data_1kuf-assembly-1_atom_site # 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 . GLN A 1 3 ? -5.008 36.473 15.178 1.0 27.32 ? 3 GLN A N 1 3 . A ATOM 2 C CA . GLN A 1 3 ? -4.539 35.060 15.026 1.0 26.35 ? 3 GLN A CA 1 3 . A ATOM 3 C C . GLN A 1 3 ? -5.621 34.207 14.361 1.0 25.05 ? 3 GLN A C 1 3 . A ATOM 4 O O . GLN A 1 3 ? -6.814 34.370 14.641 1.0 25.6 ? 3 GLN A O 1 3 . A ATOM 5 C CB . GLN A 1 3 ? -4.214 34.456 16.396 1.0 27.77 ? 3 GLN A CB 1 3 . A ATOM 6 C CG . GLN A 1 3 ? -3.153 35.203 17.220 1.0 29.78 ? 3 GLN A CG 1 3 . A ATOM 7 C CD . GLN A 1 3 ? -1.745 34.646 17.040 1.0 31.21 ? 3 GLN A CD 1 3 . A ATOM 8 O OE1 . GLN A 1 3 ? -0.794 35.146 17.645 1.0 32.7 ? 3 GLN A OE1 1 3 . A ATOM 9 N NE2 . GLN A 1 3 ? -1.606 33.605 16.212 1.0 31.34 ? 3 GLN A NE2 1 3 . A ATOM 10 N N . ARG A 1 4 ? -5.201 33.295 13.489 1.0 22.63 ? 4 ARG A N 1 4 . A ATOM 11 C CA . ARG A 1 4 ? -6.145 32.409 12.819 1.0 19.77 ? 4 ARG A CA 1 4 . A ATOM 12 C C . ARG A 1 4 ? -6.689 31.391 13.822 1.0 18.49 ? 4 ARG A C 1 4 . A ATOM 13 O O . ARG A 1 4 ? -7.846 30.967 13.732 1.0 18.11 ? 4 ARG A O 1 4 . A ATOM 14 C CB . ARG A 1 4 ? -5.466 31.684 11.654 1.0 20.55 ? 4 ARG A CB 1 4 . A ATOM 15 C CG . ARG A 1 4 ? -6.330 30.581 11.040 1.0 19.6 ? 4 ARG A CG 1 4 . A ATOM 16 C CD . ARG A 1 4 ? -5.664 29.877 9.861 1.0 19.81 ? 4 ARG A CD 1 4 . A ATOM 17 N NE . ARG A 1 4 ? -6.485 28.740 9.445 1.0 19.77 ? 4 ARG A NE 1 4 . A ATOM 18 C CZ . ARG A 1 4 ? -6.284 28.014 8.350 1.0 19.14 ? 4 ARG A CZ 1 4 . A ATOM 19 N NH1 . ARG A 1 4 ? -5.290 28.297 7.523 1.0 19.76 ? 4 ARG A NH1 1 4 . A ATOM 20 N NH2 . ARG A 1 4 ? -7.071 26.975 8.107 1.0 20.05 ? 4 ARG A NH2 1 4 . A ATOM 21 N N . PHE A 1 5 ? -5.864 31.030 14.806 1.0 15.93 ? 5 PHE A N 1 5 . A ATOM 22 C CA . PHE A 1 5 ? -6.264 30.030 15.792 1.0 13.81 ? 5 PHE A CA 1 5 . A ATOM 23 C C . PHE A 1 5 ? -6.340 30.554 17.228 1.0 13.93 ? 5 PHE A C 1 5 . A ATOM 24 O O . PHE A 1 5 ? -5.611 31.471 17.589 1.0 13.76 ? 5 PHE A O 1 5 . A ATOM 25 C CB . PHE A 1 5 ? -5.275 28.855 15.767 1.0 13.82 ? 5 PHE A CB 1 5 . A ATOM 26 C CG . PHE A 1 5 ? -5.245 28.137 14.455 1.0 12.08 ? 5 PHE A CG 1 5 . A ATOM 27 C CD1 . PHE A 1 5 ? -4.216 28.364 13.548 1.0 11.84 ? 5 PHE A CD1 1 5 . A ATOM 28 C CD2 . PHE A 1 5 ? -6.266 27.255 14.119 1.0 12.23 ? 5 PHE A CD2 1 5 . A ATOM 29 C CE1 . PHE A 1 5 ? -4.205 27.707 12.300 1.0 12.39 ? 5 PHE A CE1 1 5 . A ATOM 30 C CE2 . PHE A 1 5 ? -6.260 26.600 12.885 1.0 11.32 ? 5 PHE A CE2 1 5 . A ATOM 31 C CZ . PHE A 1 5 ? -5.232 26.829 11.982 1.0 10.94 ? 5 PHE A CZ 1 5 . A ATOM 32 N N . PRO A 1 6 ? -7.236 29.969 18.042 1.0 14.15 ? 6 PRO A N 1 6 . A ATOM 33 C CA . PRO A 1 6 ? -7.414 30.350 19.441 1.0 13.92 ? 6 PRO A CA 1 6 . A ATOM 34 C C . PRO A 1 6 ? -6.182 29.827 20.204 1.0 13.59 ? 6 PRO A C 1 6 . A ATOM 35 O O . PRO A 1 6 ? -5.516 28.862 19.772 1.0 13.3 ? 6 PRO A O 1 6 . A ATOM 36 C CB . PRO A 1 6 ? -8.699 29.631 19.825 1.0 15.26 ? 6 PRO A CB 1 6 . A ATOM 37 C CG . PRO A 1 6 ? -8.603 28.324 19.030 1.0 14.35 ? 6 PRO A CG 1 6 . A ATOM 38 C CD . PRO A 1 6 ? -8.111 28.832 17.682 1.0 14.58 ? 6 PRO A CD 1 6 . A ATOM 39 N N . GLN A 1 7 ? -5.886 30.441 21.336 1.0 13.48 ? 7 GLN A N 1 7 . A ATOM 40 C CA . GLN A 1 7 ? -4.725 30.048 22.132 1.0 12.73 ? 7 GLN A CA 1 7 . A ATOM 41 C C . GLN A 1 7 ? -4.785 28.625 22.662 1.0 12.24 ? 7 GLN A C 1 7 . A ATOM 42 O O . GLN A 1 7 ? -5.820 28.180 23.179 1.0 12.12 ? 7 GLN A O 1 7 . A ATOM 43 C CB . GLN A 1 7 ? -4.589 30.987 23.334 1.0 13.63 ? 7 GLN A CB 1 7 . A ATOM 44 C CG . GLN A 1 7 ? -3.394 30.668 24.214 1.0 15.16 ? 7 GLN A CG 1 7 . A ATOM 45 C CD . GLN A 1 7 ? -2.118 31.162 23.576 1.0 17.01 ? 7 GLN A CD 1 7 . A ATOM 46 O OE1 . GLN A 1 7 ? -2.004 32.354 23.255 1.0 18.23 ? 7 GLN A OE1 1 7 . A ATOM 47 N NE2 . GLN A 1 7 ? -1.162 30.258 23.355 1.0 15.24 ? 7 GLN A NE2 1 7 . A ATOM 48 N N . ARG A 1 8 ? -3.669 27.913 22.529 1.0 11.54 ? 8 ARG A N 1 8 . A ATOM 49 C CA . ARG A 1 8 ? -3.556 26.562 23.071 1.0 10.47 ? 8 ARG A CA 1 8 . A ATOM 50 C C . ARG A 1 8 ? -2.177 26.455 23.705 1.0 11.13 ? 8 ARG A C 1 8 . A ATOM 51 O O . ARG A 1 8 ? -1.305 27.294 23.471 1.0 11.21 ? 8 ARG A O 1 8 . A ATOM 52 C CB . ARG A 1 8 ? -3.747 25.500 21.970 1.0 10.31 ? 8 ARG A CB 1 8 . A ATOM 53 C CG . ARG A 1 8 ? -5.209 25.387 21.477 1.0 11.6 ? 8 ARG A CG 1 8 . A ATOM 54 C CD . ARG A 1 8 ? -6.137 24.896 22.562 1.0 12.26 ? 8 ARG A CD 1 8 . A ATOM 55 N NE . ARG A 1 8 ? -7.493 24.632 22.065 1.0 12.33 ? 8 ARG A NE 1 8 . A ATOM 56 C CZ . ARG A 1 8 ? -8.434 25.559 21.893 1.0 13.17 ? 8 ARG A CZ 1 8 . A ATOM 57 N NH1 . ARG A 1 8 ? -9.634 25.210 21.436 1.0 14.19 ? 8 ARG A NH1 1 8 . A ATOM 58 N NH2 . ARG A 1 8 ? -8.180 26.827 22.178 1.0 14.27 ? 8 ARG A NH2 1 8 . A ATOM 59 N N . TYR A 1 9 ? -1.997 25.418 24.512 1.0 11.39 ? 9 TYR A N 1 9 . A ATOM 60 C CA . TYR A 1 9 ? -0.731 25.208 25.223 1.0 11.77 ? 9 TYR A CA 1 9 . A ATOM 61 C C . TYR A 1 9 ? -0.333 23.757 25.192 1.0 12.21 ? 9 TYR A C 1 9 . A ATOM 62 O O . TYR A 1 9 ? -1.177 22.887 25.378 1.0 13.87 ? 9 TYR A O 1 9 . A ATOM 63 C CB . TYR A 1 9 ? -0.899 25.602 26.695 1.0 13.26 ? 9 TYR A CB 1 9 . A ATOM 64 C CG . TYR A 1 9 ? -1.550 26.931 26.910 1.0 14.33 ? 9 TYR A CG 1 9 . A ATOM 65 C CD1 . TYR A 1 9 ? -2.943 27.054 26.928 1.0 15.3 ? 9 TYR A CD1 1 9 . A ATOM 66 C CD2 . TYR A 1 9 ? -0.783 28.068 27.112 1.0 15.1 ? 9 TYR A CD2 1 9 . A ATOM 67 C CE1 . TYR A 1 9 ? -3.547 28.301 27.151 1.0 16.87 ? 9 TYR A CE1 1 9 . A ATOM 68 C CE2 . TYR A 1 9 ? -1.375 29.307 27.329 1.0 16.84 ? 9 TYR A CE2 1 9 . A ATOM 69 C CZ . TYR A 1 9 ? -2.755 29.406 27.350 1.0 17.15 ? 9 TYR A CZ 1 9 . A ATOM 70 O OH . TYR A 1 9 ? -3.368 30.620 27.576 1.0 20.16 ? 9 TYR A OH 1 9 . A ATOM 71 N N . ILE A 1 10 ? 0.941 23.481 24.929 1.0 10.73 ? 10 ILE A N 1 10 . A ATOM 72 C CA . ILE A 1 10 ? 1.373 22.084 25.002 1.0 10.33 ? 10 ILE A CA 1 10 . A ATOM 73 C C . ILE A 1 10 ? 2.560 21.991 25.945 1.0 10.42 ? 10 ILE A C 1 10 . A ATOM 74 O O . ILE A 1 10 ? 3.603 22.569 25.660 1.0 10.72 ? 10 ILE A O 1 10 . A ATOM 75 C CB . ILE A 1 10 ? 1.771 21.497 23.633 1.0 10.93 ? 10 ILE A CB 1 10 . A ATOM 76 C CG1 . ILE A 1 10 ? 0.514 21.459 22.734 1.0 11.39 ? 10 ILE A CG1 1 10 . A ATOM 77 C CG2 . ILE A 1 10 ? 2.336 20.051 23.807 1.0 11.21 ? 10 ILE A CG2 1 10 . A ATOM 78 C CD1 . ILE A 1 10 ? 0.781 21.133 21.282 1.0 11.88 ? 10 ILE A CD1 1 10 . A ATOM 79 N N . GLU A 1 11 ? 2.373 21.252 27.042 1.0 10.59 ? 11 GLU A N 1 11 . A ATOM 80 C CA . GLU A 1 11 ? 3.415 21.025 28.064 1.0 11.77 ? 11 GLU A CA 1 11 . A ATOM 81 C C . GLU A 1 11 ? 4.103 19.743 27.673 1.0 10.48 ? 11 GLU A C 1 11 . A ATOM 82 O O . GLU A 1 11 ? 3.544 18.660 27.858 1.0 9.84 ? 11 GLU A O 1 11 . A ATOM 83 C CB . GLU A 1 11 ? 2.826 20.815 29.459 1.0 15.63 ? 11 GLU A CB 1 11 . A ATOM 84 C CG . GLU A 1 11 ? 2.554 22.069 30.230 1.0 22.45 ? 11 GLU A CG 1 11 . A ATOM 85 C CD . GLU A 1 11 ? 1.346 22.770 29.732 1.0 24.36 ? 11 GLU A CD 1 11 . A ATOM 86 O OE1 . GLU A 1 11 ? 1.387 23.290 28.602 1.0 28.41 ? 11 GLU A OE1 1 11 . A ATOM 87 O OE2 . GLU A 1 11 ? 0.340 22.801 30.475 1.0 27.58 ? 11 GLU A OE2 1 11 . A ATOM 88 N N . LEU A 1 12 ? 5.328 19.865 27.185 1.0 9.19 ? 12 LEU A N 1 12 . A ATOM 89 C CA . LEU A 1 12 ? 6.091 18.715 26.706 1.0 8.31 ? 12 LEU A CA 1 12 . A ATOM 90 C C . LEU A 1 12 ? 6.977 18.031 27.703 1.0 8.77 ? 12 LEU A C 1 12 . A ATOM 91 O O . LEU A 1 12 ? 7.575 18.692 28.569 1.0 9.27 ? 12 LEU A O 1 12 . A ATOM 92 C CB . LEU A 1 12 ? 7.047 19.124 25.600 1.0 9.38 ? 12 LEU A CB 1 12 . A ATOM 93 C CG . LEU A 1 12 ? 6.618 19.679 24.272 1.0 11.09 ? 12 LEU A CG 1 12 . A ATOM 94 C CD1 . LEU A 1 12 ? 7.881 20.171 23.512 1.0 11.55 ? 12 LEU A CD1 1 12 . A ATOM 95 C CD2 . LEU A 1 12 ? 5.895 18.552 23.489 1.0 11.72 ? 12 LEU A CD2 1 12 . A ATOM 96 N N . ALA A 1 13 ? 7.089 16.712 27.585 1.0 7.45 ? 13 ALA A N 1 13 . A ATOM 97 C CA . ALA A 1 13 ? 8.101 16.009 28.355 1.0 7.82 ? 13 ALA A CA 1 13 . A ATOM 98 C C . ALA A 1 13 ? 9.045 15.496 27.255 1.0 7.65 ? 13 ALA A C 1 13 . A ATOM 99 O O . ALA A 1 13 ? 8.588 14.994 26.203 1.0 7.5 ? 13 ALA A O 1 13 . A ATOM 100 C CB . ALA A 1 13 ? 7.539 14.824 29.115 1.0 7.49 ? 13 ALA A CB 1 13 . A ATOM 101 N N . ILE A 1 14 ? 10.337 15.680 27.470 1.0 7.71 ? 14 ILE A N 1 14 . A ATOM 102 C CA . ILE A 1 14 ? 11.331 15.167 26.525 1.0 8.58 ? 14 ILE A CA 1 14 . A ATOM 103 C C . ILE A 1 14 ? 12.169 14.161 27.281 1.0 8.83 ? 14 ILE A C 1 14 . A ATOM 104 O O . ILE A 1 14 ? 12.643 14.429 28.385 1.0 9.44 ? 14 ILE A O 1 14 . A ATOM 105 C CB . ILE A 1 14 ? 12.243 16.285 25.966 1.0 8.69 ? 14 ILE A CB 1 14 . A ATOM 106 C CG1 . ILE A 1 14 ? 11.422 17.298 25.146 1.0 10.13 ? 14 ILE A CG1 1 14 . A ATOM 107 C CG2 . ILE A 1 14 ? 13.364 15.660 25.118 1.0 9.0 ? 14 ILE A CG2 1 14 . A ATOM 108 C CD1 . ILE A 1 14 ? 10.691 16.694 23.971 1.0 10.41 ? 14 ILE A CD1 1 14 . A ATOM 109 N N . VAL A 1 15 ? 12.313 12.982 26.688 1.0 8.49 ? 15 VAL A N 1 15 . A ATOM 110 C CA . VAL A 1 15 ? 13.089 11.902 27.273 1.0 8.42 ? 15 VAL A CA 1 15 . A ATOM 111 C C . VAL A 1 15 ? 14.266 11.633 26.334 1.0 8.56 ? 15 VAL A C 1 15 . A ATOM 112 O O . VAL A 1 15 ? 14.091 11.448 25.138 1.0 8.31 ? 15 VAL A O 1 15 . A ATOM 113 C CB . VAL A 1 15 ? 12.258 10.622 27.387 1.0 10.03 ? 15 VAL A CB 1 15 . A ATOM 114 C CG1 . VAL A 1 15 ? 13.101 9.542 28.007 1.0 11.28 ? 15 VAL A CG1 1 15 . A ATOM 115 C CG2 . VAL A 1 15 ? 11.025 10.878 28.218 1.0 10.8 ? 15 VAL A CG2 1 15 . A ATOM 116 N N . VAL A 1 16 ? 15.479 11.657 26.873 1.0 8.34 ? 16 VAL A N 1 16 . A ATOM 117 C CA . VAL A 1 16 ? 16.688 11.393 26.081 1.0 8.66 ? 16 VAL A CA 1 16 . A ATOM 118 C C . VAL A 1 16 ? 17.136 9.974 26.452 1.0 8.83 ? 16 VAL A C 1 16 . A ATOM 119 O O . VAL A 1 16 ? 17.414 9.702 27.634 1.0 8.79 ? 16 VAL A O 1 16 . A ATOM 120 C CB . VAL A 1 16 ? 17.763 12.444 26.436 1.0 8.39 ? 16 VAL A CB 1 16 . A ATOM 121 C CG1 . VAL A 1 16 ? 19.092 12.094 25.745 1.0 8.99 ? 16 VAL A CG1 1 16 . A ATOM 122 C CG2 . VAL A 1 16 ? 17.288 13.824 25.953 1.0 9.11 ? 16 VAL A CG2 1 16 . A ATOM 123 N N . ASP A 1 17 ? 17.254 9.082 25.466 1.0 7.33 ? 17 ASP A N 1 17 . A ATOM 124 C CA . ASP A 1 17 ? 17.623 7.704 25.807 1.0 7.96 ? 17 ASP A CA 1 17 . A ATOM 125 C C . ASP A 1 17 ? 19.114 7.531 26.096 1.0 7.6 ? 17 ASP A C 1 17 . A ATOM 126 O O . ASP A 1 17 ? 19.902 8.475 26.007 1.0 8.29 ? 17 ASP A O 1 17 . A ATOM 127 C CB . ASP A 1 17 ? 17.092 6.669 24.775 1.0 7.76 ? 17 ASP A CB 1 17 . A ATOM 128 C CG . ASP A 1 17 ? 17.881 6.627 23.483 1.0 8.15 ? 17 ASP A CG 1 17 . A ATOM 129 O OD1 . ASP A 1 17 ? 17.494 5.760 22.659 1.0 8.02 ? 17 ASP A OD1 1 17 . A ATOM 130 O OD2 . ASP A 1 17 ? 18.844 7.411 23.297 1.0 8.23 ? 17 ASP A OD2 1 17 . A ATOM 131 N N . HIS A 1 18 ? 19.507 6.312 26.457 1.0 8.77 ? 18 HIS A N 1 18 . A ATOM 132 C CA . HIS A 1 18 ? 20.891 6.109 26.848 1.0 9.98 ? 18 HIS A CA 1 18 . A ATOM 133 C C . HIS A 1 18 ? 21.888 6.205 25.711 1.0 9.45 ? 18 HIS A C 1 18 . A ATOM 134 O O . HIS A 1 18 ? 23.008 6.662 25.902 1.0 9.42 ? 18 HIS A O 1 18 . A ATOM 135 C CB . HIS A 1 18 ? 21.040 4.764 27.583 1.0 10.47 ? 18 HIS A CB 1 18 . A ATOM 136 C CG . HIS A 1 18 ? 22.362 4.615 28.271 1.0 11.84 ? 18 HIS A CG 1 18 . A ATOM 137 N ND1 . HIS A 1 18 ? 22.734 5.412 29.332 1.0 12.73 ? 18 HIS A ND1 1 18 . A ATOM 138 C CD2 . HIS A 1 18 ? 23.431 3.826 28.002 1.0 12.83 ? 18 HIS A CD2 1 18 . A ATOM 139 C CE1 . HIS A 1 18 ? 23.979 5.124 29.686 1.0 13.52 ? 18 HIS A CE1 1 18 . A ATOM 140 N NE2 . HIS A 1 18 ? 24.428 4.167 28.895 1.0 13.28 ? 18 HIS A NE2 1 18 . A ATOM 141 N N . GLY A 1 19 ? 21.476 5.791 24.512 1.0 9.51 ? 19 GLY A N 1 19 . A ATOM 142 C CA . GLY A 1 19 ? 22.347 5.891 23.358 1.0 9.83 ? 19 GLY A CA 1 19 . A ATOM 143 C C . GLY A 1 19 ? 22.628 7.364 23.062 1.0 9.07 ? 19 GLY A C 1 19 . A ATOM 144 O O . GLY A 1 19 ? 23.756 7.741 22.752 1.0 9.68 ? 19 GLY A O 1 19 . A ATOM 145 N N . MET A 1 20 ? 21.600 8.209 23.164 1.0 9.56 ? 20 MET A N 1 20 . A ATOM 146 C CA . MET A 1 20 ? 21.810 9.636 22.919 1.0 10.27 ? 20 MET A CA 1 20 . A ATOM 147 C C . MET A 1 20 ? 22.655 10.247 24.030 1.0 10.46 ? 20 MET A C 1 20 . A ATOM 148 O O . MET A 1 20 ? 23.504 11.089 23.751 1.0 9.91 ? 20 MET A O 1 20 . A ATOM 149 C CB . MET A 1 20 ? 20.488 10.391 22.787 1.0 10.72 ? 20 MET A CB 1 20 . A ATOM 150 C CG . MET A 1 20 ? 20.707 11.861 22.444 1.0 9.98 ? 20 MET A CG 1 20 . A ATOM 151 S SD . MET A 1 20 ? 19.174 12.616 21.849 1.0 13.11 ? 20 MET A SD 1 20 . A ATOM 152 C CE . MET A 1 20 ? 19.579 14.376 21.964 1.0 12.14 ? 20 MET A CE 1 20 . A ATOM 153 N N . TYR A 1 21 ? 22.433 9.818 25.268 1.0 11.04 ? 21 TYR A N 1 21 . A ATOM 154 C CA . TYR A 1 21 ? 23.237 10.292 26.398 1.0 11.83 ? 21 TYR A CA 1 21 . A ATOM 155 C C . TYR A 1 21 ? 24.715 9.985 26.102 1.0 12.5 ? 21 TYR A C 1 21 . A ATOM 156 O O . TYR A 1 21 ? 25.584 10.850 26.251 1.0 12.5 ? 21 TYR A O 1 21 . A ATOM 157 C CB . TYR A 1 21 ? 22.784 9.573 27.667 1.0 12.95 ? 21 TYR A CB 1 21 . A ATOM 158 C CG . TYR A 1 21 ? 23.643 9.806 28.895 1.0 15.06 ? 21 TYR A CG 1 21 . A ATOM 159 C CD1 . TYR A 1 21 ? 23.553 10.990 29.619 1.0 14.58 ? 21 TYR A CD1 1 21 . A ATOM 160 C CD2 . TYR A 1 21 ? 24.493 8.806 29.363 1.0 16.29 ? 21 TYR A CD2 1 21 . A ATOM 161 C CE1 . TYR A 1 21 ? 24.295 11.167 30.807 1.0 16.37 ? 21 TYR A CE1 1 21 . A ATOM 162 C CE2 . TYR A 1 21 ? 25.228 8.972 30.532 1.0 16.87 ? 21 TYR A CE2 1 21 . A ATOM 163 C CZ . TYR A 1 21 ? 25.120 10.149 31.249 1.0 16.84 ? 21 TYR A CZ 1 21 . A ATOM 164 O OH . TYR A 1 21 ? 25.821 10.293 32.438 1.0 19.63 ? 21 TYR A OH 1 21 . A ATOM 165 N N . THR A 1 22 ? 25.000 8.756 25.664 1.0 12.04 ? 22 THR A N 1 22 . A ATOM 166 C CA . THR A 1 22 ? 26.357 8.335 25.335 1.0 12.33 ? 22 THR A CA 1 22 . A ATOM 167 C C . THR A 1 22 ? 26.909 9.137 24.155 1.0 12.48 ? 22 THR A C 1 22 . A ATOM 168 O O . THR A 1 22 ? 28.081 9.549 24.158 1.0 11.94 ? 22 THR A O 1 22 . A ATOM 169 C CB . THR A 1 22 ? 26.372 6.819 24.988 1.0 13.49 ? 22 THR A CB 1 22 . A ATOM 170 O OG1 . THR A 1 22 ? 25.886 6.088 26.123 1.0 14.96 ? 22 THR A OG1 1 22 . A ATOM 171 C CG2 . THR A 1 22 ? 27.799 6.346 24.648 1.0 14.48 ? 22 THR A CG2 1 22 . A ATOM 172 N N . LYS A 1 23 ? 26.067 9.357 23.143 1.0 10.99 ? 23 LYS A N 1 23 . A ATOM 173 C CA . LYS A 1 23 ? 26.470 10.122 21.963 1.0 12.39 ? 23 LYS A CA 1 23 . A ATOM 174 C C . LYS A 1 23 ? 26.994 11.508 22.341 1.0 12.57 ? 23 LYS A C 1 23 . A ATOM 175 O O . LYS A 1 23 ? 27.966 11.981 21.748 1.0 13.83 ? 23 LYS A O 1 23 . A ATOM 176 C CB . LYS A 1 23 ? 25.288 10.271 20.991 1.0 11.45 ? 23 LYS A CB 1 23 . A ATOM 177 C CG . LYS A 1 23 ? 25.519 11.196 19.800 1.0 11.03 ? 23 LYS A CG 1 23 . A ATOM 178 C CD . LYS A 1 23 ? 24.260 11.262 18.916 1.0 9.91 ? 23 LYS A CD 1 23 . A ATOM 179 C CE . LYS A 1 23 ? 24.456 12.182 17.718 1.0 10.53 ? 23 LYS A CE 1 23 . A ATOM 180 N NZ . LYS A 1 23 ? 23.249 12.171 16.807 1.0 11.73 ? 23 LYS A NZ 1 23 . A ATOM 181 N N . TYR A 1 24 ? 26.357 12.136 23.322 1.0 13.49 ? 24 TYR A N 1 24 . A ATOM 182 C CA . TYR A 1 24 ? 26.729 13.477 23.764 1.0 13.61 ? 24 TYR A CA 1 24 . A ATOM 183 C C . TYR A 1 24 ? 27.672 13.467 24.968 1.0 15.05 ? 24 TYR A C 1 24 . A ATOM 184 O O . TYR A 1 24 ? 27.539 14.284 25.889 1.0 14.62 ? 24 TYR A O 1 24 . A ATOM 185 C CB . TYR A 1 24 ? 25.447 14.294 24.041 1.0 13.67 ? 24 TYR A CB 1 24 . A ATOM 186 C CG . TYR A 1 24 ? 24.796 14.718 22.737 1.0 12.89 ? 24 TYR A CG 1 24 . A ATOM 187 C CD1 . TYR A 1 24 ? 25.284 15.806 22.007 1.0 13.45 ? 24 TYR A CD1 1 24 . A ATOM 188 C CD2 . TYR A 1 24 ? 23.782 13.945 22.157 1.0 12.25 ? 24 TYR A CD2 1 24 . A ATOM 189 C CE1 . TYR A 1 24 ? 24.796 16.107 20.735 1.0 13.25 ? 24 TYR A CE1 1 24 . A ATOM 190 C CE2 . TYR A 1 24 ? 23.290 14.242 20.893 1.0 13.72 ? 24 TYR A CE2 1 24 . A ATOM 191 C CZ . TYR A 1 24 ? 23.800 15.317 20.186 1.0 12.94 ? 24 TYR A CZ 1 24 . A ATOM 192 O OH . TYR A 1 24 ? 23.330 15.605 18.923 1.0 12.03 ? 24 TYR A OH 1 24 . A ATOM 193 N N . SER A 1 25 ? 28.621 12.527 24.938 1.0 15.14 ? 25 SER A N 1 25 . A ATOM 194 C CA . SER A 1 25 ? 29.656 12.401 25.974 1.0 16.92 ? 25 SER A CA 1 25 . A ATOM 195 C C . SER A 1 25 ? 29.171 12.229 27.411 1.0 16.71 ? 25 SER A C 1 25 . A ATOM 196 O O . SER A 1 25 ? 29.885 12.592 28.360 1.0 16.2 ? 25 SER A O 1 25 . A ATOM 197 C CB . SER A 1 25 ? 30.583 13.616 25.890 1.0 18.13 ? 25 SER A CB 1 25 . A ATOM 198 O OG . SER A 1 25 ? 31.100 13.734 24.576 1.0 21.35 ? 25 SER A OG 1 25 . A ATOM 199 N N . SER A 1 26 ? 27.978 11.667 27.588 1.0 15.87 ? 26 SER A N 1 26 . A ATOM 200 C CA . SER A 1 26 ? 27.428 11.456 28.925 1.0 16.24 ? 26 SER A CA 1 26 . A ATOM 201 C C . SER A 1 26 ? 27.427 12.775 29.718 1.0 16.12 ? 26 SER A C 1 26 . A ATOM 202 O O . SER A 1 26 ? 27.537 12.774 30.947 1.0 16.01 ? 26 SER A O 1 26 . A ATOM 203 C CB . SER A 1 26 ? 28.257 10.390 29.665 1.0 16.69 ? 26 SER A CB 1 26 . A ATOM 204 O OG . SER A 1 26 ? 28.338 9.210 28.885 1.0 18.1 ? 26 SER A OG 1 26 . A ATOM 205 N N . ASN A 1 27 ? 27.275 13.885 28.998 1.0 16.14 ? 27 ASN A N 1 27 . A ATOM 206 C CA . ASN A 1 27 ? 27.277 15.239 29.567 1.0 16.29 ? 27 ASN A CA 1 27 . A ATOM 207 C C . ASN A 1 27 ? 25.839 15.788 29.679 1.0 16.39 ? 27 ASN A C 1 27 . A ATOM 208 O O . ASN A 1 27 ? 25.254 16.260 28.682 1.0 15.97 ? 27 ASN A O 1 27 . A ATOM 209 C CB . ASN A 1 27 ? 28.145 16.127 28.665 1.0 17.89 ? 27 ASN A CB 1 27 . A ATOM 210 C CG . ASN A 1 27 ? 28.335 17.550 29.194 1.0 19.47 ? 27 ASN A CG 1 27 . A ATOM 211 O OD1 . ASN A 1 27 ? 29.333 18.197 28.867 1.0 22.19 ? 27 ASN A OD1 1 27 . A ATOM 212 N ND2 . ASN A 1 27 ? 27.388 18.049 29.968 1.0 18.17 ? 27 ASN A ND2 1 27 . A ATOM 213 N N . PHE A 1 28 ? 25.279 15.712 30.882 1.0 16.01 ? 28 PHE A N 1 28 . A ATOM 214 C CA . PHE A 1 28 ? 23.920 16.196 31.135 1.0 16.28 ? 28 PHE A CA 1 28 . A ATOM 215 C C . PHE A 1 28 ? 23.733 17.661 30.749 1.0 16.35 ? 28 PHE A C 1 28 . A ATOM 216 O O . PHE A 1 28 ? 22.754 18.001 30.093 1.0 14.52 ? 28 PHE A O 1 28 . A ATOM 217 C CB . PHE A 1 28 ? 23.540 16.012 32.611 1.0 17.05 ? 28 PHE A CB 1 28 . A ATOM 218 C CG . PHE A 1 28 ? 22.162 16.508 32.939 1.0 19.09 ? 28 PHE A CG 1 28 . A ATOM 219 C CD1 . PHE A 1 28 ? 21.039 15.715 32.699 1.0 18.77 ? 28 PHE A CD1 1 28 . A ATOM 220 C CD2 . PHE A 1 28 ? 21.975 17.802 33.442 1.0 19.29 ? 28 PHE A CD2 1 28 . A ATOM 221 C CE1 . PHE A 1 28 ? 19.757 16.204 32.948 1.0 19.67 ? 28 PHE A CE1 1 28 . A ATOM 222 C CE2 . PHE A 1 28 ? 20.696 18.296 33.692 1.0 19.87 ? 28 PHE A CE2 1 28 . A ATOM 223 C CZ . PHE A 1 28 ? 19.589 17.499 33.443 1.0 20.11 ? 28 PHE A CZ 1 28 . A ATOM 224 N N . LYS A 1 29 ? 24.667 18.524 31.136 1.0 16.44 ? 29 LYS A N 1 29 . A ATOM 225 C CA . LYS A 1 29 ? 24.552 19.950 30.812 1.0 18.06 ? 29 LYS A CA 1 29 . A ATOM 226 C C . LYS A 1 29 ? 24.435 20.184 29.306 1.0 16.89 ? 29 LYS A C 1 29 . A ATOM 227 O O . LYS A 1 29 ? 23.582 20.954 28.858 1.0 16.16 ? 29 LYS A O 1 29 . A ATOM 228 C CB . LYS A 1 29 ? 25.768 20.723 31.352 1.0 20.8 ? 29 LYS A CB 1 29 . A ATOM 229 C CG . LYS A 1 29 ? 25.489 22.172 31.784 1.0 24.71 ? 29 LYS A CG 1 29 . A ATOM 230 C CD . LYS A 1 29 ? 25.138 23.117 30.638 1.0 27.08 ? 29 LYS A CD 1 29 . A ATOM 231 C CE . LYS A 1 29 ? 24.884 24.558 31.157 1.0 28.15 ? 29 LYS A CE 1 29 . A ATOM 232 N NZ . LYS A 1 29 ? 23.772 24.663 32.166 1.0 29.53 ? 29 LYS A NZ 1 29 . A ATOM 233 N N . LYS A 1 30 ? 25.294 19.532 28.530 1.0 15.96 ? 30 LYS A N 1 30 . A ATOM 234 C CA . LYS A 1 30 ? 25.282 19.659 27.081 1.0 15.44 ? 30 LYS A CA 1 30 . A ATOM 235 C C . LYS A 1 30 ? 23.940 19.178 26.498 1.0 13.72 ? 30 LYS A C 1 30 . A ATOM 236 O O . LYS A 1 30 ? 23.375 19.811 25.590 1.0 12.37 ? 30 LYS A O 1 30 . A ATOM 237 C CB . LYS A 1 30 ? 26.440 18.850 26.482 1.0 17.82 ? 30 LYS A CB 1 30 . A ATOM 238 C CG . LYS A 1 30 ? 26.494 18.844 24.956 1.0 21.94 ? 30 LYS A CG 1 30 . A ATOM 239 C CD . LYS A 1 30 ? 27.661 18.002 24.425 1.0 24.55 ? 30 LYS A CD 1 30 . A ATOM 240 C CE . LYS A 1 30 ? 28.995 18.668 24.682 1.0 26.53 ? 30 LYS A CE 1 30 . A ATOM 241 N NZ . LYS A 1 30 ? 30.136 17.861 24.117 1.0 28.12 ? 30 LYS A NZ 1 30 . A ATOM 242 N N . ILE A 1 31 ? 23.460 18.052 27.012 1.0 11.81 ? 31 ILE A N 1 31 . A ATOM 243 C CA . ILE A 1 31 ? 22.199 17.472 26.569 1.0 11.61 ? 31 ILE A CA 1 31 . A ATOM 244 C C . ILE A 1 31 ? 21.041 18.413 26.906 1.0 9.7 ? 31 ILE A C 1 31 . A ATOM 245 O O . ILE A 1 31 ? 20.183 18.676 26.053 1.0 10.02 ? 31 ILE A O 1 31 . A ATOM 246 C CB . ILE A 1 31 ? 21.970 16.071 27.234 1.0 11.22 ? 31 ILE A CB 1 31 . A ATOM 247 C CG1 . ILE A 1 31 ? 23.021 15.087 26.714 1.0 12.36 ? 31 ILE A CG1 1 31 . A ATOM 248 C CG2 . ILE A 1 31 ? 20.532 15.574 26.963 1.0 11.21 ? 31 ILE A CG2 1 31 . A ATOM 249 C CD1 . ILE A 1 31 ? 23.060 13.793 27.469 1.0 13.78 ? 31 ILE A CD1 1 31 . A ATOM 250 N N . ARG A 1 32 ? 21.022 18.953 28.112 1.0 10.09 ? 32 ARG A N 1 32 . A ATOM 251 C CA . ARG A 1 32 ? 19.933 19.853 28.515 1.0 9.69 ? 32 ARG A CA 1 32 . A ATOM 252 C C . ARG A 1 32 ? 19.897 21.083 27.622 1.0 10.19 ? 32 ARG A C 1 32 . A ATOM 253 O O . ARG A 1 32 ? 18.828 21.550 27.218 1.0 9.16 ? 32 ARG A O 1 32 . A ATOM 254 C CB . ARG A 1 32 ? 20.122 20.284 29.982 1.0 12.2 ? 32 ARG A CB 1 32 . A ATOM 255 C CG . ARG A 1 32 ? 18.949 21.124 30.483 1.0 13.74 ? 32 ARG A CG 1 32 . A ATOM 256 C CD . ARG A 1 32 ? 19.066 21.401 31.981 1.0 17.98 ? 32 ARG A CD 1 32 . A ATOM 257 N NE . ARG A 1 32 ? 20.361 21.985 32.291 1.0 22.14 ? 32 ARG A NE 1 32 . A ATOM 258 C CZ . ARG A 1 32 ? 20.798 22.241 33.524 1.0 25.03 ? 32 ARG A CZ 1 32 . A ATOM 259 N NH1 . ARG A 1 32 ? 20.030 21.967 34.577 1.0 26.17 ? 32 ARG A NH1 1 32 . A ATOM 260 N NH2 . ARG A 1 32 ? 22.011 22.765 33.700 1.0 26.5 ? 32 ARG A NH2 1 32 . A ATOM 261 N N . LYS A 1 33 ? 21.076 21.625 27.327 1.0 9.52 ? 33 LYS A N 1 33 . A ATOM 262 C CA . LYS A 1 33 ? 21.162 22.795 26.468 1.0 10.82 ? 33 LYS A CA 1 33 . A ATOM 263 C C . LYS A 1 33 ? 20.618 22.483 25.083 1.0 10.54 ? 33 LYS A C 1 33 . A ATOM 264 O O . LYS A 1 33 ? 19.892 23.283 24.507 1.0 9.78 ? 33 LYS A O 1 33 . A ATOM 265 C CB . LYS A 1 33 ? 22.618 23.238 26.342 1.0 13.72 ? 33 LYS A CB 1 33 . A ATOM 266 C CG . LYS A 1 33 ? 22.860 24.409 25.396 1.0 18.81 ? 33 LYS A CG 1 33 . A ATOM 267 C CD . LYS A 1 33 ? 24.354 24.574 25.125 1.0 23.0 ? 33 LYS A CD 1 33 . A ATOM 268 C CE . LYS A 1 33 ? 25.129 24.766 26.407 1.0 25.56 ? 33 LYS A CE 1 33 . A ATOM 269 N NZ . LYS A 1 33 ? 26.611 24.622 26.173 1.0 29.06 ? 33 LYS A NZ 1 33 . A ATOM 270 N N . ARG A 1 34 ? 20.982 21.322 24.532 1.0 9.28 ? 34 ARG A N 1 34 . A ATOM 271 C CA . ARG A 1 34 ? 20.502 20.960 23.206 1.0 9.52 ? 34 ARG A CA 1 34 . A ATOM 272 C C . ARG A 1 34 ? 18.986 20.806 23.243 1.0 8.11 ? 34 ARG A C 1 34 . A ATOM 273 O O . ARG A 1 34 ? 18.298 21.306 22.344 1.0 8.24 ? 34 ARG A O 1 34 . A ATOM 274 C CB . ARG A 1 34 ? 21.160 19.647 22.722 1.0 10.59 ? 34 ARG A CB 1 34 . A ATOM 275 C CG . ARG A 1 34 ? 20.700 19.245 21.317 1.0 11.87 ? 34 ARG A CG 1 34 . A ATOM 276 C CD . ARG A 1 34 ? 21.469 18.026 20.810 1.0 13.03 ? 34 ARG A CD 1 34 . A ATOM 277 N NE . ARG A 1 34 ? 21.029 17.595 19.494 1.0 11.54 ? 34 ARG A NE 1 34 . A ATOM 278 C CZ . ARG A 1 34 ? 21.545 17.998 18.339 1.0 12.45 ? 34 ARG A CZ 1 34 . A ATOM 279 N NH1 . ARG A 1 34 ? 22.545 18.883 18.307 1.0 13.57 ? 34 ARG A NH1 1 34 . A ATOM 280 N NH2 . ARG A 1 34 ? 21.099 17.454 17.208 1.0 9.41 ? 34 ARG A NH2 1 34 . A ATOM 281 N N . VAL A 1 35 ? 18.458 20.157 24.277 1.0 7.85 ? 35 VAL A N 1 35 . A ATOM 282 C CA . VAL A 1 35 ? 17.012 19.988 24.365 1.0 7.86 ? 35 VAL A CA 1 35 . A ATOM 283 C C . VAL A 1 35 ? 16.297 21.338 24.470 1.0 6.85 ? 35 VAL A C 1 35 . A ATOM 284 O O . VAL A 1 35 ? 15.261 21.557 23.816 1.0 7.05 ? 35 VAL A O 1 35 . A ATOM 285 C CB . VAL A 1 35 ? 16.638 19.077 25.543 1.0 7.66 ? 35 VAL A CB 1 35 . A ATOM 286 C CG1 . VAL A 1 35 ? 15.129 19.108 25.790 1.0 9.34 ? 35 VAL A CG1 1 35 . A ATOM 287 C CG2 . VAL A 1 35 ? 17.101 17.663 25.238 1.0 9.41 ? 35 VAL A CG2 1 35 . A ATOM 288 N N . HIS A 1 36 ? 16.827 22.246 25.284 1.0 6.44 ? 36 HIS A N 1 36 . A ATOM 289 C CA . HIS A 1 36 ? 16.216 23.563 25.352 1.0 6.27 ? 36 HIS A CA 1 36 . A ATOM 290 C C . HIS A 1 36 ? 16.221 24.265 23.986 1.0 6.39 ? 36 HIS A C 1 36 . A ATOM 291 O O . HIS A 1 36 ? 15.222 24.893 23.595 1.0 7.34 ? 36 HIS A O 1 36 . A ATOM 292 C CB . HIS A 1 36 ? 16.942 24.417 26.396 1.0 7.15 ? 36 HIS A CB 1 36 . A ATOM 293 C CG . HIS A 1 36 ? 16.448 24.193 27.787 1.0 7.23 ? 36 HIS A CG 1 36 . A ATOM 294 N ND1 . HIS A 1 36 ? 15.912 25.210 28.562 1.0 8.72 ? 36 HIS A ND1 1 36 . A ATOM 295 C CD2 . HIS A 1 36 ? 16.389 23.066 28.534 1.0 8.73 ? 36 HIS A CD2 1 36 . A ATOM 296 C CE1 . HIS A 1 36 ? 15.542 24.702 29.726 1.0 7.8 ? 36 HIS A CE1 1 36 . A ATOM 297 N NE2 . HIS A 1 36 ? 15.818 23.407 29.738 1.0 7.9 ? 36 HIS A NE2 1 36 . A ATOM 298 N N . GLN A 1 37 ? 17.321 24.156 23.247 1.0 6.36 ? 37 GLN A N 1 37 . A ATOM 299 C CA . GLN A 1 37 ? 17.369 24.810 21.947 1.0 7.49 ? 37 GLN A CA 1 37 . A ATOM 300 C C . GLN A 1 37 ? 16.343 24.181 20.998 1.0 7.41 ? 37 GLN A C 1 37 . A ATOM 301 O O . GLN A 1 37 ? 15.748 24.868 20.163 1.0 7.05 ? 37 GLN A O 1 37 . A ATOM 302 C CB . GLN A 1 37 ? 18.768 24.741 21.319 1.0 9.13 ? 37 GLN A CB 1 37 . A ATOM 303 C CG . GLN A 1 37 ? 18.841 25.584 20.080 1.0 14.57 ? 37 GLN A CG 1 37 . A ATOM 304 C CD . GLN A 1 37 ? 20.192 25.549 19.397 1.0 16.29 ? 37 GLN A CD 1 37 . A ATOM 305 O OE1 . GLN A 1 37 ? 20.294 25.811 18.182 1.0 14.49 ? 37 GLN A OE1 1 37 . A ATOM 306 N NE2 . GLN A 1 37 ? 21.249 25.241 20.177 1.0 18.17 ? 37 GLN A NE2 1 37 . A ATOM 307 N N . MET A 1 38 ? 16.136 22.875 21.130 1.0 6.81 ? 38 MET A N 1 38 . A ATOM 308 C CA . MET A 1 38 ? 15.099 22.215 20.316 1.0 7.16 ? 38 MET A CA 1 38 . A ATOM 309 C C . MET A 1 38 ? 13.724 22.773 20.678 1.0 6.67 ? 38 MET A C 1 38 . A ATOM 310 O O . MET A 1 38 ? 12.947 23.158 19.796 1.0 6.66 ? 38 MET A O 1 38 . A ATOM 311 C CB . MET A 1 38 ? 15.107 20.710 20.575 1.0 9.01 ? 38 MET A CB 1 38 . A ATOM 312 C CG . MET A 1 38 ? 16.360 20.042 20.087 1.0 10.41 ? 38 MET A CG 1 38 . A ATOM 313 S SD . MET A 1 38 ? 16.442 18.359 20.792 1.0 13.6 ? 38 MET A SD 1 38 . A ATOM 314 C CE . MET A 1 38 ? 17.311 17.509 19.543 1.0 14.5 ? 38 MET A CE 1 38 . A ATOM 315 N N . VAL A 1 39 ? 13.422 22.849 21.977 1.0 6.33 ? 39 VAL A N 1 39 . A ATOM 316 C CA . VAL A 1 39 ? 12.120 23.366 22.364 1.0 6.79 ? 39 VAL A CA 1 39 . A ATOM 317 C C . VAL A 1 39 ? 11.944 24.821 21.895 1.0 6.62 ? 39 VAL A C 1 39 . A ATOM 318 O O . VAL A 1 39 ? 10.856 25.193 21.452 1.0 6.12 ? 39 VAL A O 1 39 . A ATOM 319 C CB . VAL A 1 39 ? 11.935 23.225 23.891 1.0 7.76 ? 39 VAL A CB 1 39 . A ATOM 320 C CG1 . VAL A 1 39 ? 10.667 23.960 24.344 1.0 9.14 ? 39 VAL A CG1 1 39 . A ATOM 321 C CG2 . VAL A 1 39 ? 11.875 21.738 24.250 1.0 8.46 ? 39 VAL A CG2 1 39 . A ATOM 322 N N . SER A 1 40 ? 12.992 25.638 21.945 1.0 6.32 ? 40 SER A N 1 40 . A ATOM 323 C CA . SER A 1 40 ? 12.833 27.025 21.504 1.0 7.02 ? 40 SER A CA 1 40 . A ATOM 324 C C . SER A 1 40 ? 12.464 27.055 20.007 1.0 7.1 ? 40 SER A C 1 40 . A ATOM 325 O O . SER A 1 40 ? 11.699 27.909 19.569 1.0 6.83 ? 40 SER A O 1 40 . A ATOM 326 C CB . SER A 1 40 ? 14.104 27.827 21.773 1.0 7.43 ? 40 SER A CB 1 40 . A ATOM 327 O OG . SER A 1 40 ? 14.375 27.917 23.167 1.0 7.52 ? 40 SER A OG 1 40 . A ATOM 328 N N . ASN A 1 41 ? 13.010 26.124 19.225 1.0 6.67 ? 41 ASN A N 1 41 . A ATOM 329 C CA . ASN A 1 41 ? 12.651 26.015 17.802 1.0 6.9 ? 41 ASN A CA 1 41 . A ATOM 330 C C . ASN A 1 41 ? 11.239 25.470 17.599 1.0 6.8 ? 41 ASN A C 1 41 . A ATOM 331 O O . ASN A 1 41 ? 10.514 25.978 16.741 1.0 7.22 ? 41 ASN A O 1 41 . A ATOM 332 C CB . ASN A 1 41 ? 13.670 25.159 17.044 1.0 6.33 ? 41 ASN A CB 1 41 . A ATOM 333 C CG . ASN A 1 41 ? 14.890 25.957 16.661 1.0 6.53 ? 41 ASN A CG 1 41 . A ATOM 334 O OD1 . ASN A 1 41 ? 14.812 26.832 15.806 1.0 7.1 ? 41 ASN A OD1 1 41 . A ATOM 335 N ND2 . ASN A 1 41 ? 16.001 25.702 17.326 1.0 6.97 ? 41 ASN A ND2 1 41 . A ATOM 336 N N . ILE A 1 42 ? 10.831 24.467 18.383 1.0 5.98 ? 42 ILE A N 1 42 . A ATOM 337 C CA . ILE A 1 42 ? 9.457 23.967 18.270 1.0 6.05 ? 42 ILE A CA 1 42 . A ATOM 338 C C . ILE A 1 42 ? 8.485 25.113 18.594 1.0 5.98 ? 42 ILE A C 1 42 . A ATOM 339 O O . ILE A 1 42 ? 7.474 25.290 17.913 1.0 6.42 ? 42 ILE A O 1 42 . A ATOM 340 C CB . ILE A 1 42 ? 9.223 22.791 19.249 1.0 6.25 ? 42 ILE A CB 1 42 . A ATOM 341 C CG1 . ILE A 1 42 ? 10.124 21.622 18.871 1.0 5.83 ? 42 ILE A CG1 1 42 . A ATOM 342 C CG2 . ILE A 1 42 ? 7.740 22.351 19.193 1.0 7.31 ? 42 ILE A CG2 1 42 . A ATOM 343 C CD1 . ILE A 1 42 ? 10.145 20.544 19.954 1.0 7.67 ? 42 ILE A CD1 1 42 . A ATOM 344 N N . ASN A 1 43 ? 8.784 25.869 19.642 1.0 6.33 ? 43 ASN A N 1 43 . A ATOM 345 C CA . ASN A 1 43 ? 7.955 27.005 20.014 1.0 6.92 ? 43 ASN A CA 1 43 . A ATOM 346 C C . ASN A 1 43 ? 7.835 28.019 18.871 1.0 6.43 ? 43 ASN A C 1 43 . A ATOM 347 O O . ASN A 1 43 ? 6.729 28.462 18.506 1.0 6.5 ? 43 ASN A O 1 43 . A ATOM 348 C CB . ASN A 1 43 ? 8.541 27.668 21.252 1.0 8.74 ? 43 ASN A CB 1 43 . A ATOM 349 C CG . ASN A 1 43 ? 7.652 28.744 21.774 1.0 12.31 ? 43 ASN A CG 1 43 . A ATOM 350 O OD1 . ASN A 1 43 ? 6.556 28.477 22.263 1.0 13.55 ? 43 ASN A OD1 1 43 . A ATOM 351 N ND2 . ASN A 1 43 ? 8.105 29.993 21.645 1.0 14.2 ? 43 ASN A ND2 1 43 . A ATOM 352 N N . GLU A 1 44 ? 8.975 28.333 18.258 1.0 5.64 ? 44 GLU A N 1 44 . A ATOM 353 C CA . GLU A 1 44 ? 8.975 29.255 17.125 1.0 7.12 ? 44 GLU A CA 1 44 . A ATOM 354 C C . GLU A 1 44 ? 8.120 28.706 15.967 1.0 6.88 ? 44 GLU A C 1 44 . A ATOM 355 O O . GLU A 1 44 ? 7.326 29.437 15.362 1.0 7.17 ? 44 GLU A O 1 44 . A ATOM 356 C CB . GLU A 1 44 ? 10.408 29.498 16.653 1.0 7.06 ? 44 GLU A CB 1 44 . A ATOM 357 C CG . GLU A 1 44 ? 10.530 30.198 15.329 1.0 8.97 ? 44 GLU A CG 1 44 . A ATOM 358 C CD . GLU A 1 44 ? 9.912 31.570 15.269 1.0 10.57 ? 44 GLU A CD 1 44 . A ATOM 359 O OE1 . GLU A 1 44 ? 9.698 32.213 16.322 1.0 9.92 ? 44 GLU A OE1 1 44 . A ATOM 360 O OE2 . GLU A 1 44 ? 9.683 32.030 14.120 1.0 11.83 ? 44 GLU A OE2 1 44 . A ATOM 361 N N . MET A 1 45 ? 8.258 27.412 15.679 1.0 6.99 ? 45 MET A N 1 45 . A ATOM 362 C CA . MET A 1 45 ? 7.495 26.842 14.577 1.0 6.26 ? 45 MET A CA 1 45 . A ATOM 363 C C . MET A 1 45 ? 6.008 26.765 14.848 1.0 6.11 ? 45 MET A C 1 45 . A ATOM 364 O O . MET A 1 45 ? 5.212 26.817 13.908 1.0 7.2 ? 45 MET A O 1 45 . A ATOM 365 C CB . MET A 1 45 ? 8.050 25.469 14.193 1.0 6.04 ? 45 MET A CB 1 45 . A ATOM 366 C CG . MET A 1 45 ? 9.375 25.611 13.444 1.0 6.85 ? 45 MET A CG 1 45 . A ATOM 367 S SD . MET A 1 45 ? 10.078 24.047 12.893 1.0 8.41 ? 45 MET A SD 1 45 . A ATOM 368 C CE . MET A 1 45 ? 11.264 23.730 14.286 1.0 6.66 ? 45 MET A CE 1 45 . A ATOM 369 N N . CYS A 1 46 ? 5.624 26.711 16.124 1.0 6.09 ? 46 CYS A N 1 46 . A ATOM 370 C CA . CYS A 1 46 ? 4.213 26.655 16.446 1.0 7.2 ? 46 CYS A CA 1 46 . A ATOM 371 C C . CYS A 1 46 ? 3.558 28.026 16.634 1.0 7.63 ? 46 CYS A C 1 46 . A ATOM 372 O O . CYS A 1 46 ? 2.344 28.091 16.838 1.0 7.69 ? 46 CYS A O 1 46 . A ATOM 373 C CB . CYS A 1 46 ? 3.985 25.804 17.691 1.0 6.95 ? 46 CYS A CB 1 46 . A ATOM 374 S SG . CYS A 1 46 ? 4.277 24.030 17.447 1.0 8.12 ? 46 CYS A SG 1 46 . A ATOM 375 N N . ARG A 1 47 ? 4.340 29.103 16.527 1.0 9.07 ? 47 ARG A N 1 47 . A ATOM 376 C CA . ARG A 1 47 ? 3.762 30.445 16.699 1.0 11.08 ? 47 ARG A CA 1 47 . A ATOM 377 C C . ARG A 1 47 ? 2.575 30.711 15.771 1.0 11.67 ? 47 ARG A C 1 47 . A ATOM 378 O O . ARG A 1 47 ? 1.579 31.264 16.197 1.0 12.33 ? 47 ARG A O 1 47 . A ATOM 379 C CB . ARG A 1 47 ? 4.790 31.535 16.404 1.0 13.08 ? 47 ARG A CB 1 47 . A ATOM 380 C CG . ARG A 1 47 ? 5.667 32.013 17.521 1.0 15.76 ? 47 ARG A CG 1 47 . A ATOM 381 C CD . ARG A 1 47 ? 6.202 33.463 17.183 1.0 14.53 ? 47 ARG A CD 1 47 . A ATOM 382 N NE . ARG A 1 47 ? 7.142 33.456 16.039 1.0 17.72 ? 47 ARG A NE 1 47 . A ATOM 383 C CZ . ARG A 1 47 ? 7.036 34.242 14.968 1.0 16.91 ? 47 ARG A CZ 1 47 . A ATOM 384 N NH1 . ARG A 1 47 ? 6.030 35.115 14.869 1.0 17.87 ? 47 ARG A NH1 1 47 . A ATOM 385 N NH2 . ARG A 1 47 ? 7.933 34.159 13.994 1.0 17.61 ? 47 ARG A NH2 1 47 . A ATOM 386 N N . PRO A 1 48 ? 2.684 30.359 14.477 1.0 11.81 ? 48 PRO A N 1 48 . A ATOM 387 C CA . PRO A 1 48 ? 1.539 30.627 13.598 1.0 12.95 ? 48 PRO A CA 1 48 . A ATOM 388 C C . PRO A 1 48 ? 0.297 29.804 13.910 1.0 12.51 ? 48 PRO A C 1 48 . A ATOM 389 O O . PRO A 1 48 ? -0.786 30.079 13.375 1.0 13.46 ? 48 PRO A O 1 48 . A ATOM 390 C CB . PRO A 1 48 ? 2.104 30.359 12.195 1.0 13.15 ? 48 PRO A CB 1 48 . A ATOM 391 C CG . PRO A 1 48 ? 3.571 30.655 12.356 1.0 14.3 ? 48 PRO A CG 1 48 . A ATOM 392 C CD . PRO A 1 48 ? 3.868 29.985 13.682 1.0 12.88 ? 48 PRO A CD 1 48 . A ATOM 393 N N . LEU A 1 49 ? 0.439 28.798 14.775 1.0 11.09 ? 49 LEU A N 1 49 . A ATOM 394 C CA . LEU A 1 49 ? -0.706 27.985 15.176 1.0 10.57 ? 49 LEU A CA 1 49 . A ATOM 395 C C . LEU A 1 49 ? -1.272 28.475 16.514 1.0 10.35 ? 49 LEU A C 1 49 . A ATOM 396 O O . LEU A 1 49 ? -2.283 27.947 17.001 1.0 10.47 ? 49 LEU A O 1 49 . A ATOM 397 C CB . LEU A 1 49 ? -0.319 26.515 15.358 1.0 10.38 ? 49 LEU A CB 1 49 . A ATOM 398 C CG . LEU A 1 49 ? 0.242 25.780 14.140 1.0 11.76 ? 49 LEU A CG 1 49 . A ATOM 399 C CD1 . LEU A 1 49 ? 0.517 24.354 14.547 1.0 12.08 ? 49 LEU A CD1 1 49 . A ATOM 400 C CD2 . LEU A 1 49 ? -0.757 25.792 12.981 1.0 12.85 ? 49 LEU A CD2 1 49 . A ATOM 401 N N . ASN A 1 50 ? -0.599 29.467 17.091 1.0 10.4 ? 50 ASN A N 1 50 . A ATOM 402 C CA . ASN A 1 50 ? -0.955 30.022 18.402 1.0 10.54 ? 50 ASN A CA 1 50 . A ATOM 403 C C . ASN A 1 50 ? -0.920 28.970 19.506 1.0 10.49 ? 50 ASN A C 1 50 . A ATOM 404 O O . ASN A 1 50 ? -1.793 28.914 20.362 1.0 10.8 ? 50 ASN A O 1 50 . A ATOM 405 C CB . ASN A 1 50 ? -2.326 30.711 18.363 1.0 10.03 ? 50 ASN A CB 1 50 . A ATOM 406 C CG . ASN A 1 50 ? -2.455 31.814 19.393 1.0 12.03 ? 50 ASN A CG 1 50 . A ATOM 407 O OD1 . ASN A 1 50 ? -1.480 32.209 20.038 1.0 11.66 ? 50 ASN A OD1 1 50 . A ATOM 408 N ND2 . ASN A 1 50 ? -3.686 32.337 19.541 1.0 12.18 ? 50 ASN A ND2 1 50 . A ATOM 409 N N . ILE A 1 51 ? 0.108 28.128 19.466 1.0 10.56 ? 51 ILE A N 1 51 . A ATOM 410 C CA . ILE A 1 51 ? 0.294 27.116 20.513 1.0 9.64 ? 51 ILE A CA 1 51 . A ATOM 411 C C . ILE A 1 51 ? 1.572 27.477 21.260 1.0 9.86 ? 51 ILE A C 1 51 . A ATOM 412 O O . ILE A 1 51 ? 2.661 27.568 20.684 1.0 10.06 ? 51 ILE A O 1 51 . A ATOM 413 C CB . ILE A 1 51 ? 0.475 25.689 19.961 1.0 10.02 ? 51 ILE A CB 1 51 . A ATOM 414 C CG1 . ILE A 1 51 ? -0.665 25.354 19.000 1.0 10.15 ? 51 ILE A CG1 1 51 . A ATOM 415 C CG2 . ILE A 1 51 ? 0.492 24.668 21.155 1.0 10.76 ? 51 ILE A CG2 1 51 . A ATOM 416 C CD1 . ILE A 1 51 ? -0.544 23.939 18.358 1.0 11.99 ? 51 ILE A CD1 1 51 . A ATOM 417 N N . ALA A 1 52 ? 1.427 27.700 22.550 1.0 8.59 ? 52 ALA A N 1 52 . A ATOM 418 C CA . ALA A 1 52 ? 2.550 28.029 23.399 1.0 9.27 ? 52 ALA A CA 1 52 . A ATOM 419 C C . ALA A 1 52 ? 3.144 26.700 23.872 1.0 9.19 ? 52 ALA A C 1 52 . A ATOM 420 O O . ALA A 1 52 ? 2.478 25.914 24.544 1.0 9.51 ? 52 ALA A O 1 52 . A ATOM 421 C CB . ALA A 1 52 ? 2.065 28.881 24.584 1.0 10.43 ? 52 ALA A CB 1 52 . A ATOM 422 N N . ILE A 1 53 ? 4.401 26.476 23.502 1.0 9.66 ? 53 ILE A N 1 53 . A ATOM 423 C CA . ILE A 1 53 ? 5.121 25.249 23.832 1.0 10.22 ? 53 ILE A CA 1 53 . A ATOM 424 C C . ILE A 1 53 ? 6.047 25.439 25.038 1.0 10.86 ? 53 ILE A C 1 53 . A ATOM 425 O O . ILE A 1 53 ? 6.836 26.381 25.056 1.0 11.61 ? 53 ILE A O 1 53 . A ATOM 426 C CB . ILE A 1 53 ? 6.008 24.815 22.634 1.0 10.23 ? 53 ILE A CB 1 53 . A ATOM 427 C CG1 . ILE A 1 53 ? 5.157 24.706 21.347 1.0 10.8 ? 53 ILE A CG1 1 53 . A ATOM 428 C CG2 . ILE A 1 53 ? 6.695 23.464 22.957 1.0 10.87 ? 53 ILE A CG2 1 53 . A ATOM 429 C CD1 . ILE A 1 53 ? 4.193 23.520 21.375 1.0 10.78 ? 53 ILE A CD1 1 53 . A ATOM 430 N N . THR A 1 54 ? 5.922 24.580 26.047 1.0 9.99 ? 54 THR A N 1 54 . A ATOM 431 C CA . THR A 1 54 ? 6.835 24.646 27.197 1.0 10.48 ? 54 THR A CA 1 54 . A ATOM 432 C C . THR A 1 54 ? 7.437 23.282 27.467 1.0 9.91 ? 54 THR A C 1 54 . A ATOM 433 O O . THR A 1 54 ? 6.886 22.248 27.055 1.0 10.88 ? 54 THR A O 1 54 . A ATOM 434 C CB . THR A 1 54 ? 6.130 25.134 28.491 1.0 11.19 ? 54 THR A CB 1 54 . A ATOM 435 O OG1 . THR A 1 54 ? 4.917 24.385 28.697 1.0 12.43 ? 54 THR A OG1 1 54 . A ATOM 436 C CG2 . THR A 1 54 ? 5.789 26.617 28.365 1.0 12.43 ? 54 THR A CG2 1 54 . A ATOM 437 N N . LEU A 1 55 ? 8.592 23.276 28.126 1.0 9.14 ? 55 LEU A N 1 55 . A ATOM 438 C CA . LEU A 1 55 ? 9.244 22.037 28.501 1.0 8.53 ? 55 LEU A CA 1 55 . A ATOM 439 C C . LEU A 1 55 ? 8.860 21.795 29.965 1.0 8.93 ? 55 LEU A C 1 55 . A ATOM 440 O O . LEU A 1 55 ? 9.412 22.442 30.893 1.0 9.81 ? 55 LEU A O 1 55 . A ATOM 441 C CB . LEU A 1 55 ? 10.761 22.178 28.371 1.0 9.08 ? 55 LEU A CB 1 55 . A ATOM 442 C CG . LEU A 1 55 ? 11.552 20.924 28.786 1.0 8.18 ? 55 LEU A CG 1 55 . A ATOM 443 C CD1 . LEU A 1 55 ? 11.215 19.695 27.895 1.0 9.61 ? 55 LEU A CD1 1 55 . A ATOM 444 C CD2 . LEU A 1 55 ? 13.047 21.262 28.695 1.0 10.58 ? 55 LEU A CD2 1 55 . A ATOM 445 N N . ALA A 1 56 ? 7.920 20.878 30.175 1.0 9.29 ? 56 ALA A N 1 56 . A ATOM 446 C CA . ALA A 1 56 ? 7.455 20.566 31.536 1.0 9.25 ? 56 ALA A CA 1 56 . A ATOM 447 C C . ALA A 1 56 ? 8.407 19.623 32.255 1.0 10.2 ? 56 ALA A C 1 56 . A ATOM 448 O O . ALA A 1 56 ? 8.554 19.662 33.476 1.0 10.97 ? 56 ALA A O 1 56 . A ATOM 449 C CB . ALA A 1 56 ? 6.056 19.929 31.467 1.0 10.06 ? 56 ALA A CB 1 56 . A ATOM 450 N N . LEU A 1 57 ? 9.100 18.796 31.487 1.0 9.7 ? 57 LEU A N 1 57 . A ATOM 451 C CA . LEU A 1 57 ? 9.920 17.785 32.117 1.0 10.84 ? 57 LEU A CA 1 57 . A ATOM 452 C C . LEU A 1 57 ? 10.974 17.258 31.179 1.0 10.14 ? 57 LEU A C 1 57 . A ATOM 453 O O . LEU A 1 57 ? 10.686 17.038 30.013 1.0 9.65 ? 57 LEU A O 1 57 . A ATOM 454 C CB . LEU A 1 57 ? 8.992 16.633 32.530 1.0 12.58 ? 57 LEU A CB 1 57 . A ATOM 455 C CG . LEU A 1 57 ? 9.573 15.351 33.101 1.0 14.52 ? 57 LEU A CG 1 57 . A ATOM 456 C CD1 . LEU A 1 57 ? 10.182 15.632 34.482 1.0 15.66 ? 57 LEU A CD1 1 57 . A ATOM 457 C CD2 . LEU A 1 57 ? 8.482 14.333 33.252 1.0 14.64 ? 57 LEU A CD2 1 57 . A ATOM 458 N N . LEU A 1 58 ? 12.180 17.090 31.697 1.0 10.19 ? 58 LEU A N 1 58 . A ATOM 459 C CA . LEU A 1 58 ? 13.284 16.504 30.931 1.0 10.84 ? 58 LEU A CA 1 58 . A ATOM 460 C C . LEU A 1 58 ? 13.749 15.272 31.709 1.0 11.37 ? 58 LEU A C 1 58 . A ATOM 461 O O . LEU A 1 58 ? 14.026 15.354 32.914 1.0 12.56 ? 58 LEU A O 1 58 . A ATOM 462 C CB . LEU A 1 58 ? 14.455 17.487 30.789 1.0 11.36 ? 58 LEU A CB 1 58 . A ATOM 463 C CG . LEU A 1 58 ? 15.762 16.885 30.233 1.0 11.39 ? 58 LEU A CG 1 58 . A ATOM 464 C CD1 . LEU A 1 58 ? 15.550 16.380 28.810 1.0 11.05 ? 58 LEU A CD1 1 58 . A ATOM 465 C CD2 . LEU A 1 58 ? 16.906 17.935 30.269 1.0 12.49 ? 58 LEU A CD2 1 58 . A ATOM 466 N N . ASP A 1 59 ? 13.810 14.122 31.051 1.0 10.46 ? 59 ASP A N 1 59 . A ATOM 467 C CA . ASP A 1 59 ? 14.289 12.906 31.701 1.0 11.93 ? 59 ASP A CA 1 59 . A ATOM 468 C C . ASP A 1 59 ? 15.394 12.342 30.821 1.0 11.46 ? 59 ASP A C 1 59 . A ATOM 469 O O . ASP A 1 59 ? 15.165 12.064 29.648 1.0 12.27 ? 59 ASP A O 1 59 . A ATOM 470 C CB . ASP A 1 59 ? 13.161 11.878 31.844 1.0 12.6 ? 59 ASP A CB 1 59 . A ATOM 471 C CG . ASP A 1 59 ? 13.616 10.617 32.530 1.0 15.94 ? 59 ASP A CG 1 59 . A ATOM 472 O OD1 . ASP A 1 59 ? 14.563 10.715 33.326 1.0 18.29 ? 59 ASP A OD1 1 59 . A ATOM 473 O OD2 . ASP A 1 59 ? 13.041 9.533 32.285 1.0 17.65 ? 59 ASP A OD2 1 59 . A ATOM 474 N N . VAL A 1 60 ? 16.599 12.216 31.376 1.0 11.16 ? 60 VAL A N 1 60 . A ATOM 475 C CA . VAL A 1 60 ? 17.755 11.704 30.638 1.0 11.15 ? 60 VAL A CA 1 60 . A ATOM 476 C C . VAL A 1 60 ? 18.117 10.340 31.217 1.0 11.7 ? 60 VAL A C 1 60 . A ATOM 477 O O . VAL A 1 60 ? 18.384 10.224 32.418 1.0 12.15 ? 60 VAL A O 1 60 . A ATOM 478 C CB . VAL A 1 60 ? 18.943 12.665 30.759 1.0 12.28 ? 60 VAL A CB 1 60 . A ATOM 479 C CG1 . VAL A 1 60 ? 20.151 12.098 30.035 1.0 13.02 ? 60 VAL A CG1 1 60 . A ATOM 480 C CG2 . VAL A 1 60 ? 18.567 14.029 30.150 1.0 12.23 ? 60 VAL A CG2 1 60 . A ATOM 481 N N . TRP A 1 61 ? 18.102 9.312 30.363 1.0 10.76 ? 61 TRP A N 1 61 . A ATOM 482 C CA . TRP A 1 61 ? 18.375 7.943 30.807 1.0 10.83 ? 61 TRP A CA 1 61 . A ATOM 483 C C . TRP A 1 61 ? 19.889 7.747 30.871 1.0 11.89 ? 61 TRP A C 1 61 . A ATOM 484 O O . TRP A 1 61 ? 20.512 7.144 29.993 1.0 11.93 ? 61 TRP A O 1 61 . A ATOM 485 C CB . TRP A 1 61 ? 17.681 6.941 29.857 1.0 9.4 ? 61 TRP A CB 1 61 . A ATOM 486 C CG . TRP A 1 61 ? 16.177 6.988 29.927 1.0 8.65 ? 61 TRP A CG 1 61 . A ATOM 487 C CD1 . TRP A 1 61 ? 15.411 7.671 30.833 1.0 8.78 ? 61 TRP A CD1 1 61 . A ATOM 488 C CD2 . TRP A 1 61 ? 15.258 6.266 29.094 1.0 7.9 ? 61 TRP A CD2 1 61 . A ATOM 489 N NE1 . TRP A 1 61 ? 14.075 7.414 30.616 1.0 9.4 ? 61 TRP A NE1 1 61 . A ATOM 490 C CE2 . TRP A 1 61 ? 13.958 6.545 29.558 1.0 9.1 ? 61 TRP A CE2 1 61 . A ATOM 491 C CE3 . TRP A 1 61 ? 15.413 5.400 27.998 1.0 9.18 ? 61 TRP A CE3 1 61 . A ATOM 492 C CZ2 . TRP A 1 61 ? 12.813 5.983 28.961 1.0 9.78 ? 61 TRP A CZ2 1 61 . A ATOM 493 C CZ3 . TRP A 1 61 ? 14.291 4.852 27.410 1.0 9.25 ? 61 TRP A CZ3 1 61 . A ATOM 494 C CH2 . TRP A 1 61 ? 13.003 5.138 27.888 1.0 8.74 ? 61 TRP A CH2 1 61 . A ATOM 495 N N . SER A 1 62 ? 20.477 8.258 31.950 1.0 12.79 ? 62 SER A N 1 62 . A ATOM 496 C CA . SER A 1 62 ? 21.920 8.223 32.127 1.0 14.32 ? 62 SER A CA 1 62 . A ATOM 497 C C . SER A 1 62 ? 22.534 6.890 32.533 1.0 14.8 ? 62 SER A C 1 62 . A ATOM 498 O O . SER A 1 62 ? 23.756 6.769 32.523 1.0 16.94 ? 62 SER A O 1 62 . A ATOM 499 C CB . SER A 1 62 ? 22.325 9.284 33.149 1.0 15.51 ? 62 SER A CB 1 62 . A ATOM 500 O OG . SER A 1 62 ? 21.602 9.066 34.337 1.0 17.73 ? 62 SER A OG 1 62 . A ATOM 501 N N . GLU A 1 63 ? 21.705 5.916 32.886 1.0 15.93 ? 63 GLU A N 1 63 . A ATOM 502 C CA . GLU A 1 63 ? 22.204 4.599 33.291 1.0 17.54 ? 63 GLU A CA 1 63 . A ATOM 503 C C . GLU A 1 63 ? 21.876 3.514 32.268 1.0 16.61 ? 63 GLU A C 1 63 . A ATOM 504 O O . GLU A 1 63 ? 22.750 2.763 31.843 1.0 17.49 ? 63 GLU A O 1 63 . A ATOM 505 C CB . GLU A 1 63 ? 21.594 4.191 34.627 1.0 19.78 ? 63 GLU A CB 1 63 . A ATOM 506 C CG . GLU A 1 63 ? 21.904 5.145 35.762 1.0 25.17 ? 63 GLU A CG 1 63 . A ATOM 507 C CD . GLU A 1 63 ? 20.659 5.557 36.520 1.0 28.25 ? 63 GLU A CD 1 63 . A ATOM 508 O OE1 . GLU A 1 63 ? 19.835 6.310 35.952 1.0 30.37 ? 63 GLU A OE1 1 63 . A ATOM 509 O OE2 . GLU A 1 63 ? 20.499 5.116 37.681 1.0 30.1 ? 63 GLU A OE2 1 63 . A ATOM 510 N N . LYS A 1 64 ? 20.612 3.468 31.856 1.0 15.93 ? 64 LYS A N 1 64 . A ATOM 511 C CA . LYS A 1 64 ? 20.155 2.470 30.907 1.0 15.62 ? 64 LYS A CA 1 64 . A ATOM 512 C C . LYS A 1 64 ? 18.794 2.806 30.331 1.0 13.94 ? 64 LYS A C 1 64 . A ATOM 513 O O . LYS A 1 64 ? 18.052 3.609 30.879 1.0 13.87 ? 64 LYS A O 1 64 . A ATOM 514 C CB . LYS A 1 64 ? 20.068 1.091 31.576 1.0 18.1 ? 64 LYS A CB 1 64 . A ATOM 515 C CG . LYS A 1 64 ? 18.968 0.924 32.603 1.0 21.18 ? 64 LYS A CG 1 64 . A ATOM 516 C CD . LYS A 1 64 ? 19.012 -0.515 33.108 1.0 24.18 ? 64 LYS A CD 1 64 . A ATOM 517 C CE . LYS A 1 64 ? 18.192 -0.739 34.351 1.0 26.02 ? 64 LYS A CE 1 64 . A ATOM 518 N NZ . LYS A 1 64 ? 18.374 -2.163 34.746 1.0 26.86 ? 64 LYS A NZ 1 64 . A ATOM 519 N N . ASP A 1 65 ? 18.478 2.178 29.207 1.0 12.2 ? 65 ASP A N 1 65 . A ATOM 520 C CA . ASP A 1 65 ? 17.178 2.381 28.584 1.0 11.46 ? 65 ASP A CA 1 65 . A ATOM 521 C C . ASP A 1 65 ? 16.129 1.652 29.391 1.0 12.63 ? 65 ASP A C 1 65 . A ATOM 522 O O . ASP A 1 65 ? 16.372 0.533 29.854 1.0 14.82 ? 65 ASP A O 1 65 . A ATOM 523 C CB . ASP A 1 65 ? 17.178 1.812 27.172 1.0 10.52 ? 65 ASP A CB 1 65 . A ATOM 524 C CG . ASP A 1 65 ? 17.893 2.704 26.192 1.0 11.43 ? 65 ASP A CG 1 65 . A ATOM 525 O OD1 . ASP A 1 65 ? 18.325 2.190 25.139 1.0 11.73 ? 65 ASP A OD1 1 65 . A ATOM 526 O OD2 . ASP A 1 65 ? 18.009 3.929 26.473 1.0 11.89 ? 65 ASP A OD2 1 65 . A ATOM 527 N N . PHE A 1 66 ? 14.957 2.258 29.546 1.0 12.53 ? 66 PHE A N 1 66 . A ATOM 528 C CA . PHE A 1 66 ? 13.877 1.632 30.292 1.0 13.31 ? 66 PHE A CA 1 66 . A ATOM 529 C C . PHE A 1 66 ? 12.878 0.938 29.380 1.0 13.59 ? 66 PHE A C 1 66 . A ATOM 530 O O . PHE A 1 66 ? 11.909 0.333 29.851 1.0 15.15 ? 66 PHE A O 1 66 . A ATOM 531 C CB . PHE A 1 66 ? 13.198 2.652 31.203 1.0 14.2 ? 66 PHE A CB 1 66 . A ATOM 532 C CG . PHE A 1 66 ? 14.079 3.099 32.332 1.0 14.56 ? 66 PHE A CG 1 66 . A ATOM 533 C CD1 . PHE A 1 66 ? 14.605 4.384 32.358 1.0 15.16 ? 66 PHE A CD1 1 66 . A ATOM 534 C CD2 . PHE A 1 66 ? 14.433 2.204 33.341 1.0 16.3 ? 66 PHE A CD2 1 66 . A ATOM 535 C CE1 . PHE A 1 66 ? 15.485 4.782 33.374 1.0 16.09 ? 66 PHE A CE1 1 66 . A ATOM 536 C CE2 . PHE A 1 66 ? 15.308 2.592 34.362 1.0 16.33 ? 66 PHE A CE2 1 66 . A ATOM 537 C CZ . PHE A 1 66 ? 15.839 3.883 34.377 1.0 16.97 ? 66 PHE A CZ 1 66 . A ATOM 538 N N . ILE A 1 67 ? 13.083 1.068 28.067 1.0 12.58 ? 67 ILE A N 1 67 . A ATOM 539 C CA . ILE A 1 67 ? 12.260 0.345 27.102 1.0 12.46 ? 67 ILE A CA 1 67 . A ATOM 540 C C . ILE A 1 67 ? 13.252 -0.128 26.042 1.0 11.68 ? 67 ILE A C 1 67 . A ATOM 541 O O . ILE A 1 67 ? 14.409 0.314 26.039 1.0 11.75 ? 67 ILE A O 1 67 . A ATOM 542 C CB . ILE A 1 67 ? 11.184 1.227 26.407 1.0 12.02 ? 67 ILE A CB 1 67 . A ATOM 543 C CG1 . ILE A 1 67 ? 11.858 2.287 25.533 1.0 12.04 ? 67 ILE A CG1 1 67 . A ATOM 544 C CG2 . ILE A 1 67 ? 10.235 1.858 27.437 1.0 11.52 ? 67 ILE A CG2 1 67 . A ATOM 545 C CD1 . ILE A 1 67 ? 10.878 2.980 24.591 1.0 13.01 ? 67 ILE A CD1 1 67 . A ATOM 546 N N . THR A 1 68 ? 12.831 -1.035 25.158 1.0 12.98 ? 68 THR A N 1 68 . A ATOM 547 C CA . THR A 1 68 ? 13.724 -1.470 24.099 1.0 14.44 ? 68 THR A CA 1 68 . A ATOM 548 C C . THR A 1 68 ? 13.535 -0.540 22.904 1.0 13.02 ? 68 THR A C 1 68 . A ATOM 549 O O . THR A 1 68 ? 12.535 -0.659 22.199 1.0 13.58 ? 68 THR A O 1 68 . A ATOM 550 C CB . THR A 1 68 ? 13.415 -2.911 23.662 1.0 15.87 ? 68 THR A CB 1 68 . A ATOM 551 O OG1 . THR A 1 68 ? 13.661 -3.795 24.764 1.0 17.31 ? 68 THR A OG1 1 68 . A ATOM 552 C CG2 . THR A 1 68 ? 14.305 -3.313 22.504 1.0 16.51 ? 68 THR A CG2 1 68 . A ATOM 553 N N . VAL A 1 69 ? 14.505 0.355 22.672 1.0 12.44 ? 69 VAL A N 1 69 . A ATOM 554 C CA . VAL A 1 69 ? 14.494 1.329 21.565 1.0 11.78 ? 69 VAL A CA 1 69 . A ATOM 555 C C . VAL A 1 69 ? 15.071 0.619 20.352 1.0 11.5 ? 69 VAL A C 1 69 . A ATOM 556 O O . VAL A 1 69 ? 16.296 0.567 20.126 1.0 13.2 ? 69 VAL A O 1 69 . A ATOM 557 C CB . VAL A 1 69 ? 15.340 2.587 21.899 1.0 10.79 ? 69 VAL A CB 1 69 . A ATOM 558 C CG1 . VAL A 1 69 ? 15.105 3.658 20.850 1.0 12.2 ? 69 VAL A CG1 1 69 . A ATOM 559 C CG2 . VAL A 1 69 ? 14.969 3.112 23.319 1.0 11.24 ? 69 VAL A CG2 1 69 . A ATOM 560 N N . GLN A 1 70 ? 14.163 0.148 19.524 1.0 10.26 ? 70 GLN A N 1 70 . A ATOM 561 C CA . GLN A 1 70 ? 14.527 -0.708 18.416 1.0 8.68 ? 70 GLN A CA 1 70 . A ATOM 562 C C . GLN A 1 70 ? 14.345 -0.119 17.042 1.0 8.37 ? 70 GLN A C 1 70 . A ATOM 563 O O . GLN A 1 70 ? 13.873 0.999 16.907 1.0 9.28 ? 70 GLN A O 1 70 . A ATOM 564 C CB . GLN A 1 70 ? 13.719 -1.977 18.576 1.0 8.98 ? 70 GLN A CB 1 70 . A ATOM 565 C CG . GLN A 1 70 ? 12.222 -1.704 18.699 1.0 8.73 ? 70 GLN A CG 1 70 . A ATOM 566 C CD . GLN A 1 70 ? 11.466 -2.942 19.103 1.0 8.34 ? 70 GLN A CD 1 70 . A ATOM 567 O OE1 . GLN A 1 70 ? 11.176 -3.774 18.261 1.0 7.81 ? 70 GLN A OE1 1 70 . A ATOM 568 N NE2 . GLN A 1 70 ? 11.165 -3.076 20.390 1.0 9.66 ? 70 GLN A NE2 1 70 . A ATOM 569 N N . ALA A 1 71 ? 14.685 -0.894 16.013 1.0 8.2 ? 71 ALA A N 1 71 . A ATOM 570 C CA . ALA A 1 71 ? 14.659 -0.375 14.655 1.0 8.98 ? 71 ALA A CA 1 71 . A ATOM 571 C C . ALA A 1 71 ? 13.309 0.054 14.136 1.0 8.9 ? 71 ALA A C 1 71 . A ATOM 572 O O . ALA A 1 71 ? 13.228 1.004 13.353 1.0 7.99 ? 71 ALA A O 1 71 . A ATOM 573 C CB . ALA A 1 71 ? 15.316 -1.390 13.705 1.0 9.54 ? 71 ALA A CB 1 71 . A ATOM 574 N N . ASP A 1 72 ? 12.245 -0.639 14.535 1.0 8.64 ? 72 ASP A N 1 72 . A ATOM 575 C CA . ASP A 1 72 ? 10.923 -0.222 14.070 1.0 9.2 ? 72 ASP A CA 1 72 . A ATOM 576 C C . ASP A 1 72 ? 10.435 0.924 14.971 1.0 7.33 ? 72 ASP A C 1 72 . A ATOM 577 O O . ASP A 1 72 ? 10.202 0.730 16.181 1.0 7.65 ? 72 ASP A O 1 72 . A ATOM 578 C CB . ASP A 1 72 ? 9.919 -1.381 14.119 1.0 9.6 ? 72 ASP A CB 1 72 . A ATOM 579 C CG . ASP A 1 72 ? 8.585 -1.009 13.478 1.0 10.47 ? 72 ASP A CG 1 72 . A ATOM 580 O OD1 . ASP A 1 72 ? 8.553 -0.721 12.267 1.0 12.52 ? 72 ASP A OD1 1 72 . A ATOM 581 O OD2 . ASP A 1 72 ? 7.555 -0.975 14.195 1.0 11.54 ? 72 ASP A OD2 1 72 . A ATOM 582 N N . ALA A 1 73 ? 10.295 2.120 14.395 1.0 8.3 ? 73 ALA A N 1 73 . A ATOM 583 C CA . ALA A 1 73 ? 9.860 3.266 15.169 1.0 8.99 ? 73 ALA A CA 1 73 . A ATOM 584 C C . ALA A 1 73 ? 8.455 3.102 15.757 1.0 8.21 ? 73 ALA A C 1 73 . A ATOM 585 O O . ALA A 1 73 ? 8.242 3.431 16.913 1.0 7.93 ? 73 ALA A O 1 73 . A ATOM 586 C CB . ALA A 1 73 ? 9.971 4.531 14.339 1.0 7.45 ? 73 ALA A CB 1 73 . A ATOM 587 N N . PRO A 1 74 ? 7.475 2.614 14.977 1.0 8.44 ? 74 PRO A N 1 74 . A ATOM 588 C CA . PRO A 1 74 ? 6.151 2.467 15.600 1.0 8.38 ? 74 PRO A CA 1 74 . A ATOM 589 C C . PRO A 1 74 ? 6.159 1.508 16.789 1.0 7.97 ? 74 PRO A C 1 74 . A ATOM 590 O O . PRO A 1 74 ? 5.491 1.751 17.789 1.0 8.65 ? 74 PRO A O 1 74 . A ATOM 591 C CB . PRO A 1 74 ? 5.275 1.953 14.452 1.0 9.47 ? 74 PRO A CB 1 74 . A ATOM 592 C CG . PRO A 1 74 ? 5.902 2.602 13.232 1.0 9.78 ? 74 PRO A CG 1 74 . A ATOM 593 C CD . PRO A 1 74 ? 7.410 2.431 13.510 1.0 8.87 ? 74 PRO A CD 1 74 . A ATOM 594 N N . THR A 1 75 ? 6.913 0.419 16.695 1.0 8.37 ? 75 THR A N 1 75 . A ATOM 595 C CA . THR A 1 75 ? 6.985 -0.507 17.821 1.0 8.2 ? 75 THR A CA 1 75 . A ATOM 596 C C . THR A 1 75 ? 7.586 0.204 19.041 1.0 8.25 ? 75 THR A C 1 75 . A ATOM 597 O O . THR A 1 75 ? 7.087 0.069 20.154 1.0 8.11 ? 75 THR A O 1 75 . A ATOM 598 C CB . THR A 1 75 ? 7.837 -1.737 17.466 1.0 10.02 ? 75 THR A CB 1 75 . A ATOM 599 O OG1 . THR A 1 75 ? 7.223 -2.421 16.362 1.0 9.61 ? 75 THR A OG1 1 75 . A ATOM 600 C CG2 . THR A 1 75 ? 7.909 -2.687 18.658 1.0 10.26 ? 75 THR A CG2 1 75 . A ATOM 601 N N . THR A 1 76 ? 8.664 0.950 18.806 1.0 7.95 ? 76 THR A N 1 76 . A ATOM 602 C CA . THR A 1 76 ? 9.321 1.700 19.888 1.0 7.6 ? 76 THR A CA 1 76 . A ATOM 603 C C . THR A 1 76 ? 8.325 2.684 20.506 1.0 8.08 ? 76 THR A C 1 76 . A ATOM 604 O O . THR A 1 76 ? 8.279 2.842 21.719 1.0 7.97 ? 76 THR A O 1 76 . A ATOM 605 C CB . THR A 1 76 ? 10.544 2.468 19.326 1.0 7.58 ? 76 THR A CB 1 76 . A ATOM 606 O OG1 . THR A 1 76 ? 11.477 1.525 18.796 1.0 7.64 ? 76 THR A OG1 1 76 . A ATOM 607 C CG2 . THR A 1 76 ? 11.245 3.262 20.416 1.0 7.7 ? 76 THR A CG2 1 76 . A ATOM 608 N N . ALA A 1 77 ? 7.546 3.355 19.655 1.0 6.93 ? 77 ALA A N 1 77 . A ATOM 609 C CA . ALA A 1 77 ? 6.555 4.321 20.141 1.0 7.01 ? 77 ALA A CA 1 77 . A ATOM 610 C C . ALA A 1 77 ? 5.511 3.687 21.047 1.0 7.58 ? 77 ALA A C 1 77 . A ATOM 611 O O . ALA A 1 77 ? 5.069 4.290 22.014 1.0 8.45 ? 77 ALA A O 1 77 . A ATOM 612 C CB . ALA A 1 77 ? 5.870 5.035 18.952 1.0 8.55 ? 77 ALA A CB 1 77 . A ATOM 613 N N . GLY A 1 78 ? 5.114 2.455 20.730 1.0 7.23 ? 78 GLY A N 1 78 . A ATOM 614 C CA . GLY A 1 78 ? 4.120 1.796 21.567 1.0 8.15 ? 78 GLY A CA 1 78 . A ATOM 615 C C . GLY A 1 78 ? 4.691 1.478 22.930 1.0 7.82 ? 78 GLY A C 1 78 . A ATOM 616 O O . GLY A 1 78 ? 4.008 1.662 23.950 1.0 9.93 ? 78 GLY A O 1 78 . A ATOM 617 N N . LEU A 1 79 ? 5.936 1.016 22.957 1.0 7.67 ? 79 LEU A N 1 79 . A ATOM 618 C CA . LEU A 1 79 ? 6.620 0.700 24.225 1.0 9.29 ? 79 LEU A CA 1 79 . A ATOM 619 C C . LEU A 1 79 ? 6.854 2.002 25.020 1.0 9.84 ? 79 LEU A C 1 79 . A ATOM 620 O O . LEU A 1 79 ? 6.749 2.023 26.255 1.0 10.65 ? 79 LEU A O 1 79 . A ATOM 621 C CB . LEU A 1 79 ? 7.968 0.012 23.968 1.0 10.0 ? 79 LEU A CB 1 79 . A ATOM 622 C CG . LEU A 1 79 ? 7.828 -1.367 23.306 1.0 10.34 ? 79 LEU A CG 1 79 . A ATOM 623 C CD1 . LEU A 1 79 ? 9.196 -1.883 22.885 1.0 11.72 ? 79 LEU A CD1 1 79 . A ATOM 624 C CD2 . LEU A 1 79 ? 7.147 -2.367 24.263 1.0 11.92 ? 79 LEU A CD2 1 79 . A ATOM 625 N N . PHE A 1 80 ? 7.176 3.080 24.307 1.0 9.2 ? 80 PHE A N 1 80 . A ATOM 626 C CA . PHE A 1 80 ? 7.385 4.366 24.969 1.0 9.41 ? 80 PHE A CA 1 80 . A ATOM 627 C C . PHE A 1 80 ? 6.072 4.904 25.534 1.0 9.46 ? 80 PHE A C 1 80 . A ATOM 628 O O . PHE A 1 80 ? 6.067 5.472 26.641 1.0 9.04 ? 80 PHE A O 1 80 . A ATOM 629 C CB . PHE A 1 80 ? 8.010 5.368 23.988 1.0 8.79 ? 80 PHE A CB 1 80 . A ATOM 630 C CG . PHE A 1 80 ? 8.303 6.732 24.597 1.0 8.77 ? 80 PHE A CG 1 80 . A ATOM 631 C CD1 . PHE A 1 80 ? 9.156 6.872 25.686 1.0 7.89 ? 80 PHE A CD1 1 80 . A ATOM 632 C CD2 . PHE A 1 80 ? 7.678 7.872 24.093 1.0 7.7 ? 80 PHE A CD2 1 80 . A ATOM 633 C CE1 . PHE A 1 80 ? 9.386 8.148 26.284 1.0 7.69 ? 80 PHE A CE1 1 80 . A ATOM 634 C CE2 . PHE A 1 80 ? 7.894 9.150 24.679 1.0 8.03 ? 80 PHE A CE2 1 80 . A ATOM 635 C CZ . PHE A 1 80 ? 8.749 9.276 25.771 1.0 8.24 ? 80 PHE A CZ 1 80 . A ATOM 636 N N . GLY A 1 81 ? 4.974 4.744 24.793 1.0 9.42 ? 81 GLY A N 1 81 . A ATOM 637 C CA . GLY A 1 81 ? 3.686 5.208 25.284 1.0 10.3 ? 81 GLY A CA 1 81 . A ATOM 638 C C . GLY A 1 81 ? 3.305 4.481 26.570 1.0 11.08 ? 81 GLY A C 1 81 . A ATOM 639 O O . GLY A 1 81 ? 2.795 5.085 27.509 1.0 11.16 ? 81 GLY A O 1 81 . A ATOM 640 N N . ASP A 1 82 ? 3.550 3.179 26.603 1.0 11.72 ? 82 ASP A N 1 82 . A ATOM 641 C CA . ASP A 1 82 ? 3.243 2.389 27.799 1.0 12.85 ? 82 ASP A CA 1 82 . A ATOM 642 C C . ASP A 1 82 ? 4.061 2.911 28.974 1.0 13.09 ? 82 ASP A C 1 82 . A ATOM 643 O O . ASP A 1 82 ? 3.517 3.118 30.064 1.0 13.16 ? 82 ASP A O 1 82 . A ATOM 644 C CB . ASP A 1 82 ? 3.597 0.913 27.588 1.0 14.26 ? 82 ASP A CB 1 82 . A ATOM 645 C CG . ASP A 1 82 ? 2.607 0.175 26.708 1.0 16.76 ? 82 ASP A CG 1 82 . A ATOM 646 O OD1 . ASP A 1 82 ? 2.963 -0.943 26.287 1.0 19.3 ? 82 ASP A OD1 1 82 . A ATOM 647 O OD2 . ASP A 1 82 ? 1.498 0.669 26.438 1.0 18.03 ? 82 ASP A OD2 1 82 . A ATOM 648 N N . TRP A 1 83 ? 5.363 3.109 28.768 1.0 12.6 ? 83 TRP A N 1 83 . A ATOM 649 C CA . TRP A 1 83 ? 6.223 3.586 29.847 1.0 13.13 ? 83 TRP A CA 1 83 . A ATOM 650 C C . TRP A 1 83 ? 5.868 5.022 30.249 1.0 13.29 ? 83 TRP A C 1 83 . A ATOM 651 O O . TRP A 1 83 ? 5.941 5.401 31.438 1.0 13.52 ? 83 TRP A O 1 83 . A ATOM 652 C CB . TRP A 1 83 ? 7.684 3.480 29.408 1.0 13.04 ? 83 TRP A CB 1 83 . A ATOM 653 C CG . TRP A 1 83 ? 8.654 3.954 30.425 1.0 13.01 ? 83 TRP A CG 1 83 . A ATOM 654 C CD1 . TRP A 1 83 ? 9.206 3.234 31.447 1.0 13.84 ? 83 TRP A CD1 1 83 . A ATOM 655 C CD2 . TRP A 1 83 ? 9.170 5.266 30.527 1.0 12.76 ? 83 TRP A CD2 1 83 . A ATOM 656 N NE1 . TRP A 1 83 ? 10.047 4.037 32.188 1.0 14.71 ? 83 TRP A NE1 1 83 . A ATOM 657 C CE2 . TRP A 1 83 ? 10.037 5.294 31.638 1.0 13.09 ? 83 TRP A CE2 1 83 . A ATOM 658 C CE3 . TRP A 1 83 ? 8.977 6.437 29.787 1.0 13.0 ? 83 TRP A CE3 1 83 . A ATOM 659 C CZ2 . TRP A 1 83 ? 10.714 6.451 32.020 1.0 13.96 ? 83 TRP A CZ2 1 83 . A ATOM 660 C CZ3 . TRP A 1 83 ? 9.649 7.586 30.164 1.0 14.0 ? 83 TRP A CZ3 1 83 . A ATOM 661 C CH2 . TRP A 1 83 ? 10.509 7.584 31.273 1.0 14.14 ? 83 TRP A CH2 1 83 . A ATOM 662 N N . ARG A 1 84 ? 5.461 5.823 29.271 1.0 12.08 ? 84 ARG A N 1 84 . A ATOM 663 C CA . ARG A 1 84 ? 5.075 7.205 29.554 1.0 12.21 ? 84 ARG A CA 1 84 . A ATOM 664 C C . ARG A 1 84 ? 3.814 7.283 30.432 1.0 12.19 ? 84 ARG A C 1 84 . A ATOM 665 O O . ARG A 1 84 ? 3.718 8.111 31.341 1.0 12.14 ? 84 ARG A O 1 84 . A ATOM 666 C CB . ARG A 1 84 ? 4.856 7.939 28.245 1.0 12.49 ? 84 ARG A CB 1 84 . A ATOM 667 C CG . ARG A 1 84 ? 4.533 9.393 28.410 1.0 11.92 ? 84 ARG A CG 1 84 . A ATOM 668 C CD . ARG A 1 84 ? 3.054 9.675 28.209 1.0 11.45 ? 84 ARG A CD 1 84 . A ATOM 669 N NE . ARG A 1 84 ? 2.748 11.094 28.386 1.0 11.34 ? 84 ARG A NE 1 84 . A ATOM 670 C CZ . ARG A 1 84 ? 1.594 11.648 28.044 1.0 12.01 ? 84 ARG A CZ 1 84 . A ATOM 671 N NH1 . ARG A 1 84 ? 0.653 10.905 27.496 1.0 11.47 ? 84 ARG A NH1 1 84 . A ATOM 672 N NH2 . ARG A 1 84 ? 1.378 12.950 28.248 1.0 11.88 ? 84 ARG A NH2 1 84 . A ATOM 673 N N . GLU A 1 85 ? 2.857 6.410 30.167 1.0 11.57 ? 85 GLU A N 1 85 . A ATOM 674 C CA . GLU A 1 85 ? 1.627 6.408 30.951 1.0 12.56 ? 85 GLU A CA 1 85 . A ATOM 675 C C . GLU A 1 85 ? 1.898 5.870 32.361 1.0 13.03 ? 85 GLU A C 1 85 . A ATOM 676 O O . GLU A 1 85 ? 1.529 6.488 33.362 1.0 13.44 ? 85 GLU A O 1 85 . A ATOM 677 C CB . GLU A 1 85 ? 0.562 5.536 30.268 1.0 13.18 ? 85 GLU A CB 1 85 . A ATOM 678 C CG . GLU A 1 85 ? -0.703 5.416 31.107 1.0 14.31 ? 85 GLU A CG 1 85 . A ATOM 679 C CD . GLU A 1 85 ? -1.791 4.597 30.443 1.0 16.37 ? 85 GLU A CD 1 85 . A ATOM 680 O OE1 . GLU A 1 85 ? -1.603 4.149 29.295 1.0 18.4 ? 85 GLU A OE1 1 85 . A ATOM 681 O OE2 . GLU A 1 85 ? -2.832 4.402 31.106 1.0 16.26 ? 85 GLU A OE2 1 85 . A ATOM 682 N N . ARG A 1 86 ? 2.592 4.746 32.433 1.0 13.4 ? 86 ARG A N 1 86 . A ATOM 683 C CA . ARG A 1 86 ? 2.852 4.091 33.708 1.0 15.35 ? 86 ARG A CA 1 86 . A ATOM 684 C C . ARG A 1 86 ? 3.897 4.726 34.592 1.0 14.54 ? 86 ARG A C 1 86 . A ATOM 685 O O . ARG A 1 86 ? 3.816 4.621 35.823 1.0 14.97 ? 86 ARG A O 1 86 . A ATOM 686 C CB . ARG A 1 86 ? 3.236 2.634 33.453 1.0 17.6 ? 86 ARG A CB 1 86 . A ATOM 687 C CG . ARG A 1 86 ? 2.155 1.868 32.705 1.0 22.08 ? 86 ARG A CG 1 86 . A ATOM 688 C CD . ARG A 1 86 ? 2.665 0.566 32.144 1.0 25.37 ? 86 ARG A CD 1 86 . A ATOM 689 N NE . ARG A 1 86 ? 1.729 0.017 31.163 1.0 29.25 ? 86 ARG A NE 1 86 . A ATOM 690 C CZ . ARG A 1 86 ? 1.994 -1.032 30.389 1.0 30.55 ? 86 ARG A CZ 1 86 . A ATOM 691 N NH1 . ARG A 1 86 ? 3.165 -1.646 30.481 1.0 32.05 ? 86 ARG A NH1 1 86 . A ATOM 692 N NH2 . ARG A 1 86 ? 1.092 -1.458 29.516 1.0 31.94 ? 86 ARG A NH2 1 86 . A ATOM 693 N N . VAL A 1 87 ? 4.874 5.390 33.992 1.0 14.46 ? 87 VAL A N 1 87 . A ATOM 694 C CA . VAL A 1 87 ? 5.947 5.964 34.780 1.0 14.79 ? 87 VAL A CA 1 87 . A ATOM 695 C C . VAL A 1 87 ? 6.103 7.465 34.657 1.0 14.18 ? 87 VAL A C 1 87 . A ATOM 696 O O . VAL A 1 87 ? 6.005 8.180 35.645 1.0 14.88 ? 87 VAL A O 1 87 . A ATOM 697 C CB . VAL A 1 87 ? 7.290 5.302 34.412 1.0 15.87 ? 87 VAL A CB 1 87 . A ATOM 698 C CG1 . VAL A 1 87 ? 8.429 6.028 35.116 1.0 15.62 ? 87 VAL A CG1 1 87 . A ATOM 699 C CG2 . VAL A 1 87 ? 7.261 3.820 34.783 1.0 16.07 ? 87 VAL A CG2 1 87 . A ATOM 700 N N . LEU A 1 88 ? 6.339 7.956 33.444 1.0 13.89 ? 88 LEU A N 1 88 . A ATOM 701 C CA . LEU A 1 88 ? 6.588 9.383 33.268 1.0 13.74 ? 88 LEU A CA 1 88 . A ATOM 702 C C . LEU A 1 88 ? 5.453 10.287 33.760 1.0 13.73 ? 88 LEU A C 1 88 . A ATOM 703 O O . LEU A 1 88 ? 5.707 11.291 34.466 1.0 13.45 ? 88 LEU A O 1 88 . A ATOM 704 C CB . LEU A 1 88 ? 6.962 9.674 31.795 1.0 13.59 ? 88 LEU A CB 1 88 . A ATOM 705 C CG . LEU A 1 88 ? 7.669 11.023 31.538 1.0 14.9 ? 88 LEU A CG 1 88 . A ATOM 706 C CD1 . LEU A 1 88 ? 9.066 11.044 32.183 1.0 15.58 ? 88 LEU A CD1 1 88 . A ATOM 707 C CD2 . LEU A 1 88 ? 7.780 11.254 30.023 1.0 14.61 ? 88 LEU A CD2 1 88 . A ATOM 708 N N . LEU A 1 89 ? 4.211 9.970 33.405 1.0 12.45 ? 89 LEU A N 1 89 . A ATOM 709 C CA . LEU A 1 89 ? 3.081 10.776 33.871 1.0 13.94 ? 89 LEU A CA 1 89 . A ATOM 710 C C . LEU A 1 89 ? 2.953 10.817 35.396 1.0 15.48 ? 89 LEU A C 1 89 . A ATOM 711 O O . LEU A 1 89 ? 2.426 11.785 35.947 1.0 14.97 ? 89 LEU A O 1 89 . A ATOM 712 C CB . LEU A 1 89 ? 1.771 10.283 33.244 1.0 14.01 ? 89 LEU A CB 1 89 . A ATOM 713 C CG . LEU A 1 89 ? 1.442 10.910 31.879 1.0 13.69 ? 89 LEU A CG 1 89 . A ATOM 714 C CD1 . LEU A 1 89 ? 0.217 10.220 31.317 1.0 14.35 ? 89 LEU A CD1 1 89 . A ATOM 715 C CD2 . LEU A 1 89 ? 1.186 12.416 31.994 1.0 12.93 ? 89 LEU A CD2 1 89 . A ATOM 716 N N . LYS A 1 90 ? 3.453 9.792 36.082 1.0 15.89 ? 90 LYS A N 1 90 . A ATOM 717 C CA . LYS A 1 90 ? 3.392 9.782 37.549 1.0 18.06 ? 90 LYS A CA 1 90 . A ATOM 718 C C . LYS A 1 90 ? 4.460 10.702 38.151 1.0 17.94 ? 90 LYS A C 1 90 . A ATOM 719 O O . LYS A 1 90 ? 4.373 11.089 39.321 1.0 18.09 ? 90 LYS A O 1 90 . A ATOM 720 C CB . LYS A 1 90 ? 3.574 8.355 38.093 1.0 19.59 ? 90 LYS A CB 1 90 . A ATOM 721 C CG . LYS A 1 90 ? 2.534 7.336 37.600 1.0 23.27 ? 90 LYS A CG 1 90 . A ATOM 722 C CD . LYS A 1 90 ? 1.126 7.905 37.597 1.0 25.75 ? 90 LYS A CD 1 90 . A ATOM 723 C CE . LYS A 1 90 ? 0.056 6.809 37.643 1.0 27.77 ? 90 LYS A CE 1 90 . A ATOM 724 N NZ . LYS A 1 90 ? 0.055 5.937 36.437 1.0 28.8 ? 90 LYS A NZ 1 90 . A ATOM 725 N N . LYS A 1 91 ? 5.472 11.057 37.364 1.0 17.77 ? 91 LYS A N 1 91 . A ATOM 726 C CA . LYS A 1 91 ? 6.522 11.937 37.855 1.0 17.54 ? 91 LYS A CA 1 91 . A ATOM 727 C C . LYS A 1 91 ? 6.066 13.393 37.794 1.0 16.38 ? 91 LYS A C 1 91 . A ATOM 728 O O . LYS A 1 91 ? 6.258 14.159 38.742 1.0 15.91 ? 91 LYS A O 1 91 . A ATOM 729 C CB . LYS A 1 91 ? 7.805 11.739 37.040 1.0 18.87 ? 91 LYS A CB 1 91 . A ATOM 730 C CG . LYS A 1 91 ? 8.305 10.295 37.060 1.0 21.72 ? 91 LYS A CG 1 91 . A ATOM 731 C CD . LYS A 1 91 ? 8.485 9.810 38.492 1.0 24.37 ? 91 LYS A CD 1 91 . A ATOM 732 C CE . LYS A 1 91 ? 8.409 8.287 38.605 1.0 26.42 ? 91 LYS A CE 1 91 . A ATOM 733 N NZ . LYS A 1 91 ? 7.039 7.745 38.307 1.0 27.07 ? 91 LYS A NZ 1 91 . A ATOM 734 N N . LYS A 1 92 ? 5.453 13.780 36.683 1.0 14.4 ? 92 LYS A N 1 92 . A ATOM 735 C CA . LYS A 1 92 ? 4.963 15.145 36.538 1.0 13.29 ? 92 LYS A CA 1 92 . A ATOM 736 C C . LYS A 1 92 ? 4.000 15.145 35.387 1.0 13.12 ? 92 LYS A C 1 92 . A ATOM 737 O O . LYS A 1 92 ? 4.298 14.611 34.314 1.0 11.68 ? 92 LYS A O 1 92 . A ATOM 738 C CB . LYS A 1 92 ? 6.101 16.121 36.235 1.0 11.8 ? 92 LYS A CB 1 92 . A ATOM 739 C CG . LYS A 1 92 ? 5.670 17.594 36.279 1.0 11.93 ? 92 LYS A CG 1 92 . A ATOM 740 C CD . LYS A 1 92 ? 6.836 18.526 35.983 1.0 12.03 ? 92 LYS A CD 1 92 . A ATOM 741 C CE . LYS A 1 92 ? 6.429 20.012 36.018 1.0 11.69 ? 92 LYS A CE 1 92 . A ATOM 742 N NZ . LYS A 1 92 ? 7.581 20.898 35.707 1.0 12.85 ? 92 LYS A NZ 1 92 . A ATOM 743 N N . ASN A 1 93 ? 2.836 15.734 35.585 1.0 12.27 ? 93 ASN A N 1 93 . A ATOM 744 C CA . ASN A 1 93 ? 1.886 15.746 34.504 1.0 12.66 ? 93 ASN A CA 1 93 . A ATOM 745 C C . ASN A 1 93 ? 2.378 16.584 33.335 1.0 11.73 ? 93 ASN A C 1 93 . A ATOM 746 O O . ASN A 1 93 ? 3.099 17.569 33.503 1.0 11.17 ? 93 ASN A O 1 93 . A ATOM 747 C CB . ASN A 1 93 ? 0.526 16.255 34.961 1.0 14.52 ? 93 ASN A CB 1 93 . A ATOM 748 C CG . ASN A 1 93 ? -0.497 16.156 33.861 1.0 17.78 ? 93 ASN A CG 1 93 . A ATOM 749 O OD1 . ASN A 1 93 ? -0.750 15.067 33.334 1.0 18.25 ? 93 ASN A OD1 1 93 . A ATOM 750 N ND2 . ASN A 1 93 ? -1.069 17.285 33.481 1.0 20.45 ? 93 ASN A ND2 1 93 . A ATOM 751 N N . HIS A 1 94 ? 1.998 16.156 32.129 1.0 9.32 ? 94 HIS A N 1 94 . A ATOM 752 C CA . HIS A 1 94 ? 2.378 16.868 30.915 1.0 8.91 ? 94 HIS A CA 1 94 . A ATOM 753 C C . HIS A 1 94 ? 1.425 16.389 29.817 1.0 9.33 ? 94 HIS A C 1 94 . A ATOM 754 O O . HIS A 1 94 ? 0.756 15.379 29.988 1.0 9.93 ? 94 HIS A O 1 94 . A ATOM 755 C CB . HIS A 1 94 ? 3.836 16.571 30.551 1.0 8.44 ? 94 HIS A CB 1 94 . A ATOM 756 C CG . HIS A 1 94 ? 4.132 15.109 30.394 1.0 8.67 ? 94 HIS A CG 1 94 . A ATOM 757 N ND1 . HIS A 1 94 ? 4.393 14.275 31.462 1.0 9.49 ? 94 HIS A ND1 1 94 . A ATOM 758 C CD2 . HIS A 1 94 ? 4.176 14.328 29.288 1.0 8.68 ? 94 HIS A CD2 1 94 . A ATOM 759 C CE1 . HIS A 1 94 ? 4.587 13.045 31.017 1.0 9.07 ? 94 HIS A CE1 1 94 . A ATOM 760 N NE2 . HIS A 1 94 ? 4.462 13.052 29.704 1.0 8.28 ? 94 HIS A NE2 1 94 . A ATOM 761 N N . ASP A 1 95 ? 1.441 17.068 28.680 1.0 8.23 ? 95 ASP A N 1 95 . A ATOM 762 C CA . ASP A 1 95 ? 0.474 16.799 27.607 1.0 7.98 ? 95 ASP A CA 1 95 . A ATOM 763 C C . ASP A 1 95 ? 0.894 15.840 26.512 1.0 8.14 ? 95 ASP A C 1 95 . A ATOM 764 O O . ASP A 1 95 ? 0.052 15.159 25.906 1.0 8.75 ? 95 ASP A O 1 95 . A ATOM 765 C CB . ASP A 1 95 ? 0.108 18.136 26.921 1.0 9.26 ? 95 ASP A CB 1 95 . A ATOM 766 C CG . ASP A 1 95 ? -0.477 19.147 27.879 1.0 9.78 ? 95 ASP A CG 1 95 . A ATOM 767 O OD1 . ASP A 1 95 ? -0.235 20.358 27.677 1.0 11.64 ? 95 ASP A OD1 1 95 . A ATOM 768 O OD2 . ASP A 1 95 ? -1.164 18.732 28.815 1.0 11.0 ? 95 ASP A OD2 1 95 . A ATOM 769 N N . HIS A 1 96 ? 2.200 15.811 26.244 1.0 7.47 ? 96 HIS A N 1 96 . A ATOM 770 C CA . HIS A 1 96 ? 2.762 15.030 25.138 1.0 7.72 ? 96 HIS A CA 1 96 . A ATOM 771 C C . HIS A 1 96 ? 4.203 14.760 25.498 1.0 7.72 ? 96 HIS A C 1 96 . A ATOM 772 O O . HIS A 1 96 ? 4.876 15.620 26.070 1.0 8.94 ? 96 HIS A O 1 96 . A ATOM 773 C CB . HIS A 1 96 ? 2.712 15.920 23.871 1.0 7.0 ? 96 HIS A CB 1 96 . A ATOM 774 C CG . HIS A 1 96 ? 3.171 15.232 22.622 1.0 6.86 ? 96 HIS A CG 1 96 . A ATOM 775 N ND1 . HIS A 1 96 ? 4.442 15.360 22.084 1.0 8.44 ? 96 HIS A ND1 1 96 . A ATOM 776 C CD2 . HIS A 1 96 ? 2.510 14.377 21.810 1.0 4.68 ? 96 HIS A CD2 1 96 . A ATOM 777 C CE1 . HIS A 1 96 ? 4.537 14.614 20.995 1.0 4.96 ? 96 HIS A CE1 1 96 . A ATOM 778 N NE2 . HIS A 1 96 ? 3.377 14.006 20.812 1.0 8.56 ? 96 HIS A NE2 1 96 . A ATOM 779 N N . ALA A 1 97 ? 4.681 13.570 25.148 1.0 6.24 ? 97 ALA A N 1 97 . A ATOM 780 C CA . ALA A 1 97 ? 6.068 13.245 25.452 1.0 6.72 ? 97 ALA A CA 1 97 . A ATOM 781 C C . ALA A 1 97 ? 6.789 12.734 24.199 1.0 6.24 ? 97 ALA A C 1 97 . A ATOM 782 O O . ALA A 1 97 ? 6.203 11.992 23.395 1.0 7.33 ? 97 ALA A O 1 97 . A ATOM 783 C CB . ALA A 1 97 ? 6.127 12.167 26.549 1.0 7.97 ? 97 ALA A CB 1 97 . A ATOM 784 N N . GLN A 1 98 ? 8.044 13.141 24.021 1.0 5.94 ? 98 GLN A N 1 98 . A ATOM 785 C CA . GLN A 1 98 ? 8.825 12.643 22.894 1.0 6.31 ? 98 GLN A CA 1 98 . A ATOM 786 C C . GLN A 1 98 ? 10.098 11.991 23.400 1.0 6.26 ? 98 GLN A C 1 98 . A ATOM 787 O O . GLN A 1 98 ? 10.766 12.513 24.299 1.0 6.86 ? 98 GLN A O 1 98 . A ATOM 788 C CB . GLN A 1 98 ? 9.184 13.761 21.896 1.0 6.66 ? 98 GLN A CB 1 98 . A ATOM 789 C CG . GLN A 1 98 ? 7.948 14.518 21.402 1.0 6.26 ? 98 GLN A CG 1 98 . A ATOM 790 C CD . GLN A 1 98 ? 8.182 15.254 20.101 1.0 5.92 ? 98 GLN A CD 1 98 . A ATOM 791 O OE1 . GLN A 1 98 ? 9.334 15.537 19.713 1.0 8.46 ? 98 GLN A OE1 1 98 . A ATOM 792 N NE2 . GLN A 1 98 ? 7.091 15.562 19.406 1.0 6.63 ? 98 GLN A NE2 1 98 . A ATOM 793 N N . LEU A 1 99 ? 10.415 10.842 22.822 1.0 6.32 ? 99 LEU A N 1 99 . A ATOM 794 C CA . LEU A 1 99 ? 11.637 10.120 23.117 1.0 7.18 ? 99 LEU A CA 1 99 . A ATOM 795 C C . LEU A 1 99 ? 12.652 10.452 22.024 1.0 6.67 ? 99 LEU A C 1 99 . A ATOM 796 O O . LEU A 1 99 ? 12.379 10.213 20.828 1.0 7.56 ? 99 LEU A O 1 99 . A ATOM 797 C CB . LEU A 1 99 ? 11.381 8.600 23.092 1.0 7.2 ? 99 LEU A CB 1 99 . A ATOM 798 C CG . LEU A 1 99 ? 12.637 7.712 23.252 1.0 7.51 ? 99 LEU A CG 1 99 . A ATOM 799 C CD1 . LEU A 1 99 ? 13.183 7.852 24.676 1.0 8.67 ? 99 LEU A CD1 1 99 . A ATOM 800 C CD2 . LEU A 1 99 ? 12.271 6.228 22.989 1.0 8.71 ? 99 LEU A CD2 1 99 . A ATOM 801 N N . LEU A 1 100 ? 13.809 10.996 22.413 1.0 6.59 ? 100 LEU A N 1 100 . A ATOM 802 C CA . LEU A 1 100 ? 14.896 11.313 21.470 1.0 7.7 ? 100 LEU A CA 1 100 . A ATOM 803 C C . LEU A 1 100 ? 15.900 10.188 21.552 1.0 8.15 ? 100 LEU A C 1 100 . A ATOM 804 O O . LEU A 1 100 ? 16.306 9.774 22.652 1.0 7.95 ? 100 LEU A O 1 100 . A ATOM 805 C CB . LEU A 1 100 ? 15.595 12.638 21.844 1.0 7.9 ? 100 LEU A CB 1 100 . A ATOM 806 C CG . LEU A 1 100 ? 14.868 13.926 21.492 1.0 10.6 ? 100 LEU A CG 1 100 . A ATOM 807 C CD1 . LEU A 1 100 ? 15.482 15.107 22.222 1.0 11.38 ? 100 LEU A CD1 1 100 . A ATOM 808 C CD2 . LEU A 1 100 ? 15.013 14.119 19.965 1.0 11.23 ? 100 LEU A CD2 1 100 . A ATOM 809 N N . THR A 1 101 ? 16.344 9.717 20.387 1.0 8.1 ? 101 THR A N 1 101 . A ATOM 810 C CA . THR A 1 101 ? 17.265 8.583 20.361 1.0 8.36 ? 101 THR A CA 1 101 . A ATOM 811 C C . THR A 1 101 ? 18.243 8.699 19.214 1.0 7.88 ? 101 THR A C 1 101 . A ATOM 812 O O . THR A 1 101 ? 17.980 9.437 18.245 1.0 7.59 ? 101 THR A O 1 101 . A ATOM 813 C CB . THR A 1 101 ? 16.453 7.273 20.169 1.0 8.13 ? 101 THR A CB 1 101 . A ATOM 814 O OG1 . THR A 1 101 ? 17.321 6.129 20.184 1.0 7.56 ? 101 THR A OG1 1 101 . A ATOM 815 C CG2 . THR A 1 101 ? 15.679 7.287 18.846 1.0 8.97 ? 101 THR A CG2 1 101 . A ATOM 816 N N . ASP A 1 102 ? 19.370 8.004 19.318 1.0 8.1 ? 102 ASP A N 1 102 . A ATOM 817 C CA . ASP A 1 102 ? 20.307 7.975 18.211 1.0 8.3 ? 102 ASP A CA 1 102 . A ATOM 818 C C . ASP A 1 102 ? 20.149 6.662 17.411 1.0 8.14 ? 102 ASP A C 1 102 . A ATOM 819 O O . ASP A 1 102 ? 20.915 6.382 16.501 1.0 8.74 ? 102 ASP A O 1 102 . A ATOM 820 C CB . ASP A 1 102 ? 21.746 8.127 18.655 1.0 10.36 ? 102 ASP A CB 1 102 . A ATOM 821 C CG . ASP A 1 102 ? 22.649 8.361 17.481 1.0 13.89 ? 102 ASP A CG 1 102 . A ATOM 822 O OD1 . ASP A 1 102 ? 22.324 9.278 16.681 1.0 16.84 ? 102 ASP A OD1 1 102 . A ATOM 823 O OD2 . ASP A 1 102 ? 23.652 7.631 17.335 1.0 16.4 ? 102 ASP A OD2 1 102 . A ATOM 824 N N . THR A 1 103 ? 19.106 5.906 17.733 1.0 6.97 ? 103 THR A N 1 103 . A ATOM 825 C CA . THR A 1 103 ? 18.837 4.639 17.059 1.0 7.28 ? 103 THR A CA 1 103 . A ATOM 826 C C . THR A 1 103 ? 18.711 4.810 15.555 1.0 8.32 ? 103 THR A C 1 103 . A ATOM 827 O O . THR A 1 103 ? 18.050 5.735 15.066 1.0 7.18 ? 103 THR A O 1 103 . A ATOM 828 C CB . THR A 1 103 ? 17.517 4.026 17.588 1.0 8.22 ? 103 THR A CB 1 103 . A ATOM 829 O OG1 . THR A 1 103 ? 17.668 3.718 18.973 1.0 9.06 ? 103 THR A OG1 1 103 . A ATOM 830 C CG2 . THR A 1 103 ? 17.182 2.719 16.861 1.0 7.92 ? 103 THR A CG2 1 103 . A ATOM 831 N N . ASN A 1 104 ? 19.331 3.895 14.809 1.0 8.08 ? 104 ASN A N 1 104 . A ATOM 832 C CA . ASN A 1 104 ? 19.218 3.927 13.366 1.0 10.22 ? 104 ASN A CA 1 104 . A ATOM 833 C C . ASN A 1 104 ? 17.900 3.197 13.008 1.0 9.36 ? 104 ASN A C 1 104 . A ATOM 834 O O . ASN A 1 104 ? 17.878 2.018 12.669 1.0 8.91 ? 104 ASN A O 1 104 . A ATOM 835 C CB . ASN A 1 104 ? 20.439 3.222 12.777 1.0 11.73 ? 104 ASN A CB 1 104 . A ATOM 836 C CG . ASN A 1 104 ? 20.574 3.412 11.310 1.0 14.77 ? 104 ASN A CG 1 104 . A ATOM 837 O OD1 . ASN A 1 104 ? 21.443 2.788 10.651 1.0 18.54 ? 104 ASN A OD1 1 104 . A ATOM 838 N ND2 . ASN A 1 104 ? 19.743 4.254 10.762 1.0 13.49 ? 104 ASN A ND2 1 104 . A ATOM 839 N N . PHE A 1 105 ? 16.783 3.897 13.136 1.0 8.32 ? 105 PHE A N 1 105 . A ATOM 840 C CA . PHE A 1 105 ? 15.488 3.317 12.792 1.0 9.12 ? 105 PHE A CA 1 105 . A ATOM 841 C C . PHE A 1 105 ? 15.537 2.798 11.348 1.0 9.46 ? 105 PHE A C 1 105 . A ATOM 842 O O . PHE A 1 105 ? 16.228 3.343 10.487 1.0 9.35 ? 105 PHE A O 1 105 . A ATOM 843 C CB . PHE A 1 105 ? 14.370 4.363 12.890 1.0 8.59 ? 105 PHE A CB 1 105 . A ATOM 844 C CG . PHE A 1 105 ? 14.029 4.805 14.294 1.0 8.91 ? 105 PHE A CG 1 105 . A ATOM 845 C CD1 . PHE A 1 105 ? 13.836 6.173 14.562 1.0 9.2 ? 105 PHE A CD1 1 105 . A ATOM 846 C CD2 . PHE A 1 105 ? 13.801 3.881 15.313 1.0 7.52 ? 105 PHE A CD2 1 105 . A ATOM 847 C CE1 . PHE A 1 105 ? 13.414 6.599 15.833 1.0 9.38 ? 105 PHE A CE1 1 105 . A ATOM 848 C CE2 . PHE A 1 105 ? 13.385 4.299 16.573 1.0 8.48 ? 105 PHE A CE2 1 105 . A ATOM 849 C CZ . PHE A 1 105 ? 13.191 5.670 16.837 1.0 7.89 ? 105 PHE A CZ 1 105 . A ATOM 850 N N . ALA A 1 106 ? 14.752 1.761 11.105 1.0 10.18 ? 106 ALA A N 1 106 . A ATOM 851 C CA . ALA A 1 106 ? 14.693 1.129 9.793 1.0 10.02 ? 106 ALA A CA 1 106 . A ATOM 852 C C . ALA A 1 106 ? 14.216 2.069 8.695 1.0 12.4 ? 106 ALA A C 1 106 . A ATOM 853 O O . ALA A 1 106 ? 13.478 3.025 8.941 1.0 12.45 ? 106 ALA A O 1 106 . A ATOM 854 C CB . ALA A 1 106 ? 13.785 -0.052 9.873 1.0 11.05 ? 106 ALA A CB 1 106 . A ATOM 855 N N . ARG A 1 107 ? 14.677 1.788 7.481 1.0 13.19 ? 107 ARG A N 1 107 . A ATOM 856 C CA . ARG A 1 107 ? 14.283 2.549 6.299 1.0 15.51 ? 107 ARG A CA 1 107 . A ATOM 857 C C . ARG A 1 107 ? 14.556 4.038 6.375 1.0 14.99 ? 107 ARG A C 1 107 . A ATOM 858 O O . ARG A 1 107 ? 13.809 4.857 5.824 1.0 15.24 ? 107 ARG A O 1 107 . A ATOM 859 C CB . ARG A 1 107 ? 12.806 2.297 6.042 1.0 18.29 ? 107 ARG A CB 1 107 . A ATOM 860 C CG . ARG A 1 107 ? 12.502 0.849 5.724 1.0 22.4 ? 107 ARG A CG 1 107 . A ATOM 861 C CD . ARG A 1 107 ? 11.013 0.613 5.758 1.0 26.37 ? 107 ARG A CD 1 107 . A ATOM 862 N NE . ARG A 1 107 ? 10.554 -0.276 4.698 1.0 30.45 ? 107 ARG A NE 1 107 . A ATOM 863 C CZ . ARG A 1 107 ? 10.723 -0.050 3.397 1.0 31.99 ? 107 ARG A CZ 1 107 . A ATOM 864 N NH1 . ARG A 1 107 ? 11.352 1.042 2.982 1.0 32.63 ? 107 ARG A NH1 1 107 . A ATOM 865 N NH2 . ARG A 1 107 ? 10.237 -0.908 2.507 1.0 33.62 ? 107 ARG A NH2 1 107 . A ATOM 866 N N . ASN A 1 108 ? 15.644 4.389 7.036 1.0 13.68 ? 108 ASN A N 1 108 . A ATOM 867 C CA . ASN A 1 108 ? 16.042 5.777 7.179 1.0 14.55 ? 108 ASN A CA 1 108 . A ATOM 868 C C . ASN A 1 108 ? 14.939 6.600 7.825 1.0 13.15 ? 108 ASN A C 1 108 . A ATOM 869 O O . ASN A 1 108 ? 14.868 7.807 7.613 1.0 13.3 ? 108 ASN A O 1 108 . A ATOM 870 C CB . ASN A 1 108 ? 16.374 6.346 5.803 1.0 17.18 ? 108 ASN A CB 1 108 . A ATOM 871 C CG . ASN A 1 108 ? 17.159 5.372 4.967 1.0 21.35 ? 108 ASN A CG 1 108 . A ATOM 872 O OD1 . ASN A 1 108 ? 16.953 5.262 3.749 1.0 23.58 ? 108 ASN A OD1 1 108 . A ATOM 873 N ND2 . ASN A 1 108 ? 18.066 4.645 5.612 1.0 22.84 ? 108 ASN A ND2 1 108 . A ATOM 874 N N . THR A 1 109 ? 14.097 5.952 8.622 1.0 11.42 ? 109 THR A N 1 109 . A ATOM 875 C CA . THR A 1 109 ? 13.012 6.641 9.327 1.0 11.35 ? 109 THR A CA 1 109 . A ATOM 876 C C . THR A 1 109 ? 13.630 7.520 10.413 1.0 9.04 ? 109 THR A C 1 109 . A ATOM 877 O O . THR A 1 109 ? 14.612 7.150 11.042 1.0 9.67 ? 109 THR A O 1 109 . A ATOM 878 C CB . THR A 1 109 ? 12.041 5.612 9.962 1.0 12.93 ? 109 THR A CB 1 109 . A ATOM 879 O OG1 . THR A 1 109 ? 11.248 5.033 8.910 1.0 16.31 ? 109 THR A OG1 1 109 . A ATOM 880 C CG2 . THR A 1 109 ? 11.110 6.296 11.020 1.0 14.29 ? 109 THR A CG2 1 109 . A ATOM 881 N N . ILE A 1 110 ? 13.090 8.717 10.611 1.0 7.83 ? 110 ILE A N 1 110 . A ATOM 882 C CA . ILE A 1 110 ? 13.645 9.622 11.616 1.0 8.33 ? 110 ILE A CA 1 110 . A ATOM 883 C C . ILE A 1 110 ? 12.647 10.019 12.697 1.0 8.24 ? 110 ILE A C 1 110 . A ATOM 884 O O . ILE A 1 110 ? 12.989 10.764 13.600 1.0 7.32 ? 110 ILE A O 1 110 . A ATOM 885 C CB . ILE A 1 110 ? 14.247 10.891 10.955 1.0 7.78 ? 110 ILE A CB 1 110 . A ATOM 886 C CG1 . ILE A 1 110 ? 13.191 11.593 10.109 1.0 7.74 ? 110 ILE A CG1 1 110 . A ATOM 887 C CG2 . ILE A 1 110 ? 15.426 10.503 10.061 1.0 8.71 ? 110 ILE A CG2 1 110 . A ATOM 888 C CD1 . ILE A 1 110 ? 13.689 12.915 9.520 1.0 9.7 ? 110 ILE A CD1 1 110 . A ATOM 889 N N . GLY A 1 111 ? 11.426 9.505 12.637 1.0 8.26 ? 111 GLY A N 1 111 . A ATOM 890 C CA . GLY A 1 111 ? 10.463 9.806 13.692 1.0 8.82 ? 111 GLY A CA 1 111 . A ATOM 891 C C . GLY A 1 111 ? 9.134 9.135 13.403 1.0 8.47 ? 111 GLY A C 1 111 . A ATOM 892 O O . GLY A 1 111 ? 8.880 8.696 12.285 1.0 8.92 ? 111 GLY A O 1 111 . A ATOM 893 N N . TRP A 1 112 ? 8.279 9.049 14.423 1.0 7.99 ? 112 TRP A N 1 112 . A ATOM 894 C CA . TRP A 1 112 ? 6.953 8.457 14.254 1.0 7.76 ? 112 TRP A CA 1 112 . A ATOM 895 C C . TRP A 1 112 ? 6.067 8.904 15.432 1.0 7.69 ? 112 TRP A C 1 112 . A ATOM 896 O O . TRP A 1 112 ? 6.571 9.136 16.531 1.0 8.45 ? 112 TRP A O 1 112 . A ATOM 897 C CB . TRP A 1 112 ? 7.034 6.922 14.217 1.0 8.81 ? 112 TRP A CB 1 112 . A ATOM 898 C CG . TRP A 1 112 ? 5.784 6.294 13.704 1.0 10.0 ? 112 TRP A CG 1 112 . A ATOM 899 C CD1 . TRP A 1 112 ? 5.463 6.057 12.400 1.0 11.76 ? 112 TRP A CD1 1 112 . A ATOM 900 C CD2 . TRP A 1 112 ? 4.660 5.874 14.484 1.0 10.87 ? 112 TRP A CD2 1 112 . A ATOM 901 N NE1 . TRP A 1 112 ? 4.199 5.517 12.322 1.0 12.91 ? 112 TRP A NE1 1 112 . A ATOM 902 C CE2 . TRP A 1 112 ? 3.684 5.389 13.586 1.0 11.14 ? 112 TRP A CE2 1 112 . A ATOM 903 C CE3 . TRP A 1 112 ? 4.379 5.861 15.852 1.0 11.01 ? 112 TRP A CE3 1 112 . A ATOM 904 C CZ2 . TRP A 1 112 ? 2.439 4.886 14.020 1.0 12.68 ? 112 TRP A CZ2 1 112 . A ATOM 905 C CZ3 . TRP A 1 112 ? 3.141 5.363 16.283 1.0 12.44 ? 112 TRP A CZ3 1 112 . A ATOM 906 C CH2 . TRP A 1 112 ? 2.189 4.879 15.368 1.0 12.31 ? 112 TRP A CH2 1 112 . A ATOM 907 N N . ALA A 1 113 ? 4.760 9.041 15.198 1.0 7.71 ? 113 ALA A N 1 113 . A ATOM 908 C CA . ALA A 1 113 ? 3.830 9.428 16.280 1.0 6.6 ? 113 ALA A CA 1 113 . A ATOM 909 C C . ALA A 1 113 ? 2.446 8.994 15.851 1.0 7.02 ? 113 ALA A C 1 113 . A ATOM 910 O O . ALA A 1 113 ? 2.201 8.833 14.663 1.0 9.3 ? 113 ALA A O 1 113 . A ATOM 911 C CB . ALA A 1 113 ? 3.826 10.962 16.517 1.0 7.96 ? 113 ALA A CB 1 113 . A ATOM 912 N N . TYR A 1 114 ? 1.561 8.799 16.827 1.0 8.04 ? 114 TYR A N 1 114 . A ATOM 913 C CA . TYR A 1 114 ? 0.165 8.463 16.560 1.0 9.19 ? 114 TYR A CA 1 114 . A ATOM 914 C C . TYR A 1 114 ? -0.563 9.703 16.012 1.0 8.86 ? 114 TYR A C 1 114 . A ATOM 915 O O . TYR A 1 114 ? -0.314 10.841 16.440 1.0 8.87 ? 114 TYR A O 1 114 . A ATOM 916 C CB . TYR A 1 114 ? -0.490 8.021 17.860 1.0 10.51 ? 114 TYR A CB 1 114 . A ATOM 917 C CG . TYR A 1 114 ? 0.159 6.792 18.443 1.0 11.41 ? 114 TYR A CG 1 114 . A ATOM 918 C CD1 . TYR A 1 114 ? -0.204 5.527 18.002 1.0 11.83 ? 114 TYR A CD1 1 114 . A ATOM 919 C CD2 . TYR A 1 114 ? 1.170 6.895 19.398 1.0 11.63 ? 114 TYR A CD2 1 114 . A ATOM 920 C CE1 . TYR A 1 114 ? 0.426 4.382 18.494 1.0 12.66 ? 114 TYR A CE1 1 114 . A ATOM 921 C CE2 . TYR A 1 114 ? 1.792 5.778 19.891 1.0 11.7 ? 114 TYR A CE2 1 114 . A ATOM 922 C CZ . TYR A 1 114 ? 1.421 4.529 19.442 1.0 13.06 ? 114 TYR A CZ 1 114 . A ATOM 923 O OH . TYR A 1 114 ? 2.020 3.416 19.936 1.0 13.79 ? 114 TYR A OH 1 114 . A ATOM 924 N N . VAL A 1 115 ? -1.452 9.501 15.052 1.0 9.58 ? 115 VAL A N 1 115 . A ATOM 925 C CA . VAL A 1 115 ? -2.163 10.638 14.501 1.0 10.34 ? 115 VAL A CA 1 115 . A ATOM 926 C C . VAL A 1 115 ? -3.384 11.026 15.325 1.0 10.58 ? 115 VAL A C 1 115 . A ATOM 927 O O . VAL A 1 115 ? -4.228 10.172 15.663 1.0 10.96 ? 115 VAL A O 1 115 . A ATOM 928 C CB . VAL A 1 115 ? -2.624 10.353 13.067 1.0 10.71 ? 115 VAL A CB 1 115 . A ATOM 929 C CG1 . VAL A 1 115 ? -3.446 11.523 12.537 1.0 11.51 ? 115 VAL A CG1 1 115 . A ATOM 930 C CG2 . VAL A 1 115 ? -1.419 10.099 12.201 1.0 11.11 ? 115 VAL A CG2 1 115 . A ATOM 931 N N . GLY A 1 116 ? -3.448 12.311 15.679 1.0 9.3 ? 116 GLY A N 1 116 . A ATOM 932 C CA . GLY A 1 116 ? -4.590 12.884 16.390 1.0 10.04 ? 116 GLY A CA 1 116 . A ATOM 933 C C . GLY A 1 116 ? -4.843 12.447 17.809 1.0 10.06 ? 116 GLY A C 1 116 . A ATOM 934 O O . GLY A 1 116 ? -5.966 12.569 18.318 1.0 12.26 ? 116 GLY A O 1 116 . A ATOM 935 N N . ARG A 1 117 ? -3.815 11.958 18.472 1.0 10.15 ? 117 ARG A N 1 117 . A ATOM 936 C CA . ARG A 1 117 ? -4.002 11.500 19.832 1.0 11.19 ? 117 ARG A CA 1 117 . A ATOM 937 C C . ARG A 1 117 ? -3.442 12.409 20.925 1.0 10.23 ? 117 ARG A C 1 117 . A ATOM 938 O O . ARG A 1 117 ? -3.228 11.963 22.057 1.0 10.03 ? 117 ARG A O 1 117 . A ATOM 939 C CB . ARG A 1 117 ? -3.463 10.073 19.985 1.0 12.17 ? 117 ARG A CB 1 117 . A ATOM 940 C CG . ARG A 1 117 ? -4.139 9.056 19.073 1.0 15.51 ? 117 ARG A CG 1 117 . A ATOM 941 C CD . ARG A 1 117 ? -5.647 9.132 19.212 1.0 20.17 ? 117 ARG A CD 1 117 . A ATOM 942 N NE . ARG A 1 117 ? -6.137 8.531 20.447 1.0 23.49 ? 117 ARG A NE 1 117 . A ATOM 943 C CZ . ARG A 1 117 ? -6.380 7.229 20.600 1.0 25.68 ? 117 ARG A CZ 1 117 . A ATOM 944 N NH1 . ARG A 1 117 ? -6.173 6.395 19.590 1.0 26.1 ? 117 ARG A NH1 1 117 . A ATOM 945 N NH2 . ARG A 1 117 ? -6.846 6.769 21.756 1.0 26.57 ? 117 ARG A NH2 1 117 . A ATOM 946 N N . MET A 1 118 ? -3.255 13.692 20.608 1.0 9.83 ? 118 MET A N 1 118 . A ATOM 947 C CA . MET A 1 118 ? -2.770 14.666 21.589 1.0 9.57 ? 118 MET A CA 1 118 . A ATOM 948 C C . MET A 1 118 ? -3.639 14.578 22.869 1.0 9.95 ? 118 MET A C 1 118 . A ATOM 949 O O . MET A 1 118 ? -4.865 14.519 22.790 1.0 10.53 ? 118 MET A O 1 118 . A ATOM 950 C CB . MET A 1 118 ? -2.835 16.069 20.986 1.0 8.95 ? 118 MET A CB 1 118 . A ATOM 951 C CG . MET A 1 118 ? -2.547 17.230 21.967 1.0 9.22 ? 118 MET A CG 1 118 . A ATOM 952 S SD . MET A 1 118 ? -0.912 17.165 22.727 1.0 9.54 ? 118 MET A SD 1 118 . A ATOM 953 C CE . MET A 1 118 ? 0.232 17.135 21.267 1.0 8.71 ? 118 MET A CE 1 118 . A ATOM 954 N N . CYS A 1 119 ? -2.972 14.578 24.020 1.0 9.77 ? 119 CYS A N 1 119 . A ATOM 955 C CA . CYS A 1 119 ? -3.549 14.481 25.365 1.0 9.99 ? 119 CYS A CA 1 119 . A ATOM 956 C C . CYS A 1 119 ? -3.808 13.060 25.847 1.0 10.98 ? 119 CYS A C 1 119 . A ATOM 957 O O . CYS A 1 119 ? -3.926 12.834 27.053 1.0 10.85 ? 119 CYS A O 1 119 . A ATOM 958 C CB . CYS A 1 119 ? -4.857 15.292 25.506 1.0 9.9 ? 119 CYS A CB 1 119 . A ATOM 959 S SG . CYS A 1 119 ? -4.639 17.082 25.322 1.0 10.94 ? 119 CYS A SG 1 119 . A ATOM 960 N N . ASP A 1 120 ? -3.918 12.101 24.933 1.0 10.47 ? 120 ASP A N 1 120 . A ATOM 961 C CA . ASP A 1 120 ? -4.152 10.727 25.369 1.0 12.27 ? 120 ASP A CA 1 120 . A ATOM 962 C C . ASP A 1 120 ? -3.015 10.226 26.270 1.0 11.88 ? 120 ASP A C 1 120 . A ATOM 963 O O . ASP A 1 120 ? -1.854 10.430 25.975 1.0 10.81 ? 120 ASP A O 1 120 . A ATOM 964 C CB . ASP A 1 120 ? -4.312 9.800 24.165 1.0 13.77 ? 120 ASP A CB 1 120 . A ATOM 965 C CG . ASP A 1 120 ? -4.790 8.420 24.574 1.0 16.07 ? 120 ASP A CG 1 120 . A ATOM 966 O OD1 . ASP A 1 120 ? -3.969 7.544 24.873 1.0 14.45 ? 120 ASP A OD1 1 120 . A ATOM 967 O OD2 . ASP A 1 120 ? -6.018 8.219 24.630 1.0 19.4 ? 120 ASP A OD2 1 120 . A ATOM 968 N N . GLU A 1 121 ? -3.350 9.550 27.376 1.0 12.38 ? 121 GLU A N 1 121 . A ATOM 969 C CA . GLU A 1 121 ? -2.326 9.074 28.298 1.0 12.8 ? 121 GLU A CA 1 121 . A ATOM 970 C C . GLU A 1 121 ? -1.286 8.154 27.703 1.0 11.82 ? 121 GLU A C 1 121 . A ATOM 971 O O . GLU A 1 121 ? -0.105 8.192 28.093 1.0 11.83 ? 121 GLU A O 1 121 . A ATOM 972 C CB . GLU A 1 121 ? -2.973 8.382 29.497 1.0 15.48 ? 121 GLU A CB 1 121 . A ATOM 973 C CG . GLU A 1 121 ? -3.572 9.344 30.469 1.0 20.72 ? 121 GLU A CG 1 121 . A ATOM 974 C CD . GLU A 1 121 ? -3.975 8.650 31.734 1.0 22.79 ? 121 GLU A CD 1 121 . A ATOM 975 O OE1 . GLU A 1 121 ? -4.730 7.656 31.640 1.0 24.78 ? 121 GLU A OE1 1 121 . A ATOM 976 O OE2 . GLU A 1 121 ? -3.529 9.097 32.803 1.0 26.2 ? 121 GLU A OE2 1 121 . A ATOM 977 N N . LYS A 1 122 ? -1.721 7.307 26.775 1.0 11.83 ? 122 LYS A N 1 122 . A ATOM 978 C CA . LYS A 1 122 ? -0.787 6.395 26.131 1.0 12.68 ? 122 LYS A CA 1 122 . A ATOM 979 C C . LYS A 1 122 ? -0.336 6.864 24.750 1.0 12.38 ? 122 LYS A C 1 122 . A ATOM 980 O O . LYS A 1 122 ? 0.827 6.686 24.390 1.0 13.21 ? 122 LYS A O 1 122 . A ATOM 981 C CB . LYS A 1 122 ? -1.412 5.000 25.980 1.0 14.72 ? 122 LYS A CB 1 122 . A ATOM 982 C CG . LYS A 1 122 ? -0.526 4.002 25.196 1.0 18.33 ? 122 LYS A CG 1 122 . A ATOM 983 C CD . LYS A 1 122 ? -0.974 2.557 25.372 1.0 20.9 ? 122 LYS A CD 1 122 . A ATOM 984 C CE . LYS A 1 122 ? -0.488 1.671 24.217 1.0 22.4 ? 122 LYS A CE 1 122 . A ATOM 985 N NZ . LYS A 1 122 ? 0.966 1.745 23.878 1.0 22.74 ? 122 LYS A NZ 1 122 . A ATOM 986 N N . TYR A 1 123 ? -1.236 7.497 24.000 1.0 11.4 ? 123 TYR A N 1 123 . A ATOM 987 C CA . TYR A 1 123 ? -0.904 7.854 22.631 1.0 10.24 ? 123 TYR A CA 1 123 . A ATOM 988 C C . TYR A 1 123 ? -0.442 9.266 22.338 1.0 9.23 ? 123 TYR A C 1 123 . A ATOM 989 O O . TYR A 1 123 ? -0.174 9.599 21.176 1.0 9.57 ? 123 TYR A O 1 123 . A ATOM 990 C CB . TYR A 1 123 ? -2.072 7.469 21.704 1.0 11.67 ? 123 TYR A CB 1 123 . A ATOM 991 C CG . TYR A 1 123 ? -2.359 5.986 21.779 1.0 13.48 ? 123 TYR A CG 1 123 . A ATOM 992 C CD1 . TYR A 1 123 ? -3.449 5.508 22.492 1.0 15.29 ? 123 TYR A CD1 1 123 . A ATOM 993 C CD2 . TYR A 1 123 ? -1.512 5.068 21.161 1.0 14.69 ? 123 TYR A CD2 1 123 . A ATOM 994 C CE1 . TYR A 1 123 ? -3.690 4.135 22.588 1.0 16.56 ? 123 TYR A CE1 1 123 . A ATOM 995 C CE2 . TYR A 1 123 ? -1.741 3.683 21.248 1.0 16.37 ? 123 TYR A CE2 1 123 . A ATOM 996 C CZ . TYR A 1 123 ? -2.844 3.243 21.971 1.0 16.58 ? 123 TYR A CZ 1 123 . A ATOM 997 O OH . TYR A 1 123 ? -3.135 1.907 22.088 1.0 19.96 ? 123 TYR A OH 1 123 . A ATOM 998 N N . SER A 1 124 ? -0.310 10.093 23.369 1.0 7.83 ? 124 SER A N 1 124 . A ATOM 999 C CA . SER A 1 124 ? 0.193 11.446 23.112 1.0 6.95 ? 124 SER A CA 1 124 . A ATOM 1000 C C . SER A 1 124 ? 1.728 11.375 23.202 1.0 7.48 ? 124 SER A C 1 124 . A ATOM 1001 O O . SER A 1 124 ? 2.356 11.965 24.111 1.0 7.39 ? 124 SER A O 1 124 . A ATOM 1002 C CB . SER A 1 124 ? -0.351 12.434 24.143 1.0 8.12 ? 124 SER A CB 1 124 . A ATOM 1003 O OG . SER A 1 124 ? -0.092 13.755 23.664 1.0 8.73 ? 124 SER A OG 1 124 . A ATOM 1004 N N . VAL A 1 125 ? 2.330 10.623 22.269 1.0 7.83 ? 125 VAL A N 1 125 . A ATOM 1005 C CA . VAL A 1 125 ? 3.760 10.454 22.255 1.0 7.51 ? 125 VAL A CA 1 125 . A ATOM 1006 C C . VAL A 1 125 ? 4.298 10.402 20.848 1.0 7.2 ? 125 VAL A C 1 125 . A ATOM 1007 O O . VAL A 1 125 ? 3.552 10.217 19.870 1.0 8.65 ? 125 VAL A O 1 125 . A ATOM 1008 C CB . VAL A 1 125 ? 4.245 9.128 22.976 1.0 8.53 ? 125 VAL A CB 1 125 . A ATOM 1009 C CG1 . VAL A 1 125 ? 3.859 9.131 24.446 1.0 8.7 ? 125 VAL A CG1 1 125 . A ATOM 1010 C CG2 . VAL A 1 125 ? 3.683 7.883 22.252 1.0 9.12 ? 125 VAL A CG2 1 125 . A ATOM 1011 N N . ALA A 1 126 ? 5.613 10.581 20.758 1.0 6.46 ? 126 ALA A N 1 126 . A ATOM 1012 C CA . ALA A 1 126 ? 6.370 10.496 19.523 1.0 5.76 ? 126 ALA A CA 1 126 . A ATOM 1013 C C . ALA A 1 126 ? 7.758 9.968 19.842 1.0 6.48 ? 126 ALA A C 1 126 . A ATOM 1014 O O . ALA A 1 126 ? 8.231 10.069 20.979 1.0 6.54 ? 126 ALA A O 1 126 . A ATOM 1015 C CB . ALA A 1 126 ? 6.519 11.902 18.878 1.0 7.06 ? 126 ALA A CB 1 126 . A ATOM 1016 N N . VAL A 1 127 ? 8.395 9.384 18.829 1.0 6.61 ? 127 VAL A N 1 127 . A ATOM 1017 C CA . VAL A 1 127 ? 9.799 8.987 18.939 1.0 6.72 ? 127 VAL A CA 1 127 . A ATOM 1018 C C . VAL A 1 127 ? 10.477 9.744 17.789 1.0 6.58 ? 127 VAL A C 1 127 . A ATOM 1019 O O . VAL A 1 127 ? 9.917 9.884 16.691 1.0 7.2 ? 127 VAL A O 1 127 . A ATOM 1020 C CB . VAL A 1 127 ? 10.015 7.462 18.861 1.0 6.68 ? 127 VAL A CB 1 127 . A ATOM 1021 C CG1 . VAL A 1 127 ? 9.197 6.801 19.959 1.0 6.73 ? 127 VAL A CG1 1 127 . A ATOM 1022 C CG2 . VAL A 1 127 ? 9.624 6.877 17.504 1.0 7.74 ? 127 VAL A CG2 1 127 . A ATOM 1023 N N . VAL A 1 128 ? 11.673 10.246 18.078 1.0 6.21 ? 128 VAL A N 1 128 . A ATOM 1024 C CA . VAL A 1 128 ? 12.415 11.062 17.129 1.0 6.01 ? 128 VAL A CA 1 128 . A ATOM 1025 C C . VAL A 1 128 ? 13.885 10.709 17.147 1.0 5.52 ? 128 VAL A C 1 128 . A ATOM 1026 O O . VAL A 1 128 ? 14.507 10.619 18.217 1.0 7.17 ? 128 VAL A O 1 128 . A ATOM 1027 C CB . VAL A 1 128 ? 12.267 12.570 17.519 1.0 6.2 ? 128 VAL A CB 1 128 . A ATOM 1028 C CG1 . VAL A 1 128 ? 13.106 13.455 16.578 1.0 8.34 ? 128 VAL A CG1 1 128 . A ATOM 1029 C CG2 . VAL A 1 128 ? 10.762 12.966 17.503 1.0 8.73 ? 128 VAL A CG2 1 128 . A ATOM 1030 N N . LYS A 1 129 ? 14.448 10.526 15.960 1.0 5.49 ? 129 LYS A N 1 129 . A ATOM 1031 C CA . LYS A 1 129 ? 15.873 10.272 15.867 1.0 6.64 ? 129 LYS A CA 1 129 . A ATOM 1032 C C . LYS A 1 129 ? 16.663 11.602 15.864 1.0 6.58 ? 129 LYS A C 1 129 . A ATOM 1033 O O . LYS A 1 129 ? 16.286 12.560 15.168 1.0 7.02 ? 129 LYS A O 1 129 . A ATOM 1034 C CB . LYS A 1 129 ? 16.162 9.512 14.576 1.0 6.49 ? 129 LYS A CB 1 129 . A ATOM 1035 C CG . LYS A 1 129 ? 17.618 9.171 14.380 1.0 7.23 ? 129 LYS A CG 1 129 . A ATOM 1036 C CD . LYS A 1 129 ? 17.814 8.375 13.057 1.0 8.81 ? 129 LYS A CD 1 129 . A ATOM 1037 C CE . LYS A 1 129 ? 19.279 7.980 12.871 1.0 8.96 ? 129 LYS A CE 1 129 . A ATOM 1038 N NZ . LYS A 1 129 ? 19.535 7.349 11.507 1.0 11.13 ? 129 LYS A NZ 1 129 . A ATOM 1039 N N . ASP A 1 130 ? 17.766 11.642 16.611 1.0 7.31 ? 130 ASP A N 1 130 . A ATOM 1040 C CA . ASP A 1 130 ? 18.649 12.823 16.660 1.0 7.64 ? 130 ASP A CA 1 130 . A ATOM 1041 C C . ASP A 1 130 ? 19.482 12.674 15.365 1.0 7.9 ? 130 ASP A C 1 130 . A ATOM 1042 O O . ASP A 1 130 ? 20.679 12.365 15.370 1.0 9.21 ? 130 ASP A O 1 130 . A ATOM 1043 C CB . ASP A 1 130 ? 19.526 12.715 17.898 1.0 8.34 ? 130 ASP A CB 1 130 . A ATOM 1044 C CG . ASP A 1 130 ? 20.332 13.965 18.130 1.0 10.47 ? 130 ASP A CG 1 130 . A ATOM 1045 O OD1 . ASP A 1 130 ? 21.573 13.861 18.277 1.0 9.85 ? 130 ASP A OD1 1 130 . A ATOM 1046 O OD2 . ASP A 1 130 ? 19.722 15.061 18.158 1.0 9.68 ? 130 ASP A OD2 1 130 . A ATOM 1047 N N . HIS A 1 131 ? 18.808 12.929 14.245 1.0 8.15 ? 131 HIS A N 1 131 . A ATOM 1048 C CA . HIS A 1 131 ? 19.342 12.631 12.927 1.0 8.2 ? 131 HIS A CA 1 131 . A ATOM 1049 C C . HIS A 1 131 ? 20.208 13.635 12.220 1.0 8.96 ? 131 HIS A C 1 131 . A ATOM 1050 O O . HIS A 1 131 ? 20.548 13.444 11.052 1.0 9.86 ? 131 HIS A O 1 131 . A ATOM 1051 C CB . HIS A 1 131 ? 18.144 12.247 12.042 1.0 8.91 ? 131 HIS A CB 1 131 . A ATOM 1052 C CG . HIS A 1 131 ? 17.268 13.408 11.706 1.0 8.54 ? 131 HIS A CG 1 131 . A ATOM 1053 N ND1 . HIS A 1 131 ? 17.546 14.250 10.646 1.0 9.38 ? 131 HIS A ND1 1 131 . A ATOM 1054 C CD2 . HIS A 1 131 ? 16.164 13.901 12.317 1.0 9.0 ? 131 HIS A CD2 1 131 . A ATOM 1055 C CE1 . HIS A 1 131 ? 16.632 15.214 10.619 1.0 8.8 ? 131 HIS A CE1 1 131 . A ATOM 1056 N NE2 . HIS A 1 131 ? 15.788 15.027 11.623 1.0 9.48 ? 131 HIS A NE2 1 131 . A ATOM 1057 N N . SER A 1 132 ? 20.558 14.706 12.922 1.0 8.87 ? 132 SER A N 1 132 . A ATOM 1058 C CA . SER A 1 132 ? 21.407 15.739 12.367 1.0 9.49 ? 132 SER A CA 1 132 . A ATOM 1059 C C . SER A 1 132 ? 22.149 16.433 13.467 1.0 9.73 ? 132 SER A C 1 132 . A ATOM 1060 O O . SER A 1 132 ? 21.646 16.521 14.589 1.0 10.95 ? 132 SER A O 1 132 . A ATOM 1061 C CB . SER A 1 132 ? 20.551 16.795 11.673 1.0 9.47 ? 132 SER A CB 1 132 . A ATOM 1062 O OG . SER A 1 132 ? 21.399 17.783 11.102 1.0 12.35 ? 132 SER A OG 1 132 . A ATOM 1063 N N . SER A 1 133 ? 23.346 16.940 13.172 1.0 10.93 ? 133 SER A N 1 133 . A ATOM 1064 C CA . SER A 1 133 ? 24.040 17.690 14.193 1.0 12.39 ? 133 SER A CA 1 133 . A ATOM 1065 C C . SER A 1 133 ? 23.308 19.040 14.318 1.0 12.61 ? 133 SER A C 1 133 . A ATOM 1066 O O . SER A 1 133 ? 23.415 19.705 15.360 1.0 14.26 ? 133 SER A O 1 133 . A ATOM 1067 C CB . SER A 1 133 ? 25.515 17.914 13.810 1.0 13.88 ? 133 SER A CB 1 133 . A ATOM 1068 O OG . SER A 1 133 ? 25.627 18.618 12.590 1.0 14.48 ? 133 SER A OG 1 133 . A ATOM 1069 N N . LYS A 1 134 ? 22.550 19.420 13.281 1.0 11.74 ? 134 LYS A N 1 134 . A ATOM 1070 C CA . LYS A 1 134 ? 21.819 20.711 13.293 1.0 11.92 ? 134 LYS A CA 1 134 . A ATOM 1071 C C . LYS A 1 134 ? 20.555 20.646 14.159 1.0 9.81 ? 134 LYS A C 1 134 . A ATOM 1072 O O . LYS A 1 134 ? 19.592 19.916 13.846 1.0 9.49 ? 134 LYS A O 1 134 . A ATOM 1073 C CB . LYS A 1 134 ? 21.418 21.130 11.877 1.0 12.73 ? 134 LYS A CB 1 134 . A ATOM 1074 C CG . LYS A 1 134 ? 22.565 21.316 10.867 1.0 16.6 ? 134 LYS A CG 1 134 . A ATOM 1075 C CD . LYS A 1 134 ? 21.979 21.686 9.506 1.0 19.99 ? 134 LYS A CD 1 134 . A ATOM 1076 C CE . LYS A 1 134 ? 23.058 21.905 8.465 1.0 22.59 ? 134 LYS A CE 1 134 . A ATOM 1077 N NZ . LYS A 1 134 ? 23.933 20.723 8.339 1.0 24.72 ? 134 LYS A NZ 1 134 . A ATOM 1078 N N . VAL A 1 135 ? 20.562 21.408 15.249 1.0 9.04 ? 135 VAL A N 1 135 . A ATOM 1079 C CA . VAL A 1 135 ? 19.427 21.435 16.151 1.0 9.25 ? 135 VAL A CA 1 135 . A ATOM 1080 C C . VAL A 1 135 ? 18.131 21.684 15.403 1.0 8.89 ? 135 VAL A C 1 135 . A ATOM 1081 O O . VAL A 1 135 ? 17.117 21.035 15.674 1.0 7.84 ? 135 VAL A O 1 135 . A ATOM 1082 C CB . VAL A 1 135 ? 19.620 22.528 17.234 1.0 9.9 ? 135 VAL A CB 1 135 . A ATOM 1083 C CG1 . VAL A 1 135 ? 18.360 22.702 18.064 1.0 11.78 ? 135 VAL A CG1 1 135 . A ATOM 1084 C CG2 . VAL A 1 135 ? 20.813 22.154 18.148 1.0 11.26 ? 135 VAL A CG2 1 135 . A ATOM 1085 N N . PHE A 1 136 ? 18.143 22.639 14.482 1.0 8.21 ? 136 PHE A N 1 136 . A ATOM 1086 C CA . PHE A 1 136 ? 16.921 22.935 13.758 1.0 7.59 ? 136 PHE A CA 1 136 . A ATOM 1087 C C . PHE A 1 136 ? 16.340 21.723 13.045 1.0 7.69 ? 136 PHE A C 1 136 . A ATOM 1088 O O . PHE A 1 136 ? 15.129 21.515 13.064 1.0 7.56 ? 136 PHE A O 1 136 . A ATOM 1089 C CB . PHE A 1 136 ? 17.146 24.083 12.757 1.0 7.96 ? 136 PHE A CB 1 136 . A ATOM 1090 C CG . PHE A 1 136 ? 15.945 24.371 11.900 1.0 9.19 ? 136 PHE A CG 1 136 . A ATOM 1091 C CD1 . PHE A 1 136 ? 14.867 25.086 12.413 1.0 9.72 ? 136 PHE A CD1 1 136 . A ATOM 1092 C CD2 . PHE A 1 136 ? 15.857 23.865 10.603 1.0 8.96 ? 136 PHE A CD2 1 136 . A ATOM 1093 C CE1 . PHE A 1 136 ? 13.713 25.290 11.631 1.0 10.44 ? 136 PHE A CE1 1 136 . A ATOM 1094 C CE2 . PHE A 1 136 ? 14.718 24.057 9.829 1.0 10.42 ? 136 PHE A CE2 1 136 . A ATOM 1095 C CZ . PHE A 1 136 ? 13.640 24.779 10.353 1.0 10.82 ? 136 PHE A CZ 1 136 . A ATOM 1096 N N . MET A 1 137 ? 17.186 20.931 12.396 1.0 7.9 ? 137 MET A N 1 137 . A ATOM 1097 C CA . MET A 1 137 ? 16.657 19.804 11.666 1.0 9.49 ? 137 MET A CA 1 137 . A ATOM 1098 C C . MET A 1 137 ? 16.010 18.756 12.565 1.0 8.43 ? 137 MET A C 1 137 . A ATOM 1099 O O . MET A 1 137 ? 14.979 18.191 12.189 1.0 9.26 ? 137 MET A O 1 137 . A ATOM 1100 C CB . MET A 1 137 ? 17.738 19.197 10.797 1.0 9.74 ? 137 MET A CB 1 137 . A ATOM 1101 C CG . MET A 1 137 ? 18.194 20.181 9.681 1.0 11.06 ? 137 MET A CG 1 137 . A ATOM 1102 S SD . MET A 1 137 ? 16.823 20.582 8.522 1.0 14.22 ? 137 MET A SD 1 137 . A ATOM 1103 C CE . MET A 1 137 ? 17.038 19.290 7.439 1.0 15.39 ? 137 MET A CE 1 137 . A ATOM 1104 N N . VAL A 1 138 ? 16.549 18.533 13.751 1.0 6.87 ? 138 VAL A N 1 138 . A ATOM 1105 C CA . VAL A 1 138 ? 15.909 17.581 14.647 1.0 6.68 ? 138 VAL A CA 1 138 . A ATOM 1106 C C . VAL A 1 138 ? 14.620 18.204 15.221 1.0 7.17 ? 138 VAL A C 1 138 . A ATOM 1107 O O . VAL A 1 138 ? 13.594 17.530 15.374 1.0 6.73 ? 138 VAL A O 1 138 . A ATOM 1108 C CB . VAL A 1 138 ? 16.886 17.176 15.760 1.0 5.99 ? 138 VAL A CB 1 138 . A ATOM 1109 C CG1 . VAL A 1 138 ? 16.235 16.082 16.641 1.0 7.59 ? 138 VAL A CG1 1 138 . A ATOM 1110 C CG2 . VAL A 1 138 ? 18.168 16.692 15.135 1.0 6.75 ? 138 VAL A CG2 1 138 . A ATOM 1111 N N . ALA A 1 139 ? 14.636 19.514 15.486 1.0 6.87 ? 139 ALA A N 1 139 . A ATOM 1112 C CA . ALA A 1 139 ? 13.455 20.167 16.028 1.0 6.11 ? 139 ALA A CA 1 139 . A ATOM 1113 C C . ALA A 1 139 ? 12.327 20.155 14.995 1.0 4.82 ? 139 ALA A C 1 139 . A ATOM 1114 O O . ALA A 1 139 ? 11.169 20.093 15.370 1.0 5.29 ? 139 ALA A O 1 139 . A ATOM 1115 C CB . ALA A 1 139 ? 13.777 21.632 16.460 1.0 7.04 ? 139 ALA A CB 1 139 . A ATOM 1116 N N . VAL A 1 140 ? 12.653 20.285 13.711 1.0 5.64 ? 140 VAL A N 1 140 . A ATOM 1117 C CA . VAL A 1 140 ? 11.612 20.206 12.682 1.0 6.37 ? 140 VAL A CA 1 140 . A ATOM 1118 C C . VAL A 1 140 ? 10.942 18.822 12.780 1.0 6.2 ? 140 VAL A C 1 140 . A ATOM 1119 O O . VAL A 1 140 ? 9.728 18.710 12.687 1.0 6.42 ? 140 VAL A O 1 140 . A ATOM 1120 C CB . VAL A 1 140 ? 12.211 20.373 11.263 1.0 7.36 ? 140 VAL A CB 1 140 . A ATOM 1121 C CG1 . VAL A 1 140 ? 11.203 19.881 10.195 1.0 9.17 ? 140 VAL A CG1 1 140 . A ATOM 1122 C CG2 . VAL A 1 140 ? 12.575 21.783 11.029 1.0 10.58 ? 140 VAL A CG2 1 140 . A ATOM 1123 N N . THR A 1 141 ? 11.734 17.779 12.958 1.0 5.98 ? 141 THR A N 1 141 . A ATOM 1124 C CA . THR A 1 141 ? 11.169 16.428 13.053 1.0 6.12 ? 141 THR A CA 1 141 . A ATOM 1125 C C . THR A 1 141 ? 10.314 16.292 14.307 1.0 6.02 ? 141 THR A C 1 141 . A ATOM 1126 O O . THR A 1 141 ? 9.234 15.723 14.267 1.0 5.83 ? 141 THR A O 1 141 . A ATOM 1127 C CB . THR A 1 141 ? 12.271 15.393 12.987 1.0 7.38 ? 141 THR A CB 1 141 . A ATOM 1128 O OG1 . THR A 1 141 ? 13.038 15.624 11.795 1.0 7.64 ? 141 THR A OG1 1 141 . A ATOM 1129 C CG2 . THR A 1 141 ? 11.669 13.976 12.914 1.0 7.25 ? 141 THR A CG2 1 141 . A ATOM 1130 N N . MET A 1 142 ? 10.748 16.864 15.424 1.0 6.62 ? 142 MET A N 1 142 . A ATOM 1131 C CA . MET A 1 142 ? 9.930 16.825 16.634 1.0 6.3 ? 142 MET A CA 1 142 . A ATOM 1132 C C . MET A 1 142 ? 8.609 17.548 16.369 1.0 6.54 ? 142 MET A C 1 142 . A ATOM 1133 O O . MET A 1 142 ? 7.529 17.115 16.816 1.0 6.34 ? 142 MET A O 1 142 . A ATOM 1134 C CB . MET A 1 142 ? 10.666 17.528 17.780 1.0 6.61 ? 142 MET A CB 1 142 . A ATOM 1135 C CG . MET A 1 142 ? 11.972 16.814 18.124 1.0 6.5 ? 142 MET A CG 1 142 . A ATOM 1136 S SD . MET A 1 142 ? 13.057 17.704 19.278 1.0 8.55 ? 142 MET A SD 1 142 . A ATOM 1137 C CE . MET A 1 142 ? 12.228 17.445 20.755 1.0 10.56 ? 142 MET A CE 1 142 . A ATOM 1138 N N . THR A 1 143 ? 8.705 18.674 15.658 1.0 5.84 ? 143 THR A N 1 143 . A ATOM 1139 C CA . THR A 1 143 ? 7.488 19.454 15.345 1.0 5.74 ? 143 THR A CA 1 143 . A ATOM 1140 C C . THR A 1 143 ? 6.566 18.707 14.353 1.0 6.0 ? 143 THR A C 1 143 . A ATOM 1141 O O . THR A 1 143 ? 5.331 18.772 14.463 1.0 6.2 ? 143 THR A O 1 143 . A ATOM 1142 C CB . THR A 1 143 ? 7.883 20.848 14.811 1.0 6.51 ? 143 THR A CB 1 143 . A ATOM 1143 O OG1 . THR A 1 143 ? 8.738 21.477 15.775 1.0 6.48 ? 143 THR A OG1 1 143 . A ATOM 1144 C CG2 . THR A 1 143 ? 6.648 21.732 14.620 1.0 7.01 ? 143 THR A CG2 1 143 . A ATOM 1145 N N . HIS A 1 144 ? 7.175 17.964 13.425 1.0 6.32 ? 144 HIS A N 1 144 . A ATOM 1146 C CA . HIS A 1 144 ? 6.458 17.142 12.444 1.0 6.36 ? 144 HIS A CA 1 144 . A ATOM 1147 C C . HIS A 1 144 ? 5.668 16.057 13.196 1.0 6.08 ? 144 HIS A C 1 144 . A ATOM 1148 O O . HIS A 1 144 ? 4.483 15.853 12.935 1.0 6.35 ? 144 HIS A O 1 144 . A ATOM 1149 C CB . HIS A 1 144 ? 7.499 16.521 11.473 1.0 6.81 ? 144 HIS A CB 1 144 . A ATOM 1150 C CG . HIS A 1 144 ? 6.925 15.554 10.479 1.0 6.99 ? 144 HIS A CG 1 144 . A ATOM 1151 N ND1 . HIS A 1 144 ? 6.774 15.875 9.149 1.0 6.22 ? 144 HIS A ND1 1 144 . A ATOM 1152 C CD2 . HIS A 1 144 ? 6.536 14.260 10.604 1.0 7.01 ? 144 HIS A CD2 1 144 . A ATOM 1153 C CE1 . HIS A 1 144 ? 6.323 14.815 8.488 1.0 6.56 ? 144 HIS A CE1 1 144 . A ATOM 1154 N NE2 . HIS A 1 144 ? 6.163 13.819 9.347 1.0 6.8 ? 144 HIS A NE2 1 144 . A ATOM 1155 N N . GLU A 1 145 ? 6.309 15.363 14.136 1.0 6.18 ? 145 GLU A N 1 145 . A ATOM 1156 C CA . GLU A 1 145 ? 5.609 14.315 14.888 1.0 6.17 ? 145 GLU A CA 1 145 . A ATOM 1157 C C . GLU A 1 145 ? 4.536 14.922 15.774 1.0 6.67 ? 145 GLU A C 1 145 . A ATOM 1158 O O . GLU A 1 145 ? 3.441 14.367 15.914 1.0 6.96 ? 145 GLU A O 1 145 . A ATOM 1159 C CB . GLU A 1 145 ? 6.587 13.486 15.735 1.0 7.38 ? 145 GLU A CB 1 145 . A ATOM 1160 C CG . GLU A 1 145 ? 7.720 12.868 14.921 1.0 8.47 ? 145 GLU A CG 1 145 . A ATOM 1161 C CD . GLU A 1 145 ? 7.264 12.097 13.674 1.0 8.81 ? 145 GLU A CD 1 145 . A ATOM 1162 O OE1 . GLU A 1 145 ? 8.110 11.948 12.777 1.0 12.01 ? 145 GLU A OE1 1 145 . A ATOM 1163 O OE2 . GLU A 1 145 ? 6.097 11.652 13.626 1.0 10.38 ? 145 GLU A OE2 1 145 . A ATOM 1164 N N . LEU A 1 146 ? 4.834 16.074 16.375 1.0 6.49 ? 146 LEU A N 1 146 . A ATOM 1165 C CA . LEU A 1 146 ? 3.828 16.773 17.163 1.0 7.48 ? 146 LEU A CA 1 146 . A ATOM 1166 C C . LEU A 1 146 ? 2.630 17.078 16.247 1.0 7.53 ? 146 LEU A C 1 146 . A ATOM 1167 O O . LEU A 1 146 ? 1.463 16.925 16.644 1.0 7.04 ? 146 LEU A O 1 146 . A ATOM 1168 C CB . LEU A 1 146 ? 4.440 18.081 17.692 1.0 8.56 ? 146 LEU A CB 1 146 . A ATOM 1169 C CG . LEU A 1 146 ? 3.568 18.904 18.630 1.0 10.24 ? 146 LEU A CG 1 146 . A ATOM 1170 C CD1 . LEU A 1 146 ? 3.362 18.100 19.935 1.0 11.35 ? 146 LEU A CD1 1 146 . A ATOM 1171 C CD2 . LEU A 1 146 ? 4.224 20.244 18.953 1.0 10.66 ? 146 LEU A CD2 1 146 . A ATOM 1172 N N . GLY A 1 147 ? 2.916 17.511 15.022 1.0 6.84 ? 147 GLY A N 1 147 . A ATOM 1173 C CA . GLY A 1 147 ? 1.860 17.845 14.066 1.0 6.64 ? 147 GLY A CA 1 147 . A ATOM 1174 C C . GLY A 1 147 ? 0.968 16.651 13.799 1.0 7.15 ? 147 GLY A C 1 147 . A ATOM 1175 O O . GLY A 1 147 ? -0.270 16.767 13.771 1.0 6.67 ? 147 GLY A O 1 147 . A ATOM 1176 N N . HIS A 1 148 ? 1.562 15.494 13.546 1.0 6.52 ? 148 HIS A N 1 148 . A ATOM 1177 C CA . HIS A 1 148 ? 0.746 14.288 13.351 1.0 7.39 ? 148 HIS A CA 1 148 . A ATOM 1178 C C . HIS A 1 148 ? -0.137 14.075 14.595 1.0 7.56 ? 148 HIS A C 1 148 . A ATOM 1179 O O . HIS A 1 148 ? -1.321 13.758 14.494 1.0 7.32 ? 148 HIS A O 1 148 . A ATOM 1180 C CB . HIS A 1 148 ? 1.634 13.045 13.206 1.0 7.39 ? 148 HIS A CB 1 148 . A ATOM 1181 C CG . HIS A 1 148 ? 2.226 12.844 11.852 1.0 6.81 ? 148 HIS A CG 1 148 . A ATOM 1182 N ND1 . HIS A 1 148 ? 1.485 12.899 10.687 1.0 7.23 ? 148 HIS A ND1 1 148 . A ATOM 1183 C CD2 . HIS A 1 148 ? 3.469 12.450 11.491 1.0 7.39 ? 148 HIS A CD2 1 148 . A ATOM 1184 C CE1 . HIS A 1 148 ? 2.249 12.535 9.671 1.0 7.24 ? 148 HIS A CE1 1 148 . A ATOM 1185 N NE2 . HIS A 1 148 ? 3.461 12.260 10.134 1.0 7.83 ? 148 HIS A NE2 1 148 . A ATOM 1186 N N . ASN A 1 149 ? 0.433 14.251 15.779 1.0 6.62 ? 149 ASN A N 1 149 . A ATOM 1187 C CA . ASN A 1 149 ? -0.340 14.033 17.010 1.0 6.88 ? 149 ASN A CA 1 149 . A ATOM 1188 C C . ASN A 1 149 ? -1.475 15.064 17.154 1.0 7.14 ? 149 ASN A C 1 149 . A ATOM 1189 O O . ASN A 1 149 ? -2.443 14.812 17.864 1.0 7.99 ? 149 ASN A O 1 149 . A ATOM 1190 C CB . ASN A 1 149 ? 0.600 14.046 18.226 1.0 7.01 ? 149 ASN A CB 1 149 . A ATOM 1191 C CG . ASN A 1 149 ? 0.124 13.145 19.367 1.0 7.16 ? 149 ASN A CG 1 149 . A ATOM 1192 O OD1 . ASN A 1 149 ? 0.066 13.589 20.518 1.0 7.74 ? 149 ASN A OD1 1 149 . A ATOM 1193 N ND2 . ASN A 1 149 ? -0.186 11.860 19.059 1.0 6.89 ? 149 ASN A ND2 1 149 . A ATOM 1194 N N . LEU A 1 150 ? -1.355 16.200 16.452 1.0 6.55 ? 150 LEU A N 1 150 . A ATOM 1195 C CA . LEU A 1 150 ? -2.393 17.244 16.414 1.0 7.56 ? 150 LEU A CA 1 150 . A ATOM 1196 C C . LEU A 1 150 ? -3.331 17.062 15.209 1.0 8.13 ? 150 LEU A C 1 150 . A ATOM 1197 O O . LEU A 1 150 ? -4.027 17.998 14.792 1.0 9.0 ? 150 LEU A O 1 150 . A ATOM 1198 C CB . LEU A 1 150 ? -1.765 18.653 16.390 1.0 8.68 ? 150 LEU A CB 1 150 . A ATOM 1199 C CG . LEU A 1 150 ? -1.039 19.094 17.679 1.0 9.03 ? 150 LEU A CG 1 150 . A ATOM 1200 C CD1 . LEU A 1 150 ? -0.206 20.332 17.378 1.0 9.73 ? 150 LEU A CD1 1 150 . A ATOM 1201 C CD2 . LEU A 1 150 ? -2.043 19.366 18.804 1.0 11.09 ? 150 LEU A CD2 1 150 . A ATOM 1202 N N . GLY A 1 151 ? -3.330 15.854 14.647 1.0 7.9 ? 151 GLY A N 1 151 . A ATOM 1203 C CA . GLY A 1 151 ? -4.256 15.526 13.571 1.0 7.73 ? 151 GLY A CA 1 151 . A ATOM 1204 C C . GLY A 1 151 ? -3.830 15.804 12.143 1.0 8.29 ? 151 GLY A C 1 151 . A ATOM 1205 O O . GLY A 1 151 ? -4.647 15.692 11.219 1.0 8.08 ? 151 GLY A O 1 151 . A ATOM 1206 N N . MET A 1 152 ? -2.557 16.124 11.944 1.0 7.56 ? 152 MET A N 1 152 . A ATOM 1207 C CA . MET A 1 152 ? -2.077 16.428 10.625 1.0 8.13 ? 152 MET A CA 1 152 . A ATOM 1208 C C . MET A 1 152 ? -1.561 15.202 9.888 1.0 8.15 ? 152 MET A C 1 152 . A ATOM 1209 O O . MET A 1 152 ? -0.961 14.297 10.467 1.0 8.14 ? 152 MET A O 1 152 . A ATOM 1210 C CB . MET A 1 152 ? -0.934 17.436 10.701 1.0 8.14 ? 152 MET A CB 1 152 . A ATOM 1211 C CG . MET A 1 152 ? -1.294 18.759 11.344 1.0 8.52 ? 152 MET A CG 1 152 . A ATOM 1212 S SD . MET A 1 152 ? 0.210 19.779 11.503 1.0 7.13 ? 152 MET A SD 1 152 . A ATOM 1213 C CE . MET A 1 152 ? -0.419 21.115 12.487 1.0 8.44 ? 152 MET A CE 1 152 . A ATOM 1214 N N . GLU A 1 153 ? -1.844 15.166 8.592 1.0 9.04 ? 153 GLU A N 1 153 . A ATOM 1215 C CA . GLU A 1 153 ? -1.297 14.123 7.733 1.0 8.9 ? 153 GLU A CA 1 153 . A ATOM 1216 C C . GLU A 1 153 ? -0.212 14.855 6.918 1.0 8.92 ? 153 GLU A C 1 153 . A ATOM 1217 O O . GLU A 1 153 ? -0.042 16.081 7.062 1.0 9.43 ? 153 GLU A O 1 153 . A ATOM 1218 C CB . GLU A 1 153 ? -2.362 13.605 6.764 1.0 9.38 ? 153 GLU A CB 1 153 . A ATOM 1219 C CG . GLU A 1 153 ? -3.586 12.928 7.432 1.0 13.33 ? 153 GLU A CG 1 153 . A ATOM 1220 C CD . GLU A 1 153 ? -3.248 11.621 8.158 1.0 15.96 ? 153 GLU A CD 1 153 . A ATOM 1221 O OE1 . GLU A 1 153 ? -2.191 11.010 7.881 1.0 18.68 ? 153 GLU A OE1 1 153 . A ATOM 1222 O OE2 . GLU A 1 153 ? -4.051 11.194 9.021 1.0 20.03 ? 153 GLU A OE2 1 153 . A ATOM 1223 N N . HIS A 1 154 ? 0.510 14.142 6.059 1.0 8.38 ? 154 HIS A N 1 154 . A ATOM 1224 C CA . HIS A 1 154 ? 1.518 14.786 5.230 1.0 7.96 ? 154 HIS A CA 1 154 . A ATOM 1225 C C . HIS A 1 154 ? 0.932 15.775 4.240 1.0 8.7 ? 154 HIS A C 1 154 . A ATOM 1226 O O . HIS A 1 154 ? -0.226 15.666 3.822 1.0 9.8 ? 154 HIS A O 1 154 . A ATOM 1227 C CB . HIS A 1 154 ? 2.313 13.731 4.450 1.0 8.48 ? 154 HIS A CB 1 154 . A ATOM 1228 C CG . HIS A 1 154 ? 3.156 12.872 5.327 1.0 9.17 ? 154 HIS A CG 1 154 . A ATOM 1229 N ND1 . HIS A 1 154 ? 3.519 11.582 5.003 1.0 10.67 ? 154 HIS A ND1 1 154 . A ATOM 1230 C CD2 . HIS A 1 154 ? 3.705 13.131 6.536 1.0 9.49 ? 154 HIS A CD2 1 154 . A ATOM 1231 C CE1 . HIS A 1 154 ? 4.253 11.082 5.982 1.0 10.55 ? 154 HIS A CE1 1 154 . A ATOM 1232 N NE2 . HIS A 1 154 ? 4.379 12.001 6.925 1.0 8.6 ? 154 HIS A NE2 1 154 . A ATOM 1233 N N . ASP A 1 155 ? 1.742 16.744 3.857 1.0 7.64 ? 155 ASP A N 1 155 . A ATOM 1234 C CA . ASP A 1 155 ? 1.301 17.718 2.871 1.0 7.67 ? 155 ASP A CA 1 155 . A ATOM 1235 C C . ASP A 1 155 ? 1.021 16.986 1.558 1.0 7.37 ? 155 ASP A C 1 155 . A ATOM 1236 O O . ASP A 1 155 ? 1.689 16.023 1.209 1.0 8.71 ? 155 ASP A O 1 155 . A ATOM 1237 C CB . ASP A 1 155 ? 2.402 18.750 2.699 1.0 7.48 ? 155 ASP A CB 1 155 . A ATOM 1238 C CG . ASP A 1 155 ? 2.486 19.682 3.890 1.0 7.66 ? 155 ASP A CG 1 155 . A ATOM 1239 O OD1 . ASP A 1 155 ? 1.486 19.813 4.594 1.0 7.78 ? 155 ASP A OD1 1 155 . A ATOM 1240 O OD2 . ASP A 1 155 ? 3.554 20.278 4.122 1.0 9.83 ? 155 ASP A OD2 1 155 . A ATOM 1241 N N . ASP A 1 156 ? 0.043 17.501 0.825 1.0 7.43 ? 156 ASP A N 1 156 . A ATOM 1242 C CA . ASP A 1 156 ? -0.363 16.930 -0.466 1.0 7.22 ? 156 ASP A CA 1 156 . A ATOM 1243 C C . ASP A 1 156 ? -0.467 18.099 -1.441 1.0 6.9 ? 156 ASP A C 1 156 . A ATOM 1244 O O . ASP A 1 156 ? -1.140 19.084 -1.150 1.0 8.07 ? 156 ASP A O 1 156 . A ATOM 1245 C CB . ASP A 1 156 ? -1.719 16.215 -0.294 1.0 7.78 ? 156 ASP A CB 1 156 . A ATOM 1246 C CG . ASP A 1 156 ? -2.293 15.723 -1.602 1.0 8.13 ? 156 ASP A CG 1 156 . A ATOM 1247 O OD1 . ASP A 1 156 ? -2.864 16.550 -2.318 1.0 8.29 ? 156 ASP A OD1 1 156 . A ATOM 1248 O OD2 . ASP A 1 156 ? -2.164 14.530 -1.911 1.0 7.9 ? 156 ASP A OD2 1 156 . A ATOM 1249 N N . LYS A 1 157 ? 0.213 17.984 -2.580 1.0 7.33 ? 157 LYS A N 1 157 . A ATOM 1250 C CA . LYS A 1 157 ? 0.264 19.051 -3.583 1.0 8.66 ? 157 LYS A CA 1 157 . A ATOM 1251 C C . LYS A 1 157 ? -1.080 19.532 -4.127 1.0 8.56 ? 157 LYS A C 1 157 . A ATOM 1252 O O . LYS A 1 157 ? -1.230 20.709 -4.493 1.0 9.03 ? 157 LYS A O 1 157 . A ATOM 1253 C CB . LYS A 1 157 ? 1.168 18.614 -4.752 1.0 10.66 ? 157 LYS A CB 1 157 . A ATOM 1254 C CG . LYS A 1 157 ? 1.540 19.735 -5.688 1.0 16.35 ? 157 LYS A CG 1 157 . A ATOM 1255 C CD . LYS A 1 157 ? 1.976 20.956 -4.913 1.0 18.93 ? 157 LYS A CD 1 157 . A ATOM 1256 C CE . LYS A 1 157 ? 3.330 20.753 -4.314 1.0 19.28 ? 157 LYS A CE 1 157 . A ATOM 1257 N NZ . LYS A 1 157 ? 4.347 21.354 -5.245 1.0 22.3 ? 157 LYS A NZ 1 157 . A ATOM 1258 N N . ASP A 1 158 ? -2.057 18.638 -4.193 1.0 8.67 ? 158 ASP A N 1 158 . A ATOM 1259 C CA . ASP A 1 158 ? -3.376 19.044 -4.683 1.0 8.29 ? 158 ASP A CA 1 158 . A ATOM 1260 C C . ASP A 1 158 ? -4.052 19.920 -3.634 1.0 8.83 ? 158 ASP A C 1 158 . A ATOM 1261 O O . ASP A 1 158 ? -4.805 20.828 -3.978 1.0 10.2 ? 158 ASP A O 1 158 . A ATOM 1262 C CB . ASP A 1 158 ? -4.229 17.817 -4.946 1.0 8.23 ? 158 ASP A CB 1 158 . A ATOM 1263 C CG . ASP A 1 158 ? -3.727 17.010 -6.128 1.0 9.39 ? 158 ASP A CG 1 158 . A ATOM 1264 O OD1 . ASP A 1 158 ? -3.635 17.618 -7.229 1.0 10.1 ? 158 ASP A OD1 1 158 . A ATOM 1265 O OD2 . ASP A 1 158 ? -3.429 15.800 -5.944 1.0 7.95 ? 158 ASP A OD2 1 158 . A ATOM 1266 N N . LYS A 1 159 ? -3.785 19.651 -2.359 1.0 8.1 ? 159 LYS A N 1 159 . A ATOM 1267 C CA . LYS A 1 159 ? -4.412 20.407 -1.275 1.0 8.06 ? 159 LYS A CA 1 159 . A ATOM 1268 C C . LYS A 1 159 ? -3.719 21.737 -0.917 1.0 8.57 ? 159 LYS A C 1 159 . A ATOM 1269 O O . LYS A 1 159 ? -4.377 22.693 -0.487 1.0 10.13 ? 159 LYS A O 1 159 . A ATOM 1270 C CB . LYS A 1 159 ? -4.514 19.494 -0.046 1.0 8.26 ? 159 LYS A CB 1 159 . A ATOM 1271 C CG . LYS A 1 159 ? -5.659 18.468 -0.161 1.0 10.05 ? 159 LYS A CG 1 159 . A ATOM 1272 C CD . LYS A 1 159 ? -5.683 17.442 0.978 1.0 11.48 ? 159 LYS A CD 1 159 . A ATOM 1273 C CE . LYS A 1 159 ? -5.633 18.113 2.362 1.0 13.27 ? 159 LYS A CE 1 159 . A ATOM 1274 N NZ . LYS A 1 159 ? -6.912 18.741 2.776 1.0 16.89 ? 159 LYS A NZ 1 159 . A ATOM 1275 N N . CYS A 1 160 ? -2.400 21.789 -1.059 1.0 8.01 ? 160 CYS A N 1 160 . A ATOM 1276 C CA . CYS A 1 160 ? -1.647 23.014 -0.753 1.0 8.58 ? 160 CYS A CA 1 160 . A ATOM 1277 C C . CYS A 1 160 ? -0.338 22.971 -1.527 1.0 9.05 ? 160 CYS A C 1 160 . A ATOM 1278 O O . CYS A 1 160 ? 0.173 21.900 -1.845 1.0 8.77 ? 160 CYS A O 1 160 . A ATOM 1279 C CB . CYS A 1 160 ? -1.392 23.167 0.762 1.0 7.83 ? 160 CYS A CB 1 160 . A ATOM 1280 S SG . CYS A 1 160 ? -0.420 21.818 1.487 1.0 8.82 ? 160 CYS A SG 1 160 . A ATOM 1281 N N . LYS A 1 161 ? 0.220 24.138 -1.788 1.0 9.14 ? 161 LYS A N 1 161 . A ATOM 1282 C CA . LYS A 1 161 ? 1.420 24.194 -2.614 1.0 10.14 ? 161 LYS A CA 1 161 . A ATOM 1283 C C . LYS A 1 161 ? 2.787 24.065 -1.970 1.0 11.32 ? 161 LYS A C 1 161 . A ATOM 1284 O O . LYS A 1 161 ? 3.743 23.764 -2.655 1.0 11.5 ? 161 LYS A O 1 161 . A ATOM 1285 C CB . LYS A 1 161 ? 1.396 25.470 -3.474 1.0 11.53 ? 161 LYS A CB 1 161 . A ATOM 1286 C CG . LYS A 1 161 ? 0.147 25.582 -4.365 1.0 15.03 ? 161 LYS A CG 1 161 . A ATOM 1287 C CD . LYS A 1 161 ? 0.042 24.373 -5.286 1.0 17.49 ? 161 LYS A CD 1 161 . A ATOM 1288 C CE . LYS A 1 161 ? -0.921 24.675 -6.448 1.0 19.87 ? 161 LYS A CE 1 161 . A ATOM 1289 N NZ . LYS A 1 161 ? -0.476 23.871 -7.635 1.0 20.22 ? 161 LYS A NZ 1 161 . A ATOM 1290 N N . CYS A 1 162 ? 2.881 24.227 -0.660 1.0 10.48 ? 162 CYS A N 1 162 . A ATOM 1291 C CA . CYS A 1 162 ? 4.189 24.139 -0.026 1.0 10.69 ? 162 CYS A CA 1 162 . A ATOM 1292 C C . CYS A 1 162 ? 4.811 22.770 -0.179 1.0 11.37 ? 162 CYS A C 1 162 . A ATOM 1293 O O . CYS A 1 162 ? 4.161 21.774 0.173 1.0 11.8 ? 162 CYS A O 1 162 . A ATOM 1294 C CB . CYS A 1 162 ? 4.076 24.468 1.453 1.0 10.41 ? 162 CYS A CB 1 162 . A ATOM 1295 S SG . CYS A 1 162 ? 5.729 24.674 2.147 1.0 9.77 ? 162 CYS A SG 1 162 . A ATOM 1296 N N . ASP A 1 163 ? 6.057 22.764 -0.678 1.0 12.77 ? 163 ASP A N 1 163 . A ATOM 1297 C CA . ASP A 1 163 ? 6.860 21.569 -0.956 1.0 14.78 ? 163 ASP A CA 1 163 . A ATOM 1298 C C . ASP A 1 163 ? 7.890 21.218 0.105 1.0 13.84 ? 163 ASP A C 1 163 . A ATOM 1299 O O . ASP A 1 163 ? 8.412 20.088 0.113 1.0 13.92 ? 163 ASP A O 1 163 . A ATOM 1300 C CB . ASP A 1 163 ? 7.682 21.770 -2.241 1.0 18.03 ? 163 ASP A CB 1 163 . A ATOM 1301 C CG . ASP A 1 163 ? 6.841 22.080 -3.430 1.0 22.36 ? 163 ASP A CG 1 163 . A ATOM 1302 O OD1 . ASP A 1 163 ? 6.866 21.276 -4.372 1.0 24.39 ? 163 ASP A OD1 1 163 . A ATOM 1303 O OD2 . ASP A 1 163 ? 6.171 23.135 -3.425 1.0 26.05 ? 163 ASP A OD2 1 163 . A ATOM 1304 N N . THR A 1 164 ? 8.209 22.178 0.967 1.0 12.09 ? 164 THR A N 1 164 . A ATOM 1305 C CA . THR A 1 164 ? 9.260 21.957 1.958 1.0 12.33 ? 164 THR A CA 1 164 . A ATOM 1306 C C . THR A 1 164 ? 8.822 22.313 3.365 1.0 11.25 ? 164 THR A C 1 164 . A ATOM 1307 O O . THR A 1 164 ? 9.668 22.585 4.231 1.0 10.34 ? 164 THR A O 1 164 . A ATOM 1308 C CB . THR A 1 164 ? 10.450 22.840 1.641 1.0 13.03 ? 164 THR A CB 1 164 . A ATOM 1309 O OG1 . THR A 1 164 ? 9.988 24.184 1.538 1.0 15.9 ? 164 THR A OG1 1 164 . A ATOM 1310 C CG2 . THR A 1 164 ? 11.100 22.430 0.316 1.0 14.64 ? 164 THR A CG2 1 164 . A ATOM 1311 N N . CYS A 1 165 ? 7.513 22.321 3.593 1.0 8.79 ? 165 CYS A N 1 165 . A ATOM 1312 C CA . CYS A 1 165 ? 6.988 22.670 4.906 1.0 7.66 ? 165 CYS A CA 1 165 . A ATOM 1313 C C . CYS A 1 165 ? 7.168 21.542 5.938 1.0 6.76 ? 165 CYS A C 1 165 . A ATOM 1314 O O . CYS A 1 165 ? 7.600 20.434 5.601 1.0 7.92 ? 165 CYS A O 1 165 . A ATOM 1315 C CB . CYS A 1 165 ? 5.537 23.121 4.797 1.0 6.91 ? 165 CYS A CB 1 165 . A ATOM 1316 S SG . CYS A 1 165 ? 5.381 24.826 4.156 1.0 8.55 ? 165 CYS A SG 1 165 . A ATOM 1317 N N . ILE A 1 166 ? 6.828 21.830 7.195 1.0 6.4 ? 166 ILE A N 1 166 . A ATOM 1318 C CA . ILE A 1 166 ? 7.057 20.896 8.284 1.0 6.59 ? 166 ILE A CA 1 166 . A ATOM 1319 C C . ILE A 1 166 ? 6.494 19.518 8.048 1.0 6.14 ? 166 ILE A C 1 166 . A ATOM 1320 O O . ILE A 1 166 ? 7.169 18.519 8.307 1.0 6.62 ? 166 ILE A O 1 166 . A ATOM 1321 C CB . ILE A 1 166 ? 6.551 21.484 9.623 1.0 7.24 ? 166 ILE A CB 1 166 . A ATOM 1322 C CG1 . ILE A 1 166 ? 7.392 22.721 9.974 1.0 8.45 ? 166 ILE A CG1 1 166 . A ATOM 1323 C CG2 . ILE A 1 166 ? 6.575 20.393 10.723 1.0 8.09 ? 166 ILE A CG2 1 166 . A ATOM 1324 C CD1 . ILE A 1 166 ? 6.808 23.552 11.096 1.0 8.16 ? 166 ILE A CD1 1 166 . A ATOM 1325 N N . MET A 1 167 ? 5.281 19.467 7.496 1.0 6.11 ? 167 MET A N 1 167 . A ATOM 1326 C CA . MET A 1 167 ? 4.643 18.161 7.270 1.0 7.24 ? 167 MET A CA 1 167 . A ATOM 1327 C C . MET A 1 167 ? 4.903 17.513 5.908 1.0 8.0 ? 167 MET A C 1 167 . A ATOM 1328 O O . MET A 1 167 ? 4.134 16.649 5.443 1.0 7.62 ? 167 MET A O 1 167 . A ATOM 1329 C CB . MET A 1 167 ? 3.132 18.246 7.506 1.0 7.03 ? 167 MET A CB 1 167 . A ATOM 1330 C CG . MET A 1 167 ? 2.737 18.636 8.928 1.0 6.52 ? 167 MET A CG 1 167 . A ATOM 1331 S SD . MET A 1 167 ? 3.521 17.641 10.277 1.0 7.07 ? 167 MET A SD 1 167 . A ATOM 1332 C CE . MET A 1 167 ? 2.947 15.944 9.872 1.0 7.71 ? 167 MET A CE 1 167 . A ATOM 1333 N N . SER A 1 168 ? 5.996 17.900 5.267 1.0 8.19 ? 168 SER A N 1 168 . A ATOM 1334 C CA . SER A 1 168 ? 6.351 17.229 4.023 1.0 10.58 ? 168 SER A CA 1 168 . A ATOM 1335 C C . SER A 1 168 ? 6.574 15.755 4.391 1.0 11.0 ? 168 SER A C 1 168 . A ATOM 1336 O O . SER A 1 168 ? 7.067 15.444 5.472 1.0 10.22 ? 168 SER A O 1 168 . A ATOM 1337 C CB . SER A 1 168 ? 7.639 17.831 3.472 1.0 12.12 ? 168 SER A CB 1 168 . A ATOM 1338 O OG . SER A 1 168 ? 7.934 17.274 2.208 1.0 17.6 ? 168 SER A OG 1 168 . A ATOM 1339 N N . ALA A 1 169 ? 6.234 14.839 3.492 1.0 12.25 ? 169 ALA A N 1 169 . A ATOM 1340 C CA . ALA A 1 169 ? 6.397 13.419 3.785 1.0 14.51 ? 169 ALA A CA 1 169 . A ATOM 1341 C C . ALA A 1 169 ? 7.827 13.033 4.160 1.0 17.13 ? 169 ALA A C 1 169 . A ATOM 1342 O O . ALA A 1 169 ? 8.043 12.157 5.009 1.0 18.17 ? 169 ALA A O 1 169 . A ATOM 1343 C CB . ALA A 1 169 ? 5.946 12.600 2.600 1.0 14.72 ? 169 ALA A CB 1 169 . A ATOM 1344 N N . VAL A 1 170 ? 8.791 13.678 3.513 1.0 18.92 ? 170 VAL A N 1 170 . A ATOM 1345 C CA . VAL A 1 170 ? 10.213 13.422 3.778 1.0 21.77 ? 170 VAL A CA 1 170 . A ATOM 1346 C C . VAL A 1 170 ? 10.932 14.753 3.999 1.0 22.0 ? 170 VAL A C 1 170 . A ATOM 1347 O O . VAL A 1 170 ? 10.576 15.766 3.415 1.0 21.26 ? 170 VAL A O 1 170 . A ATOM 1348 C CB . VAL A 1 170 ? 10.878 12.677 2.590 1.0 23.08 ? 170 VAL A CB 1 170 . A ATOM 1349 C CG1 . VAL A 1 170 ? 12.327 12.352 2.912 1.0 25.44 ? 170 VAL A CG1 1 170 . A ATOM 1350 C CG2 . VAL A 1 170 ? 10.112 11.400 2.290 1.0 24.74 ? 170 VAL A CG2 1 170 . A ATOM 1351 N N . ILE A 1 171 ? 11.954 14.741 4.844 1.0 23.23 ? 171 ILE A N 1 171 . A ATOM 1352 C CA . ILE A 1 171 ? 12.702 15.947 5.144 1.0 25.27 ? 171 ILE A CA 1 171 . A ATOM 1353 C C . ILE A 1 171 ? 13.745 16.185 4.047 1.0 26.2 ? 171 ILE A C 1 171 . A ATOM 1354 O O . ILE A 1 171 ? 14.048 15.282 3.268 1.0 26.42 ? 171 ILE A O 1 171 . A ATOM 1355 C CB . ILE A 1 171 ? 13.397 15.803 6.531 1.0 25.78 ? 171 ILE A CB 1 171 . A ATOM 1356 C CG1 . ILE A 1 171 ? 13.830 17.170 7.061 1.0 25.97 ? 171 ILE A CG1 1 171 . A ATOM 1357 C CG2 . ILE A 1 171 ? 14.590 14.855 6.423 1.0 26.41 ? 171 ILE A CG2 1 171 . A ATOM 1358 C CD1 . ILE A 1 171 ? 14.282 17.157 8.528 1.0 25.98 ? 171 ILE A CD1 1 171 . A ATOM 1359 N N . SER A 1 172 ? 14.276 17.400 3.977 1.0 27.47 ? 172 SER A N 1 172 . A ATOM 1360 C CA . SER A 1 172 ? 15.313 17.727 3.001 1.0 28.7 ? 172 SER A CA 1 172 . A ATOM 1361 C C . SER A 1 172 ? 16.058 18.958 3.480 1.0 29.2 ? 172 SER A C 1 172 . A ATOM 1362 O O . SER A 1 172 ? 15.581 19.672 4.352 1.0 27.97 ? 172 SER A O 1 172 . A ATOM 1363 C CB . SER A 1 172 ? 14.717 18.014 1.625 1.0 29.65 ? 172 SER A CB 1 172 . A ATOM 1364 O OG . SER A 1 172 ? 14.475 19.398 1.480 1.0 30.38 ? 172 SER A OG 1 172 . A ATOM 1365 N N . ASP A 1 173 ? 17.228 19.204 2.898 1.0 30.09 ? 173 ASP A N 1 173 . A ATOM 1366 C CA . ASP A 1 173 ? 18.050 20.348 3.274 1.0 30.19 ? 173 ASP A CA 1 173 . A ATOM 1367 C C . ASP A 1 173 ? 17.343 21.700 3.139 1.0 28.92 ? 173 ASP A C 1 173 . A ATOM 1368 O O . ASP A 1 173 ? 17.629 22.619 3.904 1.0 29.06 ? 173 ASP A O 1 173 . A ATOM 1369 C CB . ASP A 1 173 ? 19.355 20.351 2.457 1.0 33.22 ? 173 ASP A CB 1 173 . A ATOM 1370 C CG . ASP A 1 173 ? 19.289 21.258 1.234 1.0 34.97 ? 173 ASP A CG 1 173 . A ATOM 1371 O OD1 . ASP A 1 173 ? 19.350 22.495 1.407 1.0 37.54 ? 173 ASP A OD1 1 173 . A ATOM 1372 O OD2 . ASP A 1 173 ? 19.173 20.741 0.102 1.0 36.89 ? 173 ASP A OD2 1 173 . A ATOM 1373 N N . LYS A 1 174 ? 16.420 21.835 2.186 1.0 26.76 ? 174 LYS A N 1 174 . A ATOM 1374 C CA . LYS A 1 174 ? 15.733 23.116 2.032 1.0 24.03 ? 174 LYS A CA 1 174 . A ATOM 1375 C C . LYS A 1 174 ? 14.520 23.246 2.949 1.0 21.29 ? 174 LYS A C 1 174 . A ATOM 1376 O O . LYS A 1 174 ? 13.672 24.109 2.755 1.0 19.23 ? 174 LYS A O 1 174 . A ATOM 1377 C CB . LYS A 1 174 ? 15.312 23.350 0.579 1.0 26.83 ? 174 LYS A CB 1 174 . A ATOM 1378 C CG . LYS A 1 174 ? 14.387 22.312 -0.010 1.0 29.25 ? 174 LYS A CG 1 174 . A ATOM 1379 C CD . LYS A 1 174 ? 13.939 22.731 -1.421 1.0 31.1 ? 174 LYS A CD 1 174 . A ATOM 1380 C CE . LYS A 1 174 ? 13.283 21.588 -2.181 1.0 31.77 ? 174 LYS A CE 1 174 . A ATOM 1381 N NZ . LYS A 1 174 ? 14.262 20.536 -2.581 1.0 33.59 ? 174 LYS A NZ 1 174 . A ATOM 1382 N N . GLN A 1 175 ? 14.457 22.374 3.946 1.0 17.32 ? 175 GLN A N 1 175 . A ATOM 1383 C CA . GLN A 1 175 ? 13.364 22.379 4.925 1.0 14.55 ? 175 GLN A CA 1 175 . A ATOM 1384 C C . GLN A 1 175 ? 13.016 23.786 5.416 1.0 13.26 ? 175 GLN A C 1 175 . A ATOM 1385 O O . GLN A 1 175 ? 13.885 24.539 5.857 1.0 13.73 ? 175 GLN A O 1 175 . A ATOM 1386 C CB . GLN A 1 175 ? 13.769 21.526 6.119 1.0 13.78 ? 175 GLN A CB 1 175 . A ATOM 1387 C CG . GLN A 1 175 ? 12.713 21.427 7.201 1.0 13.15 ? 175 GLN A CG 1 175 . A ATOM 1388 C CD . GLN A 1 175 ? 11.487 20.719 6.709 1.0 12.54 ? 175 GLN A CD 1 175 . A ATOM 1389 O OE1 . GLN A 1 175 ? 11.553 19.570 6.246 1.0 14.97 ? 175 GLN A OE1 1 175 . A ATOM 1390 N NE2 . GLN A 1 175 ? 10.364 21.386 6.791 1.0 11.83 ? 175 GLN A NE2 1 175 . A ATOM 1391 N N . SER A 1 176 ? 11.730 24.105 5.392 1.0 11.28 ? 176 SER A N 1 176 . A ATOM 1392 C CA . SER A 1 176 ? 11.222 25.397 5.844 1.0 9.75 ? 176 SER A CA 1 176 . A ATOM 1393 C C . SER A 1 176 ? 10.723 25.242 7.282 1.0 9.44 ? 176 SER A C 1 176 . A ATOM 1394 O O . SER A 1 176 ? 10.368 24.148 7.692 1.0 9.49 ? 176 SER A O 1 176 . A ATOM 1395 C CB . SER A 1 176 ? 10.051 25.801 4.931 1.0 10.72 ? 176 SER A CB 1 176 . A ATOM 1396 O OG . SER A 1 176 ? 9.223 26.775 5.506 1.0 11.1 ? 176 SER A OG 1 176 . A ATOM 1397 N N . LYS A 1 177 ? 10.699 26.333 8.040 1.0 8.74 ? 177 LYS A N 1 177 . A ATOM 1398 C CA . LYS A 1 177 ? 10.187 26.275 9.403 1.0 8.83 ? 177 LYS A CA 1 177 . A ATOM 1399 C C . LYS A 1 177 ? 8.669 26.511 9.431 1.0 8.6 ? 177 LYS A C 1 177 . A ATOM 1400 O O . LYS A 1 177 ? 8.077 26.583 10.493 1.0 7.82 ? 177 LYS A O 1 177 . A ATOM 1401 C CB . LYS A 1 177 ? 10.846 27.355 10.276 1.0 10.16 ? 177 LYS A CB 1 177 . A ATOM 1402 C CG . LYS A 1 177 ? 10.497 28.769 9.900 1.0 11.89 ? 177 LYS A CG 1 177 . A ATOM 1403 C CD . LYS A 1 177 ? 11.149 29.677 10.928 1.0 13.27 ? 177 LYS A CD 1 177 . A ATOM 1404 C CE . LYS A 1 177 ? 10.901 31.112 10.654 1.0 13.27 ? 177 LYS A CE 1 177 . A ATOM 1405 N NZ . LYS A 1 177 ? 11.362 31.927 11.866 1.0 11.89 ? 177 LYS A NZ 1 177 . A ATOM 1406 N N . LEU A 1 178 ? 8.033 26.609 8.263 1.0 7.73 ? 178 LEU A N 1 178 . A ATOM 1407 C CA . LEU A 1 178 ? 6.593 26.867 8.213 1.0 8.47 ? 178 LEU A CA 1 178 . A ATOM 1408 C C . LEU A 1 178 ? 5.681 25.658 8.075 1.0 7.59 ? 178 LEU A C 1 178 . A ATOM 1409 O O . LEU A 1 178 ? 6.063 24.649 7.459 1.0 8.05 ? 178 LEU A O 1 178 . A ATOM 1410 C CB . LEU A 1 178 ? 6.278 27.775 7.012 1.0 8.95 ? 178 LEU A CB 1 178 . A ATOM 1411 C CG . LEU A 1 178 ? 6.917 29.167 7.002 1.0 9.82 ? 178 LEU A CG 1 178 . A ATOM 1412 C CD1 . LEU A 1 178 ? 6.540 29.864 5.677 1.0 11.29 ? 178 LEU A CD1 1 178 . A ATOM 1413 C CD2 . LEU A 1 178 ? 6.445 29.985 8.233 1.0 12.74 ? 178 LEU A CD2 1 178 . A ATOM 1414 N N . PHE A 1 179 ? 4.487 25.779 8.651 1.0 7.08 ? 179 PHE A N 1 179 . A ATOM 1415 C CA . PHE A 1 179 ? 3.448 24.773 8.432 1.0 7.51 ? 179 PHE A CA 1 179 . A ATOM 1416 C C . PHE A 1 179 ? 2.708 25.226 7.153 1.0 7.54 ? 179 PHE A C 1 179 . A ATOM 1417 O O . PHE A 1 179 ? 2.447 26.430 6.945 1.0 8.38 ? 179 PHE A O 1 179 . A ATOM 1418 C CB . PHE A 1 179 ? 2.427 24.757 9.562 1.0 7.12 ? 179 PHE A CB 1 179 . A ATOM 1419 C CG . PHE A 1 179 ? 2.848 23.964 10.751 1.0 7.61 ? 179 PHE A CG 1 179 . A ATOM 1420 C CD1 . PHE A 1 179 ? 2.823 22.556 10.734 1.0 7.87 ? 179 PHE A CD1 1 179 . A ATOM 1421 C CD2 . PHE A 1 179 ? 3.269 24.612 11.914 1.0 7.56 ? 179 PHE A CD2 1 179 . A ATOM 1422 C CE1 . PHE A 1 179 ? 3.207 21.813 11.847 1.0 8.83 ? 179 PHE A CE1 1 179 . A ATOM 1423 C CE2 . PHE A 1 179 ? 3.650 23.870 13.029 1.0 8.4 ? 179 PHE A CE2 1 179 . A ATOM 1424 C CZ . PHE A 1 179 ? 3.620 22.476 12.999 1.0 8.16 ? 179 PHE A CZ 1 179 . A ATOM 1425 N N . SER A 1 180 ? 2.365 24.259 6.314 1.0 7.35 ? 180 SER A N 1 180 . A ATOM 1426 C CA . SER A 1 180 ? 1.634 24.521 5.074 1.0 7.6 ? 180 SER A CA 1 180 . A ATOM 1427 C C . SER A 1 180 ? 0.153 24.834 5.374 1.0 7.77 ? 180 SER A C 1 180 . A ATOM 1428 O O . SER A 1 180 ? -0.323 24.679 6.509 1.0 7.81 ? 180 SER A O 1 180 . A ATOM 1429 C CB . SER A 1 180 ? 1.650 23.263 4.246 1.0 6.0 ? 180 SER A CB 1 180 . A ATOM 1430 O OG . SER A 1 180 ? 0.780 22.324 4.881 1.0 6.95 ? 180 SER A OG 1 180 . A ATOM 1431 N N . ASP A 1 181 ? -0.595 25.255 4.346 1.0 7.94 ? 181 ASP A N 1 181 . A ATOM 1432 C CA . ASP A 1 181 ? -2.028 25.456 4.534 1.0 8.66 ? 181 ASP A CA 1 181 . A ATOM 1433 C C . ASP A 1 181 ? -2.705 24.085 4.746 1.0 8.27 ? 181 ASP A C 1 181 . A ATOM 1434 O O . ASP A 1 181 ? -3.742 24.014 5.399 1.0 8.21 ? 181 ASP A O 1 181 . A ATOM 1435 C CB . ASP A 1 181 ? -2.666 26.153 3.326 1.0 10.82 ? 181 ASP A CB 1 181 . A ATOM 1436 C CG . ASP A 1 181 ? -4.150 26.445 3.548 1.0 14.87 ? 181 ASP A CG 1 181 . A ATOM 1437 O OD1 . ASP A 1 181 ? -4.451 27.223 4.482 1.0 17.86 ? 181 ASP A OD1 1 181 . A ATOM 1438 O OD2 . ASP A 1 181 ? -5.012 25.891 2.820 1.0 14.97 ? 181 ASP A OD2 1 181 . A ATOM 1439 N N . CYS A 1 182 ? -2.115 22.998 4.228 1.0 7.5 ? 182 CYS A N 1 182 . A ATOM 1440 C CA . CYS A 1 182 ? -2.685 21.662 4.449 1.0 7.34 ? 182 CYS A CA 1 182 . A ATOM 1441 C C . CYS A 1 182 ? -2.676 21.422 5.950 1.0 7.13 ? 182 CYS A C 1 182 . A ATOM 1442 O O . CYS A 1 182 ? -3.660 20.977 6.520 1.0 6.57 ? 182 CYS A O 1 182 . A ATOM 1443 C CB . CYS A 1 182 ? -1.831 20.550 3.859 1.0 8.44 ? 182 CYS A CB 1 182 . A ATOM 1444 S SG . CYS A 1 182 ? -1.798 20.364 2.041 1.0 9.09 ? 182 CYS A SG 1 182 . A ATOM 1445 N N . SER A 1 183 ? -1.541 21.713 6.574 1.0 6.71 ? 183 SER A N 1 183 . A ATOM 1446 C CA . SER A 1 183 ? -1.366 21.498 8.014 1.0 6.32 ? 183 SER A CA 1 183 . A ATOM 1447 C C . SER A 1 183 ? -2.268 22.365 8.856 1.0 6.6 ? 183 SER A C 1 183 . A ATOM 1448 O O . SER A 1 183 ? -2.865 21.892 9.817 1.0 6.67 ? 183 SER A O 1 183 . A ATOM 1449 C CB . SER A 1 183 ? 0.082 21.752 8.413 1.0 6.92 ? 183 SER A CB 1 183 . A ATOM 1450 O OG . SER A 1 183 ? 0.944 20.836 7.760 1.0 6.46 ? 183 SER A OG 1 183 . A ATOM 1451 N N . LYS A 1 184 ? -2.367 23.643 8.502 1.0 7.62 ? 184 LYS A N 1 184 . A ATOM 1452 C CA . LYS A 1 184 ? -3.239 24.536 9.252 1.0 7.52 ? 184 LYS A CA 1 184 . A ATOM 1453 C C . LYS A 1 184 ? -4.695 24.076 9.120 1.0 7.55 ? 184 LYS A C 1 184 . A ATOM 1454 O O . LYS A 1 184 ? -5.438 24.062 10.115 1.0 8.35 ? 184 LYS A O 1 184 . A ATOM 1455 C CB . LYS A 1 184 ? -3.042 25.986 8.790 1.0 8.71 ? 184 LYS A CB 1 184 . A ATOM 1456 C CG . LYS A 1 184 ? -1.644 26.509 9.106 1.0 10.17 ? 184 LYS A CG 1 184 . A ATOM 1457 C CD . LYS A 1 184 ? -1.447 27.929 8.599 1.0 11.41 ? 184 LYS A CD 1 184 . A ATOM 1458 C CE . LYS A 1 184 ? -0.023 28.388 8.776 1.0 14.24 ? 184 LYS A CE 1 184 . A ATOM 1459 N NZ . LYS A 1 184 ? 0.015 29.822 8.378 1.0 16.65 ? 184 LYS A NZ 1 184 . A ATOM 1460 N N . ASP A 1 185 ? -5.093 23.644 7.920 1.0 8.26 ? 185 ASP A N 1 185 . A ATOM 1461 C CA . ASP A 1 185 ? -6.455 23.150 7.748 1.0 9.17 ? 185 ASP A CA 1 185 . A ATOM 1462 C C . ASP A 1 185 ? -6.683 21.866 8.586 1.0 8.64 ? 185 ASP A C 1 185 . A ATOM 1463 O O . ASP A 1 185 ? -7.739 21.700 9.168 1.0 9.17 ? 185 ASP A O 1 185 . A ATOM 1464 C CB . ASP A 1 185 ? -6.747 22.889 6.266 1.0 9.47 ? 185 ASP A CB 1 185 . A ATOM 1465 C CG . ASP A 1 185 ? -6.823 24.181 5.422 1.0 11.95 ? 185 ASP A CG 1 185 . A ATOM 1466 O OD1 . ASP A 1 185 ? -6.682 25.311 5.931 1.0 12.03 ? 185 ASP A OD1 1 185 . A ATOM 1467 O OD2 . ASP A 1 185 ? -7.033 24.060 4.203 1.0 11.97 ? 185 ASP A OD2 1 185 . A ATOM 1468 N N . TYR A 1 186 ? -5.704 20.956 8.651 1.0 8.24 ? 186 TYR A N 1 186 . A ATOM 1469 C CA . TYR A 1 186 ? -5.856 19.751 9.491 1.0 7.45 ? 186 TYR A CA 1 186 . A ATOM 1470 C C . TYR A 1 186 ? -5.987 20.146 10.953 1.0 7.56 ? 186 TYR A C 1 186 . A ATOM 1471 O O . TYR A 1 186 ? -6.761 19.539 11.700 1.0 7.69 ? 186 TYR A O 1 186 . A ATOM 1472 C CB . TYR A 1 186 ? -4.641 18.840 9.383 1.0 7.83 ? 186 TYR A CB 1 186 . A ATOM 1473 C CG . TYR A 1 186 ? -4.622 17.956 8.159 1.0 6.6 ? 186 TYR A CG 1 186 . A ATOM 1474 C CD1 . TYR A 1 186 ? -3.523 17.971 7.312 1.0 6.33 ? 186 TYR A CD1 1 186 . A ATOM 1475 C CD2 . TYR A 1 186 ? -5.685 17.082 7.869 1.0 7.46 ? 186 TYR A CD2 1 186 . A ATOM 1476 C CE1 . TYR A 1 186 ? -3.470 17.146 6.207 1.0 7.92 ? 186 TYR A CE1 1 186 . A ATOM 1477 C CE2 . TYR A 1 186 ? -5.638 16.257 6.749 1.0 8.8 ? 186 TYR A CE2 1 186 . A ATOM 1478 C CZ . TYR A 1 186 ? -4.530 16.310 5.927 1.0 7.78 ? 186 TYR A CZ 1 186 . A ATOM 1479 O OH . TYR A 1 186 ? -4.464 15.582 4.760 1.0 10.46 ? 186 TYR A OH 1 186 . A ATOM 1480 N N . TYR A 1 187 ? -5.237 21.172 11.367 1.0 7.36 ? 187 TYR A N 1 187 . A ATOM 1481 C CA . TYR A 1 187 ? -5.306 21.600 12.768 1.0 8.49 ? 187 TYR A CA 1 187 . A ATOM 1482 C C . TYR A 1 187 ? -6.695 22.185 13.057 1.0 9.16 ? 187 TYR A C 1 187 . A ATOM 1483 O O . TYR A 1 187 ? -7.275 21.946 14.113 1.0 9.23 ? 187 TYR A O 1 187 . A ATOM 1484 C CB . TYR A 1 187 ? -4.188 22.608 13.096 1.0 8.34 ? 187 TYR A CB 1 187 . A ATOM 1485 C CG . TYR A 1 187 ? -4.129 23.017 14.564 1.0 8.49 ? 187 TYR A CG 1 187 . A ATOM 1486 C CD1 . TYR A 1 187 ? -4.094 22.067 15.587 1.0 9.25 ? 187 TYR A CD1 1 187 . A ATOM 1487 C CD2 . TYR A 1 187 ? -4.119 24.356 14.915 1.0 8.38 ? 187 TYR A CD2 1 187 . A ATOM 1488 C CE1 . TYR A 1 187 ? -4.063 22.464 16.937 1.0 9.19 ? 187 TYR A CE1 1 187 . A ATOM 1489 C CE2 . TYR A 1 187 ? -4.070 24.769 16.260 1.0 9.65 ? 187 TYR A CE2 1 187 . A ATOM 1490 C CZ . TYR A 1 187 ? -4.049 23.815 17.256 1.0 9.27 ? 187 TYR A CZ 1 187 . A ATOM 1491 O OH . TYR A 1 187 ? -4.021 24.202 18.576 1.0 9.99 ? 187 TYR A OH 1 187 . A ATOM 1492 N N . GLN A 1 188 ? -7.243 22.937 12.110 1.0 9.51 ? 188 GLN A N 1 188 . A ATOM 1493 C CA . GLN A 1 188 ? -8.591 23.482 12.315 1.0 10.64 ? 188 GLN A CA 1 188 . A ATOM 1494 C C . GLN A 1 188 ? -9.597 22.325 12.495 1.0 10.44 ? 188 GLN A C 1 188 . A ATOM 1495 O O . GLN A 1 188 ? -10.462 22.372 13.379 1.0 11.14 ? 188 GLN A O 1 188 . A ATOM 1496 C CB . GLN A 1 188 ? -9.001 24.341 11.109 1.0 11.58 ? 188 GLN A CB 1 188 . A ATOM 1497 C CG . GLN A 1 188 ? -10.401 24.943 11.231 1.0 14.44 ? 188 GLN A CG 1 188 . A ATOM 1498 C CD . GLN A 1 188 ? -10.565 25.732 12.519 1.0 16.11 ? 188 GLN A CD 1 188 . A ATOM 1499 O OE1 . GLN A 1 188 ? -11.369 25.375 13.399 1.0 21.33 ? 188 GLN A OE1 1 188 . A ATOM 1500 N NE2 . GLN A 1 188 ? -9.798 26.791 12.654 1.0 15.42 ? 188 GLN A NE2 1 188 . A ATOM 1501 N N . THR A 1 189 ? -9.483 21.293 11.662 1.0 10.06 ? 189 THR A N 1 189 . A ATOM 1502 C CA . THR A 1 189 ? -10.371 20.128 11.745 1.0 10.45 ? 189 THR A CA 1 189 . A ATOM 1503 C C . THR A 1 189 ? -10.219 19.456 13.110 1.0 10.52 ? 189 THR A C 1 189 . A ATOM 1504 O O . THR A 1 189 ? -11.207 19.072 13.742 1.0 10.95 ? 189 THR A O 1 189 . A ATOM 1505 C CB . THR A 1 189 ? -10.052 19.137 10.598 1.0 11.56 ? 189 THR A CB 1 189 . A ATOM 1506 O OG1 . THR A 1 189 ? -10.289 19.798 9.346 1.0 13.36 ? 189 THR A OG1 1 189 . A ATOM 1507 C CG2 . THR A 1 189 ? -10.917 17.878 10.694 1.0 12.05 ? 189 THR A CG2 1 189 . A ATOM 1508 N N . PHE A 1 190 ? -8.978 19.342 13.584 1.0 10.3 ? 190 PHE A N 1 190 . A ATOM 1509 C CA . PHE A 1 190 ? -8.718 18.733 14.892 1.0 10.93 ? 190 PHE A CA 1 190 . A ATOM 1510 C C . PHE A 1 190 ? -9.342 19.559 16.027 1.0 11.37 ? 190 PHE A C 1 190 . A ATOM 1511 O O . PHE A 1 190 ? -9.952 19.017 16.960 1.0 11.06 ? 190 PHE A O 1 190 . A ATOM 1512 C CB . PHE A 1 190 ? -7.199 18.630 15.083 1.0 10.42 ? 190 PHE A CB 1 190 . A ATOM 1513 C CG . PHE A 1 190 ? -6.784 17.959 16.358 1.0 11.67 ? 190 PHE A CG 1 190 . A ATOM 1514 C CD1 . PHE A 1 190 ? -6.948 16.598 16.520 1.0 11.63 ? 190 PHE A CD1 1 190 . A ATOM 1515 C CD2 . PHE A 1 190 ? -6.218 18.697 17.387 1.0 11.91 ? 190 PHE A CD2 1 190 . A ATOM 1516 C CE1 . PHE A 1 190 ? -6.547 15.957 17.701 1.0 12.6 ? 190 PHE A CE1 1 190 . A ATOM 1517 C CE2 . PHE A 1 190 ? -5.812 18.063 18.582 1.0 12.4 ? 190 PHE A CE2 1 190 . A ATOM 1518 C CZ . PHE A 1 190 ? -5.980 16.690 18.720 1.0 11.47 ? 190 PHE A CZ 1 190 . A ATOM 1519 N N . LEU A 1 191 ? -9.205 20.875 15.960 1.0 12.37 ? 191 LEU A N 1 191 . A ATOM 1520 C CA . LEU A 1 191 ? -9.785 21.702 17.025 1.0 13.49 ? 191 LEU A CA 1 191 . A ATOM 1521 C C . LEU A 1 191 ? -11.313 21.660 16.978 1.0 14.4 ? 191 LEU A C 1 191 . A ATOM 1522 O O . LEU A 1 191 ? -11.975 21.748 18.014 1.0 15.55 ? 191 LEU A O 1 191 . A ATOM 1523 C CB . LEU A 1 191 ? -9.309 23.153 16.932 1.0 13.74 ? 191 LEU A CB 1 191 . A ATOM 1524 C CG . LEU A 1 191 ? -7.842 23.432 17.296 1.0 12.89 ? 191 LEU A CG 1 191 . A ATOM 1525 C CD1 . LEU A 1 191 ? -7.562 24.930 17.210 1.0 13.23 ? 191 LEU A CD1 1 191 . A ATOM 1526 C CD2 . LEU A 1 191 ? -7.543 22.938 18.704 1.0 14.32 ? 191 LEU A CD2 1 191 . A ATOM 1527 N N . THR A 1 192 ? -11.871 21.493 15.788 1.0 14.94 ? 192 THR A N 1 192 . A ATOM 1528 C CA . THR A 1 192 ? -13.328 21.435 15.652 1.0 16.48 ? 192 THR A CA 1 192 . A ATOM 1529 C C . THR A 1 192 ? -13.889 20.069 16.056 1.0 17.42 ? 192 THR A C 1 192 . A ATOM 1530 O O . THR A 1 192 ? -14.873 19.985 16.804 1.0 18.38 ? 192 THR A O 1 192 . A ATOM 1531 C CB . THR A 1 192 ? -13.742 21.736 14.212 1.0 17.38 ? 192 THR A CB 1 192 . A ATOM 1532 O OG1 . THR A 1 192 ? -13.339 23.069 13.868 1.0 17.42 ? 192 THR A OG1 1 192 . A ATOM 1533 C CG2 . THR A 1 192 ? -15.278 21.616 14.054 1.0 17.84 ? 192 THR A CG2 1 192 . A ATOM 1534 N N . ASN A 1 193 ? -13.251 18.995 15.607 1.0 17.06 ? 193 ASN A N 1 193 . A ATOM 1535 C CA . ASN A 1 193 ? -13.774 17.668 15.897 1.0 17.89 ? 193 ASN A CA 1 193 . A ATOM 1536 C C . ASN A 1 193 ? -13.300 16.975 17.155 1.0 18.18 ? 193 ASN A C 1 193 . A ATOM 1537 O O . ASN A 1 193 ? -14.016 16.135 17.706 1.0 18.73 ? 193 ASN A O 1 193 . A ATOM 1538 C CB . ASN A 1 193 ? -13.505 16.724 14.723 1.0 18.9 ? 193 ASN A CB 1 193 . A ATOM 1539 C CG . ASN A 1 193 ? -14.134 17.206 13.424 1.0 19.66 ? 193 ASN A CG 1 193 . A ATOM 1540 O OD1 . ASN A 1 193 ? -15.049 18.040 13.427 1.0 20.86 ? 193 ASN A OD1 1 193 . A ATOM 1541 N ND2 . ASN A 1 193 ? -13.649 16.676 12.306 1.0 20.31 ? 193 ASN A ND2 1 193 . A ATOM 1542 N N . ASP A 1 194 ? -12.088 17.287 17.596 1.0 17.28 ? 194 ASP A N 1 194 . A ATOM 1543 C CA . ASP A 1 194 ? -11.522 16.621 18.761 1.0 16.91 ? 194 ASP A CA 1 194 . A ATOM 1544 C C . ASP A 1 194 ? -11.442 17.586 19.932 1.0 16.73 ? 194 ASP A C 1 194 . A ATOM 1545 O O . ASP A 1 194 ? -11.990 17.312 20.994 1.0 17.4 ? 194 ASP A O 1 194 . A ATOM 1546 C CB . ASP A 1 194 ? -10.135 16.065 18.401 1.0 18.11 ? 194 ASP A CB 1 194 . A ATOM 1547 C CG . ASP A 1 194 ? -9.621 15.061 19.422 1.0 20.57 ? 194 ASP A CG 1 194 . A ATOM 1548 O OD1 . ASP A 1 194 ? -9.112 13.994 19.019 1.0 22.98 ? 194 ASP A OD1 1 194 . A ATOM 1549 O OD2 . ASP A 1 194 ? -9.711 15.333 20.634 1.0 21.48 ? 194 ASP A OD2 1 194 . A ATOM 1550 N N . ASN A 1 195 ? -10.745 18.699 19.747 1.0 15.79 ? 195 ASN A N 1 195 . A ATOM 1551 C CA . ASN A 1 195 ? -10.620 19.719 20.776 1.0 15.79 ? 195 ASN A CA 1 195 . A ATOM 1552 C C . ASN A 1 195 ? -10.276 19.146 22.165 1.0 15.46 ? 195 ASN A C 1 195 . A ATOM 1553 O O . ASN A 1 195 ? -11.010 19.379 23.141 1.0 15.22 ? 195 ASN A O 1 195 . A ATOM 1554 C CB . ASN A 1 195 ? -11.926 20.502 20.837 1.0 17.42 ? 195 ASN A CB 1 195 . A ATOM 1555 C CG . ASN A 1 195 ? -11.781 21.796 21.591 1.0 18.2 ? 195 ASN A CG 1 195 . A ATOM 1556 O OD1 . ASN A 1 195 ? -10.708 22.409 21.599 1.0 18.16 ? 195 ASN A OD1 1 195 . A ATOM 1557 N ND2 . ASN A 1 195 ? -12.869 22.244 22.209 1.0 19.8 ? 195 ASN A ND2 1 195 . A ATOM 1558 N N . PRO A 1 196 ? -9.143 18.430 22.279 1.0 15.14 ? 196 PRO A N 1 196 . A ATOM 1559 C CA . PRO A 1 196 ? -8.737 17.835 23.557 1.0 14.74 ? 196 PRO A CA 1 196 . A ATOM 1560 C C . PRO A 1 196 ? -8.542 18.868 24.657 1.0 14.72 ? 196 PRO A C 1 196 . A ATOM 1561 O O . PRO A 1 196 ? -7.956 19.919 24.457 1.0 14.07 ? 196 PRO A O 1 196 . A ATOM 1562 C CB . PRO A 1 196 ? -7.467 17.063 23.199 1.0 15.99 ? 196 PRO A CB 1 196 . A ATOM 1563 C CG . PRO A 1 196 ? -6.913 17.837 22.102 1.0 14.86 ? 196 PRO A CG 1 196 . A ATOM 1564 C CD . PRO A 1 196 ? -8.098 18.226 21.263 1.0 15.02 ? 196 PRO A CD 1 196 . A ATOM 1565 N N . GLN A 1 197 ? -9.020 18.529 25.842 1.0 15.14 ? 197 GLN A N 1 197 . A ATOM 1566 C CA . GLN A 1 197 ? -8.975 19.450 26.955 1.0 16.22 ? 197 GLN A CA 1 197 . A ATOM 1567 C C . GLN A 1 197 ? -7.617 19.847 27.515 1.0 14.54 ? 197 GLN A C 1 197 . A ATOM 1568 O O . GLN A 1 197 ? -7.438 20.988 27.926 1.0 13.51 ? 197 GLN A O 1 197 . A ATOM 1569 C CB . GLN A 1 197 ? -9.853 18.893 28.089 1.0 17.53 ? 197 GLN A CB 1 197 . A ATOM 1570 C CG . GLN A 1 197 ? -9.829 19.685 29.383 1.0 23.62 ? 197 GLN A CG 1 197 . A ATOM 1571 C CD . GLN A 1 197 ? -10.481 21.047 29.264 1.0 26.27 ? 197 GLN A CD 1 197 . A ATOM 1572 O OE1 . GLN A 1 197 ? -11.606 21.170 28.766 1.0 28.21 ? 197 GLN A OE1 1 197 . A ATOM 1573 N NE2 . GLN A 1 197 ? -9.782 22.086 29.737 1.0 28.12 ? 197 GLN A NE2 1 197 . A ATOM 1574 N N . CYS A 1 198 ? -6.657 18.932 27.524 1.0 13.58 ? 198 CYS A N 1 198 . A ATOM 1575 C CA . CYS A 1 198 ? -5.376 19.259 28.144 1.0 12.71 ? 198 CYS A CA 1 198 . A ATOM 1576 C C . CYS A 1 198 ? -4.625 20.425 27.527 1.0 12.79 ? 198 CYS A C 1 198 . A ATOM 1577 O O . CYS A 1 198 ? -3.883 21.114 28.234 1.0 13.35 ? 198 CYS A O 1 198 . A ATOM 1578 C CB . CYS A 1 198 ? -4.476 18.013 28.218 1.0 13.51 ? 198 CYS A CB 1 198 . A ATOM 1579 S SG . CYS A 1 198 ? -3.374 17.644 26.818 1.0 12.2 ? 198 CYS A SG 1 198 . A ATOM 1580 N N . ILE A 1 199 ? -4.838 20.681 26.240 1.0 11.89 ? 199 ILE A N 1 199 . A ATOM 1581 C CA . ILE A 1 199 ? -4.129 21.782 25.593 1.0 12.25 ? 199 ILE A CA 1 199 . A ATOM 1582 C C . ILE A 1 199 ? -4.869 23.112 25.718 1.0 12.7 ? 199 ILE A C 1 199 . A ATOM 1583 O O . ILE A 1 199 ? -4.427 24.143 25.213 1.0 11.23 ? 199 ILE A O 1 199 . A ATOM 1584 C CB . ILE A 1 199 ? -3.777 21.457 24.108 1.0 11.29 ? 199 ILE A CB 1 199 . A ATOM 1585 C CG1 . ILE A 1 199 ? -5.036 21.202 23.281 1.0 11.28 ? 199 ILE A CG1 1 199 . A ATOM 1586 C CG2 . ILE A 1 199 ? -2.854 20.220 24.056 1.0 11.65 ? 199 ILE A CG2 1 199 . A ATOM 1587 C CD1 . ILE A 1 199 ? -4.717 21.117 21.771 1.0 13.29 ? 199 ILE A CD1 1 199 . A ATOM 1588 N N . LEU A 1 200 ? -5.996 23.078 26.422 1.0 14.15 ? 200 LEU A N 1 200 . A ATOM 1589 C CA . LEU A 1 200 ? -6.765 24.291 26.676 1.0 16.97 ? 200 LEU A CA 1 200 . A ATOM 1590 C C . LEU A 1 200 ? -6.227 24.863 27.984 1.0 18.6 ? 200 LEU A C 1 200 . A ATOM 1591 O O . LEU A 1 200 ? -6.370 26.039 28.252 1.0 20.07 ? 200 LEU A O 1 200 . A ATOM 1592 C CB . LEU A 1 200 ? -8.255 23.966 26.860 1.0 18.21 ? 200 LEU A CB 1 200 . A ATOM 1593 C CG . LEU A 1 200 ? -9.142 23.704 25.645 1.0 20.27 ? 200 LEU A CG 1 200 . A ATOM 1594 C CD1 . LEU A 1 200 ? -10.546 23.325 26.124 1.0 21.4 ? 200 LEU A CD1 1 200 . A ATOM 1595 C CD2 . LEU A 1 200 ? -9.216 24.949 24.791 1.0 21.13 ? 200 LEU A CD2 1 200 . A ATOM 1596 N N . ASN A 1 201 ? -5.579 24.009 28.767 1.0 20.01 ? 201 ASN A N 1 201 . A ATOM 1597 C CA . ASN A 1 201 ? -5.030 24.372 30.077 1.0 21.23 ? 201 ASN A CA 1 201 . A ATOM 1598 C C . ASN A 1 201 ? -3.638 25.034 30.085 1.0 20.86 ? 201 ASN A C 1 201 . A ATOM 1599 O O . ASN A 1 201 ? -2.643 24.381 29.794 1.0 20.94 ? 201 ASN A O 1 201 . A ATOM 1600 C CB . ASN A 1 201 ? -4.950 23.115 30.965 1.0 23.16 ? 201 ASN A CB 1 201 . A ATOM 1601 C CG . ASN A 1 201 ? -6.293 22.398 31.120 1.0 24.92 ? 201 ASN A CG 1 201 . A ATOM 1602 O OD1 . ASN A 1 201 ? -7.337 23.033 31.228 1.0 26.67 ? 201 ASN A OD1 1 201 . A ATOM 1603 N ND2 . ASN A 1 201 ? -6.256 21.059 31.171 1.0 25.96 ? 201 ASN A ND2 1 201 . A ATOM 1604 N N . ALA A 1 202 ? -3.559 26.317 30.417 1.0 20.13 ? 202 ALA A N 1 202 . A ATOM 1605 C CA . ALA A 1 202 ? -2.253 26.967 30.512 1.0 18.99 ? 202 ALA A CA 1 202 . A ATOM 1606 C C . ALA A 1 202 ? -1.551 26.405 31.763 1.0 18.12 ? 202 ALA A C 1 202 . A ATOM 1607 O O . ALA A 1 202 ? -2.188 26.033 32.737 1.0 18.53 ? 202 ALA A O 1 202 . A ATOM 1608 C CB . ALA A 1 202 ? -2.427 28.477 30.645 1.0 20.17 ? 202 ALA A CB 1 202 . A ATOM 1609 N N . PRO A 1 203 ? -0.223 26.343 31.748 1.0 17.05 ? 203 PRO A N 1 203 . A ATOM 1610 C CA . PRO A 1 203 ? 0.488 25.810 32.917 1.0 17.32 ? 203 PRO A CA 1 203 . A ATOM 1611 C C . PRO A 1 203 ? 0.168 26.568 34.228 1.0 17.88 ? 203 PRO A C 1 203 . A ATOM 1612 O O . PRO A 1 203 ? -0.193 27.762 34.176 1.0 17.37 ? 203 PRO A O 1 203 . A ATOM 1613 C CB . PRO A 1 203 ? 1.954 25.948 32.520 1.0 17.17 ? 203 PRO A CB 1 203 . A ATOM 1614 C CG . PRO A 1 203 ? 1.911 25.904 30.976 1.0 17.07 ? 203 PRO A CG 1 203 . A ATOM 1615 C CD . PRO A 1 203 ? 0.695 26.712 30.658 1.0 17.02 ? 203 PRO A CD 1 203 . A ATOM 1616 O OXT . PRO A 1 203 ? 0.295 25.953 35.292 1.0 17.32 ? 203 PRO A OXT 1 203 . A HETATM 1617 CD CD . CD B 2 . ? 5.353 11.758 8.918 1.0 9.15 ? 701 CD B CD 1 701 . A HETATM 1618 CD CD . CD C 2 . ? 15.804 27.427 28.083 1.0 8.56 ? 702 CD C CD 1 702 . A HETATM 1619 CD CD . CD D 2 . ? -7.007 26.323 3.726 1.0 14.7 ? 703 CD D CD 1 703 . A HETATM 1620 CD CD . CD E 2 . ? 26.463 3.259 29.263 1.0 28.68 ? 704 CD E CD 1 704 . A HETATM 1621 CD CD . CD F 2 . ? -0.898 33.499 21.751 1.0 22.44 ? 705 CD F CD 1 705 . A HETATM 1622 CD CD . CD G 2 . ? -8.664 13.277 21.188 1.0 29.41 ? 706 CD G CD 1 706 . A HETATM 1623 CD CD . CD H 2 . ? -0.012 27.950 36.488 1.0 34.79 ? 707 CD H CD 1 707 . A HETATM 1624 CD CD . CD I 2 . ? 19.061 13.882 8.995 1.0 12.87 ? 708 CD I CD 1 708 . A HETATM 1625 CD CD . CD J 2 . ? -0.105 27.919 0.742 1.0 27.78 ? 709 CD J CD 1 709 . A HETATM 1626 CD CD . CD K 2 . ? -4.349 3.405 29.973 1.0 27.86 ? 710 CD K CD 1 710 . A HETATM 1627 O O . HOH L 3 . ? 22.638 23.537 15.070 1.0 17.0 ? 301 HOH L O 1 301 . A HETATM 1628 O O . HOH L 3 . ? 20.372 24.231 13.602 1.0 11.39 ? 302 HOH L O 1 302 . A HETATM 1629 O O . HOH L 3 . ? 20.899 25.027 10.853 1.0 17.58 ? 303 HOH L O 1 303 . A HETATM 1630 O O . HOH L 3 . ? 11.990 -3.477 15.619 1.0 8.9 ? 304 HOH L O 1 304 . A HETATM 1631 O O . HOH L 3 . ? 10.682 2.607 11.497 1.0 15.66 ? 305 HOH L O 1 305 . A HETATM 1632 O O . HOH L 3 . ? 20.914 25.492 6.095 1.0 34.54 ? 306 HOH L O 1 306 . A HETATM 1633 O O . HOH L 3 . ? 12.345 28.546 6.803 1.0 15.15 ? 307 HOH L O 1 307 . A HETATM 1634 O O . HOH L 3 . ? 13.663 30.520 7.723 1.0 12.47 ? 308 HOH L O 1 308 . A HETATM 1635 O O . HOH L 3 . ? 21.218 1.610 25.415 1.0 21.55 ? 309 HOH L O 1 309 . A HETATM 1636 O O . HOH L 3 . ? 10.215 0.247 10.371 1.0 24.03 ? 310 HOH L O 1 310 . A HETATM 1637 O O . HOH L 3 . ? 13.383 -2.947 7.944 1.0 9.24 ? 311 HOH L O 1 311 . A HETATM 1638 O O . HOH L 3 . ? 16.407 -0.384 7.211 1.0 8.84 ? 312 HOH L O 1 312 . A HETATM 1639 O O . HOH L 3 . ? 11.121 15.780 9.772 1.0 14.85 ? 313 HOH L O 1 313 . A HETATM 1640 O O . HOH L 3 . ? 19.366 -0.073 11.531 1.0 11.57 ? 314 HOH L O 1 314 . A HETATM 1641 O O . HOH L 3 . ? 4.407 29.425 19.905 1.0 14.16 ? 315 HOH L O 1 315 . A HETATM 1642 O O . HOH L 3 . ? -10.694 28.358 22.433 1.0 28.65 ? 316 HOH L O 1 316 . A HETATM 1643 O O . HOH L 3 . ? 6.139 32.528 20.720 1.0 20.63 ? 317 HOH L O 1 317 . A HETATM 1644 O O . HOH L 3 . ? 5.384 32.669 23.285 1.0 15.87 ? 318 HOH L O 1 318 . A HETATM 1645 O O . HOH L 3 . ? -8.152 21.792 22.255 1.0 13.06 ? 319 HOH L O 1 319 . A HETATM 1646 O O . HOH L 3 . ? -3.002 34.971 21.373 1.0 20.84 ? 320 HOH L O 1 320 . A HETATM 1647 O O . HOH L 3 . ? 0.884 31.851 22.058 1.0 18.48 ? 321 HOH L O 1 321 . A HETATM 1648 O O . HOH L 3 . ? 10.615 28.261 24.035 1.0 11.59 ? 322 HOH L O 1 322 . A HETATM 1649 O O . HOH L 3 . ? 2.750 28.350 28.331 1.0 19.9 ? 323 HOH L O 1 323 . A HETATM 1650 O O . HOH L 3 . ? -3.766 34.209 24.413 1.0 37.51 ? 324 HOH L O 1 324 . A HETATM 1651 O O . HOH L 3 . ? -6.780 6.574 26.388 1.0 12.4 ? 325 HOH L O 1 325 . A HETATM 1652 O O . HOH L 3 . ? -1.475 12.803 28.637 1.0 16.86 ? 326 HOH L O 1 326 . A HETATM 1653 O O . HOH L 3 . ? 4.543 22.210 33.750 1.0 7.47 ? 327 HOH L O 1 327 . A HETATM 1654 O O . HOH L 3 . ? 15.131 21.500 31.988 1.0 15.54 ? 328 HOH L O 1 328 . A HETATM 1655 O O . HOH L 3 . ? 25.384 3.348 25.138 1.0 28.26 ? 329 HOH L O 1 329 . A HETATM 1656 O O . HOH L 3 . ? 18.705 5.551 32.934 1.0 17.28 ? 330 HOH L O 1 330 . A HETATM 1657 O O . HOH L 3 . ? 13.201 7.678 34.529 1.0 38.27 ? 331 HOH L O 1 331 . A HETATM 1658 O O . HOH L 3 . ? 27.629 8.387 33.322 1.0 41.61 ? 332 HOH L O 1 332 . A HETATM 1659 O O . HOH L 3 . ? 19.395 3.952 23.474 1.0 12.43 ? 333 HOH L O 1 333 . A HETATM 1660 O O . HOH L 3 . ? 20.809 3.653 21.118 1.0 17.15 ? 334 HOH L O 1 334 . A HETATM 1661 O O . HOH L 3 . ? 29.653 9.112 26.557 1.0 24.91 ? 335 HOH L O 1 335 . A HETATM 1662 O O . HOH L 3 . ? 1.859 13.921 39.831 1.0 34.98 ? 336 HOH L O 1 336 . A HETATM 1663 O O . HOH L 3 . ? 2.262 17.424 37.865 1.0 16.82 ? 337 HOH L O 1 337 . A HETATM 1664 O O . HOH L 3 . ? 3.834 18.302 39.906 1.0 20.28 ? 338 HOH L O 1 338 . A HETATM 1665 O O . HOH L 3 . ? 7.050 9.727 41.761 1.0 44.36 ? 339 HOH L O 1 339 . A HETATM 1666 O O . HOH L 3 . ? 6.020 16.655 39.954 1.0 24.12 ? 340 HOH L O 1 340 . A HETATM 1667 O O . HOH L 3 . ? 2.964 7.401 41.990 1.0 35.25 ? 341 HOH L O 1 341 . A HETATM 1668 O O . HOH L 3 . ? -2.065 16.704 30.563 1.0 23.87 ? 342 HOH L O 1 342 . A HETATM 1669 O O . HOH L 3 . ? -1.451 22.130 29.079 1.0 24.28 ? 343 HOH L O 1 343 . A HETATM 1670 O O . HOH L 3 . ? -2.323 20.248 30.116 1.0 21.14 ? 344 HOH L O 1 344 . A HETATM 1671 O O . HOH L 3 . ? 27.418 3.513 18.441 1.0 30.53 ? 345 HOH L O 1 345 . A HETATM 1672 O O . HOH L 3 . ? 24.073 13.647 14.550 1.0 32.05 ? 346 HOH L O 1 346 . A HETATM 1673 O O . HOH L 3 . ? 17.174 6.051 10.596 1.0 9.49 ? 347 HOH L O 1 347 . A HETATM 1674 O O . HOH L 3 . ? 17.800 2.707 8.282 1.0 13.11 ? 348 HOH L O 1 348 . A HETATM 1675 O O . HOH L 3 . ? -7.449 15.930 27.642 1.0 16.27 ? 349 HOH L O 1 349 . A HETATM 1676 O O . HOH L 3 . ? 18.088 27.791 27.215 1.0 1.95 ? 350 HOH L O 1 350 . A HETATM 1677 O O . HOH L 3 . ? -1.018 15.578 -4.553 1.0 11.52 ? 351 HOH L O 1 351 . A HETATM 1678 O O . HOH L 3 . ? 13.915 20.153 34.578 1.0 11.37 ? 352 HOH L O 1 352 . A HETATM 1679 O O . HOH L 3 . ? 12.687 18.358 34.268 1.0 17.16 ? 353 HOH L O 1 353 . A HETATM 1680 O O . HOH L 3 . ? 24.532 21.462 23.746 1.0 21.2 ? 354 HOH L O 1 354 . A HETATM 1681 O O . HOH L 3 . ? 20.362 16.618 6.527 1.0 18.68 ? 355 HOH L O 1 355 . A HETATM 1682 O O . HOH L 3 . ? 18.863 11.677 8.778 1.0 14.21 ? 356 HOH L O 1 356 . A HETATM 1683 O O . HOH L 3 . ? 18.832 16.203 8.241 1.0 9.92 ? 357 HOH L O 1 357 . A HETATM 1684 O O . HOH L 3 . ? 17.673 12.539 7.435 1.0 24.22 ? 358 HOH L O 1 358 . A HETATM 1685 O O . HOH L 3 . ? 6.410 10.745 10.699 1.0 13.27 ? 359 HOH L O 1 359 . A HETATM 1686 O O . HOH L 3 . ? 6.230 6.221 -0.012 0.5 42.94 ? 360 HOH L O 1 360 . A HETATM 1687 O O . HOH L 3 . ? 5.510 20.480 2.279 1.0 12.58 ? 361 HOH L O 1 361 . A HETATM 1688 O O . HOH L 3 . ? 5.541 18.014 0.610 1.0 17.52 ? 362 HOH L O 1 362 . A HETATM 1689 O O . HOH L 3 . ? -7.185 16.819 11.341 1.0 10.64 ? 363 HOH L O 1 363 . A HETATM 1690 O O . HOH L 3 . ? -8.681 15.546 13.439 1.0 16.88 ? 364 HOH L O 1 364 . A HETATM 1691 O O . HOH L 3 . ? -2.559 16.933 2.864 1.0 13.37 ? 365 HOH L O 1 365 . A HETATM 1692 O O . HOH L 3 . ? 1.022 13.165 0.732 1.0 24.06 ? 366 HOH L O 1 366 . A HETATM 1693 O O . HOH L 3 . ? -1.124 12.675 2.996 1.0 33.44 ? 367 HOH L O 1 367 . A HETATM 1694 O O . HOH L 3 . ? -0.173 18.778 6.583 1.0 7.54 ? 368 HOH L O 1 368 . A HETATM 1695 O O . HOH L 3 . ? 0.404 11.251 6.546 1.0 18.23 ? 369 HOH L O 1 369 . A HETATM 1696 O O . HOH L 3 . ? -2.825 8.464 9.390 1.0 40.38 ? 370 HOH L O 1 370 . A HETATM 1697 O O . HOH L 3 . ? 3.392 21.492 6.642 1.0 7.21 ? 371 HOH L O 1 371 . A HETATM 1698 O O . HOH L 3 . ? 4.398 15.637 1.359 1.0 14.59 ? 372 HOH L O 1 372 . A HETATM 1699 O O . HOH L 3 . ? 1.509 15.348 -3.061 1.0 10.28 ? 373 HOH L O 1 373 . A HETATM 1700 O O . HOH L 3 . ? -8.395 16.315 3.686 1.0 17.73 ? 374 HOH L O 1 374 . A HETATM 1701 O O . HOH L 3 . ? -9.188 16.763 6.722 1.0 31.99 ? 375 HOH L O 1 375 . A HETATM 1702 O O . HOH L 3 . ? -9.289 14.680 5.260 1.0 42.05 ? 376 HOH L O 1 376 . A HETATM 1703 O O . HOH L 3 . ? -5.989 19.674 5.263 1.0 14.3 ? 377 HOH L O 1 377 . A HETATM 1704 O O . HOH L 3 . ? 2.041 20.147 -0.520 1.0 8.41 ? 378 HOH L O 1 378 . A HETATM 1705 O O . HOH L 3 . ? 6.462 24.079 -5.956 1.0 28.41 ? 379 HOH L O 1 379 . A HETATM 1706 O O . HOH L 3 . ? 11.371 19.396 -5.193 1.0 43.21 ? 380 HOH L O 1 380 . A HETATM 1707 O O . HOH L 3 . ? 0.682 -1.722 25.679 1.0 15.2 ? 381 HOH L O 1 381 . A HETATM 1708 O O . HOH L 3 . ? 6.459 0.297 30.913 1.0 35.5 ? 382 HOH L O 1 382 . A HETATM 1709 O O . HOH L 3 . ? -1.652 26.542 -0.930 1.0 8.42 ? 383 HOH L O 1 383 . A HETATM 1710 O O . HOH L 3 . ? 9.979 17.727 7.885 1.0 12.07 ? 384 HOH L O 1 384 . A HETATM 1711 O O . HOH L 3 . ? 5.967 36.203 17.005 1.0 30.62 ? 385 HOH L O 1 385 . A HETATM 1712 O O . HOH L 3 . ? 5.989 27.994 11.540 1.0 10.32 ? 386 HOH L O 1 386 . A HETATM 1713 O O . HOH L 3 . ? 3.632 28.035 10.035 1.0 11.07 ? 387 HOH L O 1 387 . A HETATM 1714 O O . HOH L 3 . ? 2.756 30.414 8.814 1.0 15.42 ? 388 HOH L O 1 388 . A HETATM 1715 O O . HOH L 3 . ? 0.816 25.855 1.561 1.0 1.0 ? 389 HOH L O 1 389 . A HETATM 1716 O O . HOH L 3 . ? 12.190 19.567 2.005 1.0 32.47 ? 390 HOH L O 1 390 . A HETATM 1717 O O . HOH L 3 . ? -0.622 28.768 5.308 1.0 24.04 ? 391 HOH L O 1 391 . A HETATM 1718 O O . HOH L 3 . ? -9.918 22.865 7.727 1.0 16.22 ? 392 HOH L O 1 392 . A HETATM 1719 O O . HOH L 3 . ? -10.053 20.643 5.287 1.0 25.73 ? 393 HOH L O 1 393 . A HETATM 1720 O O . HOH L 3 . ? -5.399 22.456 2.387 1.0 21.21 ? 394 HOH L O 1 394 . A HETATM 1721 O O . HOH L 3 . ? -3.405 30.880 6.920 1.0 18.39 ? 395 HOH L O 1 395 . A HETATM 1722 O O . HOH L 3 . ? -10.779 13.975 9.958 1.0 27.79 ? 396 HOH L O 1 396 . A HETATM 1723 O O . HOH L 3 . ? -11.400 14.928 12.640 1.0 26.31 ? 397 HOH L O 1 397 . A HETATM 1724 O O . HOH L 3 . ? -9.703 28.939 14.478 1.0 21.22 ? 398 HOH L O 1 398 . A HETATM 1725 O O . HOH L 3 . ? -8.914 27.891 10.553 1.0 18.62 ? 399 HOH L O 1 399 . A HETATM 1726 O O . HOH L 3 . ? -15.647 18.592 20.206 1.0 37.06 ? 400 HOH L O 1 400 . A HETATM 1727 O O . HOH L 3 . ? -15.582 21.025 20.561 1.0 42.78 ? 401 HOH L O 1 401 . A HETATM 1728 O O . HOH L 3 . ? -13.104 24.141 18.765 1.0 38.16 ? 402 HOH L O 1 402 . A HETATM 1729 O O . HOH L 3 . ? 3.707 35.426 20.635 1.0 41.68 ? 403 HOH L O 1 403 . A HETATM 1730 O O . HOH L 3 . ? 0.495 34.764 20.158 1.0 28.92 ? 404 HOH L O 1 404 . A HETATM 1731 O O . HOH L 3 . ? -8.690 33.494 17.402 1.0 35.78 ? 405 HOH L O 1 405 . A HETATM 1732 O O . HOH L 3 . ? -11.909 26.908 16.449 1.0 35.78 ? 406 HOH L O 1 406 . A HETATM 1733 O O . HOH L 3 . ? -7.684 32.372 22.371 1.0 22.93 ? 407 HOH L O 1 407 . A HETATM 1734 O O . HOH L 3 . ? 2.730 25.673 27.442 1.0 11.88 ? 408 HOH L O 1 408 . A HETATM 1735 O O . HOH L 3 . ? 5.259 23.700 31.213 1.0 23.89 ? 409 HOH L O 1 409 . A HETATM 1736 O O . HOH L 3 . ? 5.200 26.313 32.368 1.0 15.82 ? 410 HOH L O 1 410 . A HETATM 1737 O O . HOH L 3 . ? 17.181 13.317 34.070 1.0 19.13 ? 411 HOH L O 1 411 . A HETATM 1738 O O . HOH L 3 . ? 25.322 6.091 21.273 1.0 13.85 ? 412 HOH L O 1 412 . A HETATM 1739 O O . HOH L 3 . ? 23.977 5.688 19.087 1.0 24.08 ? 413 HOH L O 1 413 . A HETATM 1740 O O . HOH L 3 . ? 20.977 0.863 28.001 1.0 18.24 ? 414 HOH L O 1 414 . A HETATM 1741 O O . HOH L 3 . ? 10.570 9.122 9.243 1.0 12.38 ? 415 HOH L O 1 415 . A HETATM 1742 O O . HOH L 3 . ? 5.037 9.620 8.924 1.0 19.28 ? 416 HOH L O 1 416 . A HETATM 1743 O O . HOH L 3 . ? 9.327 11.613 9.842 1.0 23.66 ? 417 HOH L O 1 417 . A HETATM 1744 O O . HOH L 3 . ? 7.363 11.180 7.887 1.0 15.21 ? 418 HOH L O 1 418 . A HETATM 1745 O O . HOH L 3 . ? 1.611 8.259 11.919 1.0 32.19 ? 419 HOH L O 1 419 . A HETATM 1746 O O . HOH L 3 . ? 3.710 18.236 -1.434 1.0 18.18 ? 420 HOH L O 1 420 . A HETATM 1747 O O . HOH L 3 . ? -6.391 13.601 4.597 1.0 25.35 ? 421 HOH L O 1 421 . A HETATM 1748 O O . HOH L 3 . ? -1.857 6.614 14.193 1.0 21.21 ? 422 HOH L O 1 422 . A HETATM 1749 O O . HOH L 3 . ? 8.479 24.872 -3.297 1.0 35.45 ? 423 HOH L O 1 423 . A HETATM 1750 O O . HOH L 3 . ? 8.855 22.891 -4.798 1.0 36.66 ? 424 HOH L O 1 424 . A HETATM 1751 O O . HOH L 3 . ? 12.097 -4.414 29.641 1.0 41.33 ? 425 HOH L O 1 425 . A HETATM 1752 O O . HOH L 3 . ? 18.829 0.340 8.701 1.0 15.24 ? 426 HOH L O 1 426 . A HETATM 1753 O O . HOH L 3 . ? 23.622 20.844 20.087 1.0 22.26 ? 427 HOH L O 1 427 . A HETATM 1754 O O . HOH L 3 . ? 21.083 13.713 7.896 1.0 18.33 ? 428 HOH L O 1 428 . A HETATM 1755 O O . HOH L 3 . ? 23.224 0.907 29.765 1.0 19.23 ? 429 HOH L O 1 429 . A HETATM 1756 O O . HOH L 3 . ? 0.635 36.533 26.358 1.0 43.7 ? 430 HOH L O 1 430 . A HETATM 1757 O O . HOH L 3 . ? 24.498 -1.785 33.229 1.0 28.8 ? 431 HOH L O 1 431 . A HETATM 1758 O O . HOH L 3 . ? 16.429 19.479 34.016 1.0 22.86 ? 432 HOH L O 1 432 . A HETATM 1759 O O . HOH L 3 . ? 12.606 20.996 32.378 1.0 27.63 ? 433 HOH L O 1 433 . A HETATM 1760 O O . HOH L 3 . ? 9.440 22.906 33.590 1.0 17.64 ? 434 HOH L O 1 434 . A HETATM 1761 O O . HOH L 3 . ? -8.819 26.964 4.999 1.0 19.57 ? 435 HOH L O 1 435 . A HETATM 1762 O O . HOH L 3 . ? -9.759 25.445 7.404 1.0 14.82 ? 436 HOH L O 1 436 . A HETATM 1763 O O . HOH L 3 . ? -6.728 28.476 3.511 1.0 22.83 ? 437 HOH L O 1 437 . A HETATM 1764 O O . HOH L 3 . ? -8.465 19.346 7.072 1.0 17.4 ? 438 HOH L O 1 438 . A HETATM 1765 O O . HOH L 3 . ? -11.910 16.710 6.710 1.0 31.96 ? 439 HOH L O 1 439 . A HETATM 1766 O O . HOH L 3 . ? -2.891 31.568 14.785 1.0 13.14 ? 440 HOH L O 1 440 . A HETATM 1767 O O . HOH L 3 . ? -2.974 34.018 12.099 1.0 40.99 ? 441 HOH L O 1 441 . A HETATM 1768 O O . HOH L 3 . ? -0.090 34.775 23.504 1.0 22.21 ? 442 HOH L O 1 442 . A HETATM 1769 O O . HOH L 3 . ? -3.915 26.887 18.813 1.0 12.07 ? 443 HOH L O 1 443 . A HETATM 1770 O O . HOH L 3 . ? 2.378 34.778 22.920 1.0 39.61 ? 444 HOH L O 1 444 . A HETATM 1771 O O . HOH L 3 . ? 8.310 28.556 25.491 1.0 15.31 ? 445 HOH L O 1 445 . A HETATM 1772 O O . HOH L 3 . ? -1.770 30.888 10.820 1.0 22.79 ? 446 HOH L O 1 446 . A HETATM 1773 O O . HOH L 3 . ? -7.618 11.035 21.568 1.0 30.09 ? 447 HOH L O 1 447 . A HETATM 1774 O O . HOH L 3 . ? -8.714 13.900 23.765 1.0 32.12 ? 448 HOH L O 1 448 . A HETATM 1775 O O . HOH L 3 . ? -10.417 16.103 26.321 1.0 26.93 ? 449 HOH L O 1 449 . A HETATM 1776 O O . HOH L 3 . ? -6.051 9.177 28.098 1.0 23.49 ? 450 HOH L O 1 450 . A HETATM 1777 O O . HOH L 3 . ? 0.950 1.247 15.667 1.0 40.2 ? 451 HOH L O 1 451 . A HETATM 1778 O O . HOH L 3 . ? 3.420 -1.623 23.188 1.0 38.12 ? 452 HOH L O 1 452 . A HETATM 1779 O O . HOH L 3 . ? -12.843 19.601 8.783 1.0 31.74 ? 453 HOH L O 1 453 . A HETATM 1780 O O . HOH L 3 . ? -5.976 13.462 10.187 1.0 28.07 ? 454 HOH L O 1 454 . A HETATM 1781 O O . HOH L 3 . ? 7.221 -0.271 27.643 1.0 19.05 ? 455 HOH L O 1 455 . A HETATM 1782 O O . HOH L 3 . ? 5.027 -1.714 20.836 1.0 18.1 ? 456 HOH L O 1 456 . A HETATM 1783 O O . HOH L 3 . ? 23.075 -1.829 31.119 1.0 39.64 ? 457 HOH L O 1 457 . A HETATM 1784 O O . HOH L 3 . ? -4.760 3.319 27.295 1.0 28.11 ? 458 HOH L O 1 458 . A HETATM 1785 O O . HOH L 3 . ? -3.516 1.104 29.814 1.0 8.6 ? 459 HOH L O 1 459 . A HETATM 1786 O O . HOH L 3 . ? -5.373 5.354 30.518 1.0 29.49 ? 460 HOH L O 1 460 . A HETATM 1787 O O . HOH L 3 . ? 10.407 -2.206 26.394 1.0 24.44 ? 461 HOH L O 1 461 . A HETATM 1788 O O . HOH L 3 . ? 26.769 17.777 33.086 1.0 21.16 ? 462 HOH L O 1 462 . A HETATM 1789 O O . HOH L 3 . ? 18.478 25.314 31.791 1.0 38.27 ? 463 HOH L O 1 463 . A HETATM 1790 O O . HOH L 3 . ? 22.644 25.608 16.711 1.0 16.81 ? 464 HOH L O 1 464 . A HETATM 1791 O O . HOH L 3 . ? 24.545 16.296 10.572 1.0 22.81 ? 465 HOH L O 1 465 . A HETATM 1792 O O . HOH L 3 . ? 2.575 19.440 35.744 1.0 26.56 ? 466 HOH L O 1 466 . A HETATM 1793 O O . HOH L 3 . ? 23.281 2.968 24.144 1.0 20.03 ? 467 HOH L O 1 467 . A HETATM 1794 O O . HOH L 3 . ? 23.177 2.247 21.388 1.0 14.35 ? 468 HOH L O 1 468 . A HETATM 1795 O O . HOH L 3 . ? 23.192 -0.252 19.785 1.0 18.6 ? 469 HOH L O 1 469 . A HETATM 1796 O O . HOH L 3 . ? 25.876 -2.348 29.475 1.0 38.74 ? 470 HOH L O 1 470 . A HETATM 1797 O O . HOH L 3 . ? 30.352 5.181 27.424 1.0 34.61 ? 471 HOH L O 1 471 . A HETATM 1798 O O . HOH L 3 . ? -0.052 31.849 5.549 1.0 30.48 ? 472 HOH L O 1 472 . A HETATM 1799 O O . HOH L 3 . ? 27.769 2.508 22.498 1.0 27.14 ? 473 HOH L O 1 473 . A HETATM 1800 O O . HOH L 3 . ? 27.969 13.261 17.928 1.0 47.79 ? 474 HOH L O 1 474 . A HETATM 1801 O O . HOH L 3 . ? 31.737 10.282 22.381 1.0 46.62 ? 475 HOH L O 1 475 . A HETATM 1802 O O . HOH L 3 . ? 31.883 16.509 28.002 1.0 41.08 ? 476 HOH L O 1 476 . A HETATM 1803 O O . HOH L 3 . ? 16.259 16.381 34.017 1.0 24.9 ? 477 HOH L O 1 477 . A HETATM 1804 O O . HOH L 3 . ? 22.338 22.901 30.666 1.0 28.0 ? 478 HOH L O 1 478 . A HETATM 1805 O O . HOH L 3 . ? 16.439 26.438 33.438 1.0 36.2 ? 479 HOH L O 1 479 . A HETATM 1806 O O . HOH L 3 . ? 11.364 3.047 34.820 1.0 35.5 ? 480 HOH L O 1 480 . A HETATM 1807 O O . HOH L 3 . ? 16.941 9.273 34.525 1.0 36.67 ? 481 HOH L O 1 481 . A HETATM 1808 O O . HOH L 3 . ? 13.853 -2.134 33.187 1.0 41.96 ? 482 HOH L O 1 482 . A HETATM 1809 O O . HOH L 3 . ? 7.744 4.810 38.742 1.0 40.13 ? 483 HOH L O 1 483 . A HETATM 1810 O O . HOH L 3 . ? -0.103 12.999 35.510 1.0 31.07 ? 484 HOH L O 1 484 . A HETATM 1811 O O . HOH L 3 . ? 2.117 9.765 41.094 1.0 37.82 ? 485 HOH L O 1 485 . A HETATM 1812 O O . HOH L 3 . ? 25.399 3.533 20.865 1.0 28.92 ? 486 HOH L O 1 486 . A HETATM 1813 O O . HOH L 3 . ? 22.248 10.580 12.887 1.0 36.19 ? 487 HOH L O 1 487 . A HETATM 1814 O O . HOH L 3 . ? 20.105 9.570 9.876 1.0 25.14 ? 488 HOH L O 1 488 . A HETATM 1815 O O . HOH L 3 . ? 22.052 6.219 12.196 1.0 25.95 ? 489 HOH L O 1 489 . A HETATM 1816 O O . HOH L 3 . ? 23.252 13.696 9.724 1.0 38.11 ? 490 HOH L O 1 490 . A HETATM 1817 O O . HOH L 3 . ? 21.498 10.862 6.426 1.0 43.43 ? 491 HOH L O 1 491 . A HETATM 1818 O O . HOH L 3 . ? 19.699 4.569 8.345 1.0 25.47 ? 492 HOH L O 1 492 . A HETATM 1819 O O . HOH L 3 . ? 26.446 18.782 17.619 1.0 37.55 ? 493 HOH L O 1 493 . A HETATM 1820 O O . HOH L 3 . ? 25.140 16.355 17.003 1.0 23.15 ? 494 HOH L O 1 494 . A HETATM 1821 O O . HOH L 3 . ? 11.173 -2.667 9.503 1.0 31.43 ? 495 HOH L O 1 495 . A HETATM 1822 O O . HOH L 3 . ? 10.422 13.433 8.334 1.0 21.53 ? 496 HOH L O 1 496 . A HETATM 1823 O O . HOH L 3 . ? 8.433 7.089 10.081 1.0 24.46 ? 497 HOH L O 1 497 . A HETATM 1824 O O . HOH L 3 . ? 21.947 9.129 8.389 1.0 44.32 ? 498 HOH L O 1 498 . A HETATM 1825 O O . HOH L 3 . ? 12.152 12.099 6.465 1.0 20.67 ? 499 HOH L O 1 499 . A HETATM 1826 O O . HOH L 3 . ? -8.552 15.560 9.301 1.0 20.48 ? 500 HOH L O 1 500 . A HETATM 1827 O O . HOH L 3 . ? -11.461 12.914 14.837 1.0 36.59 ? 501 HOH L O 1 501 . A HETATM 1828 O O . HOH L 3 . ? -13.025 24.844 23.582 1.0 30.35 ? 502 HOH L O 1 502 . A HETATM 1829 O O . HOH L 3 . ? -4.279 5.902 17.376 1.0 39.22 ? 503 HOH L O 1 503 . A HETATM 1830 O O . HOH L 3 . ? -7.984 9.517 25.205 1.0 41.19 ? 504 HOH L O 1 504 . A HETATM 1831 O O . HOH L 3 . ? 5.251 -2.221 27.464 1.0 23.57 ? 505 HOH L O 1 505 . A HETATM 1832 O O . HOH L 3 . ? 6.609 0.458 33.934 1.0 41.37 ? 506 HOH L O 1 506 . A HETATM 1833 O O . HOH L 3 . ? 24.489 23.770 13.172 1.0 28.54 ? 507 HOH L O 1 507 . A HETATM 1834 O O . HOH L 3 . ? 22.926 24.675 7.351 1.0 44.22 ? 508 HOH L O 1 508 . A HETATM 1835 O O . HOH L 3 . ? 2.613 10.117 2.913 1.0 25.36 ? 509 HOH L O 1 509 . A HETATM 1836 O O . HOH L 3 . ? 7.798 24.900 -0.858 1.0 29.76 ? 510 HOH L O 1 510 . A HETATM 1837 O O . HOH L 3 . ? 20.223 18.235 4.449 1.0 43.05 ? 511 HOH L O 1 511 . A HETATM 1838 O O . HOH L 3 . ? 16.610 24.152 5.544 1.0 34.36 ? 512 HOH L O 1 512 . A HETATM 1839 O O . HOH L 3 . ? 1.518 31.036 28.341 1.0 33.61 ? 513 HOH L O 1 513 . A HETATM 1840 O O . HOH L 3 . ? -9.766 32.353 12.528 1.0 34.46 ? 514 HOH L O 1 514 . A HETATM 1841 O O . HOH L 3 . ? -7.661 29.096 24.825 1.0 24.67 ? 515 HOH L O 1 515 . A HETATM 1842 O O . HOH L 3 . ? 14.856 9.875 35.602 1.0 22.79 ? 516 HOH L O 1 516 . A HETATM 1843 O O . HOH L 3 . ? -10.440 32.614 20.565 1.0 38.21 ? 517 HOH L O 1 517 . A HETATM 1844 O O . HOH L 3 . ? 1.384 9.597 8.020 1.0 39.03 ? 518 HOH L O 1 518 . A HETATM 1845 O O . HOH L 3 . ? 27.777 7.001 20.629 1.0 23.23 ? 519 HOH L O 1 519 . A HETATM 1846 O O . HOH L 3 . ? 29.101 10.866 19.349 1.0 37.79 ? 520 HOH L O 1 520 . A HETATM 1847 O O . HOH L 3 . ? 11.378 20.648 34.991 1.0 26.04 ? 521 HOH L O 1 521 . A HETATM 1848 O O . HOH L 3 . ? 1.720 4.150 37.235 1.0 40.17 ? 522 HOH L O 1 522 . A HETATM 1849 O O . HOH L 3 . ? -17.647 13.378 19.093 1.0 39.44 ? 523 HOH L O 1 523 . A HETATM 1850 O O . HOH L 3 . ? -8.643 12.745 16.513 1.0 34.09 ? 524 HOH L O 1 524 . A HETATM 1851 O O . HOH L 3 . ? -16.770 14.374 13.183 1.0 39.39 ? 525 HOH L O 1 525 . A HETATM 1852 O O . HOH L 3 . ? -4.064 7.574 15.492 1.0 36.37 ? 526 HOH L O 1 526 . A HETATM 1853 O O . HOH L 3 . ? 3.854 -3.271 15.878 1.0 42.03 ? 527 HOH L O 1 527 . A HETATM 1854 O O . HOH L 3 . ? 3.074 -0.545 12.658 1.0 39.88 ? 528 HOH L O 1 528 . A HETATM 1855 O O . HOH L 3 . ? 5.125 -1.714 13.266 1.0 33.01 ? 529 HOH L O 1 529 . A HETATM 1856 O O . HOH L 3 . ? 24.218 25.376 19.237 1.0 32.16 ? 530 HOH L O 1 530 . A HETATM 1857 O O . HOH L 3 . ? -7.366 13.318 14.209 1.0 27.27 ? 531 HOH L O 1 531 . A HETATM 1858 O O . HOH L 3 . ? -9.880 11.575 11.081 1.0 40.11 ? 532 HOH L O 1 532 . A HETATM 1859 O O . HOH L 3 . ? -10.812 12.465 21.958 1.0 30.27 ? 533 HOH L O 1 533 . A HETATM 1860 O O . HOH L 3 . ? -6.499 3.723 14.775 1.0 43.68 ? 534 HOH L O 1 534 . A HETATM 1861 O O . HOH L 3 . ? 2.876 4.685 9.746 1.0 41.21 ? 535 HOH L O 1 535 . A HETATM 1862 O O . HOH L 3 . ? -8.263 12.484 27.627 1.0 39.66 ? 536 HOH L O 1 536 . A HETATM 1863 O O . HOH L 3 . ? 10.315 17.396 37.792 1.0 37.77 ? 537 HOH L O 1 537 . A HETATM 1864 O O . HOH L 3 . ? 26.631 14.453 32.944 1.0 32.4 ? 538 HOH L O 1 538 . A HETATM 1865 O O . HOH L 3 . ? 25.503 7.480 36.103 1.0 40.4 ? 539 HOH L O 1 539 . A HETATM 1866 O O . HOH L 3 . ? 23.096 22.770 21.833 1.0 31.07 ? 540 HOH L O 1 540 . A HETATM 1867 O O . HOH L 3 . ? 19.894 24.372 36.948 1.0 40.06 ? 541 HOH L O 1 541 . A HETATM 1868 O O . HOH L 3 . ? 29.404 19.356 32.407 1.0 41.75 ? 542 HOH L O 1 542 . A HETATM 1869 O O . HOH L 3 . ? 26.968 23.016 28.065 1.0 44.54 ? 543 HOH L O 1 543 . A HETATM 1870 O O . HOH L 3 . ? 26.083 21.160 12.779 1.0 30.41 ? 544 HOH L O 1 544 . A HETATM 1871 O O . HOH L 3 . ? 28.446 17.010 11.400 1.0 40.35 ? 545 HOH L O 1 545 . A HETATM 1872 O O . HOH L 3 . ? 21.173 19.263 6.593 1.0 35.64 ? 546 HOH L O 1 546 . A HETATM 1873 O O . HOH L 3 . ? 21.766 17.887 8.456 1.0 36.96 ? 547 HOH L O 1 547 . A HETATM 1874 O O . HOH L 3 . ? 12.250 28.717 2.550 1.0 23.58 ? 548 HOH L O 1 548 . A HETATM 1875 O O . HOH L 3 . ? 12.266 25.966 1.666 1.0 31.11 ? 549 HOH L O 1 549 . A HETATM 1876 O O . HOH L 3 . ? 14.582 27.062 5.922 1.0 22.54 ? 550 HOH L O 1 550 . A HETATM 1877 O O . HOH L 3 . ? 23.863 25.697 10.816 1.0 31.56 ? 551 HOH L O 1 551 . A HETATM 1878 O O . HOH L 3 . ? -1.055 36.768 8.850 1.0 40.72 ? 552 HOH L O 1 552 . A HETATM 1879 O O . HOH L 3 . ? 10.665 29.094 4.636 1.0 17.54 ? 553 HOH L O 1 553 . A HETATM 1880 O O . HOH L 3 . ? -6.804 33.901 9.081 1.0 37.02 ? 554 HOH L O 1 554 . A HETATM 1881 O O . HOH L 3 . ? 15.347 12.807 3.320 1.0 32.23 ? 555 HOH L O 1 555 . A HETATM 1882 O O . HOH L 3 . ? 15.825 27.718 3.185 1.0 35.28 ? 556 HOH L O 1 556 . A HETATM 1883 O O . HOH L 3 . ? 11.706 -0.132 32.679 1.0 35.98 ? 557 HOH L O 1 557 . A HETATM 1884 O O . HOH L 3 . ? 9.454 15.304 6.707 1.0 15.29 ? 558 HOH L O 1 558 . A HETATM 1885 O O . HOH L 3 . ? 14.980 11.515 6.294 1.0 34.82 ? 559 HOH L O 1 559 . A HETATM 1886 O O . HOH L 3 . ? 8.032 17.506 -0.239 1.0 31.77 ? 560 HOH L O 1 560 . A HETATM 1887 O O . HOH L 3 . ? 1.589 22.541 -8.012 1.0 30.54 ? 561 HOH L O 1 561 . A HETATM 1888 O O . HOH L 3 . ? 1.682 28.039 -0.796 1.0 29.51 ? 562 HOH L O 1 562 . A HETATM 1889 O O . HOH L 3 . ? 0.400 28.729 3.083 1.0 28.66 ? 563 HOH L O 1 563 . A HETATM 1890 O O . HOH L 3 . ? -0.808 29.722 0.350 1.0 25.9 ? 564 HOH L O 1 564 . A HETATM 1891 O O . HOH L 3 . ? 25.799 8.500 17.696 1.0 34.03 ? 565 HOH L O 1 565 . A HETATM 1892 O O . HOH L 3 . ? 19.983 6.093 21.097 1.0 23.47 ? 566 HOH L O 1 566 . A HETATM 1893 O O . HOH L 3 . ? 21.845 6.115 19.972 1.0 19.78 ? 567 HOH L O 1 567 . A HETATM 1894 O O . HOH L 3 . ? 29.148 18.953 16.250 1.0 39.41 ? 568 HOH L O 1 568 . A HETATM 1895 O O . HOH L 3 . ? 8.246 4.129 10.735 1.0 24.42 ? 569 HOH L O 1 569 . A HETATM 1896 O O . HOH L 3 . ? 18.537 24.842 7.344 1.0 31.59 ? 570 HOH L O 1 570 . A HETATM 1897 O O . HOH L 3 . ? 26.679 5.333 36.015 1.0 36.67 ? 571 HOH L O 1 571 . A HETATM 1898 O O . HOH L 3 . ? 34.684 11.052 25.372 1.0 42.38 ? 572 HOH L O 1 572 . A HETATM 1899 O O . HOH L 3 . ? 29.552 21.040 28.551 1.0 37.72 ? 573 HOH L O 1 573 . A HETATM 1900 O O . HOH L 3 . ? 11.397 13.916 38.267 1.0 37.9 ? 574 HOH L O 1 574 . A HETATM 1901 O O . HOH L 3 . ? 15.299 12.350 35.305 1.0 36.39 ? 575 HOH L O 1 575 . A HETATM 1902 O O . HOH L 3 . ? 13.444 17.180 36.269 1.0 39.18 ? 576 HOH L O 1 576 . A HETATM 1903 O O . HOH L 3 . ? 20.727 15.764 37.546 1.0 40.0 ? 577 HOH L O 1 577 . A HETATM 1904 O O . HOH L 3 . ? 21.874 22.623 37.228 1.0 39.65 ? 578 HOH L O 1 578 . A HETATM 1905 O O . HOH L 3 . ? 33.328 18.543 29.045 1.0 39.11 ? 579 HOH L O 1 579 . A HETATM 1906 O O . HOH L 3 . ? 31.575 14.606 29.533 1.0 36.89 ? 580 HOH L O 1 580 . A HETATM 1907 O O . HOH L 3 . ? 29.285 11.866 32.971 1.0 34.8 ? 581 HOH L O 1 581 . A HETATM 1908 O O . HOH L 3 . ? -1.620 37.324 23.117 1.0 38.96 ? 582 HOH L O 1 582 . A HETATM 1909 O O . HOH L 3 . ? 10.277 -2.003 -0.071 1.0 35.33 ? 583 HOH L O 1 583 . A HETATM 1910 O O . HOH L 3 . ? 16.730 23.832 33.534 1.0 34.45 ? 584 HOH L O 1 584 . A HETATM 1911 O O . HOH L 3 . ? -7.139 11.880 11.885 1.0 30.51 ? 585 HOH L O 1 585 . A HETATM 1912 O O . HOH L 3 . ? -6.726 14.031 20.814 1.0 12.38 ? 586 HOH L O 1 586 . A HETATM 1913 O O . HOH L 3 . ? -15.766 24.016 17.420 1.0 37.0 ? 587 HOH L O 1 587 . A HETATM 1914 O O . HOH L 3 . ? -14.403 25.287 15.018 1.0 37.28 ? 588 HOH L O 1 588 . A HETATM 1915 O O . HOH L 3 . ? -13.779 23.883 10.888 1.0 32.53 ? 589 HOH L O 1 589 . A HETATM 1916 O O . HOH L 3 . ? -2.033 13.974 30.977 1.0 31.68 ? 590 HOH L O 1 590 . A HETATM 1917 O O . HOH L 3 . ? -6.998 5.143 23.651 1.0 39.79 ? 591 HOH L O 1 591 . A HETATM 1918 O O . HOH L 3 . ? -11.689 4.536 26.854 1.0 34.75 ? 592 HOH L O 1 592 . A HETATM 1919 O O . HOH L 3 . ? 2.598 1.007 17.600 1.0 37.76 ? 593 HOH L O 1 593 . A HETATM 1920 O O . HOH L 3 . ? -7.009 0.849 13.668 1.0 38.64 ? 594 HOH L O 1 594 . A HETATM 1921 O O . HOH L 3 . ? -6.587 2.627 29.902 1.0 28.98 ? 595 HOH L O 1 595 . A HETATM 1922 O O . HOH L 3 . ? -16.760 24.051 11.329 1.0 36.27 ? 596 HOH L O 1 596 . A HETATM 1923 O O . HOH L 3 . ? -12.393 22.077 7.379 1.0 31.26 ? 597 HOH L O 1 597 . A HETATM 1924 O O . HOH L 3 . ? -8.955 29.417 6.258 1.0 37.9 ? 598 HOH L O 1 598 . A HETATM 1925 O O . HOH L 3 . ? -14.183 16.924 9.314 1.0 35.48 ? 599 HOH L O 1 599 . A HETATM 1926 O O . HOH L 3 . ? 27.127 5.207 30.856 1.0 32.86 ? 600 HOH L O 1 600 . A HETATM 1927 O O . HOH L 3 . ? 25.754 2.670 31.909 1.0 32.43 ? 601 HOH L O 1 601 . A HETATM 1928 O O . HOH L 3 . ? 25.784 1.093 29.058 1.0 25.94 ? 602 HOH L O 1 602 . A HETATM 1929 O O . HOH L 3 . ? -6.072 30.820 27.105 1.0 37.74 ? 603 HOH L O 1 603 . A HETATM 1930 O O . HOH L 3 . ? 2.854 15.207 41.791 1.0 35.32 ? 604 HOH L O 1 604 . A HETATM 1931 O O . HOH L 3 . ? -12.138 4.058 18.901 1.0 38.9 ? 605 HOH L O 1 605 . A HETATM 1932 O O . HOH L 3 . ? -7.238 3.195 20.664 1.0 41.9 ? 606 HOH L O 1 606 . A HETATM 1933 O O . HOH L 3 . ? -4.292 3.485 18.168 1.0 38.24 ? 607 HOH L O 1 607 . A HETATM 1934 O O . HOH L 3 . ? -11.416 14.852 22.645 1.0 34.55 ? 608 HOH L O 1 608 . A HETATM 1935 O O . HOH L 3 . ? -8.012 6.105 30.739 1.0 31.49 ? 609 HOH L O 1 609 . A HETATM 1936 O O . HOH L 3 . ? 17.577 -4.294 33.319 1.0 34.4 ? 610 HOH L O 1 610 . A HETATM 1937 O O . HOH L 3 . ? 20.586 2.040 38.414 1.0 37.41 ? 611 HOH L O 1 611 . A HETATM 1938 O O . HOH L 3 . ? 15.174 -4.372 36.589 1.0 36.35 ? 612 HOH L O 1 612 . A HETATM 1939 O O . HOH L 3 . ? 14.311 9.153 5.674 1.0 32.84 ? 613 HOH L O 1 613 . A HETATM 1940 O O . HOH L 3 . ? -19.109 19.473 18.927 1.0 38.3 ? 614 HOH L O 1 614 . A HETATM 1941 O O . HOH L 3 . ? -18.140 19.669 16.048 1.0 36.52 ? 615 HOH L O 1 615 . A HETATM 1942 O O . HOH L 3 . ? -12.820 19.520 25.264 1.0 35.94 ? 616 HOH L O 1 616 . A HETATM 1943 O O . HOH L 3 . ? 32.222 14.748 35.408 1.0 40.73 ? 617 HOH L O 1 617 . A HETATM 1944 O O . HOH L 3 . ? -0.382 33.539 26.293 1.0 37.96 ? 618 HOH L O 1 618 . A HETATM 1945 O O . HOH L 3 . ? 16.833 1.635 37.493 1.0 36.38 ? 619 HOH L O 1 619 . A HETATM 1946 O O . HOH L 3 . ? 23.181 8.316 36.725 1.0 39.98 ? 620 HOH L O 1 620 . A HETATM 1947 O O . HOH L 3 . ? 5.975 36.028 20.160 1.0 38.59 ? 621 HOH L O 1 621 . A HETATM 1948 O O . HOH L 3 . ? 1.555 34.142 11.975 1.0 35.07 ? 622 HOH L O 1 622 . A HETATM 1949 O O . HOH L 3 . ? 10.346 20.925 -3.550 1.0 41.25 ? 623 HOH L O 1 623 . A HETATM 1950 O O . HOH L 3 . ? -0.726 34.510 13.466 1.0 30.2 ? 624 HOH L O 1 624 . A HETATM 1951 O O . HOH L 3 . ? 0.595 33.924 9.357 1.0 32.95 ? 625 HOH L O 1 625 . A HETATM 1952 O O . HOH L 3 . ? -1.243 32.378 12.414 1.0 31.26 ? 626 HOH L O 1 626 . A HETATM 1953 O O . HOH L 3 . ? 2.479 35.559 15.481 1.0 31.42 ? 627 HOH L O 1 627 . A HETATM 1954 O O . HOH L 3 . ? 4.445 31.122 21.694 1.0 29.58 ? 628 HOH L O 1 628 . A HETATM 1955 O O . HOH L 3 . ? 2.877 34.956 18.499 1.0 37.71 ? 629 HOH L O 1 629 . A HETATM 1956 O O . HOH L 3 . ? 1.392 33.097 18.132 1.0 30.81 ? 630 HOH L O 1 630 . A HETATM 1957 O O . HOH L 3 . ? 22.353 7.876 14.481 1.0 29.32 ? 631 HOH L O 1 631 . A HETATM 1958 O O . HOH L 3 . ? 26.437 2.340 26.977 1.0 26.65 ? 632 HOH L O 1 632 . A HETATM 1959 O O . HOH L 3 . ? 27.467 6.839 28.797 1.0 29.45 ? 633 HOH L O 1 633 . A HETATM 1960 O O . HOH L 3 . ? 27.226 4.836 27.754 1.0 35.18 ? 634 HOH L O 1 634 . A HETATM 1961 O O . HOH L 3 . ? 30.801 7.528 25.245 1.0 32.97 ? 635 HOH L O 1 635 . A HETATM 1962 O O . HOH L 3 . ? 28.071 8.374 18.768 1.0 26.66 ? 636 HOH L O 1 636 . A HETATM 1963 O O . HOH L 3 . ? 17.971 13.531 4.554 1.0 32.55 ? 637 HOH L O 1 637 . A HETATM 1964 O O . HOH L 3 . ? 14.711 12.048 0.824 1.0 30.76 ? 638 HOH L O 1 638 . A HETATM 1965 O O . HOH L 3 . ? 16.241 10.956 -0.708 1.0 30.06 ? 639 HOH L O 1 639 . A HETATM 1966 O O . HOH L 3 . ? 18.829 11.396 0.475 1.0 34.11 ? 640 HOH L O 1 640 . A HETATM 1967 O O . HOH L 3 . ? 15.177 15.140 0.012 0.5 30.64 ? 641 HOH L O 1 641 . A HETATM 1968 O O . HOH L 3 . ? 18.073 16.563 5.291 1.0 29.64 ? 642 HOH L O 1 642 . A HETATM 1969 O O . HOH L 3 . ? 19.720 20.726 5.402 1.0 35.07 ? 643 HOH L O 1 643 . A HETATM 1970 O O . HOH L 3 . ? 18.137 22.335 7.165 1.0 30.45 ? 644 HOH L O 1 644 . A HETATM 1971 O O . HOH L 3 . ? 19.414 23.680 9.321 1.0 32.72 ? 645 HOH L O 1 645 . A HETATM 1972 O O . HOH L 3 . ? 5.745 -4.824 26.488 1.0 32.67 ? 646 HOH L O 1 646 . A HETATM 1973 O O . HOH L 3 . ? 9.062 -0.267 30.288 1.0 31.47 ? 647 HOH L O 1 647 . A HETATM 1974 O O . HOH L 3 . ? 12.121 -2.058 31.453 1.0 32.09 ? 648 HOH L O 1 648 . A HETATM 1975 O O . HOH L 3 . ? 10.108 -2.805 35.607 1.0 33.83 ? 649 HOH L O 1 649 . A HETATM 1976 O O . HOH L 3 . ? 5.397 4.230 38.405 1.0 30.62 ? 650 HOH L O 1 650 . A HETATM 1977 O O . HOH L 3 . ? 10.014 3.588 38.542 1.0 34.48 ? 651 HOH L O 1 651 . A HETATM 1978 O O . HOH L 3 . ? 5.786 0.715 36.185 1.0 34.96 ? 652 HOH L O 1 652 . A HETATM 1979 O O . HOH L 3 . ? -1.111 1.139 32.135 0.5 25.33 ? 653 HOH L O 1 653 . A HETATM 1980 O O . HOH L 3 . ? 1.549 4.104 22.827 1.0 25.37 ? 654 HOH L O 1 654 . A HETATM 1981 O O . HOH L 3 . ? -4.687 0.751 24.045 1.0 27.97 ? 655 HOH L O 1 655 . A HETATM 1982 O O . HOH L 3 . ? -2.225 0.011 20.776 1.0 32.29 ? 656 HOH L O 1 656 . A HETATM 1983 O O . HOH L 3 . ? 0.969 1.115 19.571 1.0 26.83 ? 657 HOH L O 1 657 . A HETATM 1984 O O . HOH L 3 . ? 2.719 -1.065 19.087 1.0 33.09 ? 658 HOH L O 1 658 . A HETATM 1985 O O . HOH L 3 . ? 0.262 -3.415 19.310 1.0 33.63 ? 659 HOH L O 1 659 . A HETATM 1986 O O . HOH L 3 . ? 1.765 1.515 11.691 1.0 31.68 ? 660 HOH L O 1 660 . A HETATM 1987 O O . HOH L 3 . ? 6.611 0.315 10.446 1.0 24.9 ? 661 HOH L O 1 661 . A HETATM 1988 O O . HOH L 3 . ? 6.263 2.781 9.593 1.0 31.6 ? 662 HOH L O 1 662 . A HETATM 1989 O O . HOH L 3 . ? 3.052 8.231 8.252 1.0 34.59 ? 663 HOH L O 1 663 . A HETATM 1990 O O . HOH L 3 . ? -0.449 6.921 11.485 1.0 31.26 ? 664 HOH L O 1 664 . A HETATM 1991 O O . HOH L 3 . ? 0.470 10.628 10.125 1.0 36.29 ? 665 HOH L O 1 665 . A HETATM 1992 O O . HOH L 3 . ? -0.059 10.276 3.313 1.0 31.45 ? 666 HOH L O 1 666 . A HETATM 1993 O O . HOH L 3 . ? 2.595 7.463 5.404 1.0 33.03 ? 667 HOH L O 1 667 . A HETATM 1994 O O . HOH L 3 . ? 4.373 8.428 4.131 1.0 34.71 ? 668 HOH L O 1 668 . A HETATM 1995 O O . HOH L 3 . ? 4.924 14.317 -0.681 1.0 28.58 ? 669 HOH L O 1 669 . A HETATM 1996 O O . HOH L 3 . ? 8.143 14.674 0.718 1.0 25.82 ? 670 HOH L O 1 670 . A HETATM 1997 O O . HOH L 3 . ? 11.147 9.553 6.496 1.0 30.6 ? 671 HOH L O 1 671 . A HETATM 1998 O O . HOH L 3 . ? 6.438 8.822 1.695 1.0 32.99 ? 672 HOH L O 1 672 . A HETATM 1999 O O . HOH L 3 . ? 5.543 5.211 4.295 1.0 33.23 ? 673 HOH L O 1 673 . A HETATM 2000 O O . HOH L 3 . ? 8.529 7.911 2.721 1.0 32.25 ? 674 HOH L O 1 674 . A HETATM 2001 O O . HOH L 3 . ? 2.707 13.606 -2.324 1.0 31.7 ? 675 HOH L O 1 675 . A HETATM 2002 O O . HOH L 3 . ? 8.430 9.981 -0.009 1.0 33.61 ? 676 HOH L O 1 676 . A HETATM 2003 O O . HOH L 3 . ? 5.368 11.149 -0.533 1.0 29.68 ? 677 HOH L O 1 677 . A HETATM 2004 O O . HOH L 3 . ? 12.357 8.370 0.746 1.0 33.19 ? 678 HOH L O 1 678 . A HETATM 2005 O O . HOH L 3 . ? 13.816 8.410 3.359 1.0 28.64 ? 679 HOH L O 1 679 . A HETATM 2006 O O . HOH L 3 . ? 4.773 6.682 8.293 1.0 31.54 ? 680 HOH L O 1 680 . A HETATM 2007 O O . HOH L 3 . ? 6.446 8.320 6.316 1.0 35.12 ? 681 HOH L O 1 681 . A HETATM 2008 O O . HOH L 3 . ? 8.620 9.722 5.802 1.0 33.79 ? 682 HOH L O 1 682 . A HETATM 2009 O O . HOH L 3 . ? 5.993 1.240 5.587 1.0 35.94 ? 683 HOH L O 1 683 . A HETATM 2010 O O . HOH L 3 . ? 7.252 -0.356 3.784 1.0 36.57 ? 684 HOH L O 1 684 . A HETATM 2011 O O . HOH L 3 . ? 8.431 1.414 5.905 1.0 34.7 ? 685 HOH L O 1 685 . A HETATM 2012 O O . HOH L 3 . ? 9.655 2.023 8.299 1.0 32.0 ? 686 HOH L O 1 686 . A HETATM 2013 O O . HOH L 3 . ? 7.368 5.099 8.859 1.0 32.06 ? 687 HOH L O 1 687 . A HETATM 2014 O O . HOH L 3 . ? 16.086 27.016 20.756 1.0 31.33 ? 688 HOH L O 1 688 . A HETATM 2015 O O . HOH L 3 . ? 17.909 28.383 20.656 1.0 33.86 ? 689 HOH L O 1 689 . A HETATM 2016 O O . HOH L 3 . ? 20.179 25.957 25.150 1.0 32.15 ? 690 HOH L O 1 690 . A HETATM 2017 O O . HOH L 3 . ? 21.885 28.005 24.695 1.0 28.33 ? 691 HOH L O 1 691 . A HETATM 2018 O O . HOH L 3 . ? 22.296 25.779 22.392 1.0 31.57 ? 692 HOH L O 1 692 . A HETATM 2019 O O . HOH L 3 . ? 22.768 24.669 29.305 1.0 36.55 ? 693 HOH L O 1 693 . A HETATM 2020 O O . HOH L 3 . ? 21.644 26.780 29.458 1.0 35.94 ? 694 HOH L O 1 694 . A HETATM 2021 O O . HOH L 3 . ? 19.683 26.917 30.482 1.0 34.88 ? 695 HOH L O 1 695 . A HETATM 2022 O O . HOH L 3 . ? -1.222 12.546 -0.456 1.0 28.98 ? 696 HOH L O 1 696 . A #