C CBE . ZLA C 3 . ? -11.844 6.699 10.275 1.0 27.68306 ? 202 ZLA C CBE 1 202 . A HETATM 1255 C CBF . ZLA C 3 . ? -12.485 2.113 12.553 1.0 25.59484 ? 202 ZLA C CBF 1 202 . A HETATM 1256 C CBG . ZLA C 3 . ? -11.377 1.348 11.818 1.0 27.9857 ? 202 ZLA C CBG 1 202 . A HETATM 1257 C CBJ . ZLA C 3 . ? -9.724 1.419 9.959 1.0 26.55688 ? 202 ZLA C CBJ 1 202 . A HETATM 1258 C CBK . ZLA C 3 . ? -7.791 2.275 11.330 1.0 26.89638 ? 202 ZLA C CBK 1 202 . A HETATM 1259 C CBL . ZLA C 3 . ? -8.481 1.045 10.769 1.0 22.01865 ? 202 ZLA C CBL 1 202 . A HETATM 1260 C CBM . ZLA C 3 . ? -9.337 2.403 8.858 1.0 26.39739 ? 202 ZLA C CBM 1 202 . A HETATM 1261 C CBN . ZLA C 3 . ? -8.662 3.636 9.438 1.0 24.58352 ? 202 ZLA C CBN 1 202 . A HETATM 1262 C CBO . ZLA C 3 . ? -7.413 3.212 10.195 1.0 26.0925 ? 202 ZLA C CBO 1 202 . A HETATM 1263 C CBP . ZLA C 3 . ? -10.323 0.189 9.250 1.0 28.09416 ? 202 ZLA C CBP 1 202 . A HETATM 1264 N NAG . ZLA C 3 . ? -4.745 10.699 12.874 1.0 27.95482 ? 202 ZLA C NAG 1 202 . A HETATM 1265 N NAH . ZLA C 3 . ? -6.200 10.386 15.163 1.0 25.64026 ? 202 ZLA C NAH 1 202 . A HETATM 1266 N NAL . ZLA C 3 . ? -8.846 10.466 15.140 1.0 24.69361 ? 202 ZLA C NAL 1 202 . A HETATM 1267 N NAO . ZLA C 3 . ? -12.490 7.816 15.361 1.0 31.07327 ? 202 ZLA C NAO 1 202 . A HETATM 1268 N NAP . ZLA C 3 . ? -12.150 8.881 15.706 1.0 28.98552 ? 202 ZLA C NAP 1 202 . A HETATM 1269 N NAS . ZLA C 3 . ? -11.611 7.267 14.484 1.0 28.79358 ? 202 ZLA C NAS 1 202 . A HETATM 1270 N NBH . ZLA C 3 . ? -10.758 2.017 10.829 1.0 25.40674 ? 202 ZLA C NBH 1 202 . A HETATM 1271 O OAM . ZLA C 3 . ? -8.876 10.677 12.891 1.0 27.35945 ? 202 ZLA C OAM 1 202 . A HETATM 1272 O OBI . ZLA C 3 . ? -11.174 0.161 12.090 1.0 23.57465 ? 202 ZLA C OBI 1 202 . A HETATM 1273 O OBQ . ZLA C 3 . ? -9.550 -0.754 8.965 1.0 29.05454 ? 202 ZLA C OBQ 1 202 . A HETATM 1274 O OBR . ZLA C 3 . ? -11.532 0.238 8.957 1.0 30.51936 ? 202 ZLA C OBR 1 202 . A HETATM 1275 O O . HOH D 4 . ? 5.753 -1.638 8.766 1.0 49.72747 ? 301 HOH D O 1 301 . A HETATM 1276 O O . HOH D 4 . ? -19.161 15.446 13.259 1.0 43.18892 ? 302 HOH D O 1 302 . A HETATM 1277 O O . HOH D 4 . ? -6.275 -21.074 -0.647 1.0 38.5773 ? 303 HOH D O 1 303 . A HETATM 1278 O O . HOH D 4 . ? -19.178 -10.826 14.426 1.0 39.91539 ? 304 HOH D O 1 304 . A HETATM 1279 O O . HOH D 4 . ? -8.932 -22.750 15.165 1.0 39.55013 ? 305 HOH D O 1 305 . A HETATM 1280 O O . HOH D 4 . ? -18.909 1.011 -9.306 1.0 53.5669 ? 306 HOH D O 1 306 . A HETATM 1281 O O . HOH D 4 . ? -20.960 -17.474 15.869 1.0 38.57672 ? 307 HOH D O 1 307 . A HETATM 1282 O O . HOH D 4 . ? -19.085 -20.443 20.240 1.0 38.68531 ? 308 HOH D O 1 308 . A HETATM 1283 O O . HOH D 4 . ? -18.297 -33.733 19.834 1.0 48.22111 ? 309 HOH D O 1 309 . A HETATM 1284 O O . HOH D 4 . ? -27.094 5.349 10.523 1.0 53.8411 ? 310 HOH D O 1 310 . A HETATM 1285 O O . HOH D 4 . ? -9.878 5.608 -5.364 1.0 42.62 ? 311 HOH D O 1 311 . A HETATM 1286 O O . HOH D 4 . ? -5.575 -18.238 -8.134 1.0 44.3934 ? 312 HOH D O 1 312 . A HETATM 1287 O O . HOH D 4 . ? 5.769 1.902 11.659 1.0 41.23432 ? 313 HOH D O 1 313 . A HETATM 1288 O O . HOH D 4 . ? -6.539 -12.045 -9.817 1.0 43.14625 ? 314 HOH D O 1 314 . A HETATM 1289 O O . HOH D 4 . ? -20.977 8.443 6.295 1.0 37.23323 ? 315 HOH D O 1 315 . A HETATM 1290 O O . HOH D 4 . ? -15.664 13.591 1.109 1.0 44.25823 ? 316 HOH D O 1 316 . A HETATM 1291 O O . HOH D 4 . ? -14.796 -17.350 1.047 1.0 32.70641 ? 317 HOH D O 1 317 . A HETATM 1292 O O . HOH D 4 . ? -3.734 -14.702 -3.303 1.0 37.29008 ? 318 HOH D O 1 318 . A HETATM 1293 O O . HOH D 4 . ? -22.669 7.152 -0.350 1.0 43.00034 ? 319 HOH D O 1 319 . A HETATM 1294 O O . HOH D 4 . ? -23.322 3.556 -1.412 1.0 51.72556 ? 320 HOH D O 1 320 . A HETATM 1295 O O . HOH D 4 . ? -7.367 -15.310 18.304 1.0 44.7606 ? 321 HOH D O 1 321 . A HETATM 1296 O O . HOH D 4 . ? -11.642 0.740 6.446 1.0 32.39299 ? 322 HOH D O 1 322 . A HETATM 1297 O O . HOH D 4 . ? -7.332 -0.613 7.092 1.0 28.01897 ? 323 HOH D O 1 323 . A HETATM 1298 O O . HOH D 4 . ? -13.227 2.956 9.080 1.0 28.90749 ? 324 HOH D O 1 324 . A HETATM 1299 O O . HOH D 4 . ? -11.237 -22.737 16.415 1.0 34.91577 ? 325 HOH D O 1 325 . A HETATM 1300 O O . HOH D 4 . ? 6.029 11.132 18.396 1.0 37.70527 ? 326 HOH D O 1 326 . A HETATM 1301 O O . HOH D 4 . ? 0.781 13.046 1.341 1.0 42.21703 ? 327 HOH D O 1 327 . A HETATM 1302 O O . HOH D 4 . ? -18.838 -2.184 21.802 1.0 55.873 ? 328 HOH D O 1 328 . A HETATM 1303 O O . HOH D 4 . ? -18.774 10.015 6.310 1.0 32.27448 ? 329 HOH D O 1 329 . A HETATM 1304 O O . HOH D 4 . ? -3.042 6.229 0.677 1.0 22.00639 ? 330 HOH D O 1 330 . A HETATM 1305 O O . HOH D 4 . ? -4.597 -16.675 15.757 1.0 34.31261 ? 331 HOH D O 1 331 . A HETATM 1306 O O . HOH D 4 . ? -20.834 10.305 0.524 1.0 32.06252 ? 332 HOH D O 1 332 . A HETATM 1307 O O . HOH D 4 . ? -1.298 -7.675 0.574 1.0 46.96028 ? 333 HOH D O 1 333 . A HETATM 1308 O O . HOH D 4 . ? 3.950 -1.282 3.857 1.0 22.99955 ? 334 HOH D O 1 334 . A HETATM 1309 O O . HOH D 4 . ? 2.364 -18.265 5.351 1.0 40.0848 ? 335 HOH D O 1 335 . A HETATM 1310 O O . HOH D 4 . ? -13.614 7.857 23.634 1.0 30.90065 ? 336 HOH D O 1 336 . A HETATM 1311 O O . HOH D 4 . ? -8.236 -3.023 9.500 1.0 27.15535 ? 337 HOH D O 1 337 . A HETATM 1312 O O . HOH D 4 . ? -6.809 -7.986 -8.744 1.0 37.44125 ? 338 HOH D O 1 338 . A HETATM 1313 O O . HOH D 4 . ? -1.427 15.375 1.266 1.0 48.18049 ? 339 HOH D O 1 339 . A HETATM 1314 O O . HOH D 4 . ? 0.642 -4.394 16.272 1.0 45.19372 ? 340 HOH D O 1 340 . A HETATM 1315 O O . HOH D 4 . ? -2.987 15.620 4.562 1.0 38.40098 ? 341 HOH D O 1 341 . A HETATM 1316 O O . HOH D 4 . ? -5.164 -16.497 -1.602 1.0 28.81102 ? 342 HOH D O 1 342 . A HETATM 1317 O O . HOH D 4 . ? -0.098 -28.321 4.222 1.0 49.86076 ? 343 HOH D O 1 343 . A HETATM 1318 O O . HOH D 4 . ? 1.798 -7.493 14.106 1.0 46.57971 ? 344 HOH D O 1 344 . A HETATM 1319 O O . HOH D 4 . ? -8.507 -5.884 9.300 1.0 34.80382 ? 345 HOH D O 1 345 . A HETATM 1320 O O . HOH D 4 . ? -19.278 -16.178 6.668 1.0 40.1709 ? 346 HOH D O 1 346 . A HETATM 1321 O O . HOH D 4 . ? 4.775 11.222 20.793 1.0 48.91787 ? 347 HOH D O 1 347 . A HETATM 1322 O O . HOH D 4 . ? -23.927 -3.668 7.255 1.0 37.06594 ? 348 HOH D O 1 348 . A HETATM 1323 O O . HOH D 4 . ? -18.644 8.127 17.852 1.0 27.77251 ? 349 HOH D O 1 349 . A HETATM 1324 O O . HOH D 4 . ? -21.834 -20.980 13.933 1.0 21.79614 ? 350 HOH D O 1 350 . A HETATM 1325 O O . HOH D 4 . ? -2.466 -19.661 10.546 1.0 37.82288 ? 351 HOH D O 1 351 . A HETATM 1326 O O . HOH D 4 . ? -14.927 -8.813 -7.694 1.0 50.98679 ? 352 HOH D O 1 352 . A HETATM 1327 O O . HOH D 4 . ? -21.597 7.125 14.875 1.0 40.7339 ? 353 HOH D O 1 353 . A HETATM 1328 O O . HOH D 4 . ? -10.594 13.649 7.194 1.0 47.16428 ? 354 HOH D O 1 354 . A HETATM 1329 O O . HOH D 4 . ? -9.633 0.963 -8.235 1.0 43.88936 ? 355 HOH D O 1 355 . A HETATM 1330 O O . HOH D 4 . ? -13.497 -6.264 5.426 1.0 31.94499 ? 356 HOH D O 1 356 . A HETATM 1331 O O . HOH D 4 . ? -20.563 2.802 22.135 1.0 35.03821 ? 357 HOH D O 1 357 . A HETATM 1332 O O . HOH D 4 . ? -9.612 -17.992 19.206 1.0 46.85055 ? 358 HOH D O 1 358 . A HETATM 1333 O O . HOH D 4 . ? -23.950 3.833 8.054 1.0 37.8602 ? 359 HOH D O 1 359 . A HETATM 1334 O O . HOH D 4 . ? -1.476 -17.185 -1.760 1.0 39.29595 ? 360 HOH D O 1 360 . A HETATM 1335 O O . HOH D 4 . ? -3.531 1.396 -0.920 1.0 24.63919 ? 361 HOH D O 1 361 . A HETATM 1336 O O . HOH D 4 . ? 5.193 4.504 15.712 1.0 33.40085 ? 362 HOH D O 1 362 . A HETATM 1337 O O . HOH D 4 . ? -12.427 -1.167 14.347 1.0 21.81921 ? 363 HOH D O 1 363 . A HETATM 1338 O O . HOH D 4 . ? -0.468 -13.553 14.225 1.0 42.48553 ? 364 HOH D O 1 364 . A HETATM 1339 O O . HOH D 4 . ? 7.348 7.807 5.756 1.0 44.59439 ? 365 HOH D O 1 365 . A HETATM 1340 O O . HOH D 4 . ? -6.124 0.038 -4.689 1.0 30.89602 ? 366 HOH D O 1 366 . A HETATM 1341 O O . HOH D 4 . ? -12.745 16.120 9.636 1.0 43.93409 ? 367 HOH D O 1 367 . A HETATM 1342 O O . HOH D 4 . ? -18.351 -4.329 15.554 1.0 30.44162 ? 368 HOH D O 1 368 . A HETATM 1343 O O . HOH D 4 . ? -6.138 0.630 -1.544 1.0 25.58848 ? 369 HOH D O 1 369 . A HETATM 1344 O O . HOH D 4 . ? -8.346 9.454 0.084 1.0 24.66685 ? 370 HOH D O 1 370 . A HETATM 1345 O O . HOH D 4 . ? -19.797 -22.188 12.314 1.0 37.29834 ? 371 HOH D O 1 371 . A HETATM 1346 O O . HOH D 4 . ? -22.810 7.222 7.873 1.0 49.17481 ? 372 HOH D O 1 372 . A HETATM 1347 O O . HOH D 4 . ? -8.681 9.404 4.178 1.0 34.9949 ? 373 HOH D O 1 373 . A HETATM 1348 O O . HOH D 4 . ? -12.676 -3.511 5.403 1.0 27.83443 ? 374 HOH D O 1 374 . A HETATM 1349 O O . HOH D 4 . ? 1.962 0.323 2.873 1.0 21.78637 ? 375 HOH D O 1 375 . A HETATM 1350 O O . HOH D 4 . ? -15.047 -27.255 18.271 1.0 38.40854 ? 376 HOH D O 1 376 . A HETATM 1351 O O . HOH D 4 . ? -14.070 0.324 7.748 1.0 56.35718 ? 377 HOH D O 1 377 . A HETATM 1352 O O . HOH D 4 . ? -6.637 -21.988 4.380 1.0 26.70055 ? 378 HOH D O 1 378 . A HETATM 1353 O O . HOH D 4 . ? -16.902 5.924 -6.138 1.0 32.97619 ? 379 HOH D O 1 379 . A HETATM 1354 O O . HOH D 4 . ? -17.922 -9.183 7.415 1.0 30.79232 ? 380 HOH D O 1 380 . A HETATM 1355 O O . HOH D 4 . ? -4.130 12.552 7.786 1.0 26.5098 ? 381 HOH D O 1 381 . A HETATM 1356 O O . HOH D 4 . ? -5.723 -18.820 18.349 1.0 46.1764 ? 382 HOH D O 1 382 . A HETATM 1357 O O . HOH D 4 . ? -12.203 -17.327 19.116 1.0 30.84321 ? 383 HOH D O 1 383 . A HETATM 1358 O O . HOH D 4 . ? -12.107 -18.408 -2.823 1.0 41.81583 ? 384 HOH D O 1 384 . A HETATM 1359 O O . HOH D 4 . ? -12.622 -14.181 -12.356 1.0 49.04753 ? 385 HOH D O 1 385 . A HETATM 1360 O O . HOH D 4 . ? -17.275 14.279 15.505 1.0 44.53072 ? 386 HOH D O 1 386 . A HETATM 1361 O O . HOH D 4 . ? -1.275 9.056 2.126 1.0 26.11264 ? 387 HOH D O 1 387 . A HETATM 1362 O O . HOH D 4 . ? -9.888 -3.213 -8.821 1.0 34.37486 ? 388 HOH D O 1 388 . A HETATM 1363 O O . HOH D 4 . ? 1.995 15.597 18.766 1.0 43.6493 ? 389 HOH D O 1 389 . A HETATM 1364 O O . HOH D 4 . ? -9.291 -12.091 -10.728 1.0 45.99378 ? 390 HOH D O 1 390 . A HETATM 1365 O O . HOH D 4 . ? 6.869 0.302 7.280 1.0 36.50969 ? 391 HOH D O 1 391 . A HETATM 1366 O O . HOH D 4 . ? -15.617 -4.884 5.419 1.0 26.87551 ? 392 HOH D O 1 392 . A HETATM 1367 O O . HOH D 4 . ? -8.682 12.264 2.283 1.0 41.18747 ? 393 HOH D O 1 393 . A HETATM 1368 O O . HOH D 4 . ? -12.895 -11.257 -8.423 1.0 36.04907 ? 394 HOH D O 1 394 . A HETATM 1369 O O . HOH D 4 . ? -24.369 4.274 1.380 1.0 46.32836 ? 395 HOH D O 1 395 . A HETATM 1370 O O . HOH D 4 . ? 7.147 13.393 12.333 1.0 26.128 ? 396 HOH D O 1 396 . A HETATM 1371 O O . HOH D 4 . ? 9.070 12.073 5.772 1.0 51.06604 ? 397 HOH D O 1 397 . A HETATM 1372 O O . HOH D 4 . ? -21.915 -12.055 -0.977 1.0 51.4754 ? 398 HOH D O 1 398 . A HETATM 1373 O O . HOH D 4 . ? -12.554 13.386 5.873 1.0 40.29675 ? 399 HOH D O 1 399 . A HETATM 1374 O O . HOH D 4 . ? -4.573 -14.837 17.764 1.0 39.09477 ? 400 HOH D O 1 400 . A HETATM 1375 O O . HOH D 4 . ? -22.510 2.416 19.494 1.0 44.08105 ? 401 HOH D O 1 401 . A HETATM 1376 O O . HOH D 4 . ? 6.114 2.403 9.322 1.0 46.60385 ? 402 HOH D O 1 402 . A HETATM 1377 O O . HOH D 4 . ? -8.449 -2.845 2.606 1.0 27.47978 ? 403 HOH D O 1 403 . A HETATM 1378 O O . HOH D 4 . ? -11.922 12.746 -0.757 1.0 43.50205 ? 404 HOH D O 1 404 . A HETATM 1379 O O . HOH D 4 . ? 6.448 5.201 6.409 1.0 30.00147 ? 405 HOH D O 1 405 . A HETATM 1380 O O . HOH D 4 . ? -11.112 -5.519 -8.201 1.0 30.19816 ? 406 HOH D O 1 406 . A HETATM 1381 O O . HOH D 4 . ? -9.531 -7.065 19.171 1.0 43.65005 ? 407 HOH D O 1 407 . A HETATM 1382 O O . HOH D 4 . ? 2.715 -7.393 11.997 1.0 34.9105 ? 408 HOH D O 1 408 . A HETATM 1383 O O . HOH D 4 . ? -2.425 -0.428 0.770 1.0 32.28255 ? 409 HOH D O 1 409 . A HETATM 1384 O O . HOH D 4 . ? -16.259 -4.859 -9.555 1.0 45.45539 ? 410 HOH D O 1 410 . A HETATM 1385 O O . HOH D 4 . ? -5.345 17.291 12.123 1.0 42.91311 ? 411 HOH D O 1 411 . A HETATM 1386 O O . HOH D 4 . ? -25.275 -1.983 9.023 1.0 31.78266 ? 412 HOH D O 1 412 . A HETATM 1387 O O . HOH D 4 . ? -9.906 -22.490 2.199 1.0 27.9963 ? 413 HOH D O 1 413 . A HETATM 1388 O O . HOH D 4 . ? -19.965 -10.756 7.278 1.0 37.67125 ? 414 HOH D O 1 414 . A HETATM 1389 O O . HOH D 4 . ? 6.730 10.275 4.227 1.0 36.70577 ? 415 HOH D O 1 415 . A HETATM 1390 O O . HOH D 4 . ? -24.569 -6.053 11.613 1.0 53.24173 ? 416 HOH D O 1 416 . A HETATM 1391 O O . HOH D 4 . ? -19.234 -13.288 1.654 1.0 34.22616 ? 417 HOH D O 1 417 . A HETATM 1392 O O . HOH D 4 . ? -6.356 -12.647 18.169 1.0 51.29889 ? 418 HOH D O 1 418 . A HETATM 1393 O O . HOH D 4 . ? -12.180 13.459 14.853 1.0 39.87985 ? 419 HOH D O 1 419 . A HETATM 1394 O O . HOH D 4 . ? -8.125 11.455 17.992 1.0 45.54757 ? 420 HOH D O 1 420 . A HETATM 1395 O O . HOH D 4 . ? -1.109 -14.626 16.498 1.0 43.51012 ? 421 HOH D O 1 421 . A HETATM 1396 O O . HOH D 4 . ? -4.344 -18.922 -0.819 1.0 34.49109 ? 422 HOH D O 1 422 . A HETATM 1397 O O . HOH D 4 . ? 6.896 3.635 17.698 1.0 48.21424 ? 423 HOH D O 1 423 . A HETATM 1398 O O . HOH D 4 . ? 7.383 13.644 9.684 1.0 40.5477 ? 424 HOH D O 1 424 . A HETATM 1399 O O . HOH D 4 . ? -10.894 11.880 4.524 1.0 45.31284 ? 425 HOH D O 1 425 . A HETATM 1400 O O . HOH D 4 . ? 3.403 13.581 2.258 1.0 43.0744 ? 426 HOH D O 1 426 . A HETATM 1401 O O . HOH D 4 . ? -22.414 -27.193 13.802 1.0 50.11338 ? 427 HOH D O 1 427 . A HETATM 1402 O O . HOH D 4 . ? 8.918 10.083 20.976 1.0 48.34175 ? 428 HOH D O 1 428 . A HETATM 1403 O O . HOH D 4 . ? 10.532 10.786 9.674 1.0 40.71221 ? 429 HOH D O 1 429 . A HETATM 1404 O O . HOH D 4 . ? 0.000 -19.174 0.000 0.5 43.5768 ? 430 HOH D O 1 430 . A HETATM 1405 O O . HOH D 4 . ? -6.234 16.123 9.594 1.0 40.91149 ? 431 HOH D O 1 431 . A HETATM 1406 O O . HOH D 4 . ? -13.652 -6.513 -9.306 1.0 48.58035 ? 432 HOH D O 1 432 . A HETATM 1407 O O . HOH D 4 . ? -4.282 17.264 8.346 1.0 43.62049 ? 433 HOH D O 1 433 . A HETATM 1408 O O . HOH D 4 . ? 6.586 16.155 3.787 1.0 45.56477 ? 434 HOH D O 1 434 . A HETATM 1409 O O . HOH D 4 . ? -9.778 -26.001 13.285 1.0 54.8878 ? 435 HOH D O 1 435 . A HETATM 1410 O O . HOH D 4 . ? -26.416 3.122 8.742 1.0 39.26647 ? 436 HOH D O 1 436 . A HETATM 1411 O O . HOH D 4 . ? -14.112 16.831 12.119 1.0 46.46615 ? 437 HOH D O 1 437 . A HETATM 1412 O O . HOH D 4 . ? -0.330 12.810 20.619 1.0 49.48442 ? 438 HOH D O 1 438 . A HETATM 1413 O O . HOH D 4 . ? -17.024 -20.418 3.483 1.0 43.65857 ? 439 HOH D O 1 439 . A HETATM 1414 O O . HOH D 4 . ? -2.819 -29.415 6.699 1.0 52.26973 ? 440 HOH D O 1 440 . A HETATM 1415 O O . HOH D 4 . ? -11.035 -10.091 -9.783 1.0 36.86759 ? 441 HOH D O 1 441 . A HETATM 1416 O O A HOH D 4 . ? -10.083 -2.989 4.500 0.539 23.64993 ? 442 HOH D O 1 442 . A HETATM 1417 O O B HOH D 4 . ? -9.157 -3.753 6.345 0.461 17.65266 ? 442 HOH D O 1 442 . A HETATM 1418 O O . HOH D 4 . ? -3.537 12.575 19.594 1.0 54.04636 ? 443 HOH D O 1 443 . A HETATM 1419 O O . HOH D 4 . ? -13.513 10.661 22.578 1.0 51.91685 ? 444 HOH D O 1 444 . A HETATM 1420 O O . HOH D 4 . ? 10.234 10.534 4.219 1.0 69.05735 ? 445 HOH D O 1 445 . A HETATM 1421 O O . HOH D 4 . ? 3.756 17.147 17.252 1.0 46.88417 ? 446 HOH D O 1 446 . A HETATM 1422 O O . HOH D 4 . ? 7.117 4.442 8.629 1.0 48.77267 ? 447 HOH D O 1 447 . A HETATM 1423 O O . HOH D 4 . ? -3.555 15.087 7.043 1.0 45.0471 ? 448 HOH D O 1 448 . A HETATM 1424 O O . HOH D 4 . ? -17.169 -7.216 16.637 1.0 57.65325 ? 449 HOH D O 1 449 . A HETATM 1425 O O . HOH D 4 . ? -19.266 12.903 6.447 1.0 42.38233 ? 450 HOH D O 1 450 . A HETATM 1426 O O . HOH D 4 . ? -18.183 -24.478 5.024 1.0 43.55172 ? 451 HOH D O 1 451 . A HETATM 1427 O O . HOH D 4 . ? 12.299 9.354 8.338 1.0 42.33427 ? 452 HOH D O 1 452 . A HETATM 1428 O O . HOH D 4 . ? -4.071 -24.575 0.034 1.0 48.07143 ? 453 HOH D O 1 453 . A HETATM 1429 O O . HOH D 4 . ? -11.582 -25.674 16.244 1.0 46.69983 ? 454 HOH D O 1 454 . A HETATM 1430 O O . HOH D 4 . ? -9.450 11.720 -0.367 1.0 45.55391 ? 455 HOH D O 1 455 . A HETATM 1431 O O . HOH D 4 . ? -9.585 -7.539 -9.325 1.0 36.45489 ? 456 HOH D O 1 456 . A HETATM 1432 O O . HOH D 4 . ? 9.571 13.393 8.530 1.0 49.67426 ? 457 HOH D O 1 457 . A HETATM 1433 O O . HOH D 4 . ? -10.718 -22.127 18.955 1.0 45.94311 ? 458 HOH D O 1 458 . A HETATM 1434 O O . HOH D 4 . ? 7.218 -3.835 9.323 1.0 40.13321 ? 459 HOH D O 1 459 . A HETATM 1435 O O . HOH D 4 . ? -8.058 -24.199 3.208 1.0 38.32228 ? 460 HOH D O 1 460 . A HETATM 1436 O O . HOH D 4 . ? -1.933 -24.253 1.609 1.0 48.64488 ? 461 HOH D O 1 461 . A HETATM 1437 O O . HOH D 4 . ? -5.474 -9.261 -11.597 1.0 47.63579 ? 462 HOH D O 1 462 . A HETATM 1438 O O . HOH D 4 . ? -13.429 -16.291 21.204 1.0 52.24949 ? 463 HOH D O 1 463 . A HETATM 1439 O O . HOH D 4 . ? -17.763 -16.555 0.545 1.0 48.11395 ? 464 HOH D O 1 464 . A HETATM 1440 O O . HOH D 4 . ? -22.455 -16.470 13.574 1.0 29.6339 ? 465 HOH D O 1 465 . A HETATM 1441 O O . HOH D 4 . ? -12.459 -26.504 18.505 1.0 41.22344 ? 466 HOH D O 1 466 . A HETATM 1442 O O . HOH D 4 . ? -19.904 0.048 22.927 1.0 42.52678 ? 467 HOH D O 1 467 . A HETATM 1443 O O . HOH D 4 . ? -4.834 4.077 20.878 1.0 54.23825 ? 468 HOH D O 1 468 . A # _entry.id 7MLC # _cell.entry_id 7MLC _cell.length_a 51.19159 _cell.length_b 68.74427 _cell.length_c 45.99046 _cell.angle_alpha 90.00 _cell.angle_beta 90.00 _cell.angle_gamma 90.00 _cell.Z_PDB 1 _cell.pdbx_unique_axis ? # _pdbe_orig_cell.angle_alpha 90.000 _pdbe_orig_cell.angle_alpha_esd ? _pdbe_orig_cell.angle_beta 108.802 _pdbe_orig_cell.angle_beta_esd ? _pdbe_orig_cell.angle_gamma 90.000 _pdbe_orig_cell.angle_gamma_esd ? _pdbe_orig_cell.entry_id 7MLC _pdbe_orig_cell.details ? _pdbe_orig_cell.formula_units_Z ? _pdbe_orig_cell.length_a 59.545 _pdbe_orig_cell.length_a_esd ? _pdbe_orig_cell.length_b 64.394 _pdbe_orig_cell.length_b_esd ? _pdbe_orig_cell.length_c 44.597 _pdbe_orig_cell.length_c_esd ? _pdbe_orig_cell.volume 161875.188 _pdbe_orig_cell.volume_esd ? _pdbe_orig_cell.Z_PDB 4 _pdbe_orig_cell.reciprocal_angle_alpha ? _pdbe_orig_cell.reciprocal_angle_beta ? _pdbe_orig_cell.reciprocal_angle_gamma ? _pdbe_orig_cell.reciprocal_angle_alpha_esd ? _pdbe_orig_cell.reciprocal_angle_beta_esd ? _pdbe_orig_cell.reciprocal_angle_gamma_esd ? _pdbe_orig_cell.reciprocal_length_a ? _pdbe_orig_cell.reciprocal_length_b ? _pdbe_orig_cell.reciprocal_length_c ? _pdbe_orig_cell.reciprocal_length_a_esd ? _pdbe_orig_cell.reciprocal_length_b_esd ? _pdbe_orig_cell.reciprocal_length_c_esd ? _pdbe_orig_cell.pdbx_unique_axis ? # _symmetry.entry_id 7MLC _symmetry.space_group_name_H-M "P 1" _symmetry.pdbx_full_space_group_name_H-M ? _symmetry.cell_setting ? _symmetry.Int_Tables_number ? # _pdbe_orig_symmetry.entry_id 7MLC _pdbe_orig_symmetry.cell_setting ? _pdbe_orig_symmetry.Int_Tables_number 5 _pdbe_orig_symmetry.space_group_name_Hall "C 2y" _pdbe_orig_symmetry.space_group_name_H-M "C 1 2 1" _pdbe_orig_symmetry.pdbx_full_space_group_name_H-M ? # _entity_name_com.entity_id 1 _entity_name_com.name "ABI1-binding protein 8,PYR1-like protein 10,Regulatory components of ABA receptor 4" # _entity_src_gen.entity_id 1 _entity_src_gen.pdbx_src_id 1 _entity_src_gen.pdbx_alt_source_flag sample _entity_src_gen.pdbx_seq_type "Biological sequence" _entity_src_gen.pdbx_beg_seq_num 1 _entity_src_gen.pdbx_end_seq_num 159 _entity_src_gen.gene_src_common_name "Mouse-ear cress" _entity_src_gen.gene_src_genus ? _entity_src_gen.pdbx_gene_src_gene "PYL10, RCAR4, At4g27920, T13J8.30" _entity_src_gen.gene_src_species ? _entity_src_gen.gene_src_strain ? _entity_src_gen.gene_src_tissue ? _entity_src_gen.gene_src_tissue_fraction ? _entity_src_gen.gene_src_details ? _entity_src_gen.pdbx_gene_src_fragment ? _entity_src_gen.pdbx_gene_src_scientific_name "Arabidopsis thaliana" _entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 3702 _entity_src_gen.pdbx_gene_src_variant ? _entity_src_gen.pdbx_gene_src_cell_line ? _entity_src_gen.pdbx_gene_src_atcc ? _entity_src_gen.pdbx_gene_src_organ ? _entity_src_gen.pdbx_gene_src_organelle ? _entity_src_gen.pdbx_gene_src_cell ? _entity_src_gen.pdbx_gene_src_cellular_location ? _entity_src_gen.host_org_common_name ? _entity_src_gen.pdbx_host_org_scientific_name "Escherichia coli BL21(DE3)" _entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 469008 _entity_src_gen.host_org_genus ? _entity_src_gen.pdbx_host_org_gene ? _entity_src_gen.pdbx_host_org_organ ? _entity_src_gen.host_org_species ? _entity_src_gen.pdbx_host_org_tissue ? _entity_src_gen.pdbx_host_org_tissue_fraction ? _entity_src_gen.pdbx_host_org_strain ? _entity_src_gen.pdbx_host_org_variant ? _entity_src_gen.pdbx_host_org_cell_line ? _entity_src_gen.pdbx_host_org_atcc ? _entity_src_gen.pdbx_host_org_culture_collection ? _entity_src_gen.pdbx_host_org_cell ? _entity_src_gen.pdbx_host_org_organelle ? _entity_src_gen.pdbx_host_org_cellular_location ? _entity_src_gen.pdbx_host_org_vector_type ? _entity_src_gen.pdbx_host_org_vector ? _entity_src_gen.host_org_details ? _entity_src_gen.expression_system_id ? _entity_src_gen.plasmid_name ? _entity_src_gen.plasmid_details ? _entity_src_gen.pdbx_description ? # _exptl.absorpt_coefficient_mu ? _exptl.absorpt_correction_T_max ? _exptl.absorpt_correction_T_min ? _exptl.absorpt_correction_type ? _exptl.absorpt_process_details ? _exptl.entry_id 7MLC _exptl.crystals_number 1 _exptl.details ? _exptl.method "X-ray diffraction" _exptl.method_details ? # _reflns.B_iso_Wilson_estimate 26.28 _reflns.entry_id 7MLC _reflns.data_reduction_details ? _reflns.data_reduction_method ? _reflns.d_resolution_high 1.77 _reflns.d_resolution_low 50 _reflns.details ? _reflns.limit_h_max ? _reflns.limit_h_min ? _reflns.limit_k_max ? _reflns.limit_k_min ? _reflns.limit_l_max ? _reflns.limit_l_min ? _reflns.number_all ? _reflns.number_obs 15495 _reflns.observed_criterion ? _reflns.observed_criterion_F_max ? _reflns.observed_criterion_F_min ? _reflns.observed_criterion_I_max ? _reflns.observed_criterion_I_min ? _reflns.observed_criterion_sigma_F ? _reflns.observed_criterion_sigma_I ? _reflns.percent_possible_obs 97 _reflns.R_free_details ? _reflns.Rmerge_F_all ? _reflns.Rmerge_F_obs ? _reflns.Friedel_coverage ? _reflns.number_gt ? _reflns.threshold_expression ? _reflns.pdbx_redundancy 6.8 _reflns.pdbx_Rmerge_I_obs 0.046 _reflns.pdbx_Rmerge_I_all ? _reflns.pdbx_Rsym_value ? _reflns.pdbx_netI_over_av_sigmaI ? _reflns.pdbx_netI_over_sigmaI 22.7 _reflns.pdbx_res_netI_over_av_sigmaI_2 ? _reflns.pdbx_res_netI_over_sigmaI_2 ? _reflns.pdbx_chi_squared ? _reflns.pdbx_scaling_rejects ? _reflns.pdbx_d_res_high_opt ? _reflns.pdbx_d_res_low_opt ? _reflns.pdbx_d_res_opt_method ? _reflns.phase_calculation_details ? _reflns.pdbx_Rrim_I_all 0.049 _reflns.pdbx_Rpim_I_all 0.019 _reflns.pdbx_d_opt ? _reflns.pdbx_number_measured_all ? _reflns.pdbx_diffrn_id 1 _reflns.pdbx_ordinal 1 _reflns.pdbx_CC_half .999 _reflns.pdbx_CC_star 1. _reflns.pdbx_R_split ? _reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[1] ? _reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[2] ? _reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[3] ? _reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[1] ? _reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[2] ? _reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[3] ? _reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[1] ? _reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[2] ? _reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[3] ? _reflns.pdbx_aniso_diffraction_limit_1 ? _reflns.pdbx_aniso_diffraction_limit_2 ? _reflns.pdbx_aniso_diffraction_limit_3 ? _reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[1] ? _reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[2] ? _reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[3] ? _reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[1] ? _reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[2] ? _reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[3] ? _reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[1] ? _reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[2] ? _reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[3] ? _reflns.pdbx_aniso_B_tensor_eigenvalue_1 ? _reflns.pdbx_aniso_B_tensor_eigenvalue_2 ? _reflns.pdbx_aniso_B_tensor_eigenvalue_3 ? _reflns.pdbx_orthogonalization_convention ? _reflns.pdbx_percent_possible_ellipsoidal ? _reflns.pdbx_percent_possible_spherical ? _reflns.pdbx_percent_possible_ellipsoidal_anomalous ? _reflns.pdbx_percent_possible_spherical_anomalous ? _reflns.pdbx_redundancy_anomalous ? _reflns.pdbx_CC_half_anomalous ? _reflns.pdbx_absDiff_over_sigma_anomalous ? _reflns.pdbx_percent_possible_anomalous ? _reflns.pdbx_observed_signal_threshold ? _reflns.pdbx_signal_type ? _reflns.pdbx_signal_details ? _reflns.pdbx_signal_software_id ? # _refine.aniso_B[1][1] ? _refine.aniso_B[1][2] ? _refine.aniso_B[1][3] ? _refine.aniso_B[2][2] ? _refine.aniso_B[2][3] ? _refine.aniso_B[3][3] ? _refine.B_iso_max ? _refine.B_iso_mean 32.13 _refine.B_iso_min ? _refine.correlation_coeff_Fo_to_Fc ? _refine.correlation_coeff_Fo_to_Fc_free ? _refine.details ? _refine.diff_density_max ? _refine.diff_density_max_esd ? _refine.diff_density_min ? _refine.diff_density_min_esd ? _refine.diff_density_rms ? _refine.diff_density_rms_esd ? _refine.entry_id 7MLC _refine.pdbx_refine_id "X-ray diffraction" _refine.ls_abs_structure_details ? _refine.ls_abs_structure_Flack ? _refine.ls_abs_structure_Flack_esd ? _refine.ls_abs_structure_Rogers ? _refine.ls_abs_structure_Rogers_esd ? _refine.ls_d_res_high 1.77 _refine.ls_d_res_low 42.41 _refine.ls_extinction_coef ? _refine.ls_extinction_coef_esd ? _refine.ls_extinction_expression ? _refine.ls_extinction_method ? _refine.ls_goodness_of_fit_all ? _refine.ls_goodness_of_fit_all_esd ? _refine.ls_goodness_of_fit_obs ? _refine.ls_goodness_of_fit_obs_esd ? _refine.ls_hydrogen_treatment ? _refine.ls_matrix_type ? _refine.ls_number_constraints ? _refine.ls_number_parameters ? _refine.ls_number_reflns_all ? _refine.ls_number_reflns_obs 15108 _refine.ls_number_reflns_R_free 1505 _refine.ls_number_reflns_R_work 13603 _refine.ls_number_restraints ? _refine.ls_percent_reflns_obs 96.90 _refine.ls_percent_reflns_R_free 9.96 _refine.ls_R_factor_all ? _refine.ls_R_factor_obs 0.1634 _refine.ls_R_factor_R_free 0.2037 _refine.ls_R_factor_R_free_error ? _refine.ls_R_factor_R_free_error_details ? _refine.ls_R_factor_R_work 0.1591 _refine.ls_R_Fsqd_factor_obs ? _refine.ls_R_I_factor_obs ? _refine.ls_redundancy_reflns_all ? _refine.ls_redundancy_reflns_obs ? _refine.ls_restrained_S_all ? _refine.ls_restrained_S_obs ? _refine.ls_shift_over_esd_max ? _refine.ls_shift_over_esd_mean ? _refine.ls_structure_factor_coef ? _refine.ls_weighting_details ? _refine.ls_weighting_scheme ? _refine.ls_wR_factor_all ? _refine.ls_wR_factor_obs ? _refine.ls_wR_factor_R_free ? _refine.ls_wR_factor_R_work ? _refine.occupancy_max ? _refine.occupancy_min ? _refine.solvent_model_details "FLAT BULK SOLVENT MODEL" _refine.solvent_model_param_bsol ? _refine.solvent_model_param_ksol ? _refine.pdbx_R_complete ? _refine.ls_R_factor_gt ? _refine.ls_goodness_of_fit_gt ? _refine.ls_goodness_of_fit_ref ? _refine.ls_shift_over_su_max ? _refine.ls_shift_over_su_max_lt ? _refine.ls_shift_over_su_mean ? _refine.ls_shift_over_su_mean_lt ? _refine.pdbx_ls_sigma_I ? _refine.pdbx_ls_sigma_F 0.00 _refine.pdbx_ls_sigma_Fsqd ? _refine.pdbx_data_cutoff_high_absF ? _refine.pdbx_data_cutoff_high_rms_absF ? _refine.pdbx_data_cutoff_low_absF ? _refine.pdbx_isotropic_thermal_model ? _refine.pdbx_ls_cross_valid_method "FREE R-VALUE" _refine.pdbx_method_to_determine_struct "MOLECULAR REPLACEMENT" _refine.pdbx_starting_model 6NWB _refine.pdbx_stereochemistry_target_values "GeoStd + Monomer Library + CDL v1.2" _refine.pdbx_R_Free_selection_details ? _refine.pdbx_stereochem_target_val_spec_case ? _refine.pdbx_overall_ESU_R ? _refine.pdbx_overall_ESU_R_Free ? _refine.pdbx_solvent_vdw_probe_radii 1.1100 _refine.pdbx_solvent_ion_probe_radii ? _refine.pdbx_solvent_shrinkage_radii 0.9000 _refine.pdbx_real_space_R ? _refine.pdbx_density_correlation ? _refine.pdbx_pd_number_of_powder_patterns ? _refine.pdbx_pd_number_of_points ? _refine.pdbx_pd_meas_number_of_points ? _refine.pdbx_pd_proc_ls_prof_R_factor ? _refine.pdbx_pd_proc_ls_prof_wR_factor ? _refine.pdbx_pd_Marquardt_correlation_coeff ? _refine.pdbx_pd_Fsqrd_R_factor ? _refine.pdbx_pd_ls_matrix_band_width ? _refine.pdbx_overall_phase_error 20.7478 _refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_free_Blow_DPI ? _refine.pdbx_overall_SU_R_Blow_DPI ? _refine.pdbx_TLS_residual_ADP_flag ? _refine.pdbx_diffrn_id 1 _refine.overall_SU_B ? _refine.overall_SU_ML 0.2070 _refine.overall_SU_R_Cruickshank_DPI ? _refine.overall_SU_R_free ? _refine.overall_FOM_free_R_set ? _refine.overall_FOM_work_R_set ? _refine.pdbx_average_fsc_overall ? _refine.pdbx_average_fsc_work ? _refine.pdbx_average_fsc_free ? # _refine_hist.pdbx_refine_id "X-ray diffraction" _refine_hist.cycle_id LAST _refine_hist.details ? _refine_hist.d_res_high 1.77 _refine_hist.d_res_low 42.41 _refine_hist.number_atoms_solvent 168 _refine_hist.number_atoms_total 1435 _refine_hist.number_reflns_all ? _refine_hist.number_reflns_obs ? _refine_hist.number_reflns_R_free ? _refine_hist.number_reflns_R_work ? _refine_hist.R_factor_all ? _refine_hist.R_factor_obs ? _refine_hist.R_factor_R_free ? _refine_hist.R_factor_R_work ? _refine_hist.pdbx_number_residues_total ? _refine_hist.pdbx_B_iso_mean_ligand ? _refine_hist.pdbx_B_iso_mean_solvent ? _refine_hist.pdbx_number_atoms_protein 1217 _refine_hist.pdbx_number_atoms_nucleic_acid 0 _refine_hist.pdbx_number_atoms_ligand 50 _refine_hist.pdbx_number_atoms_lipid ? _refine_hist.pdbx_number_atoms_carb ? _refine_hist.pdbx_pseudo_atom_details ? # _pdbx_struct_assembly.id 1 _pdbx_struct_assembly.details author_defined_assembly _pdbx_struct_assembly.method_details ? _pdbx_struct_assembly.oligomeric_details monomeric _pdbx_struct_assembly.oligomeric_count 1 # _pdbx_struct_assembly_gen.assembly_id 1 _pdbx_struct_assembly_gen.oper_expression 1 _pdbx_struct_assembly_gen.asym_id_list A,B,C,D # _pdbx_struct_oper_list.id 1 _pdbx_struct_oper_list.type "identity operation" _pdbx_struct_oper_list.name 1_555 _pdbx_struct_oper_list.symmetry_operation x,y,z _pdbx_struct_oper_list.matrix[1][1] 1.0000000000 _pdbx_struct_oper_list.matrix[1][2] 0.0000000000 _pdbx_struct_oper_list.matrix[1][3] 0.0000000000 _pdbx_struct_oper_list.vector[1] 0.0000000000 _pdbx_struct_oper_list.matrix[2][1] 0.0000000000 _pdbx_struct_oper_list.matrix[2][2] 1.0000000000 _pdbx_struct_oper_list.matrix[2][3] 0.0000000000 _pdbx_struct_oper_list.vector[2] 0.0000000000 _pdbx_struct_oper_list.matrix[3][1] 0.0000000000 _pdbx_struct_oper_list.matrix[3][2] 0.0000000000 _pdbx_struct_oper_list.matrix[3][3] 1.0000000000 _pdbx_struct_oper_list.vector[3] 0.0000000000 # loop_ _struct_asym.id _struct_asym.pdbx_blank_PDB_chainid_flag _struct_asym.pdbx_modified _struct_asym.entity_id _struct_asym.details A N N 1 ? B N N 2 ? C N N 3 ? D N N 4 ? # _struct.entry_id 7MLC _struct.title "PYL10 bound to the ABA pan-antagonist 4a" _struct.pdbx_model_details ? _struct.pdbx_formula_weight ? _struct.pdbx_formula_weight_method ? _struct.pdbx_model_type_details ? _struct.pdbx_CASP_flag N # _atom_sites.entry_id 7MLC _atom_sites.Cartn_transform_axes ? _atom_sites.fract_transf_matrix[1][1] 1.000000 _atom_sites.fract_transf_matrix[1][2] 0.000000 _atom_sites.fract_transf_matrix[1][3] 0.000000 _atom_sites.fract_transf_matrix[2][1] 0.000000 _atom_sites.fract_transf_matrix[2][2] 1.000000 _atom_sites.fract_transf_matrix[2][3] 0.000000 _atom_sites.fract_transf_matrix[3][1] 0.000000 _atom_sites.fract_transf_matrix[3][2] 0.000000 _atom_sites.fract_transf_matrix[3][3] 1.000000 _atom_sites.fract_transf_vector[1] 0.00000 _atom_sites.fract_transf_vector[2] 0.00000 _atom_sites.fract_transf_vector[3] 0.00000 # loop_ _pdbe_orig_poly_seq_scheme.asym_id _pdbe_orig_poly_seq_scheme.entity_id _pdbe_orig_poly_seq_scheme.seq_id _pdbe_orig_poly_seq_scheme.mon_id _pdbe_orig_poly_seq_scheme.ndb_seq_num _pdbe_orig_poly_seq_scheme.pdb_seq_num _pdbe_orig_poly_seq_scheme.auth_seq_num _pdbe_orig_poly_seq_scheme.pdb_mon_id _pdbe_orig_poly_seq_scheme.auth_mon_id _pdbe_orig_poly_seq_scheme.pdb_strand_id _pdbe_orig_poly_seq_scheme.pdb_ins_code _pdbe_orig_poly_seq_scheme.hetero A 1 1 SER 1 25 25 SER SER A . n A 1 2 GLN 2 26 26 GLN GLN A . n A 1 3 CYS 3 27 27 CYS CYS A . n A 1 4 SER 4 28 28 SER SER A . n A 1 5 SER 5 29 29 SER SER A . n A 1 6 THR 6 30 30 THR THR A . n A 1 7 LEU 7 31 31 LEU LEU A . n A 1 8 VAL 8 32 32 VAL VAL A . n A 1 9 LYS 9 33 33 LYS LYS A . n A 1 10 HIS 10 34 34 HIS HIS A . n A 1 11 ILE 11 35 35 ILE ILE A . n A 1 12 LYS 12 36 36 LYS LYS A . n A 1 13 ALA 13 37 37 ALA ALA A . n A 1 14 PRO 14 38 38 PRO PRO A . n A 1 15 LEU 15 39 39 LEU LEU A . n A 1 16 HIS 16 40 40 HIS HIS A . n A 1 17 LEU 17 41 41 LEU LEU A . n A 1 18 VAL 18 42 42 VAL VAL A . n A 1 19 TRP 19 43 43 TRP TRP A . n A 1 20 SER 20 44 44 SER SER A . n A 1 21 ILE 21 45 45 ILE ILE A . n A 1 22 VAL 22 46 46 VAL VAL A . n A 1 23 ARG 23 47 47 ARG ARG A . n A 1 24 ARG 24 48 48 ARG ARG A . n A 1 25 PHE 25 49 49 PHE PHE A . n A 1 26 ASP 26 50 50 ASP ASP A . n A 1 27 GLU 27 51 51 GLU GLU A . n A 1 28 PRO 28 52 52 PRO PRO A . n A 1 29 GLN 29 53 53 GLN GLN A . n A 1 30 LYS 30 54 54 LYS LYS A . n A 1 31 TYR 31 55 55 TYR TYR A . n A 1 32 LYS 32 56 56 LYS LYS A . n A 1 33 PRO 33 57 57 PRO PRO A . n A 1 34 PHE 34 58 58 PHE PHE A . n A 1 35 ILE 35 59 59 ILE ILE A . n A 1 36 SER 36 60 60 SER SER A . n A 1 37 ARG 37 61 61 ARG ARG A . n A 1 38 CYS 38 62 62 CYS CYS A . n A 1 39 VAL 39 63 63 VAL VAL A . n A 1 40 VAL 40 64 64 VAL VAL A . n A 1 41 GLN 41 65 65 GLN GLN A . n A 1 42 GLY 42 66 66 GLY GLY A . n A 1 43 LYS 43 67 67 LYS LYS A . n A 1 44 LYS 44 68 68 LYS LYS A . n A 1 45 LEU 45 69 69 LEU LEU A . n A 1 46 GLU 46 70 70 GLU GLU A . n A 1 47 VAL 47 71 71 VAL VAL A . n A 1 48 GLY 48 72 72 GLY GLY A . n A 1 49 SER 49 73 73 SER SER A . n A 1 50 VAL 50 74 74 VAL VAL A . n A 1 51 ARG 51 75 75 ARG ARG A . n A 1 52 GLU 52 76 76 GLU GLU A . n A 1 53 VAL 53 77 77 VAL VAL A . n A 1 54 ASP 54 78 78 ASP ASP A . n A 1 55 LEU 55 79 79 LEU LEU A . n A 1 56 LYS 56 80 80 LYS LYS A . n A 1 57 SER 57 81 81 SER SER A . n A 1 58 GLY 58 82 82 GLY GLY A . n A 1 59 LEU 59 83 83 LEU LEU A . n A 1 60 PRO 60 84 84 PRO PRO A . n A 1 61 ALA 61 85 85 ALA ALA A . n A 1 62 THR 62 86 86 THR THR A . n A 1 63 LYS 63 87 87 LYS LYS A . n A 1 64 SER 64 88 88 SER SER A . n A 1 65 THR 65 89 89 THR THR A . n A 1 66 GLU 66 90 90 GLU GLU A . n A 1 67 VAL 67 91 91 VAL VAL A . n A 1 68 LEU 68 92 92 LEU LEU A . n A 1 69 GLU 69 93 93 GLU GLU A . n A 1 70 ILE 70 94 94 ILE ILE A . n A 1 71 LEU 71 95 95 LEU LEU A . n A 1 72 ASP 72 96 96 ASP ASP A . n A 1 73 ASP 73 97 97 ASP ASP A . n A 1 74 ASN 74 98 98 ASN ASN A . n A 1 75 GLU 75 99 99 GLU GLU A . n A 1 76 HIS 76 100 100 HIS HIS A . n A 1 77 ILE 77 101 101 ILE ILE A . n A 1 78 LEU 78 102 102 LEU LEU A . n A 1 79 GLY 79 103 103 GLY GLY A . n A 1 80 ILE 80 104 104 ILE ILE A . n A 1 81 ARG 81 105 105 ARG ARG A . n A 1 82 ILE 82 106 106 ILE ILE A . n A 1 83 VAL 83 107 107 VAL VAL A . n A 1 84 GLY 84 108 108 GLY GLY A . n A 1 85 GLY 85 109 109 GLY GLY A . n A 1 86 ASP 86 110 110 ASP ASP A . n A 1 87 HIS 87 111 111 HIS HIS A . n A 1 88 ARG 88 112 112 ARG ARG A . n A 1 89 LEU 89 113 113 LEU LEU A . n A 1 90 LYS 90 114 114 LYS LYS A . n A 1 91 ASN 91 115 115 ASN ASN A . n A 1 92 TYR 92 116 116 TYR TYR A . n A 1 93 SER 93 117 117 SER SER A . n A 1 94 SER 94 118 118 SER SER A . n A 1 95 THR 95 119 119 THR THR A . n A 1 96 ILE 96 120 120 ILE ILE A . n A 1 97 SER 97 121 121 SER SER A . n A 1 98 LEU 98 122 122 LEU LEU A . n A 1 99 HIS 99 123 123 HIS HIS A . n A 1 100 SER 100 124 124 SER SER A . n A 1 101 GLU 101 125 125 GLU GLU A . n A 1 102 THR 102 126 126 THR THR A . n A 1 103 ILE 103 127 127 ILE ILE A . n A 1 104 ASP 104 128 128 ASP ASP A . n A 1 105 GLY 105 129 129 GLY GLY A . n A 1 106 LYS 106 130 130 LYS LYS A . n A 1 107 THR 107 131 131 THR THR A . n A 1 108 GLY 108 132 132 GLY GLY A . n A 1 109 THR 109 133 133 THR THR A . n A 1 110 LEU 110 134 134 LEU LEU A . n A 1 111 ALA 111 135 135 ALA ALA A . n A 1 112 ILE 112 136 136 ILE ILE A . n A 1 113 GLU 113 137 137 GLU GLU A . n A 1 114 SER 114 138 138 SER SER A . n A 1 115 PHE 115 139 139 PHE PHE A . n A 1 116 VAL 116 140 140 VAL VAL A . n A 1 117 VAL 117 141 141 VAL VAL A . n A 1 118 ASP 118 142 142 ASP ASP A . n A 1 119 VAL 119 143 143 VAL VAL A . n A 1 120 PRO 120 144 144 PRO PRO A . n A 1 121 GLU 121 145 145 GLU GLU A . n A 1 122 GLY 122 146 146 GLY GLY A . n A 1 123 ASN 123 147 147 ASN ASN A . n A 1 124 THR 124 148 148 THR THR A . n A 1 125 LYS 125 149 149 LYS LYS A . n A 1 126 GLU 126 150 150 GLU GLU A . n A 1 127 GLU 127 151 151 GLU GLU A . n A 1 128 THR 128 152 152 THR THR A . n A 1 129 CYS 129 153 153 CYS CYS A . n A 1 130 PHE 130 154 154 PHE PHE A . n A 1 131 PHE 131 155 155 PHE PHE A . n A 1 132 VAL 132 156 156 VAL VAL A . n A 1 133 GLU 133 157 157 GLU GLU A . n A 1 134 ALA 134 158 158 ALA ALA A . n A 1 135 LEU 135 159 159 LEU LEU A . n A 1 136 ILE 136 160 160 ILE ILE A . n A 1 137 GLN 137 161 161 GLN GLN A . n A 1 138 CYS 138 162 162 CYS CYS A . n A 1 139 ASN 139 163 163 ASN ASN A . n A 1 140 LEU 140 164 164 LEU LEU A . n A 1 141 ASN 141 165 165 ASN ASN A . n A 1 142 SER 142 166 166 SER SER A . n A 1 143 LEU 143 167 167 LEU LEU A . n A 1 144 ALA 144 168 168 ALA ALA A . n A 1 145 ASP 145 169 169 ASP ASP A . n A 1 146 VAL 146 170 170 VAL VAL A . n A 1 147 THR 147 171 171 THR THR A . n A 1 148 GLU 148 172 172 GLU GLU A . n A 1 149 ARG 149 173 173 ARG ARG A . n A 1 150 LEU 150 174 174 LEU LEU A . n A 1 151 GLN 151 175 175 GLN GLN A . n A 1 152 ALA 152 176 176 ALA ALA A . n A 1 153 GLU 153 177 177 GLU GLU A . n A 1 154 SER 154 178 178 SER SER A . n A 1 155 MET 155 179 179 MET MET A . n A 1 156 GLU 156 180 180 GLU GLU A . n A 1 157 LYS 157 181 ? ? ? A . n A 1 158 LYS 158 182 ? ? ? A . n A 1 159 ILE 159 183 ? ? ? A . n # loop_ _pdbe_orig_nonpoly_scheme.asym_id _pdbe_orig_nonpoly_scheme.entity_id _pdbe_orig_nonpoly_scheme.mon_id _pdbe_orig_nonpoly_scheme.ndb_seq_num _pdbe_orig_nonpoly_scheme.pdb_seq_num _pdbe_orig_nonpoly_scheme.auth_seq_num _pdbe_orig_nonpoly_scheme.pdb_mon_id _pdbe_orig_nonpoly_scheme.auth_mon_id _pdbe_orig_nonpoly_scheme.pdb_strand_id _pdbe_orig_nonpoly_scheme.pdb_ins_code B 2 GOL 1 201 2 GOL GOL A . C 3 ZLA 1 202 1 ZLA DRG A . D 4 HOH 1 301 98 HOH HOH A . D 4 HOH 2 302 86 HOH HOH A . D 4 HOH 3 303 62 HOH HOH A . D 4 HOH 4 304 80 HOH HOH A . D 4 HOH 5 305 65 HOH HOH A . D 4 HOH 6 306 69 HOH HOH A . D 4 HOH 7 307 45 HOH HOH A . D 4 HOH 8 308 51 HOH HOH A . D 4 HOH 9 309 159 HOH HOH A . D 4 HOH 10 310 161 HOH HOH A . D 4 HOH 11 311 59 HOH HOH A . D 4 HOH 12 312 140 HOH HOH A . D 4 HOH 13 313 108 HOH HOH A . D 4 HOH 14 314 173 HOH HOH A . D 4 HOH 15 315 48 HOH HOH A . D 4 HOH 16 316 87 HOH HOH A . D 4 HOH 17 317 33 HOH HOH A . D 4 HOH 18 318 42 HOH HOH A . D 4 HOH 19 319 142 HOH HOH A . D 4 HOH 20 320 132 HOH HOH A . D 4 HOH 21 321 58 HOH HOH A . D 4 HOH 22 322 29 HOH HOH A . D 4 HOH 23 323 23 HOH HOH A . D 4 HOH 24 324 8 HOH HOH A . D 4 HOH 25 325 35 HOH HOH A . D 4 HOH 26 326 64 HOH HOH A . D 4 HOH 27 327 76 HOH HOH A . D 4 HOH 28 328 156 HOH HOH A . D 4 HOH 29 329 38 HOH HOH A . D 4 HOH 30 330 1 HOH HOH A . D 4 HOH 31 331 60 HOH HOH A . D 4 HOH 32 332 21 HOH HOH A . D 4 HOH 33 333 116 HOH HOH A . D 4 HOH 34 334 7 HOH HOH A . D 4 HOH 35 335 111 HOH HOH A . D 4 HOH 36 336 36 HOH HOH A . D 4 HOH 37 337 12 HOH HOH A . D 4 HOH 38 338 66 HOH HOH A . D 4 HOH 39 339 139 HOH HOH A . D 4 HOH 40 340 27 HOH HOH A . D 4 HOH 41 341 34 HOH HOH A . D 4 HOH 42 342 26 HOH HOH A . D 4 HOH 43 343 151 HOH HOH A . D 4 HOH 44 344 124 HOH HOH A . D 4 HOH 45 345 121 HOH HOH A . D 4 HOH 46 346 57 HOH HOH A . D 4 HOH 47 347 128 HOH HOH A . D 4 HOH 48 348 39 HOH HOH A . D 4 HOH 49 349 30 HOH HOH A . D 4 HOH 50 350 4 HOH HOH A . D 4 HOH 51 351 160 HOH HOH A . D 4 HOH 52 352 90 HOH HOH A . D 4 HOH 53 353 55 HOH HOH A . D 4 HOH 54 354 89 HOH HOH A . D 4 HOH 55 355 49 HOH HOH A . D 4 HOH 56 356 16 HOH HOH A . D 4 HOH 57 357 63 HOH HOH A . D 4 HOH 58 358 133 HOH HOH A . D 4 HOH 59 359 96 HOH HOH A . D 4 HOH 60 360 117 HOH HOH A . D 4 HOH 61 361 3 HOH HOH A . D 4 HOH 62 362 24 HOH HOH A . D 4 HOH 63 363 2 HOH HOH A . D 4 HOH 64 364 37 HOH HOH A . D 4 HOH 65 365 129 HOH HOH A . D 4 HOH 66 366 31 HOH HOH A . D 4 HOH 67 367 82 HOH HOH A . D 4 HOH 68 368 25 HOH HOH A . D 4 HOH 69 369 22 HOH HOH A . D 4 HOH 70 370 11 HOH HOH A . D 4 HOH 71 371 50 HOH HOH A . D 4 HOH 72 372 157 HOH HOH A . D 4 HOH 73 373 19 HOH HOH A . D 4 HOH 74 374 14 HOH HOH A . D 4 HOH 75 375 5 HOH HOH A . D 4 HOH 76 376 61 HOH HOH A . D 4 HOH 77 377 101 HOH HOH A . D 4 HOH 78 378 9 HOH HOH A . D 4 HOH 79 379 75 HOH HOH A . D 4 HOH 80 380 41 HOH HOH A . D 4 HOH 81 381 20 HOH HOH A . D 4 HOH 82 382 110 HOH HOH A . D 4 HOH 83 383 13 HOH HOH A . D 4 HOH 84 384 113 HOH HOH A . D 4 HOH 85 385 102 HOH HOH A . D 4 HOH 86 386 152 HOH HOH A . D 4 HOH 87 387 10 HOH HOH A . D 4 HOH 88 388 18 HOH HOH A . D 4 HOH 89 389 114 HOH HOH A . D 4 HOH 90 390 135 HOH HOH A . D 4 HOH 91 391 77 HOH HOH A . D 4 HOH 92 392 54 HOH HOH A . D 4 HOH 93 393 52 HOH HOH A . D 4 HOH 94 394 72 HOH HOH A . D 4 HOH 95 395 144 HOH HOH A . D 4 HOH 96 396 6 HOH HOH A . D 4 HOH 97 397 163 HOH HOH A . D 4 HOH 98 398 176 HOH HOH A . D 4 HOH 99 399 46 HOH HOH A . D 4 HOH 100 400 99 HOH HOH A . D 4 HOH 101 401 67 HOH HOH A . D 4 HOH 102 402 100 HOH HOH A . D 4 HOH 103 403 166 HOH HOH A . D 4 HOH 104 404 112 HOH HOH A . D 4 HOH 105 405 158 HOH HOH A . D 4 HOH 106 406 32 HOH HOH A . D 4 HOH 107 407 44 HOH HOH A . D 4 HOH 108 408 53 HOH HOH A . D 4 HOH 109 409 43 HOH HOH A . D 4 HOH 110 410 150 HOH HOH A . D 4 HOH 111 411 168 HOH HOH A . D 4 HOH 112 412 40 HOH HOH A . D 4 HOH 113 413 15 HOH HOH A . D 4 HOH 114 414 126 HOH HOH A . D 4 HOH 115 415 105 HOH HOH A . D 4 HOH 116 416 71 HOH HOH A . D 4 HOH 117 417 104 HOH HOH A . D 4 HOH 118 418 79 HOH HOH A . D 4 HOH 119 419 93 HOH HOH A . D 4 HOH 120 420 120 HOH HOH A . D 4 HOH 121 421 143 HOH HOH A . D 4 HOH 122 422 28 HOH HOH A . D 4 HOH 123 423 103 HOH HOH A . D 4 HOH 124 424 68 HOH HOH A . D 4 HOH 125 425 125 HOH HOH A . D 4 HOH 126 426 56 HOH HOH A . D 4 HOH 127 427 122 HOH HOH A . D 4 HOH 128 428 146 HOH HOH A . D 4 HOH 129 429 107 HOH HOH A . D 4 HOH 130 430 174 HOH HOH A . D 4 HOH 131 431 74 HOH HOH A . D 4 HOH 132 432 81 HOH HOH A . D 4 HOH 133 433 91 HOH HOH A . D 4 HOH 134 434 175 HOH HOH A . D 4 HOH 135 435 136 HOH HOH A . D 4 HOH 136 436 97 HOH HOH A . D 4 HOH 137 437 92 HOH HOH A . D 4 HOH 138 438 130 HOH HOH A . D 4 HOH 139 439 170 HOH HOH A . D 4 HOH 140 440 162 HOH HOH A . D 4 HOH 141 441 78 HOH HOH A . D 4 HOH 142 442 167 HOH HOH A . D 4 HOH 143 443 171 HOH HOH A . D 4 HOH 144 444 84 HOH HOH A . D 4 HOH 145 445 131 HOH HOH A . D 4 HOH 146 446 147 HOH HOH A . D 4 HOH 147 447 134 HOH HOH A . D 4 HOH 148 448 119 HOH HOH A . D 4 HOH 149 449 169 HOH HOH A . D 4 HOH 150 450 138 HOH HOH A . D 4 HOH 151 451 106 HOH HOH A . D 4 HOH 152 452 115 HOH HOH A . D 4 HOH 153 453 123 HOH HOH A . D 4 HOH 154 454 141 HOH HOH A . D 4 HOH 155 455 127 HOH HOH A . D 4 HOH 156 456 47 HOH HOH A . D 4 HOH 157 457 137 HOH HOH A . D 4 HOH 158 458 85 HOH HOH A . D 4 HOH 159 459 95 HOH HOH A . D 4 HOH 160 460 70 HOH HOH A . D 4 HOH 161 461 154 HOH HOH A . D 4 HOH 162 462 172 HOH HOH A . D 4 HOH 163 463 73 HOH HOH A . D 4 HOH 164 464 164 HOH HOH A . D 4 HOH 165 465 17 HOH HOH A . D 4 HOH 166 466 88 HOH HOH A . D 4 HOH 167 467 83 HOH HOH A . D 4 HOH 168 468 165 HOH HOH A . # loop_ _entity.id _entity.type _entity.src_method _entity.pdbx_description _entity.formula_weight _entity.pdbx_number_of_molecules _entity.pdbx_ec _entity.pdbx_mutation _entity.pdbx_fragment _entity.details _entity.assembly_id 1 polymer man "Abscisic acid receptor PYL10" 17747.307 1 ? ? ? ? 1 2 non-polymer syn GLYCEROL 92.094 1 ? ? ? ? 1 3 non-polymer syn "1-{2-[3,5-dicyclopropyl-4-(4-{[(quinoxaline-2-carbonyl)amino]methyl}-1H-1,2,3-triazol-1-yl)phenyl]acetamido}cyclohexane-1-carboxylic acid" 593.675 1 ? ? ? ? 1 4 water nat water 18.015 1 ? ? ? ? 1 # _entity_poly.entity_id 1 _entity_poly.type polypeptide(L) _entity_poly.nstd_linkage no _entity_poly.nstd_monomer no _entity_poly.pdbx_seq_one_letter_code ;SQCSSTLVKHIKAPLHLVWSIVRRFDEPQKYKPFISRCVVQGKKLEVGSVREVDLKSGLPATKSTEVLEILDDNEHILGI RIVGGDHRLKNYSSTISLHSETIDGKTGTLAIESFVVDVPEGNTKEETCFFVEALIQCNLNSLADVTERLQAESMEKKI ; _entity_poly.pdbx_seq_one_letter_code_can ;SQCSSTLVKHIKAPLHLVWSIVRRFDEPQKYKPFISRCVVQGKKLEVGSVREVDLKSGLPATKSTEVLEILDDNEHILGI RIVGGDHRLKNYSSTISLHSETIDGKTGTLAIESFVVDVPEGNTKEETCFFVEALIQCNLNSLADVTERLQAESMEKKI ; _entity_poly.pdbx_strand_id A _entity_poly.pdbx_target_identifier ? _entity_poly.assembly_id 1 # loop_ _pdbx_entity_nonpoly.assembly_id _pdbx_entity_nonpoly.entity_id _pdbx_entity_nonpoly.name _pdbx_entity_nonpoly.comp_id 1 2 GLYCEROL GOL 1 3 "1-{2-[3,5-dicyclopropyl-4-(4-{[(quinoxaline-2-carbonyl)amino]methyl}-1H-1,2,3-triazol-1-yl)phenyl]acetamido}cyclohexane-1-carboxylic acid" ZLA 1 4 water HOH # loop_ _pdbe_entity_remapping.source_coordinates _pdbe_entity_remapping.assembly_id _pdbe_entity_remapping.entity_id _pdbe_entity_remapping.type _pdbe_entity_remapping.description 7MLC 1 1 polypeptide(L) "Abscisic acid receptor PYL10" 7MLC 1 2 ligand GLYCEROL 7MLC 1 3 ligand "1-{2-[3,5-dicyclopropyl-4-(4-{[(quinoxaline-2-carbonyl)amino]methyl}-1H-1,2,3-triazol-1-yl)phenyl]acetamido}cyclohexane-1-carboxylic acid" 7MLC 1 4 ligand water # loop_ _pdbe_chain_remapping.source_coordinates _pdbe_chain_remapping.assembly_id _pdbe_chain_remapping.model_num _pdbe_chain_remapping.entity_id _pdbe_chain_remapping.orig_auth_asym_id _pdbe_chain_remapping.new_auth_asym_id _pdbe_chain_remapping.orig_label_asym_id _pdbe_chain_remapping.new_label_asym_id _pdbe_chain_remapping.applied_operations 7MLC 1 1 1 A A A A "_1" 7MLC 1 1 2 A B B B "_1" 7MLC 1 1 3 A C C C "_1" 7MLC 1 1 4 A D D D "_1" #