data_4j4m-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 . ARG A 1 3 ? 19.628 51.047 28.493 1.0 44.72 ? 4 ARG A N 1 3 . A ATOM 2 C CA . ARG A 1 3 ? 18.662 52.128 28.141 1.0 44.73 ? 4 ARG A CA 1 3 . A ATOM 3 C C . ARG A 1 3 ? 17.518 51.567 27.293 1.0 44.05 ? 4 ARG A C 1 3 . A ATOM 4 O O . ARG A 1 3 ? 16.360 51.964 27.453 1.0 44.51 ? 4 ARG A O 1 3 . A ATOM 5 C CB . ARG A 1 3 ? 19.397 53.231 27.374 1.0 46.36 ? 4 ARG A CB 1 3 . A ATOM 6 C CG . ARG A 1 3 ? 18.608 54.514 27.117 1.0 48.24 ? 4 ARG A CG 1 3 . A ATOM 7 C CD . ARG A 1 3 ? 19.456 55.462 26.266 1.0 49.98 ? 4 ARG A CD 1 3 . A ATOM 8 N NE . ARG A 1 3 ? 18.859 56.776 26.030 1.0 51.66 ? 4 ARG A NE 1 3 . A ATOM 9 C CZ . ARG A 1 3 ? 17.651 56.978 25.511 1.0 52.32 ? 4 ARG A CZ 1 3 . A ATOM 10 N NH1 . ARG A 1 3 ? 17.207 58.214 25.328 1.0 53.15 ? 4 ARG A NH1 1 3 . A ATOM 11 N NH2 . ARG A 1 3 ? 16.880 55.948 25.191 1.0 53.3 ? 4 ARG A NH2 1 3 . A ATOM 12 N N . PHE A 1 4 ? 17.842 50.632 26.401 1.0 41.59 ? 5 PHE A N 1 4 . A ATOM 13 C CA . PHE A 1 4 ? 16.831 50.044 25.526 1.0 39.17 ? 5 PHE A CA 1 4 . A ATOM 14 C C . PHE A 1 4 ? 16.642 48.548 25.733 1.0 37.63 ? 5 PHE A C 1 4 . A ATOM 15 O O . PHE A 1 4 ? 17.534 47.854 26.218 1.0 36.31 ? 5 PHE A O 1 4 . A ATOM 16 C CB . PHE A 1 4 ? 17.186 50.277 24.055 1.0 38.73 ? 5 PHE A CB 1 4 . A ATOM 17 C CG . PHE A 1 4 ? 17.551 51.692 23.733 1.0 37.15 ? 5 PHE A CG 1 4 . A ATOM 18 C CD1 . PHE A 1 4 ? 18.857 52.137 23.891 1.0 36.86 ? 5 PHE A CD1 1 4 . A ATOM 19 C CD2 . PHE A 1 4 ? 16.588 52.583 23.272 1.0 38.23 ? 5 PHE A CD2 1 4 . A ATOM 20 C CE1 . PHE A 1 4 ? 19.200 53.447 23.595 1.0 37.69 ? 5 PHE A CE1 1 4 . A ATOM 21 C CE2 . PHE A 1 4 ? 16.921 53.900 22.972 1.0 38.06 ? 5 PHE A CE2 1 4 . A ATOM 22 C CZ . PHE A 1 4 ? 18.231 54.332 23.135 1.0 38.05 ? 5 PHE A CZ 1 4 . A ATOM 23 N N . PRO A 1 5 ? 15.464 48.032 25.356 1.0 37.12 ? 6 PRO A N 1 5 . A ATOM 24 C CA . PRO A 1 5 ? 15.176 46.605 25.501 1.0 36.74 ? 6 PRO A CA 1 5 . A ATOM 25 C C . PRO A 1 5 ? 15.954 45.831 24.444 1.0 37.26 ? 6 PRO A C 1 5 . A ATOM 26 O O . PRO A 1 5 ? 16.333 46.385 23.410 1.0 37.27 ? 6 PRO A O 1 5 . A ATOM 27 C CB . PRO A 1 5 ? 13.671 46.540 25.277 1.0 36.57 ? 6 PRO A CB 1 5 . A ATOM 28 C CG . PRO A 1 5 ? 13.452 47.626 24.262 1.0 36.65 ? 6 PRO A CG 1 5 . A ATOM 29 C CD . PRO A 1 5 ? 14.298 48.751 24.812 1.0 36.28 ? 6 PRO A CD 1 5 . A ATOM 30 N N . GLN A 1 6 ? 16.196 44.554 24.704 1.0 36.62 ? 7 GLN A N 1 6 . A ATOM 31 C CA . GLN A 1 6 ? 16.933 43.724 23.767 1.0 35.54 ? 7 GLN A CA 1 6 . A ATOM 32 C C . GLN A 1 6 ? 16.255 43.677 22.403 1.0 33.75 ? 7 GLN A C 1 6 . A ATOM 33 O O . GLN A 1 6 ? 15.048 43.454 22.300 1.0 33.93 ? 7 GLN A O 1 6 . A ATOM 34 C CB . GLN A 1 6 ? 17.072 42.302 24.315 1.0 36.58 ? 7 GLN A CB 1 6 . A ATOM 35 C CG . GLN A 1 6 ? 17.873 41.368 23.416 1.0 39.64 ? 7 GLN A CG 1 6 . A ATOM 36 C CD . GLN A 1 6 ? 19.330 41.781 23.298 1.0 42.28 ? 7 GLN A CD 1 6 . A ATOM 37 O OE1 . GLN A 1 6 ? 20.060 41.805 24.293 1.0 43.99 ? 7 GLN A OE1 1 6 . A ATOM 38 N NE2 . GLN A 1 6 ? 19.762 42.110 22.080 1.0 39.95 ? 7 GLN A NE2 1 6 . A ATOM 39 N N . ARG A 1 7 ? 17.044 43.902 21.359 1.0 31.93 ? 8 ARG A N 1 7 . A ATOM 40 C CA . ARG A 1 7 ? 16.545 43.864 19.992 1.0 29.25 ? 8 ARG A CA 1 7 . A ATOM 41 C C . ARG A 1 7 ? 17.568 43.160 19.107 1.0 27.88 ? 8 ARG A C 1 7 . A ATOM 42 O O . ARG A 1 7 ? 18.742 43.058 19.466 1.0 26.77 ? 8 ARG A O 1 7 . A ATOM 43 C CB . ARG A 1 7 ? 16.276 45.281 19.477 1.0 29.94 ? 8 ARG A CB 1 7 . A ATOM 44 C CG . ARG A 1 7 ? 15.009 45.917 20.050 1.0 30.56 ? 8 ARG A CG 1 7 . A ATOM 45 C CD . ARG A 1 7 ? 13.785 45.105 19.671 1.0 30.72 ? 8 ARG A CD 1 7 . A ATOM 46 N NE . ARG A 1 7 ? 12.534 45.718 20.115 1.0 33.82 ? 8 ARG A NE 1 7 . A ATOM 47 C CZ . ARG A 1 7 ? 12.127 45.768 21.381 1.0 34.27 ? 8 ARG A CZ 1 7 . A ATOM 48 N NH1 . ARG A 1 7 ? 10.972 46.348 21.682 1.0 34.27 ? 8 ARG A NH1 1 7 . A ATOM 49 N NH2 . ARG A 1 7 ? 12.865 45.233 22.346 1.0 32.41 ? 8 ARG A NH2 1 7 . A ATOM 50 N N . TYR A 1 8 ? 17.114 42.671 17.956 1.0 26.91 ? 9 TYR A N 1 8 . A ATOM 51 C CA . TYR A 1 8 ? 17.986 41.960 17.031 1.0 26.7 ? 9 TYR A CA 1 8 . A ATOM 52 C C . TYR A 1 8 ? 17.763 42.385 15.588 1.0 25.71 ? 9 TYR A C 1 8 . A ATOM 53 O O . TYR A 1 8 ? 16.635 42.615 15.166 1.0 26.62 ? 9 TYR A O 1 8 . A ATOM 54 C CB . TYR A 1 8 ? 17.741 40.452 17.099 1.0 28.59 ? 9 TYR A CB 1 8 . A ATOM 55 C CG . TYR A 1 8 ? 17.773 39.862 18.482 1.0 31.34 ? 9 TYR A CG 1 8 . A ATOM 56 C CD1 . TYR A 1 8 ? 16.647 39.900 19.306 1.0 32.83 ? 9 TYR A CD1 1 8 . A ATOM 57 C CD2 . TYR A 1 8 ? 18.927 39.247 18.965 1.0 32.3 ? 9 TYR A CD2 1 8 . A ATOM 58 C CE1 . TYR A 1 8 ? 16.672 39.333 20.580 1.0 34.16 ? 9 TYR A CE1 1 8 . A ATOM 59 C CE2 . TYR A 1 8 ? 18.963 38.683 20.233 1.0 34.38 ? 9 TYR A CE2 1 8 . A ATOM 60 C CZ . TYR A 1 8 ? 17.835 38.727 21.035 1.0 35.29 ? 9 TYR A CZ 1 8 . A ATOM 61 O OH . TYR A 1 8 ? 17.876 38.155 22.286 1.0 36.49 ? 9 TYR A OH 1 8 . A ATOM 62 N N . VAL A 1 9 ? 18.847 42.493 14.834 1.0 23.86 ? 10 VAL A N 1 9 . A ATOM 63 C CA . VAL A 1 9 ? 18.730 42.819 13.425 1.0 21.78 ? 10 VAL A CA 1 9 . A ATOM 64 C C . VAL A 1 9 ? 19.433 41.699 12.676 1.0 21.04 ? 10 VAL A C 1 9 . A ATOM 65 O O . VAL A 1 9 ? 20.663 41.577 12.698 1.0 19.85 ? 10 VAL A O 1 9 . A ATOM 66 C CB . VAL A 1 9 ? 19.353 44.186 13.083 1.0 22.32 ? 10 VAL A CB 1 9 . A ATOM 67 C CG1 . VAL A 1 9 ? 19.362 44.385 11.574 1.0 22.22 ? 10 VAL A CG1 1 9 . A ATOM 68 C CG2 . VAL A 1 9 ? 18.528 45.300 13.734 1.0 20.22 ? 10 VAL A CG2 1 9 . A ATOM 69 N N . MET A 1 10 ? 18.615 40.856 12.059 1.0 19.93 ? 11 MET A N 1 10 . A ATOM 70 C CA . MET A 1 10 ? 19.069 39.712 11.283 1.0 19.96 ? 11 MET A CA 1 10 . A ATOM 71 C C . MET A 1 10 ? 19.221 40.257 9.870 1.0 18.0 ? 11 MET A C 1 10 . A ATOM 72 O O . MET A 1 10 ? 18.277 40.261 9.078 1.0 17.03 ? 11 MET A O 1 10 . A ATOM 73 C CB . MET A 1 10 ? 18.004 38.613 11.369 1.0 21.51 ? 11 MET A CB 1 10 . A ATOM 74 C CG . MET A 1 10 ? 17.684 38.236 12.823 1.0 25.98 ? 11 MET A CG 1 10 . A ATOM 75 S SD . MET A 1 10 ? 16.070 37.415 13.078 1.0 39.48 ? 11 MET A SD 1 10 . A ATOM 76 C CE . MET A 1 10 ? 15.095 38.747 13.799 1.0 28.66 ? 11 MET A CE 1 10 . A ATOM 77 N N . LEU A 1 11 ? 20.430 40.734 9.592 1.0 16.62 ? 12 LEU A N 1 11 . A ATOM 78 C CA . LEU A 1 11 ? 20.798 41.376 8.330 1.0 15.77 ? 12 LEU A CA 1 11 . A ATOM 79 C C . LEU A 1 11 ? 21.208 40.501 7.149 1.0 16.24 ? 12 LEU A C 1 11 . A ATOM 80 O O . LEU A 1 11 ? 21.935 39.514 7.295 1.0 17.28 ? 12 LEU A O 1 11 . A ATOM 81 C CB . LEU A 1 11 ? 21.939 42.370 8.608 1.0 15.58 ? 12 LEU A CB 1 11 . A ATOM 82 C CG . LEU A 1 11 ? 22.437 43.277 7.473 1.0 17.9 ? 12 LEU A CG 1 11 . A ATOM 83 C CD1 . LEU A 1 11 ? 21.394 44.351 7.172 1.0 16.29 ? 12 LEU A CD1 1 11 . A ATOM 84 C CD2 . LEU A 1 11 ? 23.752 43.930 7.894 1.0 18.21 ? 12 LEU A CD2 1 11 . A ATOM 85 N N . ALA A 1 12 ? 20.743 40.888 5.968 1.0 15.35 ? 13 ALA A N 1 12 . A ATOM 86 C CA . ALA A 1 12 ? 21.107 40.207 4.735 1.0 15.49 ? 13 ALA A CA 1 12 . A ATOM 87 C C . ALA A 1 12 ? 21.904 41.229 3.927 1.0 16.15 ? 13 ALA A C 1 12 . A ATOM 88 O O . ALA A 1 12 ? 21.579 42.416 3.927 1.0 16.06 ? 13 ALA A O 1 12 . A ATOM 89 C CB . ALA A 1 12 ? 19.859 39.792 3.952 1.0 17.16 ? 13 ALA A CB 1 12 . A ATOM 90 N N . ILE A 1 13 ? 22.967 40.782 3.274 1.0 14.97 ? 14 ILE A N 1 13 . A ATOM 91 C CA . ILE A 1 13 ? 23.741 41.691 2.443 1.0 15.18 ? 14 ILE A CA 1 13 . A ATOM 92 C C . ILE A 1 13 ? 23.837 41.077 1.058 1.0 14.97 ? 14 ILE A C 1 13 . A ATOM 93 O O . ILE A 1 13 ? 23.975 39.855 0.912 1.0 14.93 ? 14 ILE A O 1 13 . A ATOM 94 C CB . ILE A 1 13 ? 25.163 41.934 3.011 1.0 16.08 ? 14 ILE A CB 1 13 . A ATOM 95 C CG1 . ILE A 1 13 ? 25.067 42.767 4.295 1.0 16.94 ? 14 ILE A CG1 1 13 . A ATOM 96 C CG2 . ILE A 1 13 ? 26.020 42.656 1.979 1.0 16.93 ? 14 ILE A CG2 1 13 . A ATOM 97 C CD1 . ILE A 1 13 ? 26.399 43.086 4.943 1.0 19.82 ? 14 ILE A CD1 1 13 . A ATOM 98 N N . VAL A 1 14 ? 23.718 41.924 0.044 1.0 14.81 ? 15 VAL A N 1 14 . A ATOM 99 C CA . VAL A 1 14 ? 23.828 41.483 -1.341 1.0 16.09 ? 15 VAL A CA 1 14 . A ATOM 100 C C . VAL A 1 14 ? 24.945 42.308 -1.965 1.0 15.8 ? 15 VAL A C 1 14 . A ATOM 101 O O . VAL A 1 14 ? 24.900 43.535 -1.930 1.0 16.35 ? 15 VAL A O 1 14 . A ATOM 102 C CB . VAL A 1 14 ? 22.516 41.735 -2.141 1.0 16.21 ? 15 VAL A CB 1 14 . A ATOM 103 C CG1 . VAL A 1 14 ? 22.735 41.415 -3.622 1.0 17.39 ? 15 VAL A CG1 1 14 . A ATOM 104 C CG2 . VAL A 1 14 ? 21.379 40.866 -1.583 1.0 16.07 ? 15 VAL A CG2 1 14 . A ATOM 105 N N . ALA A 1 15 ? 25.965 41.645 -2.498 1.0 14.87 ? 16 ALA A N 1 15 . A ATOM 106 C CA . ALA A 1 15 ? 27.063 42.354 -3.154 1.0 16.21 ? 16 ALA A CA 1 15 . A ATOM 107 C C . ALA A 1 15 ? 26.752 42.276 -4.649 1.0 17.43 ? 16 ALA A C 1 15 . A ATOM 108 O O . ALA A 1 15 ? 26.604 41.179 -5.195 1.0 18.19 ? 16 ALA A O 1 15 . A ATOM 109 C CB . ALA A 1 15 ? 28.400 41.672 -2.841 1.0 16.31 ? 16 ALA A CB 1 15 . A ATOM 110 N N . ASP A 1 16 ? 26.647 43.423 -5.318 1.0 15.79 ? 17 ASP A N 1 16 . A ATOM 111 C CA . ASP A 1 16 ? 26.296 43.395 -6.732 1.0 17.95 ? 17 ASP A CA 1 16 . A ATOM 112 C C . ASP A 1 16 ? 27.429 42.990 -7.660 1.0 19.04 ? 17 ASP A C 1 16 . A ATOM 113 O O . ASP A 1 16 ? 28.577 42.794 -7.240 1.0 18.6 ? 17 ASP A O 1 16 . A ATOM 114 C CB . ASP A 1 16 ? 25.684 44.735 -7.182 1.0 17.78 ? 17 ASP A CB 1 16 . A ATOM 115 C CG . ASP A 1 16 ? 26.700 45.852 -7.297 1.0 19.86 ? 17 ASP A CG 1 16 . A ATOM 116 O OD1 . ASP A 1 16 ? 26.304 46.934 -7.791 1.0 19.45 ? 17 ASP A OD1 1 16 . A ATOM 117 O OD2 . ASP A 1 16 ? 27.878 45.664 -6.904 1.0 18.3 ? 17 ASP A OD2 1 16 . A ATOM 118 N N . HIS A 1 17 ? 27.090 42.840 -8.932 1.0 18.31 ? 18 HIS A N 1 17 . A ATOM 119 C CA . HIS A 1 17 ? 28.073 42.432 -9.908 1.0 17.89 ? 18 HIS A CA 1 17 . A ATOM 120 C C . HIS A 1 17 ? 29.244 43.403 -9.990 1.0 18.89 ? 18 HIS A C 1 17 . A ATOM 121 O O . HIS A 1 17 ? 30.379 42.991 -10.234 1.0 18.81 ? 18 HIS A O 1 17 . A ATOM 122 C CB . HIS A 1 17 ? 27.420 42.262 -11.268 1.0 19.96 ? 18 HIS A CB 1 17 . A ATOM 123 C CG . HIS A 1 17 ? 28.361 41.747 -12.301 1.0 23.89 ? 18 HIS A CG 1 17 . A ATOM 124 N ND1 . HIS A 1 17 ? 29.062 42.582 -13.142 1.0 27.61 ? 18 HIS A ND1 1 17 . A ATOM 125 C CD2 . HIS A 1 17 ? 28.798 40.493 -12.559 1.0 26.6 ? 18 HIS A CD2 1 17 . A ATOM 126 C CE1 . HIS A 1 17 ? 29.895 41.864 -13.873 1.0 27.14 ? 18 HIS A CE1 1 17 . A ATOM 127 N NE2 . HIS A 1 17 ? 29.754 40.594 -13.538 1.0 25.01 ? 18 HIS A NE2 1 17 . A ATOM 128 N N . GLY A 1 18 ? 28.968 44.690 -9.786 1.0 18.97 ? 19 GLY A N 1 18 . A ATOM 129 C CA . GLY A 1 18 ? 30.026 45.688 -9.813 1.0 18.24 ? 19 GLY A CA 1 18 . A ATOM 130 C C . GLY A 1 18 ? 31.085 45.363 -8.769 1.0 20.15 ? 19 GLY A C 1 18 . A ATOM 131 O O . GLY A 1 18 ? 32.283 45.570 -8.988 1.0 18.75 ? 19 GLY A O 1 18 . A ATOM 132 N N . MET A 1 19 ? 30.643 44.861 -7.619 1.0 18.21 ? 20 MET A N 1 19 . A ATOM 133 C CA . MET A 1 19 ? 31.563 44.491 -6.552 1.0 19.26 ? 20 MET A CA 1 19 . A ATOM 134 C C . MET A 1 19 ? 32.455 43.339 -7.012 1.0 20.17 ? 20 MET A C 1 19 . A ATOM 135 O O . MET A 1 19 ? 33.661 43.353 -6.792 1.0 20.86 ? 20 MET A O 1 19 . A ATOM 136 C CB . MET A 1 19 ? 30.788 44.067 -5.296 1.0 19.98 ? 20 MET A CB 1 19 . A ATOM 137 C CG . MET A 1 19 ? 30.155 45.224 -4.527 1.0 17.94 ? 20 MET A CG 1 19 . A ATOM 138 S SD . MET A 1 19 ? 31.381 46.316 -3.774 1.0 19.23 ? 20 MET A SD 1 19 . A ATOM 139 C CE . MET A 1 19 ? 32.043 45.241 -2.462 1.0 21.89 ? 20 MET A CE 1 19 . A ATOM 140 N N . VAL A 1 20 ? 31.856 42.342 -7.652 1.0 20.68 ? 21 VAL A N 1 20 . A ATOM 141 C CA . VAL A 1 20 ? 32.620 41.193 -8.132 1.0 21.58 ? 21 VAL A CA 1 20 . A ATOM 142 C C . VAL A 1 20 ? 33.706 41.645 -9.111 1.0 22.83 ? 21 VAL A C 1 20 . A ATOM 143 O O . VAL A 1 20 ? 34.842 41.166 -9.053 1.0 21.67 ? 21 VAL A O 1 20 . A ATOM 144 C CB . VAL A 1 20 ? 31.703 40.164 -8.818 1.0 19.81 ? 21 VAL A CB 1 20 . A ATOM 145 C CG1 . VAL A 1 20 ? 32.521 38.965 -9.278 1.0 19.95 ? 21 VAL A CG1 1 20 . A ATOM 146 C CG2 . VAL A 1 20 ? 30.626 39.704 -7.840 1.0 20.25 ? 21 VAL A CG2 1 20 . A ATOM 147 N N . THR A 1 21 ? 33.350 42.572 -9.996 1.0 21.46 ? 22 THR A N 1 21 . A ATOM 148 C CA . THR A 1 21 ? 34.288 43.121 -10.972 1.0 22.18 ? 22 THR A CA 1 21 . A ATOM 149 C C . THR A 1 21 ? 35.391 43.898 -10.248 1.0 23.03 ? 22 THR A C 1 21 . A ATOM 150 O O . THR A 1 21 ? 36.580 43.723 -10.523 1.0 21.93 ? 22 THR A O 1 21 . A ATOM 151 C CB . THR A 1 21 ? 33.559 44.080 -11.943 1.0 22.42 ? 22 THR A CB 1 21 . A ATOM 152 O OG1 . THR A 1 21 ? 32.579 43.346 -12.683 1.0 22.66 ? 22 THR A OG1 1 21 . A ATOM 153 C CG2 . THR A 1 21 ? 34.542 44.730 -12.914 1.0 24.23 ? 22 THR A CG2 1 21 . A ATOM 154 N N . LYS A 1 22 ? 34.991 44.749 -9.309 1.0 21.77 ? 23 LYS A N 1 22 . A ATOM 155 C CA . LYS A 1 22 ? 35.948 45.563 -8.565 1.0 22.57 ? 23 LYS A CA 1 22 . A ATOM 156 C C . LYS A 1 22 ? 37.000 44.733 -7.839 1.0 22.86 ? 23 LYS A C 1 22 . A ATOM 157 O O . LYS A 1 22 ? 38.179 45.099 -7.805 1.0 22.65 ? 23 LYS A O 1 22 . A ATOM 158 C CB . LYS A 1 22 ? 35.212 46.442 -7.555 1.0 22.3 ? 23 LYS A CB 1 22 . A ATOM 159 C CG . LYS A 1 22 ? 36.111 47.354 -6.737 1.0 21.86 ? 23 LYS A CG 1 22 . A ATOM 160 C CD . LYS A 1 22 ? 35.276 48.307 -5.891 1.0 21.82 ? 23 LYS A CD 1 22 . A ATOM 161 C CE . LYS A 1 22 ? 36.142 49.170 -4.987 1.0 20.73 ? 23 LYS A CE 1 22 . A ATOM 162 N NZ . LYS A 1 22 ? 35.318 50.056 -4.116 1.0 18.58 ? 23 LYS A NZ 1 22 . A ATOM 163 N N . TYR A 1 23 ? 36.574 43.621 -7.248 1.0 22.77 ? 24 TYR A N 1 23 . A ATOM 164 C CA . TYR A 1 23 ? 37.501 42.763 -6.524 1.0 23.35 ? 24 TYR A CA 1 23 . A ATOM 165 C C . TYR A 1 23 ? 38.005 41.585 -7.355 1.0 25.08 ? 24 TYR A C 1 23 . A ATOM 166 O O . TYR A 1 23 ? 38.335 40.519 -6.832 1.0 24.75 ? 24 TYR A O 1 23 . A ATOM 167 C CB . TYR A 1 23 ? 36.854 42.326 -5.210 1.0 22.55 ? 24 TYR A CB 1 23 . A ATOM 168 C CG . TYR A 1 23 ? 36.709 43.519 -4.293 1.0 20.8 ? 24 TYR A CG 1 23 . A ATOM 169 C CD1 . TYR A 1 23 ? 37.816 44.039 -3.626 1.0 20.59 ? 24 TYR A CD1 1 23 . A ATOM 170 C CD2 . TYR A 1 23 ? 35.498 44.213 -4.201 1.0 20.39 ? 24 TYR A CD2 1 23 . A ATOM 171 C CE1 . TYR A 1 23 ? 37.731 45.224 -2.899 1.0 21.53 ? 24 TYR A CE1 1 23 . A ATOM 172 C CE2 . TYR A 1 23 ? 35.404 45.408 -3.476 1.0 19.87 ? 24 TYR A CE2 1 23 . A ATOM 173 C CZ . TYR A 1 23 ? 36.524 45.908 -2.832 1.0 21.7 ? 24 TYR A CZ 1 23 . A ATOM 174 O OH . TYR A 1 23 ? 36.460 47.104 -2.149 1.0 22.5 ? 24 TYR A OH 1 23 . A ATOM 175 N N . SER A 1 24 ? 38.063 41.810 -8.666 1.0 26.88 ? 25 SER A N 1 24 . A ATOM 176 C CA . SER A 1 24 ? 38.567 40.839 -9.634 1.0 29.36 ? 25 SER A CA 1 24 . A ATOM 177 C C . SER A 1 24 ? 38.002 39.422 -9.586 1.0 29.89 ? 25 SER A C 1 24 . A ATOM 178 O O . SER A 1 24 ? 38.759 38.452 -9.684 1.0 29.5 ? 25 SER A O 1 24 . A ATOM 179 C CB . SER A 1 24 ? 40.093 40.772 -9.517 1.0 31.75 ? 25 SER A CB 1 24 . A ATOM 180 O OG . SER A 1 24 ? 40.666 42.072 -9.609 1.0 35.55 ? 25 SER A OG 1 24 . A ATOM 181 N N . GLY A 1 25 ? 36.682 39.300 -9.456 1.0 27.77 ? 26 GLY A N 1 25 . A ATOM 182 C CA . GLY A 1 25 ? 36.041 37.994 -9.419 1.0 25.73 ? 26 GLY A CA 1 25 . A ATOM 183 C C . GLY A 1 25 ? 36.311 37.146 -8.188 1.0 26.03 ? 26 GLY A C 1 25 . A ATOM 184 O O . GLY A 1 25 ? 35.923 35.978 -8.137 1.0 26.52 ? 26 GLY A O 1 25 . A ATOM 185 N N . ASN A 1 26 ? 36.953 37.725 -7.180 1.0 24.61 ? 27 ASN A N 1 26 . A ATOM 186 C CA . ASN A 1 26 ? 37.285 36.979 -5.970 1.0 24.44 ? 27 ASN A CA 1 26 . A ATOM 187 C C . ASN A 1 26 ? 36.174 36.988 -4.921 1.0 25.11 ? 27 ASN A C 1 26 . A ATOM 188 O O . ASN A 1 26 ? 36.200 37.808 -4.007 1.0 24.53 ? 27 ASN A O 1 26 . A ATOM 189 C CB . ASN A 1 26 ? 38.558 37.560 -5.349 1.0 25.38 ? 27 ASN A CB 1 26 . A ATOM 190 C CG . ASN A 1 26 ? 39.183 36.634 -4.326 1.0 27.6 ? 27 ASN A CG 1 26 . A ATOM 191 O OD1 . ASN A 1 26 ? 38.490 35.875 -3.651 1.0 26.93 ? 27 ASN A OD1 1 26 . A ATOM 192 N ND2 . ASN A 1 26 ? 40.503 36.703 -4.198 1.0 27.48 ? 27 ASN A ND2 1 26 . A ATOM 193 N N . SER A 1 27 ? 35.214 36.071 -5.033 1.0 24.91 ? 28 SER A N 1 27 . A ATOM 194 C CA . SER A 1 27 ? 34.115 36.014 -4.067 1.0 26.11 ? 28 SER A CA 1 27 . A ATOM 195 C C . SER A 1 27 ? 34.610 35.782 -2.644 1.0 26.47 ? 28 SER A C 1 27 . A ATOM 196 O O . SER A 1 27 ? 33.992 36.233 -1.676 1.0 27.07 ? 28 SER A O 1 27 . A ATOM 197 C CB . SER A 1 27 ? 33.127 34.911 -4.446 1.0 26.45 ? 28 SER A CB 1 27 . A ATOM 198 O OG . SER A 1 27 ? 32.485 35.212 -5.671 1.0 28.7 ? 28 SER A OG 1 27 . A ATOM 199 N N . SER A 1 28 ? 35.719 35.066 -2.505 1.0 26.18 ? 29 SER A N 1 28 . A ATOM 200 C CA . SER A 1 28 ? 36.260 34.815 -1.177 1.0 27.17 ? 29 SER A CA 1 28 . A ATOM 201 C C . SER A 1 28 ? 36.702 36.129 -0.532 1.0 26.02 ? 29 SER A C 1 28 . A ATOM 202 O O . SER A 1 28 ? 36.499 36.341 0.665 1.0 27.39 ? 29 SER A O 1 28 . A ATOM 203 C CB . SER A 1 28 ? 37.440 33.846 -1.263 1.0 30.06 ? 29 SER A CB 1 28 . A ATOM 204 O OG . SER A 1 28 ? 37.042 32.646 -1.913 1.0 35.98 ? 29 SER A OG 1 28 . A ATOM 205 N N . ALA A 1 29 ? 37.302 37.012 -1.325 1.0 24.36 ? 30 ALA A N 1 29 . A ATOM 206 C CA . ALA A 1 29 ? 37.767 38.295 -0.809 1.0 22.62 ? 30 ALA A CA 1 29 . A ATOM 207 C C . ALA A 1 29 ? 36.567 39.164 -0.444 1.0 22.64 ? 30 ALA A C 1 29 . A ATOM 208 O O . ALA A 1 29 ? 36.582 39.850 0.571 1.0 22.08 ? 30 ALA A O 1 29 . A ATOM 209 C CB . ALA A 1 29 ? 38.638 39.004 -1.841 1.0 25.3 ? 30 ALA A CB 1 29 . A ATOM 210 N N . ILE A 1 30 ? 35.527 39.125 -1.272 1.0 22.21 ? 31 ILE A N 1 30 . A ATOM 211 C CA . ILE A 1 30 ? 34.322 39.903 -0.997 1.0 21.59 ? 31 ILE A CA 1 30 . A ATOM 212 C C . ILE A 1 30 ? 33.685 39.417 0.302 1.0 21.71 ? 31 ILE A C 1 30 . A ATOM 213 O O . ILE A 1 30 ? 33.231 40.220 1.117 1.0 20.88 ? 31 ILE A O 1 30 . A ATOM 214 C CB . ILE A 1 30 ? 33.291 39.779 -2.142 1.0 21.93 ? 31 ILE A CB 1 30 . A ATOM 215 C CG1 . ILE A 1 30 ? 33.797 40.520 -3.382 1.0 21.96 ? 31 ILE A CG1 1 30 . A ATOM 216 C CG2 . ILE A 1 30 ? 31.935 40.345 -1.698 1.0 21.48 ? 31 ILE A CG2 1 30 . A ATOM 217 C CD1 . ILE A 1 30 ? 32.844 40.450 -4.566 1.0 23.67 ? 31 ILE A CD1 1 30 . A ATOM 218 N N . THR A 1 31 ? 33.656 38.101 0.497 1.0 20.56 ? 32 THR A N 1 31 . A ATOM 219 C CA . THR A 1 31 ? 33.072 37.530 1.710 1.0 21.74 ? 32 THR A CA 1 31 . A ATOM 220 C C . THR A 1 31 ? 33.844 38.006 2.944 1.0 21.88 ? 32 THR A C 1 31 . A ATOM 221 O O . THR A 1 31 ? 33.249 38.381 3.957 1.0 21.7 ? 32 THR A O 1 31 . A ATOM 222 C CB . THR A 1 31 ? 33.080 35.982 1.652 1.0 23.48 ? 32 THR A CB 1 31 . A ATOM 223 O OG1 . THR A 1 31 ? 32.302 35.550 0.530 1.0 24.97 ? 32 THR A OG1 1 31 . A ATOM 224 C CG2 . THR A 1 31 ? 32.484 35.385 2.926 1.0 23.84 ? 32 THR A CG2 1 31 . A ATOM 225 N N . THR A 1 32 ? 35.171 37.995 2.855 1.0 22.06 ? 33 THR A N 1 32 . A ATOM 226 C CA . THR A 1 32 ? 36.013 38.440 3.963 1.0 22.43 ? 33 THR A CA 1 32 . A ATOM 227 C C . THR A 1 32 ? 35.766 39.923 4.247 1.0 22.1 ? 33 THR A C 1 32 . A ATOM 228 O O . THR A 1 32 ? 35.754 40.365 5.399 1.0 22.17 ? 33 THR A O 1 32 . A ATOM 229 C CB . THR A 1 32 ? 37.505 38.237 3.625 1.0 25.88 ? 33 THR A CB 1 32 . A ATOM 230 O OG1 . THR A 1 32 ? 37.797 36.833 3.591 1.0 31.6 ? 33 THR A OG1 1 32 . A ATOM 231 C CG2 . THR A 1 32 ? 38.387 38.919 4.650 1.0 26.7 ? 33 THR A CG2 1 32 . A ATOM 232 N N . ARG A 1 33 ? 35.564 40.689 3.182 1.0 21.47 ? 34 ARG A N 1 33 . A ATOM 233 C CA . ARG A 1 33 ? 35.320 42.118 3.310 1.0 19.24 ? 34 ARG A CA 1 33 . A ATOM 234 C C . ARG A 1 33 ? 34.007 42.402 4.035 1.0 20.57 ? 34 ARG A C 1 33 . A ATOM 235 O O . ARG A 1 33 ? 33.951 43.236 4.939 1.0 19.86 ? 34 ARG A O 1 33 . A ATOM 236 C CB . ARG A 1 33 ? 35.286 42.764 1.923 1.0 19.71 ? 34 ARG A CB 1 33 . A ATOM 237 C CG . ARG A 1 33 ? 35.287 44.276 1.961 1.0 22.13 ? 34 ARG A CG 1 33 . A ATOM 238 C CD . ARG A 1 33 ? 35.197 44.871 0.559 1.0 22.02 ? 34 ARG A CD 1 33 . A ATOM 239 N NE . ARG A 1 33 ? 35.146 46.324 0.625 1.0 22.41 ? 34 ARG A NE 1 33 . A ATOM 240 C CZ . ARG A 1 33 ? 36.203 47.098 0.833 1.0 23.7 ? 34 ARG A CZ 1 33 . A ATOM 241 N NH1 . ARG A 1 33 ? 37.404 46.555 0.984 1.0 21.14 ? 34 ARG A NH1 1 33 . A ATOM 242 N NH2 . ARG A 1 33 ? 36.055 48.412 0.912 1.0 21.83 ? 34 ARG A NH2 1 33 . A ATOM 243 N N . VAL A 1 34 ? 32.949 41.710 3.631 1.0 18.77 ? 35 VAL A N 1 34 . A ATOM 244 C CA . VAL A 1 34 ? 31.643 41.904 4.253 1.0 19.11 ? 35 VAL A CA 1 34 . A ATOM 245 C C . VAL A 1 34 ? 31.659 41.475 5.719 1.0 20.2 ? 35 VAL A C 1 34 . A ATOM 246 O O . VAL A 1 34 ? 31.043 42.113 6.570 1.0 18.57 ? 35 VAL A O 1 34 . A ATOM 247 C CB . VAL A 1 34 ? 30.559 41.120 3.489 1.0 18.85 ? 35 VAL A CB 1 34 . A ATOM 248 C CG1 . VAL A 1 34 ? 29.237 41.151 4.254 1.0 18.03 ? 35 VAL A CG1 1 34 . A ATOM 249 C CG2 . VAL A 1 34 ? 30.392 41.722 2.099 1.0 18.31 ? 35 VAL A CG2 1 34 . A ATOM 250 N N . HIS A 1 35 ? 32.360 40.387 6.016 1.0 19.94 ? 36 HIS A N 1 35 . A ATOM 251 C CA . HIS A 1 35 ? 32.434 39.922 7.398 1.0 22.55 ? 36 HIS A CA 1 35 . A ATOM 252 C C . HIS A 1 35 ? 33.040 40.999 8.287 1.0 21.17 ? 36 HIS A C 1 35 . A ATOM 253 O O . HIS A 1 35 ? 32.506 41.286 9.351 1.0 20.5 ? 36 HIS A O 1 35 . A ATOM 254 C CB . HIS A 1 35 ? 33.241 38.626 7.486 1.0 24.94 ? 36 HIS A CB 1 35 . A ATOM 255 C CG . HIS A 1 35 ? 32.487 37.423 7.013 1.0 29.47 ? 36 HIS A CG 1 35 . A ATOM 256 N ND1 . HIS A 1 35 ? 33.028 36.156 7.007 1.0 33.12 ? 36 HIS A ND1 1 35 . A ATOM 257 C CD2 . HIS A 1 35 ? 31.224 37.294 6.539 1.0 30.62 ? 36 HIS A CD2 1 35 . A ATOM 258 C CE1 . HIS A 1 35 ? 32.132 35.297 6.552 1.0 33.48 ? 36 HIS A CE1 1 35 . A ATOM 259 N NE2 . HIS A 1 35 ? 31.028 35.963 6.262 1.0 33.47 ? 36 HIS A NE2 1 35 . A ATOM 260 N N . GLN A 1 36 ? 34.140 41.604 7.846 1.0 20.23 ? 37 GLN A N 1 36 . A ATOM 261 C CA . GLN A 1 36 ? 34.760 42.668 8.626 1.0 19.33 ? 37 GLN A CA 1 36 . A ATOM 262 C C . GLN A 1 36 ? 33.780 43.827 8.762 1.0 19.15 ? 37 GLN A C 1 36 . A ATOM 263 O O . GLN A 1 36 ? 33.621 44.400 9.832 1.0 19.22 ? 37 GLN A O 1 36 . A ATOM 264 C CB . GLN A 1 36 ? 36.044 43.185 7.959 1.0 19.6 ? 37 GLN A CB 1 36 . A ATOM 265 C CG . GLN A 1 36 ? 36.587 44.429 8.672 1.0 19.18 ? 37 GLN A CG 1 36 . A ATOM 266 C CD . GLN A 1 36 ? 37.785 45.068 7.995 1.0 18.62 ? 37 GLN A CD 1 36 . A ATOM 267 O OE1 . GLN A 1 36 ? 38.208 46.167 8.379 1.0 19.09 ? 37 GLN A OE1 1 36 . A ATOM 268 N NE2 . GLN A 1 36 ? 38.347 44.388 7.005 1.0 17.19 ? 37 GLN A NE2 1 36 . A ATOM 269 N N . MET A 1 37 ? 33.127 44.178 7.661 1.0 19.01 ? 38 MET A N 1 37 . A ATOM 270 C CA . MET A 1 37 ? 32.170 45.276 7.673 1.0 18.43 ? 38 MET A CA 1 37 . A ATOM 271 C C . MET A 1 37 ? 31.110 45.022 8.739 1.0 19.64 ? 38 MET A C 1 37 . A ATOM 272 O O . MET A 1 37 ? 30.820 45.894 9.553 1.0 18.78 ? 38 MET A O 1 37 . A ATOM 273 C CB . MET A 1 37 ? 31.511 45.407 6.296 1.0 19.7 ? 38 MET A CB 1 37 . A ATOM 274 C CG . MET A 1 37 ? 30.819 46.743 6.040 1.0 20.02 ? 38 MET A CG 1 37 . A ATOM 275 S SD . MET A 1 37 ? 30.114 46.795 4.359 1.0 22.35 ? 38 MET A SD 1 37 . A ATOM 276 C CE . MET A 1 37 ? 31.575 46.579 3.411 1.0 20.41 ? 38 MET A CE 1 37 . A ATOM 277 N N . VAL A 1 38 ? 30.547 43.816 8.744 1.0 20.24 ? 39 VAL A N 1 38 . A ATOM 278 C CA . VAL A 1 38 ? 29.515 43.457 9.717 1.0 22.83 ? 39 VAL A CA 1 38 . A ATOM 279 C C . VAL A 1 38 ? 30.032 43.485 11.152 1.0 21.66 ? 39 VAL A C 1 38 . A ATOM 280 O O . VAL A 1 38 ? 29.314 43.881 12.074 1.0 21.66 ? 39 VAL A O 1 38 . A ATOM 281 C CB . VAL A 1 38 ? 28.925 42.056 9.421 1.0 22.65 ? 39 VAL A CB 1 38 . A ATOM 282 C CG1 . VAL A 1 38 ? 28.011 41.626 10.559 1.0 24.25 ? 39 VAL A CG1 1 38 . A ATOM 283 C CG2 . VAL A 1 38 ? 28.149 42.093 8.124 1.0 22.94 ? 39 VAL A CG2 1 38 . A ATOM 284 N N . SER A 1 39 ? 31.273 43.062 11.350 1.0 22.54 ? 40 SER A N 1 39 . A ATOM 285 C CA . SER A 1 39 ? 31.842 43.089 12.692 1.0 24.47 ? 40 SER A CA 1 39 . A ATOM 286 C C . SER A 1 39 ? 31.843 44.528 13.198 1.0 21.84 ? 40 SER A C 1 39 . A ATOM 287 O O . SER A 1 39 ? 31.533 44.782 14.357 1.0 21.68 ? 40 SER A O 1 39 . A ATOM 288 C CB . SER A 1 39 ? 33.262 42.525 12.693 1.0 26.53 ? 40 SER A CB 1 39 . A ATOM 289 O OG . SER A 1 39 ? 33.239 41.112 12.520 1.0 34.71 ? 40 SER A OG 1 39 . A ATOM 290 N N . HIS A 1 40 ? 32.185 45.470 12.325 1.0 20.26 ? 41 HIS A N 1 40 . A ATOM 291 C CA . HIS A 1 40 ? 32.197 46.879 12.712 1.0 19.75 ? 41 HIS A CA 1 40 . A ATOM 292 C C . HIS A 1 40 ? 30.772 47.367 13.004 1.0 19.69 ? 41 HIS A C 1 40 . A ATOM 293 O O . HIS A 1 40 ? 30.524 48.031 14.020 1.0 21.47 ? 41 HIS A O 1 40 . A ATOM 294 C CB . HIS A 1 40 ? 32.828 47.734 11.608 1.0 20.15 ? 41 HIS A CB 1 40 . A ATOM 295 C CG . HIS A 1 40 ? 34.322 47.640 11.549 1.0 20.15 ? 41 HIS A CG 1 40 . A ATOM 296 N ND1 . HIS A 1 40 ? 35.121 47.828 12.655 1.0 20.55 ? 41 HIS A ND1 1 40 . A ATOM 297 C CD2 . HIS A 1 40 ? 35.166 47.424 10.511 1.0 22.17 ? 41 HIS A CD2 1 40 . A ATOM 298 C CE1 . HIS A 1 40 ? 36.392 47.736 12.302 1.0 21.59 ? 41 HIS A CE1 1 40 . A ATOM 299 N NE2 . HIS A 1 40 ? 36.447 47.492 11.005 1.0 20.85 ? 41 HIS A NE2 1 40 . A ATOM 300 N N . VAL A 1 41 ? 29.839 47.029 12.117 1.0 19.49 ? 42 VAL A N 1 41 . A ATOM 301 C CA . VAL A 1 41 ? 28.443 47.419 12.297 1.0 20.38 ? 42 VAL A CA 1 41 . A ATOM 302 C C . VAL A 1 41 ? 27.926 46.871 13.625 1.0 21.11 ? 42 VAL A C 1 41 . A ATOM 303 O O . VAL A 1 41 ? 27.280 47.576 14.393 1.0 20.4 ? 42 VAL A O 1 41 . A ATOM 304 C CB . VAL A 1 41 ? 27.536 46.855 11.172 1.0 21.43 ? 42 VAL A CB 1 41 . A ATOM 305 C CG1 . VAL A 1 41 ? 26.072 47.147 11.491 1.0 21.33 ? 42 VAL A CG1 1 41 . A ATOM 306 C CG2 . VAL A 1 41 ? 27.916 47.468 9.821 1.0 19.55 ? 42 VAL A CG2 1 41 . A ATOM 307 N N . THR A 1 42 ? 28.221 45.601 13.883 1.0 21.71 ? 43 THR A N 1 42 . A ATOM 308 C CA . THR A 1 42 ? 27.773 44.943 15.099 1.0 22.27 ? 43 THR A CA 1 42 . A ATOM 309 C C . THR A 1 42 ? 28.287 45.649 16.345 1.0 23.68 ? 43 THR A C 1 42 . A ATOM 310 O O . THR A 1 42 ? 27.561 45.806 17.326 1.0 23.37 ? 43 THR A O 1 42 . A ATOM 311 C CB . THR A 1 42 ? 28.242 43.483 15.128 1.0 23.72 ? 43 THR A CB 1 42 . A ATOM 312 O OG1 . THR A 1 42 ? 27.608 42.753 14.065 1.0 23.88 ? 43 THR A OG1 1 42 . A ATOM 313 C CG2 . THR A 1 42 ? 27.910 42.846 16.469 1.0 22.69 ? 43 THR A CG2 1 42 . A ATOM 314 N N . GLU A 1 43 ? 29.544 46.071 16.304 1.0 23.97 ? 44 GLU A N 1 43 . A ATOM 315 C CA . GLU A 1 43 ? 30.137 46.757 17.439 1.0 26.32 ? 44 GLU A CA 1 43 . A ATOM 316 C C . GLU A 1 43 ? 29.465 48.104 17.665 1.0 25.63 ? 44 GLU A C 1 43 . A ATOM 317 O O . GLU A 1 43 ? 29.232 48.511 18.804 1.0 26.87 ? 44 GLU A O 1 43 . A ATOM 318 C CB . GLU A 1 43 ? 31.637 46.957 17.213 1.0 29.68 ? 44 GLU A CB 1 43 . A ATOM 319 C CG . GLU A 1 43 ? 32.320 47.733 18.325 1.0 37.33 ? 44 GLU A CG 1 43 . A ATOM 320 C CD . GLU A 1 43 ? 33.782 48.034 18.034 1.0 41.65 ? 44 GLU A CD 1 43 . A ATOM 321 O OE1 . GLU A 1 43 ? 34.407 48.746 18.851 1.0 45.38 ? 44 GLU A OE1 1 43 . A ATOM 322 O OE2 . GLU A 1 43 ? 34.306 47.561 17.000 1.0 43.8 ? 44 GLU A OE2 1 43 . A ATOM 323 N N . MET A 1 44 ? 29.147 48.801 16.580 1.0 24.37 ? 45 MET A N 1 44 . A ATOM 324 C CA . MET A 1 44 ? 28.510 50.103 16.704 1.0 24.14 ? 45 MET A CA 1 44 . A ATOM 325 C C . MET A 1 44 ? 27.075 50.047 17.218 1.0 24.29 ? 45 MET A C 1 44 . A ATOM 326 O O . MET A 1 44 ? 26.580 51.025 17.768 1.0 25.34 ? 45 MET A O 1 44 . A ATOM 327 C CB . MET A 1 44 ? 28.566 50.858 15.367 1.0 22.3 ? 45 MET A CB 1 44 . A ATOM 328 C CG . MET A 1 44 ? 29.956 51.400 15.052 1.0 23.01 ? 45 MET A CG 1 44 . A ATOM 329 S SD . MET A 1 44 ? 30.092 52.335 13.508 1.0 26.33 ? 45 MET A SD 1 44 . A ATOM 330 C CE . MET A 1 44 ? 30.680 51.059 12.381 1.0 23.49 ? 45 MET A CE 1 44 . A ATOM 331 N N . TYR A 1 45 ? 26.401 48.915 17.060 1.0 23.46 ? 46 TYR A N 1 45 . A ATOM 332 C CA . TYR A 1 45 ? 25.025 48.825 17.542 1.0 25.26 ? 46 TYR A CA 1 45 . A ATOM 333 C C . TYR A 1 45 ? 24.864 48.272 18.960 1.0 26.5 ? 46 TYR A C 1 45 . A ATOM 334 O O . TYR A 1 45 ? 23.786 48.370 19.541 1.0 26.72 ? 46 TYR A O 1 45 . A ATOM 335 C CB . TYR A 1 45 ? 24.161 48.017 16.563 1.0 23.4 ? 46 TYR A CB 1 45 . A ATOM 336 C CG . TYR A 1 45 ? 23.516 48.887 15.505 1.0 24.67 ? 46 TYR A CG 1 45 . A ATOM 337 C CD1 . TYR A 1 45 ? 24.044 48.972 14.213 1.0 23.4 ? 46 TYR A CD1 1 45 . A ATOM 338 C CD2 . TYR A 1 45 ? 22.423 49.698 15.824 1.0 23.56 ? 46 TYR A CD2 1 45 . A ATOM 339 C CE1 . TYR A 1 45 ? 23.505 49.853 13.268 1.0 23.1 ? 46 TYR A CE1 1 45 . A ATOM 340 C CE2 . TYR A 1 45 ? 21.878 50.585 14.886 1.0 25.13 ? 46 TYR A CE2 1 45 . A ATOM 341 C CZ . TYR A 1 45 ? 22.429 50.660 13.616 1.0 22.72 ? 46 TYR A CZ 1 45 . A ATOM 342 O OH . TYR A 1 45 ? 21.944 51.589 12.725 1.0 24.1 ? 46 TYR A OH 1 45 . A ATOM 343 N N . SER A 1 46 ? 25.929 47.709 19.523 1.0 29.16 ? 47 SER A N 1 46 . A ATOM 344 C CA . SER A 1 46 ? 25.854 47.156 20.879 1.0 33.22 ? 47 SER A CA 1 46 . A ATOM 345 C C . SER A 1 46 ? 25.274 48.131 21.908 1.0 33.52 ? 47 SER A C 1 46 . A ATOM 346 O O . SER A 1 46 ? 24.424 47.751 22.713 1.0 33.89 ? 47 SER A O 1 46 . A ATOM 347 C CB . SER A 1 46 ? 27.234 46.689 21.347 1.0 33.77 ? 47 SER A CB 1 46 . A ATOM 348 O OG . SER A 1 46 ? 27.676 45.580 20.587 1.0 38.64 ? 47 SER A OG 1 46 . A ATOM 349 N N . PRO A 1 47 ? 25.727 49.398 21.899 1.0 34.41 ? 48 PRO A N 1 47 . A ATOM 350 C CA . PRO A 1 47 ? 25.246 50.422 22.837 1.0 34.56 ? 48 PRO A CA 1 47 . A ATOM 351 C C . PRO A 1 47 ? 23.734 50.689 22.823 1.0 34.7 ? 48 PRO A C 1 47 . A ATOM 352 O O . PRO A 1 47 ? 23.193 51.274 23.766 1.0 34.02 ? 48 PRO A O 1 47 . A ATOM 353 C CB . PRO A 1 47 ? 26.051 51.658 22.437 1.0 35.93 ? 48 PRO A CB 1 47 . A ATOM 354 C CG . PRO A 1 47 ? 27.342 51.067 21.960 1.0 34.1 ? 48 PRO A CG 1 47 . A ATOM 355 C CD . PRO A 1 47 ? 26.864 49.911 21.114 1.0 34.76 ? 48 PRO A CD 1 47 . A ATOM 356 N N . LEU A 1 48 ? 23.052 50.273 21.760 1.0 33.26 ? 49 LEU A N 1 48 . A ATOM 357 C CA . LEU A 1 48 ? 21.607 50.478 21.667 1.0 32.5 ? 49 LEU A CA 1 48 . A ATOM 358 C C . LEU A 1 48 ? 20.887 49.177 22.029 1.0 31.79 ? 49 LEU A C 1 48 . A ATOM 359 O O . LEU A 1 48 ? 19.663 49.070 21.924 1.0 31.48 ? 49 LEU A O 1 48 . A ATOM 360 C CB . LEU A 1 48 ? 21.212 50.906 20.247 1.0 31.79 ? 49 LEU A CB 1 48 . A ATOM 361 C CG . LEU A 1 48 ? 21.858 52.153 19.632 1.0 31.91 ? 49 LEU A CG 1 48 . A ATOM 362 C CD1 . LEU A 1 48 ? 21.171 52.461 18.306 1.0 31.84 ? 49 LEU A CD1 1 48 . A ATOM 363 C CD2 . LEU A 1 48 ? 21.731 53.344 20.571 1.0 32.6 ? 49 LEU A CD2 1 48 . A ATOM 364 N N . ASN A 1 49 ? 21.669 48.195 22.457 1.0 31.83 ? 50 ASN A N 1 49 . A ATOM 365 C CA . ASN A 1 49 ? 21.160 46.882 22.831 1.0 32.9 ? 50 ASN A CA 1 49 . A ATOM 366 C C . ASN A 1 49 ? 20.553 46.153 21.637 1.0 31.45 ? 50 ASN A C 1 49 . A ATOM 367 O O . ASN A 1 49 ? 19.584 45.401 21.769 1.0 30.51 ? 50 ASN A O 1 49 . A ATOM 368 C CB . ASN A 1 49 ? 20.129 46.993 23.957 1.0 36.53 ? 50 ASN A CB 1 49 . A ATOM 369 C CG . ASN A 1 49 ? 20.435 46.055 25.107 1.0 41.07 ? 50 ASN A CG 1 49 . A ATOM 370 O OD1 . ASN A 1 49 ? 20.833 44.903 24.895 1.0 41.93 ? 50 ASN A OD1 1 49 . A ATOM 371 N ND2 . ASN A 1 49 ? 20.251 46.537 26.335 1.0 42.89 ? 50 ASN A ND2 1 49 . A ATOM 372 N N . ILE A 1 50 ? 21.129 46.398 20.465 1.0 29.64 ? 51 ILE A N 1 50 . A ATOM 373 C CA . ILE A 1 50 ? 20.695 45.749 19.238 1.0 27.87 ? 51 ILE A CA 1 50 . A ATOM 374 C C . ILE A 1 50 ? 21.805 44.796 18.816 1.0 27.12 ? 51 ILE A C 1 50 . A ATOM 375 O O . ILE A 1 50 ? 22.937 45.221 18.575 1.0 26.17 ? 51 ILE A O 1 50 . A ATOM 376 C CB . ILE A 1 50 ? 20.482 46.756 18.093 1.0 27.46 ? 51 ILE A CB 1 50 . A ATOM 377 C CG1 . ILE A 1 50 ? 19.323 47.694 18.426 1.0 27.97 ? 51 ILE A CG1 1 50 . A ATOM 378 C CG2 . ILE A 1 50 ? 20.216 46.001 16.794 1.0 27.2 ? 51 ILE A CG2 1 50 . A ATOM 379 C CD1 . ILE A 1 50 ? 19.144 48.809 17.420 1.0 28.46 ? 51 ILE A CD1 1 50 . A ATOM 380 N N . ALA A 1 51 ? 21.488 43.510 18.734 1.0 25.64 ? 52 ALA A N 1 51 . A ATOM 381 C CA . ALA A 1 51 ? 22.484 42.530 18.326 1.0 24.37 ? 52 ALA A CA 1 51 . A ATOM 382 C C . ALA A 1 51 ? 22.319 42.292 16.833 1.0 23.38 ? 52 ALA A C 1 51 . A ATOM 383 O O . ALA A 1 51 ? 21.303 41.766 16.396 1.0 22.58 ? 52 ALA A O 1 51 . A ATOM 384 C CB . ALA A 1 51 ? 22.290 41.228 19.093 1.0 24.95 ? 52 ALA A CB 1 51 . A ATOM 385 N N . THR A 1 52 ? 23.311 42.695 16.049 1.0 21.68 ? 53 THR A N 1 52 . A ATOM 386 C CA . THR A 1 52 ? 23.237 42.511 14.607 1.0 22.47 ? 53 THR A CA 1 52 . A ATOM 387 C C . THR A 1 52 ? 24.004 41.266 14.172 1.0 20.56 ? 53 THR A C 1 52 . A ATOM 388 O O . THR A 1 52 ? 25.102 41.012 14.656 1.0 20.51 ? 53 THR A O 1 52 . A ATOM 389 C CB . THR A 1 52 ? 23.818 43.737 13.858 1.0 23.09 ? 53 THR A CB 1 52 . A ATOM 390 O OG1 . THR A 1 52 ? 25.188 43.917 14.229 1.0 25.53 ? 53 THR A OG1 1 52 . A ATOM 391 C CG2 . THR A 1 52 ? 23.051 45.003 14.216 1.0 22.08 ? 53 THR A CG2 1 52 . A ATOM 392 N N . THR A 1 53 ? 23.411 40.482 13.276 1.0 20.19 ? 54 THR A N 1 53 . A ATOM 393 C CA . THR A 1 53 ? 24.061 39.289 12.746 1.0 19.24 ? 54 THR A CA 1 53 . A ATOM 394 C C . THR A 1 53 ? 23.859 39.255 11.234 1.0 19.64 ? 54 THR A C 1 53 . A ATOM 395 O O . THR A 1 53 ? 22.904 39.830 10.718 1.0 19.85 ? 54 THR A O 1 53 . A ATOM 396 C CB . THR A 1 53 ? 23.490 37.969 13.358 1.0 21.14 ? 54 THR A CB 1 53 . A ATOM 397 O OG1 . THR A 1 53 ? 22.067 37.926 13.203 1.0 21.04 ? 54 THR A OG1 1 53 . A ATOM 398 C CG2 . THR A 1 53 ? 23.841 37.867 14.835 1.0 22.09 ? 54 THR A CG2 1 53 . A ATOM 399 N N . LEU A 1 54 ? 24.768 38.597 10.526 1.0 18.34 ? 55 LEU A N 1 54 . A ATOM 400 C CA . LEU A 1 54 ? 24.663 38.482 9.078 1.0 19.44 ? 55 LEU A CA 1 54 . A ATOM 401 C C . LEU A 1 54 ? 23.996 37.146 8.767 1.0 19.43 ? 55 LEU A C 1 54 . A ATOM 402 O O . LEU A 1 54 ? 24.642 36.094 8.744 1.0 19.95 ? 55 LEU A O 1 54 . A ATOM 403 C CB . LEU A 1 54 ? 26.052 38.547 8.433 1.0 19.27 ? 55 LEU A CB 1 54 . A ATOM 404 C CG . LEU A 1 54 ? 26.072 38.452 6.907 1.0 16.72 ? 55 LEU A CG 1 54 . A ATOM 405 C CD1 . LEU A 1 54 ? 25.358 39.657 6.311 1.0 16.79 ? 55 LEU A CD1 1 54 . A ATOM 406 C CD2 . LEU A 1 54 ? 27.511 38.391 6.415 1.0 19.92 ? 55 LEU A CD2 1 54 . A ATOM 407 N N . SER A 1 55 ? 22.689 37.194 8.543 1.0 18.31 ? 56 SER A N 1 55 . A ATOM 408 C CA . SER A 1 55 ? 21.930 35.986 8.255 1.0 17.57 ? 56 SER A CA 1 55 . A ATOM 409 C C . SER A 1 55 ? 22.321 35.369 6.930 1.0 17.44 ? 56 SER A C 1 55 . A ATOM 410 O O . SER A 1 55 ? 22.276 34.154 6.769 1.0 15.69 ? 56 SER A O 1 55 . A ATOM 411 C CB . SER A 1 55 ? 20.433 36.301 8.245 1.0 20.02 ? 56 SER A CB 1 55 . A ATOM 412 O OG . SER A 1 55 ? 20.025 36.772 9.516 1.0 22.12 ? 56 SER A OG 1 55 . A ATOM 413 N N . LEU A 1 56 ? 22.702 36.208 5.972 1.0 16.33 ? 57 LEU A N 1 56 . A ATOM 414 C CA . LEU A 1 56 ? 23.080 35.694 4.667 1.0 16.47 ? 57 LEU A CA 1 56 . A ATOM 415 C C . LEU A 1 56 ? 23.799 36.724 3.833 1.0 16.68 ? 57 LEU A C 1 56 . A ATOM 416 O O . LEU A 1 56 ? 23.627 37.923 4.025 1.0 13.75 ? 57 LEU A O 1 56 . A ATOM 417 C CB . LEU A 1 56 ? 21.834 35.237 3.901 1.0 16.62 ? 57 LEU A CB 1 56 . A ATOM 418 C CG . LEU A 1 56 ? 20.821 36.330 3.526 1.0 16.36 ? 57 LEU A CG 1 56 . A ATOM 419 C CD1 . LEU A 1 56 ? 21.080 36.830 2.104 1.0 17.54 ? 57 LEU A CD1 1 56 . A ATOM 420 C CD2 . LEU A 1 56 ? 19.414 35.767 3.618 1.0 18.0 ? 57 LEU A CD2 1 56 . A ATOM 421 N N . LEU A 1 57 ? 24.619 36.231 2.911 1.0 17.86 ? 58 LEU A N 1 57 . A ATOM 422 C CA . LEU A 1 57 ? 25.341 37.083 1.986 1.0 17.35 ? 58 LEU A CA 1 57 . A ATOM 423 C C . LEU A 1 57 ? 25.106 36.521 0.594 1.0 17.58 ? 58 LEU A C 1 57 . A ATOM 424 O O . LEU A 1 57 ? 25.321 35.331 0.358 1.0 18.36 ? 58 LEU A O 1 57 . A ATOM 425 C CB . LEU A 1 57 ? 26.848 37.073 2.280 1.0 16.85 ? 58 LEU A CB 1 57 . A ATOM 426 C CG . LEU A 1 57 ? 27.729 37.711 1.194 1.0 17.9 ? 58 LEU A CG 1 57 . A ATOM 427 C CD1 . LEU A 1 57 ? 27.390 39.185 1.025 1.0 16.3 ? 58 LEU A CD1 1 57 . A ATOM 428 C CD2 . LEU A 1 57 ? 29.195 37.553 1.584 1.0 20.58 ? 58 LEU A CD2 1 57 . A ATOM 429 N N . ARG A 1 58 ? 24.646 37.375 -0.318 1.0 17.05 ? 59 ARG A N 1 58 . A ATOM 430 C CA . ARG A 1 58 ? 24.421 36.977 -1.702 1.0 16.48 ? 59 ARG A CA 1 58 . A ATOM 431 C C . ARG A 1 58 ? 25.433 37.723 -2.553 1.0 16.59 ? 59 ARG A C 1 58 . A ATOM 432 O O . ARG A 1 58 ? 25.676 38.906 -2.336 1.0 16.37 ? 59 ARG A O 1 58 . A ATOM 433 C CB . ARG A 1 58 ? 23.024 37.374 -2.173 1.0 16.36 ? 59 ARG A CB 1 58 . A ATOM 434 C CG . ARG A 1 58 ? 21.891 36.602 -1.537 1.0 17.88 ? 59 ARG A CG 1 58 . A ATOM 435 C CD . ARG A 1 58 ? 21.715 35.219 -2.147 1.0 19.16 ? 59 ARG A CD 1 58 . A ATOM 436 N NE . ARG A 1 58 ? 20.579 34.544 -1.516 1.0 20.83 ? 59 ARG A NE 1 58 . A ATOM 437 C CZ . ARG A 1 58 ? 20.652 33.850 -0.381 1.0 23.63 ? 59 ARG A CZ 1 58 . A ATOM 438 N NH1 . ARG A 1 58 ? 19.562 33.291 0.129 1.0 20.89 ? 59 ARG A NH1 1 58 . A ATOM 439 N NH2 . ARG A 1 58 ? 21.821 33.675 0.223 1.0 22.13 ? 59 ARG A NH2 1 58 . A ATOM 440 N N . ILE A 1 59 ? 26.028 37.034 -3.515 1.0 15.77 ? 60 ILE A N 1 59 . A ATOM 441 C CA . ILE A 1 59 ? 26.979 37.685 -4.398 1.0 17.0 ? 60 ILE A CA 1 59 . A ATOM 442 C C . ILE A 1 59 ? 26.452 37.476 -5.808 1.0 17.73 ? 60 ILE A C 1 59 . A ATOM 443 O O . ILE A 1 59 ? 26.226 36.349 -6.236 1.0 17.63 ? 60 ILE A O 1 59 . A ATOM 444 C CB . ILE A 1 59 ? 28.398 37.091 -4.247 1.0 17.73 ? 60 ILE A CB 1 59 . A ATOM 445 C CG1 . ILE A 1 59 ? 28.898 37.327 -2.818 1.0 18.83 ? 60 ILE A CG1 1 59 . A ATOM 446 C CG2 . ILE A 1 59 ? 29.338 37.738 -5.251 1.0 18.54 ? 60 ILE A CG2 1 59 . A ATOM 447 C CD1 . ILE A 1 59 ? 30.235 36.661 -2.495 1.0 22.19 ? 60 ILE A CD1 1 59 . A ATOM 448 N N . TRP A 1 60 ? 26.215 38.570 -6.520 1.0 17.91 ? 61 TRP A N 1 60 . A ATOM 449 C CA . TRP A 1 60 ? 25.690 38.463 -7.876 1.0 18.81 ? 61 TRP A CA 1 60 . A ATOM 450 C C . TRP A 1 60 ? 26.839 38.303 -8.865 1.0 21.31 ? 61 TRP A C 1 60 . A ATOM 451 O O . TRP A 1 60 ? 27.159 39.212 -9.629 1.0 21.85 ? 61 TRP A O 1 60 . A ATOM 452 C CB . TRP A 1 60 ? 24.823 39.692 -8.193 1.0 19.25 ? 61 TRP A CB 1 60 . A ATOM 453 C CG . TRP A 1 60 ? 23.500 39.673 -7.450 1.0 18.07 ? 61 TRP A CG 1 60 . A ATOM 454 C CD1 . TRP A 1 60 ? 22.898 38.582 -6.884 1.0 19.57 ? 61 TRP A CD1 1 60 . A ATOM 455 C CD2 . TRP A 1 60 ? 22.579 40.765 -7.283 1.0 19.12 ? 61 TRP A CD2 1 60 . A ATOM 456 N NE1 . TRP A 1 60 ? 21.664 38.921 -6.387 1.0 17.48 ? 61 TRP A NE1 1 60 . A ATOM 457 C CE2 . TRP A 1 60 ? 21.441 40.253 -6.617 1.0 17.63 ? 61 TRP A CE2 1 60 . A ATOM 458 C CE3 . TRP A 1 60 ? 22.606 42.121 -7.633 1.0 17.38 ? 61 TRP A CE3 1 60 . A ATOM 459 C CZ2 . TRP A 1 60 ? 20.334 41.053 -6.296 1.0 18.65 ? 61 TRP A CZ2 1 60 . A ATOM 460 C CZ3 . TRP A 1 60 ? 21.508 42.918 -7.313 1.0 19.1 ? 61 TRP A CZ3 1 60 . A ATOM 461 C CH2 . TRP A 1 60 ? 20.385 42.378 -6.650 1.0 16.93 ? 61 TRP A CH2 1 60 . A ATOM 462 N N . SER A 1 61 ? 27.438 37.116 -8.846 1.0 22.42 ? 62 SER A N 1 61 . A ATOM 463 C CA . SER A 1 61 ? 28.581 36.791 -9.695 1.0 24.05 ? 62 SER A CA 1 61 . A ATOM 464 C C . SER A 1 61 ? 28.270 36.608 -11.181 1.0 25.65 ? 62 SER A C 1 61 . A ATOM 465 O O . SER A 1 61 ? 29.161 36.746 -12.014 1.0 25.68 ? 62 SER A O 1 61 . A ATOM 466 C CB . SER A 1 61 ? 29.277 35.532 -9.169 1.0 21.98 ? 62 SER A CB 1 61 . A ATOM 467 O OG . SER A 1 61 ? 28.468 34.385 -9.366 1.0 22.69 ? 62 SER A OG 1 61 . A ATOM 468 N N . SER A 1 62 ? 27.025 36.288 -11.522 1.0 26.74 ? 63 SER A N 1 62 . A ATOM 469 C CA . SER A 1 62 ? 26.663 36.098 -12.932 1.0 27.58 ? 63 SER A CA 1 62 . A ATOM 470 C C . SER A 1 62 ? 26.252 37.461 -13.487 1.0 27.8 ? 63 SER A C 1 62 . A ATOM 471 O O . SER A 1 62 ? 27.000 38.091 -14.238 1.0 28.39 ? 63 SER A O 1 62 . A ATOM 472 C CB . SER A 1 62 ? 25.516 35.080 -13.054 1.0 28.69 ? 63 SER A CB 1 62 . A ATOM 473 O OG . SER A 1 62 ? 25.256 34.733 -14.412 1.0 33.63 ? 63 SER A OG 1 62 . A ATOM 474 N N . LYS A 1 63 ? 25.060 37.911 -13.108 1.0 27.14 ? 64 LYS A N 1 63 . A ATOM 475 C CA . LYS A 1 63 ? 24.546 39.214 -13.512 1.0 26.4 ? 64 LYS A CA 1 63 . A ATOM 476 C C . LYS A 1 63 ? 23.732 39.731 -12.332 1.0 25.84 ? 64 LYS A C 1 63 . A ATOM 477 O O . LYS A 1 63 ? 23.321 38.952 -11.475 1.0 23.53 ? 64 LYS A O 1 63 . A ATOM 478 C CB . LYS A 1 63 ? 23.610 39.101 -14.721 1.0 29.59 ? 64 LYS A CB 1 63 . A ATOM 479 C CG . LYS A 1 63 ? 24.235 38.553 -16.001 1.0 32.84 ? 64 LYS A CG 1 63 . A ATOM 480 C CD . LYS A 1 63 ? 23.216 38.605 -17.137 1.0 37.09 ? 64 LYS A CD 1 63 . A ATOM 481 C CE . LYS A 1 63 ? 23.767 38.037 -18.441 1.0 38.01 ? 64 LYS A CE 1 63 . A ATOM 482 N NZ . LYS A 1 63 ? 22.778 38.179 -19.561 1.0 40.12 ? 64 LYS A NZ 1 63 . A ATOM 483 N N . ASP A 1 64 ? 23.506 41.039 -12.285 1.0 23.36 ? 65 ASP A N 1 64 . A ATOM 484 C CA . ASP A 1 64 ? 22.695 41.619 -11.223 1.0 23.12 ? 65 ASP A CA 1 64 . A ATOM 485 C C . ASP A 1 64 ? 21.279 41.071 -11.430 1.0 23.32 ? 65 ASP A C 1 64 . A ATOM 486 O O . ASP A 1 64 ? 20.862 40.865 -12.574 1.0 22.12 ? 65 ASP A O 1 64 . A ATOM 487 C CB . ASP A 1 64 ? 22.686 43.143 -11.350 1.0 22.92 ? 65 ASP A CB 1 64 . A ATOM 488 C CG . ASP A 1 64 ? 24.014 43.769 -10.974 1.0 23.56 ? 65 ASP A CG 1 64 . A ATOM 489 O OD1 . ASP A 1 64 ? 24.415 44.755 -11.631 1.0 23.0 ? 65 ASP A OD1 1 64 . A ATOM 490 O OD2 . ASP A 1 64 ? 24.647 43.289 -10.010 1.0 23.19 ? 65 ASP A OD2 1 64 . A ATOM 491 N N . LEU A 1 65 ? 20.545 40.830 -10.345 1.0 21.2 ? 66 LEU A N 1 65 . A ATOM 492 C CA . LEU A 1 65 ? 19.184 40.306 -10.472 1.0 22.16 ? 66 LEU A CA 1 65 . A ATOM 493 C C . LEU A 1 65 ? 18.148 41.430 -10.605 1.0 21.24 ? 66 LEU A C 1 65 . A ATOM 494 O O . LEU A 1 65 ? 16.949 41.186 -10.771 1.0 20.44 ? 66 LEU A O 1 65 . A ATOM 495 C CB . LEU A 1 65 ? 18.857 39.369 -9.298 1.0 23.42 ? 66 LEU A CB 1 65 . A ATOM 496 C CG . LEU A 1 65 ? 19.791 38.149 -9.179 1.0 24.78 ? 66 LEU A CG 1 65 . A ATOM 497 C CD1 . LEU A 1 65 ? 19.253 37.180 -8.138 1.0 23.96 ? 66 LEU A CD1 1 65 . A ATOM 498 C CD2 . LEU A 1 65 ? 19.921 37.442 -10.519 1.0 25.6 ? 66 LEU A CD2 1 65 . A ATOM 499 N N . ILE A 1 66 ? 18.631 42.664 -10.524 1.0 21.47 ? 67 ILE A N 1 66 . A ATOM 500 C CA . ILE A 1 66 ? 17.813 43.860 -10.719 1.0 20.75 ? 67 ILE A CA 1 66 . A ATOM 501 C C . ILE A 1 66 ? 18.744 44.774 -11.497 1.0 22.3 ? 67 ILE A C 1 66 . A ATOM 502 O O . ILE A 1 66 ? 19.935 44.478 -11.631 1.0 21.21 ? 67 ILE A O 1 66 . A ATOM 503 C CB . ILE A 1 66 ? 17.446 44.590 -9.400 1.0 22.09 ? 67 ILE A CB 1 66 . A ATOM 504 C CG1 . ILE A 1 66 ? 18.718 45.097 -8.706 1.0 21.0 ? 67 ILE A CG1 1 66 . A ATOM 505 C CG2 . ILE A 1 66 ? 16.635 43.674 -8.498 1.0 20.84 ? 67 ILE A CG2 1 66 . A ATOM 506 C CD1 . ILE A 1 66 ? 18.454 46.015 -7.509 1.0 22.09 ? 67 ILE A CD1 1 66 . A ATOM 507 N N . THR A 1 67 ? 18.223 45.874 -12.023 1.0 21.83 ? 68 THR A N 1 67 . A ATOM 508 C CA . THR A 1 67 ? 19.086 46.799 -12.731 1.0 21.73 ? 68 THR A CA 1 67 . A ATOM 509 C C . THR A 1 67 ? 19.684 47.721 -11.679 1.0 21.56 ? 68 THR A C 1 67 . A ATOM 510 O O . THR A 1 67 ? 18.967 48.438 -10.980 1.0 22.41 ? 68 THR A O 1 67 . A ATOM 511 C CB . THR A 1 67 ? 18.311 47.628 -13.775 1.0 23.35 ? 68 THR A CB 1 67 . A ATOM 512 O OG1 . THR A 1 67 ? 17.788 46.747 -14.780 1.0 24.89 ? 68 THR A OG1 1 67 . A ATOM 513 C CG2 . THR A 1 67 ? 19.232 48.658 -14.433 1.0 23.15 ? 68 THR A CG2 1 67 . A ATOM 514 N N . VAL A 1 68 ? 21.001 47.671 -11.537 1.0 20.19 ? 69 VAL A N 1 68 . A ATOM 515 C CA . VAL A 1 68 ? 21.673 48.518 -10.569 1.0 21.15 ? 69 VAL A CA 1 68 . A ATOM 516 C C . VAL A 1 68 ? 22.129 49.740 -11.346 1.0 23.38 ? 69 VAL A C 1 68 . A ATOM 517 O O . VAL A 1 68 ? 22.944 49.627 -12.261 1.0 24.36 ? 69 VAL A O 1 68 . A ATOM 518 C CB . VAL A 1 68 ? 22.895 47.801 -9.953 1.0 21.09 ? 69 VAL A CB 1 68 . A ATOM 519 C CG1 . VAL A 1 68 ? 23.552 48.686 -8.923 1.0 20.34 ? 69 VAL A CG1 1 68 . A ATOM 520 C CG2 . VAL A 1 68 ? 22.458 46.480 -9.326 1.0 19.93 ? 69 VAL A CG2 1 68 . A ATOM 521 N N . GLN A 1 69 ? 21.582 50.901 -11.004 1.0 24.56 ? 70 GLN A N 1 69 . A ATOM 522 C CA . GLN A 1 69 ? 21.944 52.132 -11.695 1.0 25.22 ? 70 GLN A CA 1 69 . A ATOM 523 C C . GLN A 1 69 ? 22.408 53.235 -10.754 1.0 23.74 ? 70 GLN A C 1 69 . A ATOM 524 O O . GLN A 1 69 ? 22.139 53.193 -9.549 1.0 22.36 ? 70 GLN A O 1 69 . A ATOM 525 C CB . GLN A 1 69 ? 20.772 52.613 -12.547 1.0 28.52 ? 70 GLN A CB 1 69 . A ATOM 526 C CG . GLN A 1 69 ? 19.431 52.610 -11.844 1.0 29.82 ? 70 GLN A CG 1 69 . A ATOM 527 C CD . GLN A 1 69 ? 18.282 52.717 -12.830 1.0 35.67 ? 70 GLN A CD 1 69 . A ATOM 528 O OE1 . GLN A 1 69 ? 18.159 53.710 -13.555 1.0 37.63 ? 70 GLN A OE1 1 69 . A ATOM 529 N NE2 . GLN A 1 69 ? 17.440 51.690 -12.871 1.0 34.73 ? 70 GLN A NE2 1 69 . A ATOM 530 N N . SER A 1 70 ? 23.107 54.215 -11.325 1.0 22.32 ? 71 SER A N 1 70 . A ATOM 531 C CA . SER A 1 70 ? 23.667 55.336 -10.575 1.0 23.03 ? 71 SER A CA 1 70 . A ATOM 532 C C . SER A 1 70 ? 22.681 56.116 -9.726 1.0 21.87 ? 71 SER A C 1 70 . A ATOM 533 O O . SER A 1 70 ? 23.085 56.794 -8.785 1.0 22.75 ? 71 SER A O 1 70 . A ATOM 534 C CB . SER A 1 70 ? 24.404 56.295 -11.520 1.0 24.73 ? 71 SER A CB 1 70 . A ATOM 535 O OG . SER A 1 70 ? 23.521 56.867 -12.463 1.0 29.11 ? 71 SER A OG 1 70 . A ATOM 536 N N . ASP A 1 71 ? 21.394 56.064 -10.050 1.0 22.96 ? 72 ASP A N 1 71 . A ATOM 537 C CA . ASP A 1 71 ? 20.443 56.771 -9.202 1.0 22.43 ? 72 ASP A CA 1 71 . A ATOM 538 C C . ASP A 1 71 ? 20.083 55.832 -8.063 1.0 21.29 ? 72 ASP A C 1 71 . A ATOM 539 O O . ASP A 1 71 ? 19.462 54.798 -8.285 1.0 20.62 ? 72 ASP A O 1 71 . A ATOM 540 C CB . ASP A 1 71 ? 19.161 57.144 -9.945 1.0 23.67 ? 72 ASP A CB 1 71 . A ATOM 541 C CG . ASP A 1 71 ? 18.228 57.967 -9.077 1.0 23.96 ? 72 ASP A CG 1 71 . A ATOM 542 O OD1 . ASP A 1 71 ? 18.569 59.131 -8.789 1.0 23.81 ? 72 ASP A OD1 1 71 . A ATOM 543 O OD2 . ASP A 1 71 ? 17.170 57.448 -8.660 1.0 24.49 ? 72 ASP A OD2 1 71 . A ATOM 544 N N . SER A 1 72 ? 20.470 56.191 -6.845 1.0 21.69 ? 73 SER A N 1 72 . A ATOM 545 C CA . SER A 1 72 ? 20.190 55.350 -5.690 1.0 22.2 ? 73 SER A CA 1 72 . A ATOM 546 C C . SER A 1 72 ? 18.692 55.137 -5.432 1.0 22.55 ? 73 SER A C 1 72 . A ATOM 547 O O . SER A 1 72 ? 18.260 54.028 -5.123 1.0 19.53 ? 73 SER A O 1 72 . A ATOM 548 C CB . SER A 1 72 ? 20.853 55.942 -4.444 1.0 22.51 ? 73 SER A CB 1 72 . A ATOM 549 O OG . SER A 1 72 ? 20.437 57.281 -4.231 1.0 24.14 ? 73 SER A OG 1 72 . A ATOM 550 N N . SER A 1 73 ? 17.899 56.195 -5.560 1.0 22.74 ? 74 SER A N 1 73 . A ATOM 551 C CA . SER A 1 73 ? 16.466 56.075 -5.319 1.0 23.3 ? 74 SER A CA 1 73 . A ATOM 552 C C . SER A 1 73 ? 15.791 54.988 -6.157 1.0 21.78 ? 74 SER A C 1 73 . A ATOM 553 O O . SER A 1 73 ? 15.046 54.163 -5.626 1.0 20.95 ? 74 SER A O 1 73 . A ATOM 554 C CB . SER A 1 73 ? 15.778 57.421 -5.558 1.0 25.08 ? 74 SER A CB 1 73 . A ATOM 555 O OG . SER A 1 73 ? 14.463 57.404 -5.027 1.0 32.14 ? 74 SER A OG 1 73 . A ATOM 556 N N . VAL A 1 74 ? 16.042 54.982 -7.463 1.0 21.0 ? 75 VAL A N 1 74 . A ATOM 557 C CA . VAL A 1 74 ? 15.446 53.983 -8.340 1.0 21.48 ? 75 VAL A CA 1 74 . A ATOM 558 C C . VAL A 1 74 ? 15.966 52.578 -8.008 1.0 21.84 ? 75 VAL A C 1 74 . A ATOM 559 O O . VAL A 1 74 ? 15.199 51.609 -7.924 1.0 20.06 ? 75 VAL A O 1 74 . A ATOM 560 C CB . VAL A 1 74 ? 15.739 54.309 -9.819 1.0 23.16 ? 75 VAL A CB 1 74 . A ATOM 561 C CG1 . VAL A 1 74 ? 15.309 53.150 -10.707 1.0 23.23 ? 75 VAL A CG1 1 74 . A ATOM 562 C CG2 . VAL A 1 74 ? 14.980 55.584 -10.222 1.0 22.71 ? 75 VAL A CG2 1 74 . A ATOM 563 N N . THR A 1 75 ? 17.272 52.476 -7.807 1.0 20.55 ? 76 THR A N 1 75 . A ATOM 564 C CA . THR A 1 75 ? 17.886 51.196 -7.485 1.0 19.87 ? 76 THR A CA 1 75 . A ATOM 565 C C . THR A 1 75 ? 17.346 50.630 -6.168 1.0 20.4 ? 76 THR A C 1 75 . A ATOM 566 O O . THR A 1 75 ? 17.030 49.441 -6.084 1.0 20.58 ? 76 THR A O 1 75 . A ATOM 567 C CB . THR A 1 75 ? 19.423 51.346 -7.394 1.0 20.69 ? 76 THR A CB 1 75 . A ATOM 568 O OG1 . THR A 1 75 ? 19.929 51.794 -8.660 1.0 20.03 ? 76 THR A OG1 1 75 . A ATOM 569 C CG2 . THR A 1 75 ? 20.081 50.006 -7.035 1.0 23.17 ? 76 THR A CG2 1 75 . A ATOM 570 N N . LEU A 1 76 ? 17.237 51.480 -5.148 1.0 20.22 ? 77 LEU A N 1 76 . A ATOM 571 C CA . LEU A 1 76 ? 16.738 51.045 -3.839 1.0 20.88 ? 77 LEU A CA 1 76 . A ATOM 572 C C . LEU A 1 76 ? 15.309 50.503 -3.971 1.0 21.22 ? 77 LEU A C 1 76 . A ATOM 573 O O . LEU A 1 76 ? 14.955 49.506 -3.351 1.0 18.67 ? 77 LEU A O 1 76 . A ATOM 574 C CB . LEU A 1 76 ? 16.745 52.215 -2.852 1.0 21.56 ? 77 LEU A CB 1 76 . A ATOM 575 C CG . LEU A 1 76 ? 17.109 51.991 -1.378 1.0 26.37 ? 77 LEU A CG 1 76 . A ATOM 576 C CD1 . LEU A 1 76 ? 16.187 52.828 -0.512 1.0 25.05 ? 77 LEU A CD1 1 76 . A ATOM 577 C CD2 . LEU A 1 76 ? 17.029 50.515 -1.004 1.0 25.67 ? 77 LEU A CD2 1 76 . A ATOM 578 N N . GLY A 1 77 ? 14.499 51.171 -4.791 1.0 20.86 ? 78 GLY A N 1 77 . A ATOM 579 C CA . GLY A 1 77 ? 13.126 50.742 -4.994 1.0 19.99 ? 78 GLY A CA 1 77 . A ATOM 580 C C . GLY A 1 77 ? 13.068 49.377 -5.653 1.0 19.79 ? 78 GLY A C 1 77 . A ATOM 581 O O . GLY A 1 77 ? 12.303 48.518 -5.237 1.0 20.27 ? 78 GLY A O 1 77 . A ATOM 582 N N . SER A 1 78 ? 13.876 49.177 -6.688 1.0 19.54 ? 79 SER A N 1 78 . A ATOM 583 C CA . SER A 1 78 ? 13.917 47.894 -7.379 1.0 19.11 ? 79 SER A CA 1 78 . A ATOM 584 C C . SER A 1 78 ? 14.435 46.818 -6.415 1.0 18.9 ? 79 SER A C 1 78 . A ATOM 585 O O . SER A 1 78 ? 13.941 45.688 -6.400 1.0 18.39 ? 79 SER A O 1 78 . A ATOM 586 C CB . SER A 1 78 ? 14.841 47.974 -8.599 1.0 21.34 ? 79 SER A CB 1 78 . A ATOM 587 O OG . SER A 1 78 ? 14.394 48.954 -9.522 1.0 24.9 ? 79 SER A OG 1 78 . A ATOM 588 N N . PHE A 1 79 ? 15.434 47.178 -5.614 1.0 19.55 ? 80 PHE A N 1 79 . A ATOM 589 C CA . PHE A 1 79 ? 16.012 46.240 -4.655 1.0 19.11 ? 80 PHE A CA 1 79 . A ATOM 590 C C . PHE A 1 79 ? 14.953 45.830 -3.623 1.0 19.1 ? 80 PHE A C 1 79 . A ATOM 591 O O . PHE A 1 79 ? 14.837 44.656 -3.274 1.0 17.99 ? 80 PHE A O 1 79 . A ATOM 592 C CB . PHE A 1 79 ? 17.223 46.870 -3.946 1.0 17.58 ? 80 PHE A CB 1 79 . A ATOM 593 C CG . PHE A 1 79 ? 17.963 45.909 -3.047 1.0 18.31 ? 80 PHE A CG 1 79 . A ATOM 594 C CD1 . PHE A 1 79 ? 18.547 44.756 -3.568 1.0 17.53 ? 80 PHE A CD1 1 79 . A ATOM 595 C CD2 . PHE A 1 79 ? 18.053 46.141 -1.679 1.0 18.28 ? 80 PHE A CD2 1 79 . A ATOM 596 C CE1 . PHE A 1 79 ? 19.209 43.845 -2.728 1.0 16.62 ? 80 PHE A CE1 1 79 . A ATOM 597 C CE2 . PHE A 1 79 ? 18.711 45.241 -0.835 1.0 16.18 ? 80 PHE A CE2 1 79 . A ATOM 598 C CZ . PHE A 1 79 ? 19.288 44.092 -1.360 1.0 15.96 ? 80 PHE A CZ 1 79 . A ATOM 599 N N . GLY A 1 80 ? 14.182 46.801 -3.139 1.0 19.92 ? 81 GLY A N 1 80 . A ATOM 600 C CA . GLY A 1 80 ? 13.137 46.497 -2.169 1.0 18.96 ? 81 GLY A CA 1 80 . A ATOM 601 C C . GLY A 1 80 ? 12.076 45.565 -2.742 1.0 20.2 ? 81 GLY A C 1 80 . A ATOM 602 O O . GLY A 1 80 ? 11.550 44.705 -2.036 1.0 18.89 ? 81 GLY A O 1 80 . A ATOM 603 N N . ASP A 1 81 ? 11.751 45.731 -4.024 1.0 20.9 ? 82 ASP A N 1 81 . A ATOM 604 C CA . ASP A 1 81 ? 10.764 44.867 -4.664 1.0 21.63 ? 82 ASP A CA 1 81 . A ATOM 605 C C . ASP A 1 81 ? 11.345 43.453 -4.766 1.0 21.59 ? 82 ASP A C 1 81 . A ATOM 606 O O . ASP A 1 81 ? 10.652 42.462 -4.541 1.0 22.13 ? 82 ASP A O 1 81 . A ATOM 607 C CB . ASP A 1 81 ? 10.432 45.380 -6.071 1.0 23.37 ? 82 ASP A CB 1 81 . A ATOM 608 C CG . ASP A 1 81 ? 9.644 46.680 -6.054 1.0 24.15 ? 82 ASP A CG 1 81 . A ATOM 609 O OD1 . ASP A 1 81 ? 9.604 47.355 -7.102 1.0 27.31 ? 82 ASP A OD1 1 81 . A ATOM 610 O OD2 . ASP A 1 81 ? 9.062 47.022 -5.004 1.0 27.14 ? 82 ASP A OD2 1 81 . A ATOM 611 N N . TRP A 1 82 ? 12.624 43.368 -5.111 1.0 20.83 ? 83 TRP A N 1 82 . A ATOM 612 C CA . TRP A 1 82 ? 13.299 42.079 -5.242 1.0 20.39 ? 83 TRP A CA 1 82 . A ATOM 613 C C . TRP A 1 82 ? 13.436 41.401 -3.878 1.0 19.83 ? 83 TRP A C 1 82 . A ATOM 614 O O . TRP A 1 82 ? 13.289 40.182 -3.749 1.0 21.02 ? 83 TRP A O 1 82 . A ATOM 615 C CB . TRP A 1 82 ? 14.690 42.276 -5.849 1.0 20.18 ? 83 TRP A CB 1 82 . A ATOM 616 C CG . TRP A 1 82 ? 15.414 40.982 -6.081 1.0 19.74 ? 83 TRP A CG 1 82 . A ATOM 617 C CD1 . TRP A 1 82 ? 15.214 40.099 -7.103 1.0 21.24 ? 83 TRP A CD1 1 82 . A ATOM 618 C CD2 . TRP A 1 82 ? 16.421 40.404 -5.242 1.0 19.54 ? 83 TRP A CD2 1 82 . A ATOM 619 N NE1 . TRP A 1 82 ? 16.033 39.002 -6.953 1.0 19.16 ? 83 TRP A NE1 1 82 . A ATOM 620 C CE2 . TRP A 1 82 ? 16.784 39.165 -5.817 1.0 18.99 ? 83 TRP A CE2 1 82 . A ATOM 621 C CE3 . TRP A 1 82 ? 17.049 40.811 -4.058 1.0 20.63 ? 83 TRP A CE3 1 82 . A ATOM 622 C CZ2 . TRP A 1 82 ? 17.751 38.325 -5.245 1.0 19.67 ? 83 TRP A CZ2 1 82 . A ATOM 623 C CZ3 . TRP A 1 82 ? 18.014 39.972 -3.486 1.0 19.26 ? 83 TRP A CZ3 1 82 . A ATOM 624 C CH2 . TRP A 1 82 ? 18.351 38.745 -4.085 1.0 20.29 ? 83 TRP A CH2 1 82 . A ATOM 625 N N . ARG A 1 83 ? 13.731 42.195 -2.858 1.0 18.78 ? 84 ARG A N 1 83 . A ATOM 626 C CA . ARG A 1 83 ? 13.872 41.658 -1.516 1.0 19.17 ? 84 ARG A CA 1 83 . A ATOM 627 C C . ARG A 1 83 ? 12.550 41.044 -1.059 1.0 21.05 ? 84 ARG A C 1 83 . A ATOM 628 O O . ARG A 1 83 ? 12.512 39.924 -0.540 1.0 22.86 ? 84 ARG A O 1 83 . A ATOM 629 C CB . ARG A 1 83 ? 14.284 42.768 -0.554 1.0 20.28 ? 84 ARG A CB 1 83 . A ATOM 630 C CG . ARG A 1 83 ? 14.692 42.260 0.800 1.0 20.32 ? 84 ARG A CG 1 83 . A ATOM 631 C CD . ARG A 1 83 ? 13.831 42.879 1.867 1.0 20.84 ? 84 ARG A CD 1 83 . A ATOM 632 N NE . ARG A 1 83 ? 14.069 42.254 3.155 1.0 21.53 ? 84 ARG A NE 1 83 . A ATOM 633 C CZ . ARG A 1 83 ? 13.323 42.463 4.226 1.0 20.3 ? 84 ARG A CZ 1 83 . A ATOM 634 N NH1 . ARG A 1 83 ? 12.292 43.290 4.151 1.0 20.59 ? 84 ARG A NH1 1 83 . A ATOM 635 N NH2 . ARG A 1 83 ? 13.599 41.833 5.360 1.0 20.92 ? 84 ARG A NH2 1 83 . A ATOM 636 N N . LYS A 1 84 ? 11.460 41.773 -1.269 1.0 21.48 ? 85 LYS A N 1 84 . A ATOM 637 C CA . LYS A 1 84 ? 10.137 41.301 -0.867 1.0 22.8 ? 85 LYS A CA 1 84 . A ATOM 638 C C . LYS A 1 84 ? 9.637 40.088 -1.646 1.0 23.95 ? 85 LYS A C 1 84 . A ATOM 639 O O . LYS A 1 84 ? 9.081 39.153 -1.064 1.0 24.23 ? 85 LYS A O 1 84 . A ATOM 640 C CB . LYS A 1 84 ? 9.110 42.435 -1.003 1.0 23.91 ? 85 LYS A CB 1 84 . A ATOM 641 C CG . LYS A 1 84 ? 7.654 41.994 -0.805 1.0 28.59 ? 85 LYS A CG 1 84 . A ATOM 642 C CD . LYS A 1 84 ? 6.676 43.158 -0.953 1.0 28.95 ? 85 LYS A CD 1 84 . A ATOM 643 C CE . LYS A 1 84 ? 5.230 42.683 -0.797 1.0 31.81 ? 85 LYS A CE 1 84 . A ATOM 644 N NZ . LYS A 1 84 ? 4.267 43.834 -0.805 1.0 33.39 ? 85 LYS A NZ 1 84 . A ATOM 645 N N . VAL A 1 85 ? 9.852 40.090 -2.956 1.0 22.06 ? 86 VAL A N 1 85 . A ATOM 646 C CA . VAL A 1 85 ? 9.359 39.008 -3.796 1.0 23.65 ? 86 VAL A CA 1 85 . A ATOM 647 C C . VAL A 1 85 ? 10.267 37.796 -3.968 1.0 25.0 ? 86 VAL A C 1 85 . A ATOM 648 O O . VAL A 1 85 ? 9.784 36.693 -4.260 1.0 24.45 ? 86 VAL A O 1 85 . A ATOM 649 C CB . VAL A 1 85 ? 8.984 39.551 -5.190 1.0 23.03 ? 86 VAL A CB 1 85 . A ATOM 650 C CG1 . VAL A 1 85 ? 7.977 40.680 -5.041 1.0 24.98 ? 86 VAL A CG1 1 85 . A ATOM 651 C CG2 . VAL A 1 85 ? 10.218 40.058 -5.909 1.0 22.44 ? 86 VAL A CG2 1 85 . A ATOM 652 N N . VAL A 1 86 ? 11.572 37.986 -3.778 1.0 24.5 ? 87 VAL A N 1 86 . A ATOM 653 C CA . VAL A 1 86 ? 12.518 36.889 -3.953 1.0 22.87 ? 87 VAL A CA 1 86 . A ATOM 654 C C . VAL A 1 86 ? 13.340 36.501 -2.728 1.0 22.81 ? 87 VAL A C 1 86 . A ATOM 655 O O . VAL A 1 86 ? 13.253 35.372 -2.247 1.0 23.08 ? 87 VAL A O 1 86 . A ATOM 656 C CB . VAL A 1 86 ? 13.510 37.197 -5.086 1.0 23.63 ? 87 VAL A CB 1 86 . A ATOM 657 C CG1 . VAL A 1 86 ? 14.471 36.014 -5.276 1.0 21.96 ? 87 VAL A CG1 1 86 . A ATOM 658 C CG2 . VAL A 1 86 ? 12.757 37.493 -6.370 1.0 24.65 ? 87 VAL A CG2 1 86 . A ATOM 659 N N . LEU A 1 87 ? 14.143 37.435 -2.227 1.0 21.02 ? 88 LEU A N 1 87 . A ATOM 660 C CA . LEU A 1 87 ? 15.021 37.157 -1.089 1.0 20.01 ? 88 LEU A CA 1 87 . A ATOM 661 C C . LEU A 1 87 ? 14.298 36.658 0.164 1.0 20.48 ? 88 LEU A C 1 87 . A ATOM 662 O O . LEU A 1 87 ? 14.744 35.706 0.807 1.0 18.83 ? 88 LEU A O 1 87 . A ATOM 663 C CB . LEU A 1 87 ? 15.854 38.404 -0.755 1.0 18.82 ? 88 LEU A CB 1 87 . A ATOM 664 C CG . LEU A 1 87 ? 17.039 38.183 0.194 1.0 18.26 ? 88 LEU A CG 1 87 . A ATOM 665 C CD1 . LEU A 1 87 ? 18.004 37.184 -0.440 1.0 19.71 ? 88 LEU A CD1 1 87 . A ATOM 666 C CD2 . LEU A 1 87 ? 17.750 39.509 0.466 1.0 17.62 ? 88 LEU A CD2 1 87 . A ATOM 667 N N . LEU A 1 88 ? 13.184 37.291 0.517 1.0 20.24 ? 89 LEU A N 1 88 . A ATOM 668 C CA . LEU A 1 88 ? 12.434 36.863 1.693 1.0 22.45 ? 89 LEU A CA 1 88 . A ATOM 669 C C . LEU A 1 88 ? 11.906 35.436 1.546 1.0 22.6 ? 89 LEU A C 1 88 . A ATOM 670 O O . LEU A 1 88 ? 11.724 34.732 2.537 1.0 22.8 ? 89 LEU A O 1 88 . A ATOM 671 C CB . LEU A 1 88 ? 11.272 37.823 1.967 1.0 23.07 ? 89 LEU A CB 1 88 . A ATOM 672 C CG . LEU A 1 88 ? 11.583 38.928 2.983 1.0 23.44 ? 89 LEU A CG 1 88 . A ATOM 673 C CD1 . LEU A 1 88 ? 10.440 39.936 3.038 1.0 23.77 ? 89 LEU A CD1 1 88 . A ATOM 674 C CD2 . LEU A 1 88 ? 11.817 38.294 4.353 1.0 21.77 ? 89 LEU A CD2 1 88 . A ATOM 675 N N . SER A 1 89 ? 11.660 35.011 0.312 1.0 23.04 ? 90 SER A N 1 89 . A ATOM 676 C CA . SER A 1 89 ? 11.166 33.662 0.063 1.0 23.95 ? 90 SER A CA 1 89 . A ATOM 677 C C . SER A 1 89 ? 12.269 32.639 0.317 1.0 23.31 ? 90 SER A C 1 89 . A ATOM 678 O O . SER A 1 89 ? 11.994 31.482 0.613 1.0 23.72 ? 90 SER A O 1 89 . A ATOM 679 C CB . SER A 1 89 ? 10.678 33.527 -1.383 1.0 27.04 ? 90 SER A CB 1 89 . A ATOM 680 O OG . SER A 1 89 ? 9.652 34.467 -1.675 1.0 36.49 ? 90 SER A OG 1 89 . A ATOM 681 N N . GLN A 1 90 ? 13.522 33.073 0.214 1.0 21.45 ? 91 GLN A N 1 90 . A ATOM 682 C CA . GLN A 1 90 ? 14.652 32.168 0.401 1.0 20.22 ? 91 GLN A CA 1 90 . A ATOM 683 C C . GLN A 1 90 ? 15.008 31.963 1.861 1.0 21.21 ? 91 GLN A C 1 90 . A ATOM 684 O O . GLN A 1 90 ? 15.342 30.853 2.276 1.0 21.23 ? 91 GLN A O 1 90 . A ATOM 685 C CB . GLN A 1 90 ? 15.873 32.690 -0.368 1.0 19.18 ? 91 GLN A CB 1 90 . A ATOM 686 C CG . GLN A 1 90 ? 15.593 32.957 -1.847 1.0 20.16 ? 91 GLN A CG 1 90 . A ATOM 687 C CD . GLN A 1 90 ? 16.758 33.634 -2.561 1.0 20.11 ? 91 GLN A CD 1 90 . A ATOM 688 O OE1 . GLN A 1 90 ? 17.660 34.188 -1.923 1.0 19.04 ? 91 GLN A OE1 1 90 . A ATOM 689 N NE2 . GLN A 1 90 ? 16.731 33.608 -3.888 1.0 19.52 ? 91 GLN A NE2 1 90 . A ATOM 690 N N . GLN A 1 91 ? 14.937 33.034 2.644 1.0 20.61 ? 92 GLN A N 1 91 . A ATOM 691 C CA . GLN A 1 91 ? 15.264 32.943 4.055 1.0 19.53 ? 92 GLN A CA 1 91 . A ATOM 692 C C . GLN A 1 91 ? 14.797 34.177 4.793 1.0 20.08 ? 92 GLN A C 1 91 . A ATOM 693 O O . GLN A 1 91 ? 14.975 35.298 4.322 1.0 20.91 ? 92 GLN A O 1 91 . A ATOM 694 C CB . GLN A 1 91 ? 16.777 32.793 4.241 1.0 18.24 ? 92 GLN A CB 1 91 . A ATOM 695 C CG . GLN A 1 91 ? 17.207 32.588 5.691 1.0 20.63 ? 92 GLN A CG 1 91 . A ATOM 696 C CD . GLN A 1 91 ? 18.721 32.519 5.842 1.0 20.58 ? 92 GLN A CD 1 91 . A ATOM 697 O OE1 . GLN A 1 91 ? 19.417 31.995 4.974 1.0 20.75 ? 92 GLN A OE1 1 91 . A ATOM 698 N NE2 . GLN A 1 91 ? 19.230 33.035 6.956 1.0 22.03 ? 92 GLN A NE2 1 91 . A ATOM 699 N N . ALA A 1 92 ? 14.214 33.960 5.964 1.0 21.8 ? 93 ALA A N 1 92 . A ATOM 700 C CA . ALA A 1 92 ? 13.735 35.052 6.794 1.0 21.92 ? 93 ALA A CA 1 92 . A ATOM 701 C C . ALA A 1 92 ? 14.907 35.920 7.254 1.0 20.71 ? 93 ALA A C 1 92 . A ATOM 702 O O . ALA A 1 92 ? 15.973 35.417 7.593 1.0 20.11 ? 93 ALA A O 1 92 . A ATOM 703 C CB . ALA A 1 92 ? 12.990 34.490 8.012 1.0 24.59 ? 93 ALA A CB 1 92 . A ATOM 704 N N . HIS A 1 93 ? 14.696 37.230 7.244 1.0 20.25 ? 94 HIS A N 1 93 . A ATOM 705 C CA . HIS A 1 93 ? 15.695 38.186 7.686 1.0 19.93 ? 94 HIS A CA 1 93 . A ATOM 706 C C . HIS A 1 93 ? 14.948 39.494 7.922 1.0 20.43 ? 94 HIS A C 1 93 . A ATOM 707 O O . HIS A 1 93 ? 13.852 39.693 7.391 1.0 20.91 ? 94 HIS A O 1 93 . A ATOM 708 C CB . HIS A 1 93 ? 16.824 38.356 6.646 1.0 20.23 ? 94 HIS A CB 1 93 . A ATOM 709 C CG . HIS A 1 93 ? 16.365 38.854 5.311 1.0 19.55 ? 94 HIS A CG 1 93 . A ATOM 710 N ND1 . HIS A 1 93 ? 15.728 38.048 4.393 1.0 19.79 ? 94 HIS A ND1 1 93 . A ATOM 711 C CD2 . HIS A 1 93 ? 16.441 40.082 4.745 1.0 18.92 ? 94 HIS A CD2 1 93 . A ATOM 712 C CE1 . HIS A 1 93 ? 15.432 38.759 3.319 1.0 20.18 ? 94 HIS A CE1 1 93 . A ATOM 713 N NE2 . HIS A 1 93 ? 15.853 39.997 3.508 1.0 17.82 ? 94 HIS A NE2 1 93 . A ATOM 714 N N . ASP A 1 94 ? 15.528 40.381 8.722 1.0 19.81 ? 95 ASP A N 1 94 . A ATOM 715 C CA . ASP A 1 94 ? 14.878 41.643 9.058 1.0 19.29 ? 95 ASP A CA 1 94 . A ATOM 716 C C . ASP A 1 94 ? 15.119 42.793 8.107 1.0 19.38 ? 95 ASP A C 1 94 . A ATOM 717 O O . ASP A 1 94 ? 14.267 43.670 7.970 1.0 18.56 ? 95 ASP A O 1 94 . A ATOM 718 C CB . ASP A 1 94 ? 15.325 42.099 10.446 1.0 19.47 ? 95 ASP A CB 1 94 . A ATOM 719 C CG . ASP A 1 94 ? 15.132 41.034 11.494 1.0 20.5 ? 95 ASP A CG 1 94 . A ATOM 720 O OD1 . ASP A 1 94 ? 15.929 41.002 12.453 1.0 20.22 ? 95 ASP A OD1 1 94 . A ATOM 721 O OD2 . ASP A 1 94 ? 14.184 40.237 11.353 1.0 18.83 ? 95 ASP A OD2 1 94 . A ATOM 722 N N . CYS A 1 95 ? 16.273 42.797 7.449 1.0 17.51 ? 96 CYS A N 1 95 . A ATOM 723 C CA . CYS A 1 95 ? 16.626 43.923 6.594 1.0 17.39 ? 96 CYS A CA 1 95 . A ATOM 724 C C . CYS A 1 95 ? 17.708 43.488 5.613 1.0 18.39 ? 96 CYS A C 1 95 . A ATOM 725 O O . CYS A 1 95 ? 18.552 42.657 5.943 1.0 16.46 ? 96 CYS A O 1 95 . A ATOM 726 C CB . CYS A 1 95 ? 17.151 45.041 7.505 1.0 18.31 ? 96 CYS A CB 1 95 . A ATOM 727 S SG . CYS A 1 95 ? 17.599 46.635 6.774 1.0 18.75 ? 96 CYS A SG 1 95 . A ATOM 728 N N . ALA A 1 96 ? 17.683 44.042 4.408 1.0 16.59 ? 97 ALA A N 1 96 . A ATOM 729 C CA . ALA A 1 96 ? 18.692 43.685 3.419 1.0 16.24 ? 97 ALA A CA 1 96 . A ATOM 730 C C . ALA A 1 96 ? 19.339 44.937 2.852 1.0 16.88 ? 97 ALA A C 1 96 . A ATOM 731 O O . ALA A 1 96 ? 18.655 45.902 2.529 1.0 16.21 ? 97 ALA A O 1 96 . A ATOM 732 C CB . ALA A 1 96 ? 18.070 42.877 2.306 1.0 17.37 ? 97 ALA A CB 1 96 . A ATOM 733 N N . PHE A 1 97 ? 20.664 44.923 2.746 1.0 16.61 ? 98 PHE A N 1 97 . A ATOM 734 C CA . PHE A 1 97 ? 21.386 46.057 2.194 1.0 16.18 ? 98 PHE A CA 1 97 . A ATOM 735 C C . PHE A 1 97 ? 22.133 45.639 0.945 1.0 16.64 ? 98 PHE A C 1 97 . A ATOM 736 O O . PHE A 1 97 ? 22.770 44.588 0.919 1.0 16.34 ? 98 PHE A O 1 97 . A ATOM 737 C CB . PHE A 1 97 ? 22.391 46.600 3.205 1.0 17.23 ? 98 PHE A CB 1 97 . A ATOM 738 C CG . PHE A 1 97 ? 21.819 47.612 4.138 1.0 19.04 ? 98 PHE A CG 1 97 . A ATOM 739 C CD1 . PHE A 1 97 ? 20.495 47.542 4.536 1.0 16.8 ? 98 PHE A CD1 1 97 . A ATOM 740 C CD2 . PHE A 1 97 ? 22.610 48.617 4.644 1.0 18.32 ? 98 PHE A CD2 1 97 . A ATOM 741 C CE1 . PHE A 1 97 ? 19.988 48.454 5.418 1.0 18.36 ? 98 PHE A CE1 1 97 . A ATOM 742 C CE2 . PHE A 1 97 ? 22.096 49.525 5.527 1.0 22.48 ? 98 PHE A CE2 1 97 . A ATOM 743 C CZ . PHE A 1 97 ? 20.783 49.439 5.912 1.0 22.17 ? 98 PHE A CZ 1 97 . A ATOM 744 N N . LEU A 1 98 ? 22.064 46.480 -0.080 1.0 15.67 ? 99 LEU A N 1 98 . A ATOM 745 C CA . LEU A 1 98 ? 22.750 46.221 -1.335 1.0 16.2 ? 99 LEU A CA 1 98 . A ATOM 746 C C . LEU A 1 98 ? 24.081 46.960 -1.265 1.0 16.26 ? 99 LEU A C 1 98 . A ATOM 747 O O . LEU A 1 98 ? 24.115 48.178 -1.104 1.0 15.34 ? 99 LEU A O 1 98 . A ATOM 748 C CB . LEU A 1 98 ? 21.913 46.745 -2.513 1.0 15.89 ? 99 LEU A CB 1 98 . A ATOM 749 C CG . LEU A 1 98 ? 22.536 46.651 -3.909 1.0 15.96 ? 99 LEU A CG 1 98 . A ATOM 750 C CD1 . LEU A 1 98 ? 22.836 45.199 -4.238 1.0 15.13 ? 99 LEU A CD1 1 98 . A ATOM 751 C CD2 . LEU A 1 98 ? 21.575 47.255 -4.952 1.0 18.63 ? 99 LEU A CD2 1 98 . A ATOM 752 N N . ASN A 1 99 ? 25.174 46.206 -1.365 1.0 15.13 ? 100 ASN A N 1 99 . A ATOM 753 C CA . ASN A 1 99 ? 26.533 46.757 -1.312 1.0 16.57 ? 100 ASN A CA 1 99 . A ATOM 754 C C . ASN A 1 99 ? 26.921 46.919 -2.787 1.0 16.38 ? 100 ASN A C 1 99 . A ATOM 755 O O . ASN A 1 99 ? 27.088 45.929 -3.501 1.0 17.8 ? 100 ASN A O 1 99 . A ATOM 756 C CB . ASN A 1 99 ? 27.423 45.734 -0.594 1.0 19.3 ? 100 ASN A CB 1 99 . A ATOM 757 C CG . ASN A 1 99 ? 28.747 46.300 -0.130 1.0 23.43 ? 100 ASN A CG 1 99 . A ATOM 758 O OD1 . ASN A 1 99 ? 28.940 47.519 -0.032 1.0 28.66 ? 100 ASN A OD1 1 99 . A ATOM 759 N ND2 . ASN A 1 99 ? 29.672 45.398 0.204 1.0 28.0 ? 100 ASN A ND2 1 99 . A ATOM 760 N N . THR A 1 100 ? 27.047 48.160 -3.247 1.0 15.73 ? 101 THR A N 1 100 . A ATOM 761 C CA . THR A 1 100 ? 27.348 48.405 -4.653 1.0 16.15 ? 101 THR A CA 1 100 . A ATOM 762 C C . THR A 1 100 ? 28.655 49.143 -4.914 1.0 15.72 ? 101 THR A C 1 100 . A ATOM 763 O O . THR A 1 100 ? 29.020 50.042 -4.173 1.0 16.42 ? 101 THR A O 1 100 . A ATOM 764 C CB . THR A 1 100 ? 26.196 49.196 -5.314 1.0 18.19 ? 101 THR A CB 1 100 . A ATOM 765 O OG1 . THR A 1 100 ? 26.459 49.356 -6.713 1.0 18.12 ? 101 THR A OG1 1 100 . A ATOM 766 C CG2 . THR A 1 100 ? 26.052 50.568 -4.663 1.0 19.09 ? 101 THR A CG2 1 100 . A ATOM 767 N N . ALA A 1 101 ? 29.346 48.764 -5.985 1.0 15.97 ? 102 ALA A N 1 101 . A ATOM 768 C CA . ALA A 1 101 ? 30.616 49.398 -6.338 1.0 19.41 ? 102 ALA A CA 1 101 . A ATOM 769 C C . ALA A 1 101 ? 30.381 50.673 -7.142 1.0 21.88 ? 102 ALA A C 1 101 . A ATOM 770 O O . ALA A 1 101 ? 31.198 51.590 -7.113 1.0 23.73 ? 102 ALA A O 1 101 . A ATOM 771 C CB . ALA A 1 101 ? 31.478 48.431 -7.146 1.0 18.31 ? 102 ALA A CB 1 101 . A ATOM 772 N N . THR A 1 102 ? 29.253 50.701 -7.848 1.0 21.95 ? 103 THR A N 1 102 . A ATOM 773 C CA . THR A 1 102 ? 28.813 51.806 -8.711 1.0 24.53 ? 103 THR A CA 1 102 . A ATOM 774 C C . THR A 1 102 ? 28.752 53.186 -8.061 1.0 23.45 ? 103 THR A C 1 102 . A ATOM 775 O O . THR A 1 102 ? 28.048 53.367 -7.101 1.0 22.34 ? 103 THR A O 1 102 . A ATOM 776 C CB . THR A 1 102 ? 27.397 51.499 -9.245 1.0 26.23 ? 103 THR A CB 1 102 . A ATOM 777 O OG1 . THR A 1 102 ? 27.418 50.250 -9.948 1.0 30.35 ? 103 THR A OG1 1 102 . A ATOM 778 C CG2 . THR A 1 102 ? 26.896 52.612 -10.169 1.0 28.46 ? 103 THR A CG2 1 102 . A ATOM 779 N N . ALA A 1 103 ? 29.450 54.181 -8.590 1.0 25.03 ? 104 ALA A N 1 103 . A ATOM 780 C CA . ALA A 1 103 ? 29.353 55.510 -7.981 1.0 25.12 ? 104 ALA A CA 1 103 . A ATOM 781 C C . ALA A 1 103 ? 27.930 56.034 -8.205 1.0 24.3 ? 104 ALA A C 1 103 . A ATOM 782 O O . ALA A 1 103 ? 27.371 55.857 -9.284 1.0 24.48 ? 104 ALA A O 1 103 . A ATOM 783 C CB . ALA A 1 103 ? 30.366 56.459 -8.609 1.0 28.12 ? 104 ALA A CB 1 103 . A ATOM 784 N N . LEU A 1 104 ? 27.344 56.671 -7.193 1.0 24.67 ? 105 LEU A N 1 104 . A ATOM 785 C CA . LEU A 1 104 ? 25.986 57.205 -7.314 1.0 24.19 ? 105 LEU A CA 1 104 . A ATOM 786 C C . LEU A 1 104 ? 26.005 58.520 -8.097 1.0 25.37 ? 105 LEU A C 1 104 . A ATOM 787 O O . LEU A 1 104 ? 26.987 59.273 -8.037 1.0 25.3 ? 105 LEU A O 1 104 . A ATOM 788 C CB . LEU A 1 104 ? 25.382 57.405 -5.923 1.0 22.45 ? 105 LEU A CB 1 104 . A ATOM 789 C CG . LEU A 1 104 ? 25.393 56.124 -5.072 1.0 22.82 ? 105 LEU A CG 1 104 . A ATOM 790 C CD1 . LEU A 1 104 ? 24.736 56.376 -3.723 1.0 21.34 ? 105 LEU A CD1 1 104 . A ATOM 791 C CD2 . LEU A 1 104 ? 24.674 55.015 -5.821 1.0 20.15 ? 105 LEU A CD2 1 104 . A ATOM 792 N N . ASP A 1 105 ? 24.919 58.809 -8.816 1.0 24.73 ? 106 ASP A N 1 105 . A ATOM 793 C CA . ASP A 1 105 ? 24.879 60.015 -9.644 1.0 23.5 ? 106 ASP A CA 1 105 . A ATOM 794 C C . ASP A 1 105 ? 24.916 61.370 -8.944 1.0 24.56 ? 106 ASP A C 1 105 . A ATOM 795 O O . ASP A 1 105 ? 25.261 62.369 -9.572 1.0 25.5 ? 106 ASP A O 1 105 . A ATOM 796 C CB . ASP A 1 105 ? 23.696 59.966 -10.629 1.0 22.97 ? 106 ASP A CB 1 105 . A ATOM 797 C CG . ASP A 1 105 ? 22.335 60.197 -9.970 1.0 22.58 ? 106 ASP A CG 1 105 . A ATOM 798 O OD1 . ASP A 1 105 ? 21.336 60.152 -10.715 1.0 23.88 ? 106 ASP A OD1 1 105 . A ATOM 799 O OD2 . ASP A 1 105 ? 22.247 60.425 -8.746 1.0 22.86 ? 106 ASP A OD2 1 105 . A ATOM 800 N N . ASP A 1 106 ? 24.565 61.423 -7.664 1.0 22.87 ? 107 ASP A N 1 106 . A ATOM 801 C CA . ASP A 1 106 ? 24.613 62.690 -6.946 1.0 25.4 ? 107 ASP A CA 1 106 . A ATOM 802 C C . ASP A 1 106 ? 25.776 62.664 -5.958 1.0 26.29 ? 107 ASP A C 1 106 . A ATOM 803 O O . ASP A 1 106 ? 25.832 63.446 -5.012 1.0 25.64 ? 107 ASP A O 1 106 . A ATOM 804 C CB . ASP A 1 106 ? 23.283 62.961 -6.224 1.0 24.41 ? 107 ASP A CB 1 106 . A ATOM 805 C CG . ASP A 1 106 ? 22.902 61.864 -5.244 1.0 25.67 ? 107 ASP A CG 1 106 . A ATOM 806 O OD1 . ASP A 1 106 ? 23.588 60.822 -5.198 1.0 25.97 ? 107 ASP A OD1 1 106 . A ATOM 807 O OD2 . ASP A 1 106 ? 21.905 62.052 -4.518 1.0 24.0 ? 107 ASP A OD2 1 106 . A ATOM 808 N N . SER A 1 107 ? 26.706 61.750 -6.210 1.0 28.51 ? 108 SER A N 1 107 . A ATOM 809 C CA . SER A 1 107 ? 27.899 61.566 -5.389 1.0 30.17 ? 108 SER A CA 1 107 . A ATOM 810 C C . SER A 1 107 ? 27.649 61.309 -3.905 1.0 29.97 ? 108 SER A C 1 107 . A ATOM 811 O O . SER A 1 107 ? 28.461 61.678 -3.052 1.0 31.77 ? 108 SER A O 1 107 . A ATOM 812 C CB . SER A 1 107 ? 28.853 62.749 -5.573 1.0 32.1 ? 108 SER A CB 1 107 . A ATOM 813 O OG . SER A 1 107 ? 29.456 62.694 -6.863 1.0 35.59 ? 108 SER A OG 1 107 . A ATOM 814 N N . THR A 1 108 ? 26.516 60.687 -3.598 1.0 27.83 ? 109 THR A N 1 108 . A ATOM 815 C CA . THR A 1 108 ? 26.205 60.329 -2.221 1.0 24.68 ? 109 THR A CA 1 108 . A ATOM 816 C C . THR A 1 108 ? 26.788 58.926 -2.079 1.0 22.84 ? 109 THR A C 1 108 . A ATOM 817 O O . THR A 1 108 ? 27.260 58.351 -3.058 1.0 22.04 ? 109 THR A O 1 108 . A ATOM 818 C CB . THR A 1 108 ? 24.685 60.289 -1.954 1.0 24.55 ? 109 THR A CB 1 108 . A ATOM 819 O OG1 . THR A 1 108 ? 24.040 59.505 -2.964 1.0 24.06 ? 109 THR A OG1 1 108 . A ATOM 820 C CG2 . THR A 1 108 ? 24.105 61.705 -1.948 1.0 24.87 ? 109 THR A CG2 1 108 . A ATOM 821 N N . ILE A 1 109 ? 26.762 58.365 -0.878 1.0 20.62 ? 110 ILE A N 1 109 . A ATOM 822 C CA . ILE A 1 109 ? 27.342 57.041 -0.696 1.0 20.16 ? 110 ILE A CA 1 109 . A ATOM 823 C C . ILE A 1 109 ? 26.399 56.018 -0.080 1.0 19.19 ? 110 ILE A C 1 109 . A ATOM 824 O O . ILE A 1 109 ? 26.817 54.904 0.240 1.0 18.07 ? 110 ILE A O 1 109 . A ATOM 825 C CB . ILE A 1 109 ? 28.615 57.127 0.168 1.0 20.89 ? 110 ILE A CB 1 109 . A ATOM 826 C CG1 . ILE A 1 109 ? 28.297 57.856 1.476 1.0 20.13 ? 110 ILE A CG1 1 109 . A ATOM 827 C CG2 . ILE A 1 109 ? 29.736 57.839 -0.619 1.0 24.1 ? 110 ILE A CG2 1 109 . A ATOM 828 C CD1 . ILE A 1 109 ? 29.489 58.030 2.403 1.0 22.53 ? 110 ILE A CD1 1 109 . A ATOM 829 N N . GLY A 1 110 ? 25.132 56.393 0.081 1.0 19.21 ? 111 GLY A N 1 110 . A ATOM 830 C CA . GLY A 1 110 ? 24.168 55.469 0.651 1.0 19.37 ? 111 GLY A CA 1 110 . A ATOM 831 C C . GLY A 1 110 ? 22.743 55.985 0.628 1.0 19.92 ? 111 GLY A C 1 110 . A ATOM 832 O O . GLY A 1 110 ? 22.506 57.162 0.365 1.0 19.72 ? 111 GLY A O 1 110 . A ATOM 833 N N . LEU A 1 111 ? 21.790 55.097 0.893 1.0 19.24 ? 112 LEU A N 1 111 . A ATOM 834 C CA . LEU A 1 111 ? 20.378 55.469 0.916 1.0 20.0 ? 112 LEU A CA 1 111 . A ATOM 835 C C . LEU A 1 111 ? 19.594 54.385 1.652 1.0 20.54 ? 112 LEU A C 1 111 . A ATOM 836 O O . LEU A 1 111 ? 19.956 53.212 1.605 1.0 19.8 ? 112 LEU A O 1 111 . A ATOM 837 C CB . LEU A 1 111 ? 19.836 55.608 -0.514 1.0 18.64 ? 112 LEU A CB 1 111 . A ATOM 838 C CG . LEU A 1 111 ? 18.446 56.238 -0.660 1.0 21.96 ? 112 LEU A CG 1 111 . A ATOM 839 C CD1 . LEU A 1 111 ? 18.557 57.731 -0.368 1.0 22.95 ? 112 LEU A CD1 1 111 . A ATOM 840 C CD2 . LEU A 1 111 ? 17.900 56.023 -2.072 1.0 22.12 ? 112 LEU A CD2 1 111 . A ATOM 841 N N . ALA A 1 112 ? 18.525 54.781 2.335 1.0 20.15 ? 113 ALA A N 1 112 . A ATOM 842 C CA . ALA A 1 112 ? 17.692 53.830 3.062 1.0 20.89 ? 113 ALA A CA 1 112 . A ATOM 843 C C . ALA A 1 112 ? 16.310 54.425 3.283 1.0 21.68 ? 113 ALA A C 1 112 . A ATOM 844 O O . ALA A 1 112 ? 16.125 55.634 3.172 1.0 22.53 ? 113 ALA A O 1 112 . A ATOM 845 C CB . ALA A 1 112 ? 18.327 53.498 4.408 1.0 22.05 ? 113 ALA A CB 1 112 . A ATOM 846 N N . TYR A 1 113 ? 15.344 53.573 3.602 1.0 21.74 ? 114 TYR A N 1 113 . A ATOM 847 C CA . TYR A 1 113 ? 13.985 54.036 3.865 1.0 22.74 ? 114 TYR A CA 1 113 . A ATOM 848 C C . TYR A 1 113 ? 13.833 54.327 5.349 1.0 24.18 ? 114 TYR A C 1 113 . A ATOM 849 O O . TYR A 1 113 ? 14.011 53.440 6.181 1.0 25.02 ? 114 TYR A O 1 113 . A ATOM 850 C CB . TYR A 1 113 ? 12.966 52.973 3.447 1.0 22.21 ? 114 TYR A CB 1 113 . A ATOM 851 C CG . TYR A 1 113 ? 12.864 52.767 1.956 1.0 24.29 ? 114 TYR A CG 1 113 . A ATOM 852 C CD1 . TYR A 1 113 ? 12.377 53.777 1.118 1.0 24.76 ? 114 TYR A CD1 1 113 . A ATOM 853 C CD2 . TYR A 1 113 ? 13.240 51.556 1.379 1.0 22.61 ? 114 TYR A CD2 1 113 . A ATOM 854 C CE1 . TYR A 1 113 ? 12.265 53.577 -0.263 1.0 24.3 ? 114 TYR A CE1 1 113 . A ATOM 855 C CE2 . TYR A 1 113 ? 13.131 51.348 0.012 1.0 23.46 ? 114 TYR A CE2 1 113 . A ATOM 856 C CZ . TYR A 1 113 ? 12.644 52.357 -0.803 1.0 23.57 ? 114 TYR A CZ 1 113 . A ATOM 857 O OH . TYR A 1 113 ? 12.540 52.131 -2.150 1.0 22.9 ? 114 TYR A OH 1 113 . A ATOM 858 N N . SER A 1 114 ? 13.511 55.571 5.687 1.0 25.41 ? 115 SER A N 1 114 . A ATOM 859 C CA . SER A 1 114 ? 13.336 55.936 7.084 1.0 26.88 ? 115 SER A CA 1 114 . A ATOM 860 C C . SER A 1 114 ? 12.195 55.116 7.687 1.0 26.97 ? 115 SER A C 1 114 . A ATOM 861 O O . SER A 1 114 ? 11.134 54.967 7.072 1.0 26.26 ? 115 SER A O 1 114 . A ATOM 862 C CB . SER A 1 114 ? 13.039 57.438 7.208 1.0 29.79 ? 115 SER A CB 1 114 . A ATOM 863 O OG . SER A 1 114 ? 14.171 58.224 6.837 1.0 34.05 ? 115 SER A OG 1 114 . A ATOM 864 N N . ASN A 1 115 ? 12.434 54.561 8.873 1.0 26.8 ? 116 ASN A N 1 115 . A ATOM 865 C CA . ASN A 1 115 ? 11.436 53.761 9.585 1.0 27.59 ? 116 ASN A CA 1 115 . A ATOM 866 C C . ASN A 1 115 ? 11.042 52.481 8.857 1.0 27.49 ? 116 ASN A C 1 115 . A ATOM 867 O O . ASN A 1 115 ? 10.019 51.878 9.181 1.0 26.45 ? 116 ASN A O 1 115 . A ATOM 868 C CB . ASN A 1 115 ? 10.169 54.590 9.823 1.0 31.16 ? 116 ASN A CB 1 115 . A ATOM 869 C CG . ASN A 1 115 ? 10.423 55.815 10.665 1.0 32.1 ? 116 ASN A CG 1 115 . A ATOM 870 O OD1 . ASN A 1 115 ? 9.981 56.912 10.332 1.0 36.87 ? 116 ASN A OD1 1 115 . A ATOM 871 N ND2 . ASN A 1 115 ? 11.131 55.637 11.769 1.0 33.31 ? 116 ASN A ND2 1 115 . A ATOM 872 N N . GLY A 1 116 ? 11.856 52.053 7.896 1.0 24.45 ? 117 GLY A N 1 116 . A ATOM 873 C CA . GLY A 1 116 ? 11.516 50.861 7.139 1.0 23.96 ? 117 GLY A CA 1 116 . A ATOM 874 C C . GLY A 1 116 ? 11.796 49.501 7.755 1.0 22.19 ? 117 GLY A C 1 116 . A ATOM 875 O O . GLY A 1 116 ? 11.330 48.492 7.230 1.0 21.05 ? 117 GLY A O 1 116 . A ATOM 876 N N . MET A 1 117 ? 12.534 49.461 8.860 1.0 22.18 ? 118 MET A N 1 117 . A ATOM 877 C CA . MET A 1 117 ? 12.877 48.187 9.492 1.0 22.87 ? 118 MET A CA 1 117 . A ATOM 878 C C . MET A 1 117 ? 11.699 47.226 9.616 1.0 23.78 ? 118 MET A C 1 117 . A ATOM 879 O O . MET A 1 117 ? 10.638 47.586 10.142 1.0 24.16 ? 118 MET A O 1 117 . A ATOM 880 C CB . MET A 1 117 ? 13.493 48.416 10.875 1.0 21.72 ? 118 MET A CB 1 117 . A ATOM 881 C CG . MET A 1 117 ? 13.952 47.133 11.561 1.0 21.16 ? 118 MET A CG 1 117 . A ATOM 882 S SD . MET A 1 117 ? 15.211 46.224 10.591 1.0 21.73 ? 118 MET A SD 1 117 . A ATOM 883 C CE . MET A 1 117 ? 16.602 47.345 10.756 1.0 22.0 ? 118 MET A CE 1 117 . A ATOM 884 N N . CYS A 1 118 ? 11.917 46.008 9.116 1.0 22.38 ? 119 CYS A N 1 118 . A ATOM 885 C CA . CYS A 1 118 ? 10.951 44.912 9.119 1.0 22.93 ? 119 CYS A CA 1 118 . A ATOM 886 C C . CYS A 1 118 ? 9.934 44.935 7.992 1.0 22.32 ? 119 CYS A C 1 118 . A ATOM 887 O O . CYS A 1 118 ? 9.349 43.902 7.670 1.0 23.85 ? 119 CYS A O 1 118 . A ATOM 888 C CB . CYS A 1 118 ? 10.201 44.829 10.449 1.0 25.24 ? 119 CYS A CB 1 118 . A ATOM 889 S SG . CYS A 1 118 ? 11.215 44.468 11.913 1.0 26.06 ? 119 CYS A SG 1 118 . A ATOM 890 N N . ASP A 1 119 ? 9.703 46.091 7.380 1.0 23.09 ? 120 ASP A N 1 119 . A ATOM 891 C CA . ASP A 1 119 ? 8.733 46.115 6.299 1.0 24.37 ? 120 ASP A CA 1 119 . A ATOM 892 C C . ASP A 1 119 ? 9.223 45.255 5.146 1.0 24.75 ? 120 ASP A C 1 119 . A ATOM 893 O O . ASP A 1 119 ? 10.378 45.357 4.730 1.0 25.03 ? 120 ASP A O 1 119 . A ATOM 894 C CB . ASP A 1 119 ? 8.480 47.535 5.806 1.0 24.2 ? 120 ASP A CB 1 119 . A ATOM 895 C CG . ASP A 1 119 ? 7.364 47.594 4.788 1.0 26.69 ? 120 ASP A CG 1 119 . A ATOM 896 O OD1 . ASP A 1 119 ? 7.623 47.341 3.591 1.0 23.49 ? 120 ASP A OD1 1 119 . A ATOM 897 O OD2 . ASP A 1 119 ? 6.215 47.870 5.198 1.0 27.23 ? 120 ASP A OD2 1 119 . A ATOM 898 N N . PRO A 1 120 ? 8.348 44.389 4.615 1.0 25.7 ? 121 PRO A N 1 120 . A ATOM 899 C CA . PRO A 1 120 ? 8.715 43.512 3.503 1.0 25.99 ? 121 PRO A CA 1 120 . A ATOM 900 C C . PRO A 1 120 ? 9.422 44.222 2.357 1.0 25.62 ? 121 PRO A C 1 120 . A ATOM 901 O O . PRO A 1 120 ? 10.405 43.718 1.824 1.0 24.85 ? 121 PRO A O 1 120 . A ATOM 902 C CB . PRO A 1 120 ? 7.374 42.915 3.082 1.0 26.66 ? 121 PRO A CB 1 120 . A ATOM 903 C CG . PRO A 1 120 ? 6.665 42.776 4.398 1.0 26.2 ? 121 PRO A CG 1 120 . A ATOM 904 C CD . PRO A 1 120 ? 6.975 44.103 5.076 1.0 27.47 ? 121 PRO A CD 1 120 . A ATOM 905 N N . LYS A 1 121 ? 8.926 45.394 1.981 1.0 25.83 ? 122 LYS A N 1 121 . A ATOM 906 C CA . LYS A 1 121 ? 9.531 46.128 0.880 1.0 25.26 ? 122 LYS A CA 1 121 . A ATOM 907 C C . LYS A 1 121 ? 10.503 47.224 1.308 1.0 23.99 ? 122 LYS A C 1 121 . A ATOM 908 O O . LYS A 1 121 ? 11.572 47.371 0.711 1.0 24.86 ? 122 LYS A O 1 121 . A ATOM 909 C CB . LYS A 1 121 ? 8.431 46.731 -0.010 1.0 26.27 ? 122 LYS A CB 1 121 . A ATOM 910 C CG . LYS A 1 121 ? 8.929 47.371 -1.310 1.0 29.7 ? 122 LYS A CG 1 121 . A ATOM 911 C CD . LYS A 1 121 ? 9.435 48.788 -1.101 1.0 32.11 ? 122 LYS A CD 1 121 . A ATOM 912 C CE . LYS A 1 121 ? 10.008 49.370 -2.392 1.0 35.12 ? 122 LYS A CE 1 121 . A ATOM 913 N NZ . LYS A 1 121 ? 9.048 49.305 -3.534 1.0 33.35 ? 122 LYS A NZ 1 121 . A ATOM 914 N N . PHE A 1 122 ? 10.152 47.974 2.347 1.0 21.97 ? 123 PHE A N 1 122 . A ATOM 915 C CA . PHE A 1 122 ? 10.980 49.091 2.792 1.0 21.74 ? 123 PHE A CA 1 122 . A ATOM 916 C C . PHE A 1 122 ? 12.133 48.824 3.759 1.0 21.44 ? 123 PHE A C 1 122 . A ATOM 917 O O . PHE A 1 122 ? 12.838 49.765 4.160 1.0 19.42 ? 123 PHE A O 1 122 . A ATOM 918 C CB . PHE A 1 122 ? 10.076 50.183 3.369 1.0 23.29 ? 123 PHE A CB 1 122 . A ATOM 919 C CG . PHE A 1 122 ? 9.134 50.773 2.357 1.0 26.42 ? 123 PHE A CG 1 122 . A ATOM 920 C CD1 . PHE A 1 122 ? 7.756 50.629 2.498 1.0 27.86 ? 123 PHE A CD1 1 122 . A ATOM 921 C CD2 . PHE A 1 122 ? 9.630 51.449 1.245 1.0 26.89 ? 123 PHE A CD2 1 122 . A ATOM 922 C CE1 . PHE A 1 122 ? 6.883 51.146 1.545 1.0 27.0 ? 123 PHE A CE1 1 122 . A ATOM 923 C CE2 . PHE A 1 122 ? 8.766 51.973 0.281 1.0 31.1 ? 123 PHE A CE2 1 122 . A ATOM 924 C CZ . PHE A 1 122 ? 7.386 51.819 0.435 1.0 30.22 ? 123 PHE A CZ 1 122 . A ATOM 925 N N . SER A 1 123 ? 12.329 47.566 4.146 1.0 19.53 ? 124 SER A N 1 123 . A ATOM 926 C CA . SER A 1 123 ? 13.418 47.255 5.059 1.0 19.33 ? 124 SER A CA 1 123 . A ATOM 927 C C . SER A 1 123 ? 14.659 46.949 4.243 1.0 18.96 ? 124 SER A C 1 123 . A ATOM 928 O O . SER A 1 123 ? 15.182 45.827 4.257 1.0 16.1 ? 124 SER A O 1 123 . A ATOM 929 C CB . SER A 1 123 ? 13.082 46.064 5.951 1.0 21.27 ? 124 SER A CB 1 123 . A ATOM 930 O OG . SER A 1 123 ? 13.996 46.018 7.036 1.0 20.33 ? 124 SER A OG 1 123 . A ATOM 931 N N . VAL A 1 124 ? 15.120 47.962 3.518 1.0 17.62 ? 125 VAL A N 1 124 . A ATOM 932 C CA . VAL A 1 124 ? 16.306 47.814 2.696 1.0 17.16 ? 125 VAL A CA 1 124 . A ATOM 933 C C . VAL A 1 124 ? 17.138 49.077 2.736 1.0 18.44 ? 125 VAL A C 1 124 . A ATOM 934 O O . VAL A 1 124 ? 16.655 50.157 3.098 1.0 16.42 ? 125 VAL A O 1 124 . A ATOM 935 C CB . VAL A 1 124 ? 15.952 47.496 1.225 1.0 18.99 ? 125 VAL A CB 1 124 . A ATOM 936 C CG1 . VAL A 1 124 ? 15.325 46.125 1.121 1.0 18.72 ? 125 VAL A CG1 1 124 . A ATOM 937 C CG2 . VAL A 1 124 ? 15.000 48.546 0.675 1.0 19.24 ? 125 VAL A CG2 1 124 . A ATOM 938 N N . GLY A 1 125 ? 18.405 48.921 2.381 1.0 17.45 ? 126 GLY A N 1 125 . A ATOM 939 C CA . GLY A 1 125 ? 19.314 50.042 2.356 1.0 17.07 ? 126 GLY A CA 1 125 . A ATOM 940 C C . GLY A 1 125 ? 20.264 49.824 1.197 1.0 17.79 ? 126 GLY A C 1 125 . A ATOM 941 O O . GLY A 1 125 ? 20.329 48.728 0.642 1.0 15.87 ? 126 GLY A O 1 125 . A ATOM 942 N N . LEU A 1 126 ? 21.009 50.868 0.856 1.0 16.97 ? 127 LEU A N 1 126 . A ATOM 943 C CA . LEU A 1 126 ? 21.962 50.843 -0.246 1.0 17.73 ? 127 LEU A CA 1 126 . A ATOM 944 C C . LEU A 1 126 ? 23.252 51.449 0.292 1.0 16.76 ? 127 LEU A C 1 126 . A ATOM 945 O O . LEU A 1 126 ? 23.233 52.511 0.924 1.0 16.23 ? 127 LEU A O 1 126 . A ATOM 946 C CB . LEU A 1 126 ? 21.405 51.696 -1.392 1.0 20.03 ? 127 LEU A CB 1 126 . A ATOM 947 C CG . LEU A 1 126 ? 22.114 51.955 -2.722 1.0 24.74 ? 127 LEU A CG 1 126 . A ATOM 948 C CD1 . LEU A 1 126 ? 23.500 52.517 -2.489 1.0 24.87 ? 127 LEU A CD1 1 126 . A ATOM 949 C CD2 . LEU A 1 126 ? 22.170 50.685 -3.510 1.0 27.17 ? 127 LEU A CD2 1 126 . A ATOM 950 N N . VAL A 1 127 ? 24.371 50.774 0.058 1.0 16.54 ? 128 VAL A N 1 127 . A ATOM 951 C CA . VAL A 1 127 ? 25.652 51.278 0.525 1.0 16.78 ? 128 VAL A CA 1 127 . A ATOM 952 C C . VAL A 1 127 ? 26.682 51.184 -0.595 1.0 17.36 ? 128 VAL A C 1 127 . A ATOM 953 O O . VAL A 1 127 ? 26.898 50.120 -1.163 1.0 16.92 ? 128 VAL A O 1 127 . A ATOM 954 C CB . VAL A 1 127 ? 26.161 50.477 1.752 1.0 16.57 ? 128 VAL A CB 1 127 . A ATOM 955 C CG1 . VAL A 1 127 ? 27.479 51.063 2.247 1.0 17.15 ? 128 VAL A CG1 1 127 . A ATOM 956 C CG2 . VAL A 1 127 ? 25.126 50.513 2.863 1.0 16.3 ? 128 VAL A CG2 1 127 . A ATOM 957 N N . GLN A 1 128 ? 27.310 52.310 -0.920 1.0 17.85 ? 129 GLN A N 1 128 . A ATOM 958 C CA . GLN A 1 128 ? 28.319 52.323 -1.967 1.0 18.27 ? 129 GLN A CA 1 128 . A ATOM 959 C C . GLN A 1 128 ? 29.650 51.988 -1.296 1.0 17.86 ? 129 GLN A C 1 128 . A ATOM 960 O O . GLN A 1 128 ? 29.947 52.503 -0.223 1.0 17.33 ? 129 GLN A O 1 128 . A ATOM 961 C CB . GLN A 1 128 ? 28.369 53.711 -2.615 1.0 20.75 ? 129 GLN A CB 1 128 . A ATOM 962 C CG . GLN A 1 128 ? 28.980 53.748 -4.011 1.0 23.89 ? 129 GLN A CG 1 128 . A ATOM 963 C CD . GLN A 1 128 ? 30.402 54.260 -4.011 1.0 25.64 ? 129 GLN A CD 1 128 . A ATOM 964 O OE1 . GLN A 1 128 ? 30.713 55.251 -3.350 1.0 23.49 ? 129 GLN A OE1 1 128 . A ATOM 965 N NE2 . GLN A 1 128 ? 31.273 53.597 -4.767 1.0 26.98 ? 129 GLN A NE2 1 128 . A ATOM 966 N N . ASP A 1 129 ? 30.424 51.101 -1.914 1.0 18.94 ? 130 ASP A N 1 129 . A ATOM 967 C CA . ASP A 1 129 ? 31.730 50.680 -1.390 1.0 19.25 ? 130 ASP A CA 1 129 . A ATOM 968 C C . ASP A 1 129 ? 32.688 51.834 -1.699 1.0 20.29 ? 130 ASP A C 1 129 . A ATOM 969 O O . ASP A 1 129 ? 33.571 51.724 -2.552 1.0 20.51 ? 130 ASP A O 1 129 . A ATOM 970 C CB . ASP A 1 129 ? 32.152 49.405 -2.121 1.0 19.82 ? 130 ASP A CB 1 129 . A ATOM 971 C CG . ASP A 1 129 ? 33.355 48.734 -1.494 1.0 22.32 ? 130 ASP A CG 1 129 . A ATOM 972 O OD1 . ASP A 1 129 ? 34.253 48.343 -2.268 1.0 20.33 ? 130 ASP A OD1 1 129 . A ATOM 973 O OD2 . ASP A 1 129 ? 33.394 48.587 -0.250 1.0 20.39 ? 130 ASP A OD2 1 129 . A ATOM 974 N N . HIS A 1 130 ? 32.507 52.935 -0.977 1.0 20.06 ? 131 HIS A N 1 130 . A ATOM 975 C CA . HIS A 1 130 ? 33.255 54.167 -1.213 1.0 20.93 ? 131 HIS A CA 1 130 . A ATOM 976 C C . HIS A 1 130 ? 34.695 54.324 -0.743 1.0 22.58 ? 131 HIS A C 1 130 . A ATOM 977 O O . HIS A 1 130 ? 35.331 55.334 -1.057 1.0 22.64 ? 131 HIS A O 1 130 . A ATOM 978 C CB . HIS A 1 130 ? 32.436 55.337 -0.669 1.0 20.52 ? 131 HIS A CB 1 130 . A ATOM 979 C CG . HIS A 1 130 ? 32.267 55.319 0.820 1.0 19.68 ? 131 HIS A CG 1 130 . A ATOM 980 N ND1 . HIS A 1 130 ? 33.159 55.926 1.679 1.0 19.77 ? 131 HIS A ND1 1 130 . A ATOM 981 C CD2 . HIS A 1 130 ? 31.305 54.771 1.602 1.0 19.45 ? 131 HIS A CD2 1 130 . A ATOM 982 C CE1 . HIS A 1 130 ? 32.751 55.758 2.925 1.0 21.83 ? 131 HIS A CE1 1 130 . A ATOM 983 N NE2 . HIS A 1 130 ? 31.629 55.060 2.907 1.0 19.94 ? 131 HIS A NE2 1 130 . A ATOM 984 N N . SER A 1 131 ? 35.219 53.346 -0.015 1.0 22.42 ? 132 SER A N 1 131 . A ATOM 985 C CA . SER A 1 131 ? 36.580 53.456 0.500 1.0 23.46 ? 132 SER A CA 1 131 . A ATOM 986 C C . SER A 1 131 ? 37.243 52.097 0.688 1.0 24.43 ? 132 SER A C 1 131 . A ATOM 987 O O . SER A 1 131 ? 36.565 51.081 0.856 1.0 22.31 ? 132 SER A O 1 131 . A ATOM 988 C CB . SER A 1 131 ? 36.538 54.208 1.836 1.0 23.39 ? 132 SER A CB 1 131 . A ATOM 989 O OG . SER A 1 131 ? 37.792 54.237 2.484 1.0 22.69 ? 132 SER A OG 1 131 . A ATOM 990 N N . SER A 1 132 ? 38.573 52.082 0.650 1.0 25.31 ? 133 SER A N 1 132 . A ATOM 991 C CA . SER A 1 132 ? 39.319 50.845 0.852 1.0 25.06 ? 133 SER A CA 1 132 . A ATOM 992 C C . SER A 1 132 ? 39.348 50.605 2.360 1.0 25.9 ? 133 SER A C 1 132 . A ATOM 993 O O . SER A 1 132 ? 39.713 49.528 2.836 1.0 26.66 ? 133 SER A O 1 132 . A ATOM 994 C CB . SER A 1 132 ? 40.743 50.980 0.306 1.0 25.26 ? 133 SER A CB 1 132 . A ATOM 995 O OG . SER A 1 132 ? 41.420 52.052 0.935 1.0 26.66 ? 133 SER A OG 1 132 . A ATOM 996 N N . ASN A 1 133 ? 38.964 51.627 3.113 1.0 25.13 ? 134 ASN A N 1 133 . A ATOM 997 C CA . ASN A 1 133 ? 38.908 51.513 4.561 1.0 24.56 ? 134 ASN A CA 1 133 . A ATOM 998 C C . ASN A 1 133 ? 37.534 50.921 4.862 1.0 24.49 ? 134 ASN A C 1 133 . A ATOM 999 O O . ASN A 1 133 ? 36.522 51.623 4.794 1.0 22.73 ? 134 ASN A O 1 133 . A ATOM 1000 C CB . ASN A 1 133 ? 39.032 52.887 5.218 1.0 25.57 ? 134 ASN A CB 1 133 . A ATOM 1001 C CG . ASN A 1 133 ? 39.056 52.801 6.730 1.0 26.97 ? 134 ASN A CG 1 133 . A ATOM 1002 O OD1 . ASN A 1 133 ? 38.366 51.969 7.323 1.0 24.18 ? 134 ASN A OD1 1 133 . A ATOM 1003 N ND2 . ASN A 1 133 ? 39.840 53.672 7.366 1.0 23.94 ? 134 ASN A ND2 1 133 . A ATOM 1004 N N . VAL A 1 134 ? 37.505 49.632 5.187 1.0 21.84 ? 135 VAL A N 1 134 . A ATOM 1005 C CA . VAL A 1 134 ? 36.257 48.928 5.472 1.0 21.29 ? 135 VAL A CA 1 134 . A ATOM 1006 C C . VAL A 1 134 ? 35.474 49.517 6.639 1.0 21.16 ? 135 VAL A C 1 134 . A ATOM 1007 O O . VAL A 1 134 ? 34.234 49.508 6.637 1.0 19.27 ? 135 VAL A O 1 134 . A ATOM 1008 C CB . VAL A 1 134 ? 36.538 47.427 5.712 1.0 20.88 ? 135 VAL A CB 1 134 . A ATOM 1009 C CG1 . VAL A 1 134 ? 35.256 46.686 6.017 1.0 21.16 ? 135 VAL A CG1 1 134 . A ATOM 1010 C CG2 . VAL A 1 134 ? 37.198 46.843 4.482 1.0 21.0 ? 135 VAL A CG2 1 134 . A ATOM 1011 N N . PHE A 1 135 ? 36.178 50.029 7.644 1.0 19.99 ? 136 PHE A N 1 135 . A ATOM 1012 C CA . PHE A 1 135 ? 35.484 50.630 8.767 1.0 20.84 ? 136 PHE A CA 1 135 . A ATOM 1013 C C . PHE A 1 135 ? 34.652 51.790 8.239 1.0 20.89 ? 136 PHE A C 1 135 . A ATOM 1014 O O . PHE A 1 135 ? 33.499 51.955 8.625 1.0 22.51 ? 136 PHE A O 1 135 . A ATOM 1015 C CB . PHE A 1 135 ? 36.457 51.166 9.822 1.0 20.1 ? 136 PHE A CB 1 135 . A ATOM 1016 C CG . PHE A 1 135 ? 35.782 51.984 10.898 1.0 21.93 ? 136 PHE A CG 1 135 . A ATOM 1017 C CD1 . PHE A 1 135 ? 34.889 51.391 11.786 1.0 21.25 ? 136 PHE A CD1 1 135 . A ATOM 1018 C CD2 . PHE A 1 135 ? 36.019 53.351 11.005 1.0 21.28 ? 136 PHE A CD2 1 135 . A ATOM 1019 C CE1 . PHE A 1 135 ? 34.238 52.147 12.768 1.0 22.69 ? 136 PHE A CE1 1 135 . A ATOM 1020 C CE2 . PHE A 1 135 ? 35.374 54.117 11.982 1.0 22.82 ? 136 PHE A CE2 1 135 . A ATOM 1021 C CZ . PHE A 1 135 ? 34.481 53.510 12.866 1.0 23.03 ? 136 PHE A CZ 1 135 . A ATOM 1022 N N . MET A 1 136 ? 35.245 52.593 7.358 1.0 20.19 ? 137 MET A N 1 136 . A ATOM 1023 C CA . MET A 1 136 ? 34.548 53.746 6.796 1.0 22.44 ? 137 MET A CA 1 136 . A ATOM 1024 C C . MET A 1 136 ? 33.277 53.338 6.068 1.0 20.44 ? 137 MET A C 1 136 . A ATOM 1025 O O . MET A 1 136 ? 32.250 54.008 6.172 1.0 20.09 ? 137 MET A O 1 136 . A ATOM 1026 C CB . MET A 1 136 ? 35.477 54.526 5.854 1.0 26.41 ? 137 MET A CB 1 136 . A ATOM 1027 C CG . MET A 1 136 ? 36.536 55.353 6.587 1.0 31.36 ? 137 MET A CG 1 136 . A ATOM 1028 S SD . MET A 1 136 ? 37.511 56.389 5.467 1.0 40.25 ? 137 MET A SD 1 136 . A ATOM 1029 C CE . MET A 1 136 ? 36.271 57.614 5.032 1.0 39.2 ? 137 MET A CE 1 136 . A ATOM 1030 N N . VAL A 1 137 ? 33.337 52.234 5.335 1.0 19.38 ? 138 VAL A N 1 137 . A ATOM 1031 C CA . VAL A 1 137 ? 32.156 51.770 4.620 1.0 19.29 ? 138 VAL A CA 1 137 . A ATOM 1032 C C . VAL A 1 137 ? 31.144 51.214 5.629 1.0 20.48 ? 138 VAL A C 1 137 . A ATOM 1033 O O . VAL A 1 137 ? 29.937 51.372 5.455 1.0 19.21 ? 138 VAL A O 1 137 . A ATOM 1034 C CB . VAL A 1 137 ? 32.522 50.693 3.579 1.0 20.38 ? 138 VAL A CB 1 137 . A ATOM 1035 C CG1 . VAL A 1 137 ? 31.273 50.241 2.835 1.0 19.61 ? 138 VAL A CG1 1 137 . A ATOM 1036 C CG2 . VAL A 1 137 ? 33.541 51.251 2.600 1.0 18.5 ? 138 VAL A CG2 1 137 . A ATOM 1037 N N . ALA A 1 138 ? 31.639 50.585 6.696 1.0 18.22 ? 139 ALA A N 1 138 . A ATOM 1038 C CA . ALA A 1 138 ? 30.766 50.026 7.726 1.0 18.72 ? 139 ALA A CA 1 138 . A ATOM 1039 C C . ALA A 1 138 ? 30.008 51.144 8.439 1.0 20.15 ? 139 ALA A C 1 138 . A ATOM 1040 O O . ALA A 1 138 ? 28.861 50.961 8.850 1.0 19.38 ? 139 ALA A O 1 138 . A ATOM 1041 C CB . ALA A 1 138 ? 31.582 49.209 8.735 1.0 19.79 ? 139 ALA A CB 1 138 . A ATOM 1042 N N . VAL A 1 139 ? 30.653 52.297 8.603 1.0 18.52 ? 140 VAL A N 1 139 . A ATOM 1043 C CA . VAL A 1 139 ? 29.996 53.434 9.246 1.0 20.23 ? 140 VAL A CA 1 139 . A ATOM 1044 C C . VAL A 1 139 ? 28.802 53.868 8.387 1.0 18.91 ? 140 VAL A C 1 139 . A ATOM 1045 O O . VAL A 1 139 ? 27.744 54.232 8.911 1.0 19.54 ? 140 VAL A O 1 139 . A ATOM 1046 C CB . VAL A 1 139 ? 30.966 54.631 9.418 1.0 19.61 ? 140 VAL A CB 1 139 . A ATOM 1047 C CG1 . VAL A 1 139 ? 30.187 55.902 9.747 1.0 21.94 ? 140 VAL A CG1 1 139 . A ATOM 1048 C CG2 . VAL A 1 139 ? 31.950 54.339 10.537 1.0 21.62 ? 140 VAL A CG2 1 139 . A ATOM 1049 N N . THR A 1 140 ? 28.975 53.829 7.068 1.0 18.41 ? 141 THR A N 1 140 . A ATOM 1050 C CA . THR A 1 140 ? 27.898 54.209 6.156 1.0 18.23 ? 141 THR A CA 1 140 . A ATOM 1051 C C . THR A 1 140 ? 26.754 53.205 6.282 1.0 18.27 ? 141 THR A C 1 140 . A ATOM 1052 O O . THR A 1 140 ? 25.589 53.587 6.365 1.0 19.21 ? 141 THR A O 1 140 . A ATOM 1053 C CB . THR A 1 140 ? 28.385 54.248 4.693 1.0 20.23 ? 141 THR A CB 1 140 . A ATOM 1054 O OG1 . THR A 1 140 ? 29.417 55.237 4.564 1.0 19.52 ? 141 THR A OG1 1 140 . A ATOM 1055 C CG2 . THR A 1 140 ? 27.227 54.603 3.753 1.0 19.08 ? 141 THR A CG2 1 140 . A ATOM 1056 N N . MET A 1 141 ? 27.085 51.919 6.310 1.0 17.32 ? 142 MET A N 1 141 . A ATOM 1057 C CA . MET A 1 141 ? 26.055 50.895 6.445 1.0 17.4 ? 142 MET A CA 1 141 . A ATOM 1058 C C . MET A 1 141 ? 25.322 51.068 7.775 1.0 18.21 ? 142 MET A C 1 141 . A ATOM 1059 O O . MET A 1 141 ? 24.106 50.905 7.853 1.0 19.64 ? 142 MET A O 1 141 . A ATOM 1060 C CB . MET A 1 141 ? 26.678 49.496 6.373 1.0 19.24 ? 142 MET A CB 1 141 . A ATOM 1061 C CG . MET A 1 141 ? 25.656 48.369 6.490 1.0 19.07 ? 142 MET A CG 1 141 . A ATOM 1062 S SD . MET A 1 141 ? 26.310 46.733 6.091 1.0 19.16 ? 142 MET A SD 1 141 . A ATOM 1063 C CE . MET A 1 141 ? 26.265 46.776 4.294 1.0 18.14 ? 142 MET A CE 1 141 . A ATOM 1064 N N . THR A 1 142 ? 26.073 51.395 8.821 1.0 17.6 ? 143 THR A N 1 142 . A ATOM 1065 C CA . THR A 1 142 ? 25.510 51.600 10.153 1.0 18.74 ? 143 THR A CA 1 142 . A ATOM 1066 C C . THR A 1 142 ? 24.571 52.817 10.133 1.0 20.68 ? 143 THR A C 1 142 . A ATOM 1067 O O . THR A 1 142 ? 23.511 52.819 10.763 1.0 21.41 ? 143 THR A O 1 142 . A ATOM 1068 C CB . THR A 1 142 ? 26.647 51.832 11.177 1.0 18.12 ? 143 THR A CB 1 142 . A ATOM 1069 O OG1 . THR A 1 142 ? 27.472 50.661 11.240 1.0 17.81 ? 143 THR A OG1 1 142 . A ATOM 1070 C CG2 . THR A 1 142 ? 26.089 52.122 12.551 1.0 16.96 ? 143 THR A CG2 1 142 . A ATOM 1071 N N . HIS A 1 143 ? 24.985 53.840 9.392 1.0 20.36 ? 144 HIS A N 1 143 . A ATOM 1072 C CA . HIS A 1 143 ? 24.230 55.077 9.224 1.0 20.46 ? 144 HIS A CA 1 143 . A ATOM 1073 C C . HIS A 1 143 ? 22.900 54.792 8.524 1.0 20.91 ? 144 HIS A C 1 143 . A ATOM 1074 O O . HIS A 1 143 ? 21.848 55.269 8.961 1.0 21.7 ? 144 HIS A O 1 143 . A ATOM 1075 C CB . HIS A 1 143 ? 25.067 56.056 8.385 1.0 22.14 ? 144 HIS A CB 1 143 . A ATOM 1076 C CG . HIS A 1 143 ? 24.382 57.354 8.075 1.0 22.97 ? 144 HIS A CG 1 143 . A ATOM 1077 N ND1 . HIS A 1 143 ? 24.754 58.546 8.659 1.0 23.15 ? 144 HIS A ND1 1 143 . A ATOM 1078 C CD2 . HIS A 1 143 ? 23.395 57.657 7.198 1.0 23.64 ? 144 HIS A CD2 1 143 . A ATOM 1079 C CE1 . HIS A 1 143 ? 24.029 59.529 8.153 1.0 24.17 ? 144 HIS A CE1 1 143 . A ATOM 1080 N NE2 . HIS A 1 143 ? 23.197 59.017 7.264 1.0 25.4 ? 144 HIS A NE2 1 143 . A ATOM 1081 N N . GLU A 1 144 ? 22.947 54.015 7.440 1.0 18.59 ? 145 GLU A N 1 144 . A ATOM 1082 C CA . GLU A 1 144 ? 21.733 53.687 6.689 1.0 18.23 ? 145 GLU A CA 1 144 . A ATOM 1083 C C . GLU A 1 144 ? 20.823 52.782 7.512 1.0 19.5 ? 145 GLU A C 1 144 . A ATOM 1084 O O . GLU A 1 144 ? 19.597 52.875 7.422 1.0 18.87 ? 145 GLU A O 1 144 . A ATOM 1085 C CB . GLU A 1 144 ? 22.084 53.027 5.349 1.0 19.0 ? 145 GLU A CB 1 144 . A ATOM 1086 C CG . GLU A 1 144 ? 23.001 53.875 4.465 1.0 20.77 ? 145 GLU A CG 1 144 . A ATOM 1087 C CD . GLU A 1 144 ? 22.430 55.258 4.154 1.0 21.19 ? 145 GLU A CD 1 144 . A ATOM 1088 O OE1 . GLU A 1 144 ? 23.222 56.154 3.790 1.0 20.36 ? 145 GLU A OE1 1 144 . A ATOM 1089 O OE2 . GLU A 1 144 ? 21.197 55.452 4.262 1.0 21.17 ? 145 GLU A OE2 1 144 . A ATOM 1090 N N . LEU A 1 145 ? 21.404 51.891 8.311 1.0 19.68 ? 146 LEU A N 1 145 . A ATOM 1091 C CA . LEU A 1 145 ? 20.565 51.050 9.164 1.0 19.73 ? 146 LEU A CA 1 145 . A ATOM 1092 C C . LEU A 1 145 ? 19.890 51.993 10.161 1.0 20.86 ? 146 LEU A C 1 145 . A ATOM 1093 O O . LEU A 1 145 ? 18.755 51.763 10.581 1.0 21.87 ? 146 LEU A O 1 145 . A ATOM 1094 C CB . LEU A 1 145 ? 21.407 50.008 9.909 1.0 19.05 ? 146 LEU A CB 1 145 . A ATOM 1095 C CG . LEU A 1 145 ? 21.718 48.743 9.101 1.0 21.37 ? 146 LEU A CG 1 145 . A ATOM 1096 C CD1 . LEU A 1 145 ? 22.827 47.945 9.767 1.0 22.36 ? 146 LEU A CD1 1 145 . A ATOM 1097 C CD2 . LEU A 1 145 ? 20.448 47.909 8.967 1.0 19.57 ? 146 LEU A CD2 1 145 . A ATOM 1098 N N . GLY A 1 146 ? 20.600 53.063 10.517 1.0 20.81 ? 147 GLY A N 1 146 . A ATOM 1099 C CA . GLY A 1 146 ? 20.076 54.049 11.448 1.0 22.62 ? 147 GLY A CA 1 146 . A ATOM 1100 C C . GLY A 1 146 ? 18.779 54.649 10.941 1.0 23.35 ? 147 GLY A C 1 146 . A ATOM 1101 O O . GLY A 1 146 ? 17.819 54.804 11.700 1.0 23.11 ? 147 GLY A O 1 146 . A ATOM 1102 N N . HIS A 1 147 ? 18.752 54.995 9.657 1.0 22.18 ? 148 HIS A N 1 147 . A ATOM 1103 C CA . HIS A 1 147 ? 17.554 55.550 9.042 1.0 23.0 ? 148 HIS A CA 1 147 . A ATOM 1104 C C . HIS A 1 147 ? 16.452 54.493 9.079 1.0 23.8 ? 148 HIS A C 1 147 . A ATOM 1105 O O . HIS A 1 147 ? 15.302 54.803 9.387 1.0 24.25 ? 148 HIS A O 1 147 . A ATOM 1106 C CB . HIS A 1 147 ? 17.826 55.962 7.590 1.0 23.86 ? 148 HIS A CB 1 147 . A ATOM 1107 C CG . HIS A 1 147 ? 18.604 57.234 7.453 1.0 25.72 ? 148 HIS A CG 1 147 . A ATOM 1108 N ND1 . HIS A 1 147 ? 18.184 58.426 8.004 1.0 28.32 ? 148 HIS A ND1 1 147 . A ATOM 1109 C CD2 . HIS A 1 147 ? 19.765 57.506 6.810 1.0 25.47 ? 148 HIS A CD2 1 147 . A ATOM 1110 C CE1 . HIS A 1 147 ? 19.052 59.377 7.707 1.0 28.21 ? 148 HIS A CE1 1 147 . A ATOM 1111 N NE2 . HIS A 1 147 ? 20.021 58.846 6.983 1.0 26.2 ? 148 HIS A NE2 1 147 . A ATOM 1112 N N . ASN A 1 148 ? 16.807 53.249 8.754 1.0 22.26 ? 149 ASN A N 1 148 . A ATOM 1113 C CA . ASN A 1 148 ? 15.851 52.142 8.767 1.0 22.3 ? 149 ASN A CA 1 148 . A ATOM 1114 C C . ASN A 1 148 ? 15.197 52.076 10.149 1.0 23.39 ? 149 ASN A C 1 148 . A ATOM 1115 O O . ASN A 1 148 ? 14.009 51.760 10.275 1.0 22.31 ? 149 ASN A O 1 148 . A ATOM 1116 C CB . ASN A 1 148 ? 16.558 50.800 8.511 1.0 21.16 ? 149 ASN A CB 1 148 . A ATOM 1117 C CG . ASN A 1 148 ? 16.935 50.576 7.044 1.0 24.14 ? 149 ASN A CG 1 148 . A ATOM 1118 O OD1 . ASN A 1 148 ? 17.929 49.902 6.754 1.0 23.33 ? 149 ASN A OD1 1 148 . A ATOM 1119 N ND2 . ASN A 1 148 ? 16.132 51.104 6.118 1.0 19.71 ? 149 ASN A ND2 1 148 . A ATOM 1120 N N . LEU A 1 149 ? 15.997 52.365 11.175 1.0 23.82 ? 150 LEU A N 1 149 . A ATOM 1121 C CA . LEU A 1 149 ? 15.557 52.333 12.568 1.0 25.32 ? 150 LEU A CA 1 149 . A ATOM 1122 C C . LEU A 1 149 ? 14.987 53.661 13.082 1.0 27.08 ? 150 LEU A C 1 149 . A ATOM 1123 O O . LEU A 1 149 ? 14.963 53.903 14.290 1.0 27.87 ? 150 LEU A O 1 149 . A ATOM 1124 C CB . LEU A 1 149 ? 16.716 51.888 13.470 1.0 23.66 ? 150 LEU A CB 1 149 . A ATOM 1125 C CG . LEU A 1 149 ? 17.208 50.442 13.302 1.0 25.38 ? 150 LEU A CG 1 149 . A ATOM 1126 C CD1 . LEU A 1 149 ? 18.557 50.268 13.991 1.0 21.7 ? 150 LEU A CD1 1 149 . A ATOM 1127 C CD2 . LEU A 1 149 ? 16.183 49.473 13.877 1.0 24.24 ? 150 LEU A CD2 1 149 . A ATOM 1128 N N . GLY A 1 150 ? 14.554 54.521 12.164 1.0 27.93 ? 151 GLY A N 1 150 . A ATOM 1129 C CA . GLY A 1 150 ? 13.945 55.785 12.548 1.0 29.51 ? 151 GLY A CA 1 150 . A ATOM 1130 C C . GLY A 1 150 ? 14.807 56.981 12.916 1.0 30.44 ? 151 GLY A C 1 150 . A ATOM 1131 O O . GLY A 1 150 ? 14.275 58.013 13.320 1.0 30.09 ? 151 GLY A O 1 150 . A ATOM 1132 N N . MET A 1 151 ? 16.123 56.869 12.771 1.0 29.94 ? 152 MET A N 1 151 . A ATOM 1133 C CA . MET A 1 151 ? 17.009 57.972 13.118 1.0 30.5 ? 152 MET A CA 1 151 . A ATOM 1134 C C . MET A 1 151 ? 17.117 59.021 12.023 1.0 30.99 ? 152 MET A C 1 151 . A ATOM 1135 O O . MET A 1 151 ? 17.099 58.698 10.841 1.0 31.31 ? 152 MET A O 1 151 . A ATOM 1136 C CB . MET A 1 151 ? 18.406 57.448 13.427 1.0 29.17 ? 152 MET A CB 1 151 . A ATOM 1137 C CG . MET A 1 151 ? 18.464 56.498 14.592 1.0 31.24 ? 152 MET A CG 1 151 . A ATOM 1138 S SD . MET A 1 151 ? 20.118 55.823 14.757 1.0 31.14 ? 152 MET A SD 1 151 . A ATOM 1139 C CE . MET A 1 151 ? 19.790 54.487 15.916 1.0 31.59 ? 152 MET A CE 1 151 . A ATOM 1140 N N . ALA A 1 152 ? 17.229 60.280 12.432 1.0 31.24 ? 153 ALA A N 1 152 . A ATOM 1141 C CA . ALA A 1 152 ? 17.382 61.388 11.497 1.0 32.0 ? 153 ALA A CA 1 152 . A ATOM 1142 C C . ALA A 1 152 ? 18.819 61.885 11.635 1.0 31.83 ? 153 ALA A C 1 152 . A ATOM 1143 O O . ALA A 1 152 ? 19.557 61.416 12.497 1.0 32.84 ? 153 ALA A O 1 152 . A ATOM 1144 C CB . ALA A 1 152 ? 16.394 62.508 11.828 1.0 31.55 ? 153 ALA A CB 1 152 . A ATOM 1145 N N . HIS A 1 153 ? 19.211 62.834 10.794 1.0 33.26 ? 154 HIS A N 1 153 . A ATOM 1146 C CA . HIS A 1 153 ? 20.566 63.371 10.822 1.0 35.08 ? 154 HIS A CA 1 153 . A ATOM 1147 C C . HIS A 1 153 ? 20.872 64.241 12.034 1.0 37.93 ? 154 HIS A C 1 153 . A ATOM 1148 O O . HIS A 1 153 ? 19.977 64.847 12.630 1.0 38.98 ? 154 HIS A O 1 153 . A ATOM 1149 C CB . HIS A 1 153 ? 20.829 64.179 9.550 1.0 34.81 ? 154 HIS A CB 1 153 . A ATOM 1150 C CG . HIS A 1 153 ? 21.005 63.338 8.325 1.0 35.04 ? 154 HIS A CG 1 153 . A ATOM 1151 N ND1 . HIS A 1 153 ? 20.928 63.854 7.050 1.0 35.63 ? 154 HIS A ND1 1 153 . A ATOM 1152 C CD2 . HIS A 1 153 ? 21.272 62.019 8.181 1.0 34.35 ? 154 HIS A CD2 1 153 . A ATOM 1153 C CE1 . HIS A 1 153 ? 21.138 62.889 6.173 1.0 34.15 ? 154 HIS A CE1 1 153 . A ATOM 1154 N NE2 . HIS A 1 153 ? 21.350 61.766 6.833 1.0 32.46 ? 154 HIS A NE2 1 153 . A ATOM 1155 N N . ASP A 1 154 ? 22.148 64.290 12.401 1.0 39.75 ? 155 ASP A N 1 154 . A ATOM 1156 C CA . ASP A 1 154 ? 22.574 65.119 13.517 1.0 42.04 ? 155 ASP A CA 1 154 . A ATOM 1157 C C . ASP A 1 154 ? 22.787 66.521 12.972 1.0 44.21 ? 155 ASP A C 1 154 . A ATOM 1158 O O . ASP A 1 154 ? 23.898 66.881 12.576 1.0 44.99 ? 155 ASP A O 1 154 . A ATOM 1159 C CB . ASP A 1 154 ? 23.876 64.595 14.123 1.0 40.6 ? 155 ASP A CB 1 154 . A ATOM 1160 C CG . ASP A 1 154 ? 23.677 63.323 14.907 1.0 38.55 ? 155 ASP A CG 1 154 . A ATOM 1161 O OD1 . ASP A 1 154 ? 22.636 63.213 15.582 1.0 38.66 ? 155 ASP A OD1 1 154 . A ATOM 1162 O OD2 . ASP A 1 154 ? 24.560 62.442 14.861 1.0 35.29 ? 155 ASP A OD2 1 154 . A ATOM 1163 N N . GLU A 1 155 ? 21.705 67.293 12.937 1.0 46.65 ? 156 GLU A N 1 155 . A ATOM 1164 C CA . GLU A 1 155 ? 21.738 68.662 12.440 1.0 49.61 ? 156 GLU A CA 1 155 . A ATOM 1165 C C . GLU A 1 155 ? 21.033 69.574 13.437 1.0 50.83 ? 156 GLU A C 1 155 . A ATOM 1166 O O . GLU A 1 155 ? 20.054 69.106 14.061 1.0 52.1 ? 156 GLU A O 1 155 . A ATOM 1167 C CB . GLU A 1 155 ? 21.022 68.747 11.088 1.0 50.09 ? 156 GLU A CB 1 155 . A ATOM 1168 C CG . GLU A 1 155 ? 21.543 67.781 10.038 1.0 51.68 ? 156 GLU A CG 1 155 . A ATOM 1169 C CD . GLU A 1 155 ? 20.780 67.871 8.727 1.0 52.4 ? 156 GLU A CD 1 155 . A ATOM 1170 O OE1 . GLU A 1 155 ? 19.546 67.665 8.738 1.0 52.51 ? 156 GLU A OE1 1 155 . A ATOM 1171 O OE2 . GLU A 1 155 ? 21.414 68.148 7.685 1.0 52.89 ? 156 GLU A OE2 1 155 . A ATOM 1172 N N . CYS A 1 161 ? 26.219 66.940 16.414 1.0 51.53 ? 162 CYS A N 1 161 . A ATOM 1173 C CA . CYS A 1 161 ? 27.478 66.142 16.459 1.0 50.62 ? 162 CYS A CA 1 161 . A ATOM 1174 C C . CYS A 1 161 ? 27.976 65.833 15.045 1.0 51.27 ? 162 CYS A C 1 161 . A ATOM 1175 O O . CYS A 1 161 ? 27.317 65.128 14.273 1.0 52.55 ? 162 CYS A O 1 161 . A ATOM 1176 C CB . CYS A 1 161 ? 27.241 64.849 17.246 1.0 49.5 ? 162 CYS A CB 1 161 . A ATOM 1177 S SG . CYS A 1 161 ? 28.667 63.721 17.304 1.0 49.18 ? 162 CYS A SG 1 161 . A ATOM 1178 N N . SER A 1 162 ? 29.152 66.362 14.720 1.0 50.05 ? 163 SER A N 1 162 . A ATOM 1179 C CA . SER A 1 162 ? 29.753 66.192 13.401 1.0 48.73 ? 163 SER A CA 1 162 . A ATOM 1180 C C . SER A 1 162 ? 30.515 64.888 13.164 1.0 47.11 ? 163 SER A C 1 162 . A ATOM 1181 O O . SER A 1 162 ? 30.815 64.543 12.019 1.0 47.87 ? 163 SER A O 1 162 . A ATOM 1182 C CB . SER A 1 162 ? 30.676 67.381 13.115 1.0 49.94 ? 163 SER A CB 1 162 . A ATOM 1183 O OG . SER A 1 162 ? 31.526 67.640 14.222 1.0 51.57 ? 163 SER A OG 1 162 . A ATOM 1184 N N . SER A 1 163 ? 30.832 64.163 14.229 1.0 45.0 ? 164 SER A N 1 163 . A ATOM 1185 C CA . SER A 1 163 ? 31.562 62.911 14.078 1.0 43.15 ? 164 SER A CA 1 163 . A ATOM 1186 C C . SER A 1 163 ? 30.722 61.689 14.446 1.0 41.44 ? 164 SER A C 1 163 . A ATOM 1187 O O . SER A 1 163 ? 31.192 60.555 14.352 1.0 41.41 ? 164 SER A O 1 163 . A ATOM 1188 C CB . SER A 1 163 ? 32.840 62.937 14.920 1.0 42.95 ? 164 SER A CB 1 163 . A ATOM 1189 O OG . SER A 1 163 ? 32.537 63.039 16.298 1.0 43.77 ? 164 SER A OG 1 163 . A ATOM 1190 N N . CYS A 1 164 ? 29.483 61.914 14.868 1.0 40.42 ? 165 CYS A N 1 164 . A ATOM 1191 C CA . CYS A 1 164 ? 28.611 60.800 15.224 1.0 39.59 ? 165 CYS A CA 1 164 . A ATOM 1192 C C . CYS A 1 164 ? 28.134 60.073 13.973 1.0 37.09 ? 165 CYS A C 1 164 . A ATOM 1193 O O . CYS A 1 164 ? 28.112 60.641 12.880 1.0 36.3 ? 165 CYS A O 1 164 . A ATOM 1194 C CB . CYS A 1 164 ? 27.407 61.287 16.025 1.0 41.61 ? 165 CYS A CB 1 164 . A ATOM 1195 S SG . CYS A 1 164 ? 27.828 61.908 17.681 1.0 45.37 ? 165 CYS A SG 1 164 . A ATOM 1196 N N . ILE A 1 165 ? 27.746 58.816 14.150 1.0 34.48 ? 166 ILE A N 1 165 . A ATOM 1197 C CA . ILE A 1 165 ? 27.287 57.981 13.051 1.0 31.87 ? 166 ILE A CA 1 165 . A ATOM 1198 C C . ILE A 1 165 ? 26.260 58.641 12.136 1.0 30.86 ? 166 ILE A C 1 165 . A ATOM 1199 O O . ILE A 1 165 ? 26.402 58.592 10.912 1.0 28.96 ? 166 ILE A O 1 165 . A ATOM 1200 C CB . ILE A 1 165 ? 26.706 56.650 13.584 1.0 31.05 ? 166 ILE A CB 1 165 . A ATOM 1201 C CG1 . ILE A 1 165 ? 27.807 55.863 14.303 1.0 29.94 ? 166 ILE A CG1 1 165 . A ATOM 1202 C CG2 . ILE A 1 165 ? 26.133 55.821 12.433 1.0 29.2 ? 166 ILE A CG2 1 165 . A ATOM 1203 C CD1 . ILE A 1 165 ? 27.316 54.613 15.012 1.0 30.59 ? 166 ILE A CD1 1 165 . A ATOM 1204 N N . MET A 1 166 ? 25.239 59.263 12.722 1.0 30.61 ? 167 MET A N 1 166 . A ATOM 1205 C CA . MET A 1 166 ? 24.184 59.893 11.934 1.0 32.0 ? 167 MET A CA 1 166 . A ATOM 1206 C C . MET A 1 166 ? 24.486 61.298 11.432 1.0 34.21 ? 167 MET A C 1 166 . A ATOM 1207 O O . MET A 1 166 ? 23.578 62.073 11.118 1.0 34.36 ? 167 MET A O 1 166 . A ATOM 1208 C CB . MET A 1 166 ? 22.870 59.890 12.717 1.0 30.36 ? 167 MET A CB 1 166 . A ATOM 1209 C CG . MET A 1 166 ? 22.343 58.495 13.008 1.0 28.28 ? 167 MET A CG 1 166 . A ATOM 1210 S SD . MET A 1 166 ? 22.337 57.438 11.541 1.0 27.31 ? 167 MET A SD 1 166 . A ATOM 1211 C CE . MET A 1 166 ? 21.066 58.231 10.553 1.0 27.88 ? 167 MET A CE 1 166 . A ATOM 1212 N N . SER A 1 167 ? 25.768 61.625 11.348 1.0 35.85 ? 168 SER A N 1 167 . A ATOM 1213 C CA . SER A 1 167 ? 26.172 62.924 10.844 1.0 37.68 ? 168 SER A CA 1 167 . A ATOM 1214 C C . SER A 1 167 ? 25.785 62.950 9.370 1.0 38.29 ? 168 SER A C 1 167 . A ATOM 1215 O O . SER A 1 167 ? 25.901 61.944 8.678 1.0 38.41 ? 168 SER A O 1 167 . A ATOM 1216 C CB . SER A 1 167 ? 27.681 63.094 10.984 1.0 38.6 ? 168 SER A CB 1 167 . A ATOM 1217 O OG . SER A 1 167 ? 28.078 64.365 10.520 1.0 41.33 ? 168 SER A OG 1 167 . A ATOM 1218 N N . PRO A 1 168 ? 25.308 64.098 8.871 1.0 39.9 ? 169 PRO A N 1 168 . A ATOM 1219 C CA . PRO A 1 168 ? 24.922 64.171 7.458 1.0 40.9 ? 169 PRO A CA 1 168 . A ATOM 1220 C C . PRO A 1 168 ? 26.080 63.965 6.477 1.0 42.42 ? 169 PRO A C 1 168 . A ATOM 1221 O O . PRO A 1 168 ? 25.885 63.427 5.390 1.0 44.44 ? 169 PRO A O 1 168 . A ATOM 1222 C CB . PRO A 1 168 ? 24.278 65.554 7.346 1.0 41.48 ? 169 PRO A CB 1 168 . A ATOM 1223 C CG . PRO A 1 168 ? 24.972 66.347 8.421 1.0 41.64 ? 169 PRO A CG 1 168 . A ATOM 1224 C CD . PRO A 1 168 ? 25.025 65.366 9.566 1.0 40.39 ? 169 PRO A CD 1 168 . A ATOM 1225 N N . ALA A 1 169 ? 27.284 64.376 6.859 1.0 43.3 ? 170 ALA A N 1 169 . A ATOM 1226 C CA . ALA A 1 169 ? 28.449 64.218 5.988 1.0 44.92 ? 170 ALA A CA 1 169 . A ATOM 1227 C C . ALA A 1 169 ? 29.454 63.249 6.598 1.0 45.92 ? 170 ALA A C 1 169 . A ATOM 1228 O O . ALA A 1 169 ? 29.643 63.225 7.816 1.0 45.11 ? 170 ALA A O 1 169 . A ATOM 1229 C CB . ALA A 1 169 ? 29.114 65.575 5.739 1.0 44.62 ? 170 ALA A CB 1 169 . A ATOM 1230 N N . ALA A 1 170 ? 30.100 62.459 5.743 1.0 47.77 ? 171 ALA A N 1 170 . A ATOM 1231 C CA . ALA A 1 170 ? 31.081 61.469 6.184 1.0 49.56 ? 171 ALA A CA 1 170 . A ATOM 1232 C C . ALA A 1 170 ? 32.382 62.095 6.683 1.0 50.42 ? 171 ALA A C 1 170 . A ATOM 1233 O O . ALA A 1 170 ? 33.237 62.489 5.893 1.0 52.16 ? 171 ALA A O 1 170 . A ATOM 1234 C CB . ALA A 1 170 ? 31.375 60.489 5.048 1.0 49.35 ? 171 ALA A CB 1 170 . A ATOM 1235 N N . SER A 1 171 ? 32.532 62.161 8.000 1.0 50.93 ? 172 SER A N 1 171 . A ATOM 1236 C CA . SER A 1 171 ? 33.725 62.735 8.617 1.0 50.47 ? 172 SER A CA 1 171 . A ATOM 1237 C C . SER A 1 171 ? 35.011 62.073 8.136 1.0 50.1 ? 172 SER A C 1 171 . A ATOM 1238 O O . SER A 1 171 ? 34.980 61.001 7.532 1.0 50.31 ? 172 SER A O 1 171 . A ATOM 1239 C CB . SER A 1 171 ? 33.633 62.605 10.139 1.0 50.24 ? 172 SER A CB 1 171 . A ATOM 1240 O OG . SER A 1 171 ? 34.854 62.972 10.755 1.0 50.34 ? 172 SER A OG 1 171 . A ATOM 1241 N N . SER A 1 172 ? 36.141 62.723 8.400 1.0 49.34 ? 173 SER A N 1 172 . A ATOM 1242 C CA . SER A 1 172 ? 37.440 62.177 8.021 1.0 49.08 ? 173 SER A CA 1 172 . A ATOM 1243 C C . SER A 1 172 ? 37.889 61.233 9.131 1.0 47.7 ? 173 SER A C 1 172 . A ATOM 1244 O O . SER A 1 172 ? 38.705 60.343 8.914 1.0 47.81 ? 173 SER A O 1 172 . A ATOM 1245 C CB . SER A 1 172 ? 38.474 63.295 7.844 1.0 49.78 ? 173 SER A CB 1 172 . A ATOM 1246 O OG . SER A 1 172 ? 38.226 64.053 6.673 1.0 51.02 ? 173 SER A OG 1 172 . A ATOM 1247 N N . GLY A 1 173 ? 37.346 61.448 10.326 1.0 46.42 ? 174 GLY A N 1 173 . A ATOM 1248 C CA . GLY A 1 173 ? 37.677 60.615 11.466 1.0 44.99 ? 174 GLY A CA 1 173 . A ATOM 1249 C C . GLY A 1 173 ? 36.395 60.252 12.189 1.0 44.27 ? 174 GLY A C 1 173 . A ATOM 1250 O O . GLY A 1 173 ? 36.199 60.627 13.347 1.0 44.12 ? 174 GLY A O 1 173 . A ATOM 1251 N N . PRO A 1 174 ? 35.493 59.511 11.526 1.0 43.32 ? 175 PRO A N 1 174 . A ATOM 1252 C CA . PRO A 1 174 ? 34.221 59.112 12.132 1.0 42.23 ? 175 PRO A CA 1 174 . A ATOM 1253 C C . PRO A 1 174 ? 34.361 58.304 13.415 1.0 41.6 ? 175 PRO A C 1 174 . A ATOM 1254 O O . PRO A 1 174 ? 35.265 57.480 13.544 1.0 41.42 ? 175 PRO A O 1 174 . A ATOM 1255 C CB . PRO A 1 174 ? 33.542 58.322 11.014 1.0 41.22 ? 175 PRO A CB 1 174 . A ATOM 1256 C CG . PRO A 1 174 ? 34.693 57.725 10.278 1.0 42.39 ? 175 PRO A CG 1 174 . A ATOM 1257 C CD . PRO A 1 174 ? 35.661 58.882 10.203 1.0 43.27 ? 175 PRO A CD 1 174 . A ATOM 1258 N N . SER A 1 175 ? 33.464 58.552 14.365 1.0 41.29 ? 176 SER A N 1 175 . A ATOM 1259 C CA . SER A 1 175 ? 33.476 57.825 15.628 1.0 40.83 ? 176 SER A CA 1 175 . A ATOM 1260 C C . SER A 1 175 ? 32.459 56.689 15.539 1.0 40.9 ? 176 SER A C 1 175 . A ATOM 1261 O O . SER A 1 175 ? 31.706 56.591 14.563 1.0 40.42 ? 176 SER A O 1 175 . A ATOM 1262 C CB . SER A 1 175 ? 33.100 58.746 16.789 1.0 41.13 ? 176 SER A CB 1 175 . A ATOM 1263 O OG . SER A 1 175 ? 31.717 59.048 16.772 1.0 42.56 ? 176 SER A OG 1 175 . A ATOM 1264 N N . LYS A 1 176 ? 32.442 55.838 16.559 1.0 38.6 ? 177 LYS A N 1 176 . A ATOM 1265 C CA . LYS A 1 176 ? 31.523 54.708 16.605 1.0 38.25 ? 177 LYS A CA 1 176 . A ATOM 1266 C C . LYS A 1 176 ? 30.332 55.016 17.496 1.0 38.25 ? 177 LYS A C 1 176 . A ATOM 1267 O O . LYS A 1 176 ? 29.668 54.104 17.980 1.0 38.35 ? 177 LYS A O 1 176 . A ATOM 1268 C CB . LYS A 1 176 ? 32.229 53.477 17.165 1.0 37.65 ? 177 LYS A CB 1 176 . A ATOM 1269 C CG . LYS A 1 176 ? 33.483 53.072 16.432 1.0 35.98 ? 177 LYS A CG 1 176 . A ATOM 1270 C CD . LYS A 1 176 ? 34.098 51.878 17.120 1.0 37.36 ? 177 LYS A CD 1 176 . A ATOM 1271 C CE . LYS A 1 176 ? 35.471 51.564 16.576 1.0 37.38 ? 177 LYS A CE 1 176 . A ATOM 1272 N NZ . LYS A 1 176 ? 36.109 50.507 17.402 1.0 38.75 ? 177 LYS A NZ 1 176 . A ATOM 1273 N N . LEU A 1 177 ? 30.044 56.295 17.701 1.0 37.65 ? 178 LEU A N 1 177 . A ATOM 1274 C CA . LEU A 1 177 ? 28.947 56.660 18.581 1.0 37.47 ? 178 LEU A CA 1 177 . A ATOM 1275 C C . LEU A 1 177 ? 27.718 57.272 17.938 1.0 37.17 ? 178 LEU A C 1 177 . A ATOM 1276 O O . LEU A 1 177 ? 27.802 58.008 16.954 1.0 37.71 ? 178 LEU A O 1 177 . A ATOM 1277 C CB . LEU A 1 177 ? 29.455 57.621 19.657 1.0 38.93 ? 178 LEU A CB 1 177 . A ATOM 1278 C CG . LEU A 1 177 ? 30.673 57.157 20.457 1.0 40.73 ? 178 LEU A CG 1 177 . A ATOM 1279 C CD1 . LEU A 1 177 ? 31.105 58.267 21.407 1.0 42.33 ? 178 LEU A CD1 1 177 . A ATOM 1280 C CD2 . LEU A 1 177 ? 30.336 55.884 21.224 1.0 40.33 ? 178 LEU A CD2 1 177 . A ATOM 1281 N N . PHE A 1 178 ? 26.571 56.952 18.523 1.0 36.5 ? 179 PHE A N 1 178 . A ATOM 1282 C CA . PHE A 1 178 ? 25.297 57.494 18.089 1.0 36.09 ? 179 PHE A CA 1 178 . A ATOM 1283 C C . PHE A 1 178 ? 25.070 58.712 18.973 1.0 37.54 ? 179 PHE A C 1 178 . A ATOM 1284 O O . PHE A 1 178 ? 25.403 58.685 20.159 1.0 38.55 ? 179 PHE A O 1 178 . A ATOM 1285 C CB . PHE A 1 178 ? 24.178 56.481 18.319 1.0 34.65 ? 179 PHE A CB 1 178 . A ATOM 1286 C CG . PHE A 1 178 ? 24.043 55.472 17.221 1.0 31.8 ? 179 PHE A CG 1 178 . A ATOM 1287 C CD1 . PHE A 1 178 ? 23.564 55.852 15.972 1.0 32.16 ? 179 PHE A CD1 1 178 . A ATOM 1288 C CD2 . PHE A 1 178 ? 24.396 54.145 17.431 1.0 29.64 ? 179 PHE A CD2 1 178 . A ATOM 1289 C CE1 . PHE A 1 178 ? 23.437 54.923 14.944 1.0 29.25 ? 179 PHE A CE1 1 178 . A ATOM 1290 C CE2 . PHE A 1 178 ? 24.274 53.210 16.411 1.0 30.23 ? 179 PHE A CE2 1 178 . A ATOM 1291 C CZ . PHE A 1 178 ? 23.792 53.603 15.164 1.0 28.52 ? 179 PHE A CZ 1 178 . A ATOM 1292 N N . SER A 1 179 ? 24.520 59.777 18.401 1.0 38.13 ? 180 SER A N 1 179 . A ATOM 1293 C CA . SER A 1 179 ? 24.261 60.990 19.163 1.0 39.09 ? 180 SER A CA 1 179 . A ATOM 1294 C C . SER A 1 179 ? 23.087 60.758 20.099 1.0 40.31 ? 180 SER A C 1 179 . A ATOM 1295 O O . SER A 1 179 ? 22.358 59.774 19.974 1.0 39.66 ? 180 SER A O 1 179 . A ATOM 1296 C CB . SER A 1 179 ? 23.923 62.150 18.227 1.0 38.65 ? 180 SER A CB 1 179 . A ATOM 1297 O OG . SER A 1 179 ? 22.650 61.953 17.637 1.0 36.85 ? 180 SER A OG 1 179 . A ATOM 1298 N N . ASP A 1 180 ? 22.898 61.672 21.039 1.0 41.23 ? 181 ASP A N 1 180 . A ATOM 1299 C CA . ASP A 1 180 ? 21.793 61.547 21.968 1.0 42.53 ? 181 ASP A CA 1 180 . A ATOM 1300 C C . ASP A 1 180 ? 20.493 61.775 21.216 1.0 42.19 ? 181 ASP A C 1 180 . A ATOM 1301 O O . ASP A 1 180 ? 19.457 61.208 21.561 1.0 41.75 ? 181 ASP A O 1 180 . A ATOM 1302 C CB . ASP A 1 180 ? 21.971 62.541 23.112 1.0 45.14 ? 181 ASP A CB 1 180 . A ATOM 1303 C CG . ASP A 1 180 ? 23.155 62.190 23.984 1.0 48.55 ? 181 ASP A CG 1 180 . A ATOM 1304 O OD1 . ASP A 1 180 ? 23.085 61.155 24.689 1.0 51.64 ? 181 ASP A OD1 1 180 . A ATOM 1305 O OD2 . ASP A 1 180 ? 24.180 62.917 23.962 1.0 51.55 ? 181 ASP A OD2 1 180 . A ATOM 1306 N N . CYS A 1 181 ? 20.551 62.596 20.173 1.0 42.32 ? 182 CYS A N 1 181 . A ATOM 1307 C CA . CYS A 1 181 ? 19.367 62.855 19.368 1.0 42.76 ? 182 CYS A CA 1 181 . A ATOM 1308 C C . CYS A 1 181 ? 19.016 61.555 18.648 1.0 40.81 ? 182 CYS A C 1 181 . A ATOM 1309 O O . CYS A 1 181 ? 17.848 61.180 18.561 1.0 40.36 ? 182 CYS A O 1 181 . A ATOM 1310 C CB . CYS A 1 181 ? 19.639 63.968 18.355 1.0 44.03 ? 182 CYS A CB 1 181 . A ATOM 1311 S SG . CYS A 1 181 ? 20.064 65.564 19.107 1.0 49.31 ? 182 CYS A SG 1 181 . A ATOM 1312 N N . SER A 1 182 ? 20.041 60.868 18.146 1.0 39.55 ? 183 SER A N 1 182 . A ATOM 1313 C CA . SER A 1 182 ? 19.848 59.601 17.445 1.0 38.06 ? 183 SER A CA 1 182 . A ATOM 1314 C C . SER A 1 182 ? 19.202 58.576 18.369 1.0 37.74 ? 183 SER A C 1 182 . A ATOM 1315 O O . SER A 1 182 ? 18.315 57.832 17.959 1.0 36.3 ? 183 SER A O 1 182 . A ATOM 1316 C CB . SER A 1 182 ? 21.187 59.056 16.935 1.0 37.18 ? 183 SER A CB 1 182 . A ATOM 1317 O OG . SER A 1 182 ? 21.695 59.842 15.870 1.0 36.02 ? 183 SER A OG 1 182 . A ATOM 1318 N N . LYS A 1 183 ? 19.646 58.541 19.620 1.0 38.59 ? 184 LYS A N 1 183 . A ATOM 1319 C CA . LYS A 1 183 ? 19.089 57.599 20.581 1.0 39.64 ? 184 LYS A CA 1 183 . A ATOM 1320 C C . LYS A 1 183 ? 17.630 57.922 20.871 1.0 40.44 ? 184 LYS A C 1 183 . A ATOM 1321 O O . LYS A 1 183 ? 16.814 57.019 21.067 1.0 40.46 ? 184 LYS A O 1 183 . A ATOM 1322 C CB . LYS A 1 183 ? 19.904 57.616 21.874 1.0 40.17 ? 184 LYS A CB 1 183 . A ATOM 1323 C CG . LYS A 1 183 ? 21.333 57.137 21.685 1.0 41.07 ? 184 LYS A CG 1 183 . A ATOM 1324 C CD . LYS A 1 183 ? 22.096 57.085 22.997 1.0 42.57 ? 184 LYS A CD 1 183 . A ATOM 1325 C CE . LYS A 1 183 ? 23.519 56.601 22.776 1.0 43.7 ? 184 LYS A CE 1 183 . A ATOM 1326 N NZ . LYS A 1 183 ? 24.277 56.497 24.053 1.0 45.91 ? 184 LYS A NZ 1 183 . A ATOM 1327 N N . ASP A 1 184 ? 17.300 59.210 20.891 1.0 40.66 ? 185 ASP A N 1 184 . A ATOM 1328 C CA . ASP A 1 184 ? 15.927 59.628 21.144 1.0 41.05 ? 185 ASP A CA 1 184 . A ATOM 1329 C C . ASP A 1 184 ? 15.035 59.243 19.975 1.0 40.62 ? 185 ASP A C 1 184 . A ATOM 1330 O O . ASP A 1 184 ? 13.884 58.853 20.171 1.0 40.19 ? 185 ASP A O 1 184 . A ATOM 1331 C CB . ASP A 1 184 ? 15.847 61.140 21.367 1.0 42.62 ? 185 ASP A CB 1 184 . A ATOM 1332 C CG . ASP A 1 184 ? 16.576 61.582 22.614 1.0 45.39 ? 185 ASP A CG 1 184 . A ATOM 1333 O OD1 . ASP A 1 184 ? 16.373 60.955 23.677 1.0 46.24 ? 185 ASP A OD1 1 184 . A ATOM 1334 O OD2 . ASP A 1 184 ? 17.347 62.562 22.534 1.0 47.44 ? 185 ASP A OD2 1 184 . A ATOM 1335 N N . ASP A 1 185 ? 15.561 59.360 18.758 1.0 40.0 ? 186 ASP A N 1 185 . A ATOM 1336 C CA . ASP A 1 185 ? 14.785 59.001 17.576 1.0 39.59 ? 186 ASP A CA 1 185 . A ATOM 1337 C C . ASP A 1 185 ? 14.519 57.504 17.602 1.0 37.97 ? 186 ASP A C 1 185 . A ATOM 1338 O O . ASP A 1 185 ? 13.437 57.051 17.243 1.0 36.77 ? 186 ASP A O 1 185 . A ATOM 1339 C CB . ASP A 1 185 ? 15.533 59.362 16.289 1.0 41.39 ? 186 ASP A CB 1 185 . A ATOM 1340 C CG . ASP A 1 185 ? 15.728 60.857 16.123 1.0 42.69 ? 186 ASP A CG 1 185 . A ATOM 1341 O OD1 . ASP A 1 185 ? 14.999 61.630 16.782 1.0 43.3 ? 186 ASP A OD1 1 185 . A ATOM 1342 O OD2 . ASP A 1 185 ? 16.599 61.258 15.320 1.0 42.77 ? 186 ASP A OD2 1 185 . A ATOM 1343 N N . TYR A 1 186 ? 15.519 56.737 18.021 1.0 37.5 ? 187 TYR A N 1 186 . A ATOM 1344 C CA . TYR A 1 186 ? 15.369 55.293 18.101 1.0 36.59 ? 187 TYR A CA 1 186 . A ATOM 1345 C C . TYR A 1 186 ? 14.319 54.960 19.158 1.0 37.64 ? 187 TYR A C 1 186 . A ATOM 1346 O O . TYR A 1 186 ? 13.522 54.032 18.991 1.0 36.94 ? 187 TYR A O 1 186 . A ATOM 1347 C CB . TYR A 1 186 ? 16.694 54.636 18.475 1.0 35.03 ? 187 TYR A CB 1 186 . A ATOM 1348 C CG . TYR A 1 186 ? 16.595 53.136 18.613 1.0 32.67 ? 187 TYR A CG 1 186 . A ATOM 1349 C CD1 . TYR A 1 186 ? 17.138 52.485 19.718 1.0 32.46 ? 187 TYR A CD1 1 186 . A ATOM 1350 C CD2 . TYR A 1 186 ? 15.939 52.366 17.651 1.0 32.68 ? 187 TYR A CD2 1 186 . A ATOM 1351 C CE1 . TYR A 1 186 ? 17.030 51.112 19.868 1.0 32.0 ? 187 TYR A CE1 1 186 . A ATOM 1352 C CE2 . TYR A 1 186 ? 15.826 50.983 17.792 1.0 32.02 ? 187 TYR A CE2 1 186 . A ATOM 1353 C CZ . TYR A 1 186 ? 16.372 50.367 18.905 1.0 32.05 ? 187 TYR A CZ 1 186 . A ATOM 1354 O OH . TYR A 1 186 ? 16.253 49.010 19.077 1.0 33.42 ? 187 TYR A OH 1 186 . A ATOM 1355 N N . GLN A 1 187 ? 14.323 55.715 20.253 1.0 38.05 ? 188 GLN A N 1 187 . A ATOM 1356 C CA . GLN A 1 187 ? 13.346 55.480 21.307 1.0 38.93 ? 188 GLN A CA 1 187 . A ATOM 1357 C C . GLN A 1 187 ? 11.959 55.720 20.727 1.0 37.97 ? 188 GLN A C 1 187 . A ATOM 1358 O O . GLN A 1 187 ? 11.057 54.895 20.881 1.0 37.75 ? 188 GLN A O 1 187 . A ATOM 1359 C CB . GLN A 1 187 ? 13.583 56.416 22.494 1.0 40.46 ? 188 GLN A CB 1 187 . A ATOM 1360 C CG . GLN A 1 187 ? 12.602 56.186 23.640 1.0 43.98 ? 188 GLN A CG 1 187 . A ATOM 1361 C CD . GLN A 1 187 ? 12.590 54.745 24.120 1.0 45.11 ? 188 GLN A CD 1 187 . A ATOM 1362 O OE1 . GLN A 1 187 ? 13.588 54.243 24.641 1.0 46.82 ? 188 GLN A OE1 1 187 . A ATOM 1363 N NE2 . GLN A 1 187 ? 11.457 54.070 23.943 1.0 46.32 ? 188 GLN A NE2 1 187 . A ATOM 1364 N N . THR A 1 188 ? 11.796 56.849 20.047 1.0 37.59 ? 189 THR A N 1 188 . A ATOM 1365 C CA . THR A 1 188 ? 10.514 57.176 19.438 1.0 38.73 ? 189 THR A CA 1 188 . A ATOM 1366 C C . THR A 1 188 ? 10.092 56.044 18.506 1.0 38.51 ? 189 THR A C 1 188 . A ATOM 1367 O O . THR A 1 188 ? 8.925 55.655 18.476 1.0 38.63 ? 189 THR A O 1 188 . A ATOM 1368 C CB . THR A 1 188 ? 10.595 58.483 18.633 1.0 40.18 ? 189 THR A CB 1 188 . A ATOM 1369 O OG1 . THR A 1 188 ? 11.042 59.542 19.488 1.0 40.79 ? 189 THR A OG1 1 188 . A ATOM 1370 C CG2 . THR A 1 188 ? 9.228 58.843 18.067 1.0 40.74 ? 189 THR A CG2 1 188 . A ATOM 1371 N N . PHE A 1 189 ? 11.054 55.508 17.759 1.0 37.52 ? 190 PHE A N 1 189 . A ATOM 1372 C CA . PHE A 1 189 ? 10.784 54.417 16.832 1.0 36.06 ? 190 PHE A CA 1 189 . A ATOM 1373 C C . PHE A 1 189 ? 10.237 53.194 17.563 1.0 35.37 ? 190 PHE A C 1 189 . A ATOM 1374 O O . PHE A 1 189 ? 9.242 52.604 17.143 1.0 35.86 ? 190 PHE A O 1 189 . A ATOM 1375 C CB . PHE A 1 189 ? 12.063 54.035 16.086 1.0 35.96 ? 190 PHE A CB 1 189 . A ATOM 1376 C CG . PHE A 1 189 ? 11.869 52.952 15.067 1.0 36.46 ? 190 PHE A CG 1 189 . A ATOM 1377 C CD1 . PHE A 1 189 ? 11.119 53.187 13.920 1.0 35.63 ? 190 PHE A CD1 1 189 . A ATOM 1378 C CD2 . PHE A 1 189 ? 12.442 51.695 15.249 1.0 36.87 ? 190 PHE A CD2 1 189 . A ATOM 1379 C CE1 . PHE A 1 189 ? 10.939 52.186 12.965 1.0 36.46 ? 190 PHE A CE1 1 189 . A ATOM 1380 C CE2 . PHE A 1 189 ? 12.268 50.687 14.301 1.0 35.62 ? 190 PHE A CE2 1 189 . A ATOM 1381 C CZ . PHE A 1 189 ? 11.516 50.933 13.156 1.0 36.05 ? 190 PHE A CZ 1 189 . A ATOM 1382 N N . LEU A 1 190 ? 10.893 52.813 18.654 1.0 34.92 ? 191 LEU A N 1 190 . A ATOM 1383 C CA . LEU A 1 190 ? 10.460 51.660 19.436 1.0 36.03 ? 191 LEU A CA 1 190 . A ATOM 1384 C C . LEU A 1 190 ? 9.079 51.901 20.039 1.0 36.66 ? 191 LEU A C 1 190 . A ATOM 1385 O O . LEU A 1 190 ? 8.271 50.982 20.149 1.0 37.54 ? 191 LEU A O 1 190 . A ATOM 1386 C CB . LEU A 1 190 ? 11.460 51.360 20.558 1.0 35.56 ? 191 LEU A CB 1 190 . A ATOM 1387 C CG . LEU A 1 190 ? 12.841 50.812 20.183 1.0 35.16 ? 191 LEU A CG 1 190 . A ATOM 1388 C CD1 . LEU A 1 190 ? 13.681 50.647 21.436 1.0 36.4 ? 191 LEU A CD1 1 190 . A ATOM 1389 C CD2 . LEU A 1 190 ? 12.697 49.479 19.482 1.0 35.83 ? 191 LEU A CD2 1 190 . A ATOM 1390 N N . THR A 1 191 ? 8.808 53.144 20.421 1.0 37.89 ? 192 THR A N 1 191 . A ATOM 1391 C CA . THR A 1 191 ? 7.522 53.488 21.018 1.0 39.36 ? 192 THR A CA 1 191 . A ATOM 1392 C C . THR A 1 191 ? 6.393 53.633 19.998 1.0 40.45 ? 192 THR A C 1 191 . A ATOM 1393 O O . THR A 1 191 ? 5.326 53.040 20.162 1.0 42.47 ? 192 THR A O 1 191 . A ATOM 1394 C CB . THR A 1 191 ? 7.626 54.794 21.835 1.0 39.49 ? 192 THR A CB 1 191 . A ATOM 1395 O OG1 . THR A 1 191 ? 8.524 54.596 22.936 1.0 37.56 ? 192 THR A OG1 1 191 . A ATOM 1396 C CG2 . THR A 1 191 ? 6.254 55.208 22.364 1.0 40.42 ? 192 THR A CG2 1 191 . A ATOM 1397 N N . ASN A 1 192 ? 6.622 54.408 18.944 1.0 41.17 ? 193 ASN A N 1 192 . A ATOM 1398 C CA . ASN A 1 192 ? 5.591 54.619 17.931 1.0 42.33 ? 193 ASN A CA 1 192 . A ATOM 1399 C C . ASN A 1 192 ? 5.451 53.503 16.902 1.0 42.29 ? 193 ASN A C 1 192 . A ATOM 1400 O O . ASN A 1 192 ? 4.354 53.261 16.399 1.0 42.26 ? 193 ASN A O 1 192 . A ATOM 1401 C CB . ASN A 1 192 ? 5.829 55.941 17.196 1.0 44.55 ? 193 ASN A CB 1 192 . A ATOM 1402 C CG . ASN A 1 192 ? 5.552 57.151 18.064 1.0 47.44 ? 193 ASN A CG 1 192 . A ATOM 1403 O OD1 . ASN A 1 192 ? 5.552 58.287 17.582 1.0 49.5 ? 193 ASN A OD1 1 192 . A ATOM 1404 N ND2 . ASN A 1 192 ? 5.315 56.918 19.351 1.0 47.23 ? 193 ASN A ND2 1 192 . A ATOM 1405 N N . THR A 1 193 ? 6.553 52.832 16.581 1.0 41.79 ? 194 THR A N 1 193 . A ATOM 1406 C CA . THR A 1 193 ? 6.524 51.758 15.591 1.0 41.08 ? 194 THR A CA 1 193 . A ATOM 1407 C C . THR A 1 193 ? 6.633 50.378 16.208 1.0 39.5 ? 194 THR A C 1 193 . A ATOM 1408 O O . THR A 1 193 ? 5.785 49.519 15.977 1.0 40.15 ? 194 THR A O 1 193 . A ATOM 1409 C CB . THR A 1 193 ? 7.668 51.895 14.575 1.0 41.18 ? 194 THR A CB 1 193 . A ATOM 1410 O OG1 . THR A 1 193 ? 7.539 53.134 13.878 1.0 42.5 ? 194 THR A OG1 1 193 . A ATOM 1411 C CG2 . THR A 1 193 ? 7.621 50.760 13.564 1.0 42.83 ? 194 THR A CG2 1 193 . A ATOM 1412 N N . ASN A 1 194 ? 7.693 50.167 16.978 1.0 38.46 ? 195 ASN A N 1 194 . A ATOM 1413 C CA . ASN A 1 194 ? 7.928 48.886 17.626 1.0 37.8 ? 195 ASN A CA 1 194 . A ATOM 1414 C C . ASN A 1 194 ? 7.723 47.718 16.662 1.0 36.2 ? 195 ASN A C 1 194 . A ATOM 1415 O O . ASN A 1 194 ? 6.834 46.892 16.856 1.0 35.58 ? 195 ASN A O 1 194 . A ATOM 1416 C CB . ASN A 1 194 ? 6.997 48.722 18.828 1.0 39.2 ? 195 ASN A CB 1 194 . A ATOM 1417 C CG . ASN A 1 194 ? 7.274 47.454 19.600 1.0 39.77 ? 195 ASN A CG 1 194 . A ATOM 1418 O OD1 . ASN A 1 194 ? 8.411 47.192 19.992 1.0 41.02 ? 195 ASN A OD1 1 194 . A ATOM 1419 N ND2 . ASN A 1 194 ? 6.236 46.657 19.825 1.0 41.69 ? 195 ASN A ND2 1 194 . A ATOM 1420 N N . PRO A 1 195 ? 8.548 47.637 15.605 1.0 35.7 ? 196 PRO A N 1 195 . A ATOM 1421 C CA . PRO A 1 195 ? 8.439 46.554 14.620 1.0 33.5 ? 196 PRO A CA 1 195 . A ATOM 1422 C C . PRO A 1 195 ? 8.657 45.186 15.266 1.0 32.55 ? 196 PRO A C 1 195 . A ATOM 1423 O O . PRO A 1 195 ? 9.561 45.008 16.082 1.0 31.9 ? 196 PRO A O 1 195 . A ATOM 1424 C CB . PRO A 1 195 ? 9.518 46.911 13.594 1.0 34.0 ? 196 PRO A CB 1 195 . A ATOM 1425 C CG . PRO A 1 195 ? 10.550 47.605 14.427 1.0 34.65 ? 196 PRO A CG 1 195 . A ATOM 1426 C CD . PRO A 1 195 ? 9.710 48.496 15.315 1.0 34.56 ? 196 PRO A CD 1 195 . A ATOM 1427 N N . GLN A 1 196 ? 7.823 44.225 14.883 1.0 31.66 ? 197 GLN A N 1 196 . A ATOM 1428 C CA . GLN A 1 196 ? 7.866 42.873 15.427 1.0 31.52 ? 197 GLN A CA 1 196 . A ATOM 1429 C C . GLN A 1 196 ? 9.090 42.018 15.103 1.0 30.65 ? 197 GLN A C 1 196 . A ATOM 1430 O O . GLN A 1 196 ? 9.614 41.325 15.974 1.0 29.98 ? 197 GLN A O 1 196 . A ATOM 1431 C CB . GLN A 1 196 ? 6.602 42.120 14.988 1.0 33.5 ? 197 GLN A CB 1 196 . A ATOM 1432 C CG . GLN A 1 196 ? 6.736 40.602 14.968 1.0 37.11 ? 197 GLN A CG 1 196 . A ATOM 1433 C CD . GLN A 1 196 ? 6.612 39.974 16.337 1.0 37.79 ? 197 GLN A CD 1 196 . A ATOM 1434 O OE1 . GLN A 1 196 ? 7.051 38.847 16.553 1.0 37.78 ? 197 GLN A OE1 1 196 . A ATOM 1435 N NE2 . GLN A 1 196 ? 5.997 40.695 17.268 1.0 38.89 ? 197 GLN A NE2 1 196 . A ATOM 1436 N N . CYS A 1 197 ? 9.552 42.057 13.859 1.0 28.83 ? 198 CYS A N 1 197 . A ATOM 1437 C CA . CYS A 1 197 ? 10.678 41.215 13.479 1.0 26.93 ? 198 CYS A CA 1 197 . A ATOM 1438 C C . CYS A 1 197 ? 11.946 41.354 14.323 1.0 25.01 ? 198 CYS A C 1 197 . A ATOM 1439 O O . CYS A 1 197 ? 12.600 40.352 14.606 1.0 23.63 ? 198 CYS A O 1 197 . A ATOM 1440 C CB . CYS A 1 197 ? 10.995 41.398 11.985 1.0 26.45 ? 198 CYS A CB 1 197 . A ATOM 1441 S SG . CYS A 1 197 ? 12.158 42.715 11.497 1.0 25.73 ? 198 CYS A SG 1 197 . A ATOM 1442 N N . ILE A 1 198 ? 12.286 42.566 14.756 1.0 24.53 ? 199 ILE A N 1 198 . A ATOM 1443 C CA . ILE A 1 198 ? 13.509 42.741 15.539 1.0 24.83 ? 199 ILE A CA 1 198 . A ATOM 1444 C C . ILE A 1 198 ? 13.425 42.312 17.005 1.0 26.56 ? 199 ILE A C 1 198 . A ATOM 1445 O O . ILE A 1 198 ? 14.353 42.545 17.782 1.0 25.2 ? 199 ILE A O 1 198 . A ATOM 1446 C CB . ILE A 1 198 ? 14.030 44.195 15.468 1.0 25.46 ? 199 ILE A CB 1 198 . A ATOM 1447 C CG1 . ILE A 1 198 ? 12.955 45.173 15.945 1.0 25.49 ? 199 ILE A CG1 1 198 . A ATOM 1448 C CG2 . ILE A 1 198 ? 14.466 44.515 14.038 1.0 23.2 ? 199 ILE A CG2 1 198 . A ATOM 1449 C CD1 . ILE A 1 198 ? 13.470 46.593 16.111 1.0 27.42 ? 199 ILE A CD1 1 198 . A ATOM 1450 N N . LEU A 1 199 ? 12.314 41.685 17.378 1.0 27.68 ? 200 LEU A N 1 199 . A ATOM 1451 C CA . LEU A 1 199 ? 12.131 41.188 18.738 1.0 29.8 ? 200 LEU A CA 1 199 . A ATOM 1452 C C . LEU A 1 199 ? 12.660 39.757 18.776 1.0 29.82 ? 200 LEU A C 1 199 . A ATOM 1453 O O . LEU A 1 199 ? 13.022 39.235 19.831 1.0 30.63 ? 200 LEU A O 1 199 . A ATOM 1454 C CB . LEU A 1 199 ? 10.644 41.173 19.106 1.0 30.69 ? 200 LEU A CB 1 199 . A ATOM 1455 C CG . LEU A 1 199 ? 9.943 42.497 19.403 1.0 34.22 ? 200 LEU A CG 1 199 . A ATOM 1456 C CD1 . LEU A 1 199 ? 8.446 42.251 19.571 1.0 36.66 ? 200 LEU A CD1 1 199 . A ATOM 1457 C CD2 . LEU A 1 199 ? 10.525 43.112 20.670 1.0 35.36 ? 200 LEU A CD2 1 199 . A ATOM 1458 N N . ASN A 1 200 ? 12.711 39.141 17.601 1.0 29.65 ? 201 ASN A N 1 200 . A ATOM 1459 C CA . ASN A 1 200 ? 13.142 37.758 17.457 1.0 30.55 ? 201 ASN A CA 1 200 . A ATOM 1460 C C . ASN A 1 200 ? 14.645 37.545 17.379 1.0 31.64 ? 201 ASN A C 1 200 . A ATOM 1461 O O . ASN A 1 200 ? 15.323 38.075 16.495 1.0 31.3 ? 201 ASN A O 1 200 . A ATOM 1462 C CB . ASN A 1 200 ? 12.482 37.148 16.218 1.0 30.9 ? 201 ASN A CB 1 200 . A ATOM 1463 C CG . ASN A 1 200 ? 10.975 37.314 16.226 1.0 33.73 ? 201 ASN A CG 1 200 . A ATOM 1464 O OD1 . ASN A 1 200 ? 10.310 36.957 17.197 1.0 34.51 ? 201 ASN A OD1 1 200 . A ATOM 1465 N ND2 . ASN A 1 200 ? 10.428 37.855 15.144 1.0 31.49 ? 201 ASN A ND2 1 200 . A ATOM 1466 N N . ALA A 1 201 ? 15.164 36.754 18.309 1.0 31.65 ? 202 ALA A N 1 201 . A ATOM 1467 C CA . ALA A 1 201 ? 16.583 36.451 18.324 1.0 32.3 ? 202 ALA A CA 1 201 . A ATOM 1468 C C . ALA A 1 201 ? 16.809 35.439 17.213 1.0 33.06 ? 202 ALA A C 1 201 . A ATOM 1469 O O . ALA A 1 201 ? 15.883 34.731 16.820 1.0 32.46 ? 202 ALA A O 1 201 . A ATOM 1470 C CB . ALA A 1 201 ? 16.980 35.854 19.670 1.0 32.13 ? 202 ALA A CB 1 201 . A ATOM 1471 N N . PRO A 1 202 ? 18.034 35.374 16.667 1.0 34.88 ? 203 PRO A N 1 202 . A ATOM 1472 C CA . PRO A 1 202 ? 18.289 34.403 15.598 1.0 35.59 ? 203 PRO A CA 1 202 . A ATOM 1473 C C . PRO A 1 202 ? 18.025 32.989 16.116 1.0 37.12 ? 203 PRO A C 1 202 . A ATOM 1474 O O . PRO A 1 202 ? 18.062 32.810 17.357 1.0 37.31 ? 203 PRO A O 1 202 . A ATOM 1475 C CB . PRO A 1 202 ? 19.765 34.625 15.275 1.0 35.35 ? 203 PRO A CB 1 202 . A ATOM 1476 C CG . PRO A 1 202 ? 19.955 36.072 15.552 1.0 34.24 ? 203 PRO A CG 1 202 . A ATOM 1477 C CD . PRO A 1 202 ? 19.189 36.271 16.850 1.0 34.93 ? 203 PRO A CD 1 202 . A ATOM 1478 O OXT . PRO A 1 202 ? 17.804 32.082 15.285 1.0 39.2 ? 203 PRO A OXT 1 202 . A HETATM 1479 ZN ZN . ZN C 2 . ? 21.581 59.860 6.127 1.0 28.04 ? 301 ZN C ZN 1 301 . A HETATM 1480 ZN ZN . ZN D 2 . ? 31.336 39.511 -14.219 1.0 34.35 ? 302 ZN D ZN 1 302 . A HETATM 1481 ZN ZN . ZN E 2 . ? 14.653 30.673 18.218 1.0 51.69 ? 303 ZN E ZN 1 303 . A HETATM 1482 ZN ZN . ZN F 2 . ? 19.472 60.452 -10.154 1.0 23.97 ? 304 ZN F ZN 1 304 . A HETATM 1483 O O . HOH I 3 . ? 21.865 59.006 4.086 1.0 29.96 ? 401 HOH I O 1 401 . A HETATM 1484 O O . HOH I 3 . ? 25.215 59.703 1.500 1.0 28.94 ? 402 HOH I O 1 402 . A HETATM 1485 O O . HOH I 3 . ? 18.191 60.763 -3.614 1.0 25.67 ? 403 HOH I O 1 403 . A HETATM 1486 O O . HOH I 3 . ? 24.885 33.317 9.236 1.0 20.91 ? 404 HOH I O 1 404 . A HETATM 1487 O O . HOH I 3 . ? 24.328 36.733 -10.327 1.0 24.07 ? 405 HOH I O 1 405 . A HETATM 1488 O O . HOH I 3 . ? 17.251 48.088 21.286 1.0 29.37 ? 406 HOH I O 1 406 . A HETATM 1489 O O . HOH I 3 . ? 10.832 42.026 6.695 1.0 30.72 ? 407 HOH I O 1 407 . A HETATM 1490 O O . HOH I 3 . ? 23.694 34.056 11.695 1.0 32.72 ? 408 HOH I O 1 408 . A HETATM 1491 O O . HOH I 3 . ? 30.857 61.119 23.960 1.0 60.72 ? 409 HOH I O 1 409 . A HETATM 1492 O O . HOH I 3 . ? 26.918 37.571 12.083 1.0 30.74 ? 410 HOH I O 1 410 . A HETATM 1493 O O . HOH I 3 . ? 26.435 46.039 -10.490 1.0 16.92 ? 411 HOH I O 1 411 . A HETATM 1494 O O . HOH I 3 . ? 19.110 57.599 3.220 1.0 28.24 ? 412 HOH I O 1 412 . A HETATM 1495 O O . HOH I 3 . ? 26.253 54.812 20.590 1.0 36.45 ? 413 HOH I O 1 413 . A HETATM 1496 O O . HOH I 3 . ? 22.744 46.148 -13.190 1.0 20.71 ? 414 HOH I O 1 414 . A HETATM 1497 O O . HOH I 3 . ? 33.422 36.780 10.625 1.0 45.55 ? 415 HOH I O 1 415 . A HETATM 1498 O O . HOH I 3 . ? 39.505 46.582 -9.846 1.0 39.45 ? 416 HOH I O 1 416 . A HETATM 1499 O O . HOH I 3 . ? 22.263 39.552 24.011 1.0 64.7 ? 417 HOH I O 1 417 . A HETATM 1500 O O . HOH I 3 . ? 40.744 44.314 -1.370 1.0 36.63 ? 418 HOH I O 1 418 . A HETATM 1501 O O . HOH I 3 . ? 21.205 35.955 11.718 1.0 26.93 ? 419 HOH I O 1 419 . A HETATM 1502 O O . HOH I 3 . ? 33.967 51.720 -6.157 1.0 26.11 ? 420 HOH I O 1 420 . A HETATM 1503 O O . HOH I 3 . ? 23.271 57.238 26.827 1.0 62.08 ? 421 HOH I O 1 421 . A HETATM 1504 O O . HOH I 3 . ? 25.355 38.871 25.606 1.0 64.92 ? 422 HOH I O 1 422 . A HETATM 1505 O O . HOH I 3 . ? 41.010 47.005 -0.830 1.0 31.23 ? 423 HOH I O 1 423 . A HETATM 1506 O O . HOH I 3 . ? 17.886 61.871 4.533 1.0 59.62 ? 424 HOH I O 1 424 . A HETATM 1507 O O . HOH I 3 . ? 24.369 33.190 -0.982 1.0 28.27 ? 425 HOH I O 1 425 . A HETATM 1508 O O . HOH I 3 . ? 8.263 54.712 2.818 1.0 53.26 ? 426 HOH I O 1 426 . A HETATM 1509 O O . HOH I 3 . ? 20.907 38.931 15.712 1.0 27.52 ? 427 HOH I O 1 427 . A HETATM 1510 O O . HOH I 3 . ? 15.178 29.637 4.815 1.0 27.65 ? 428 HOH I O 1 428 . A HETATM 1511 O O . HOH I 3 . ? 14.354 41.887 -11.194 1.0 48.09 ? 429 HOH I O 1 429 . A HETATM 1512 O O . HOH I 3 . ? 21.691 44.470 -15.042 1.0 45.69 ? 430 HOH I O 1 430 . A HETATM 1513 O O . HOH I 3 . ? 14.089 57.377 0.513 1.0 42.29 ? 431 HOH I O 1 431 . A HETATM 1514 O O . HOH I 3 . ? 19.608 31.662 2.296 1.0 19.47 ? 432 HOH I O 1 432 . A HETATM 1515 O O . HOH I 3 . ? 18.159 49.677 29.745 1.0 53.08 ? 433 HOH I O 1 433 . A HETATM 1516 O O . HOH I 3 . ? 30.579 58.397 12.706 1.0 32.05 ? 434 HOH I O 1 434 . A HETATM 1517 O O . HOH I 3 . ? 17.137 29.337 7.519 1.0 28.06 ? 435 HOH I O 1 435 . A HETATM 1518 O O . HOH I 3 . ? 13.039 38.081 10.211 1.0 27.73 ? 436 HOH I O 1 436 . A HETATM 1519 O O . HOH I 3 . ? 19.013 29.405 5.437 1.0 24.81 ? 437 HOH I O 1 437 . A HETATM 1520 O O . HOH I 3 . ? 22.872 43.512 22.339 1.0 51.05 ? 438 HOH I O 1 438 . A HETATM 1521 O O . HOH I 3 . ? 7.577 43.731 23.440 1.0 50.62 ? 439 HOH I O 1 439 . A HETATM 1522 O O . HOH I 3 . ? 21.996 37.903 17.882 1.0 44.36 ? 440 HOH I O 1 440 . A HETATM 1523 O O . HOH I 3 . ? 18.965 35.617 25.825 1.0 56.2 ? 441 HOH I O 1 441 . A HETATM 1524 O O . HOH I 3 . ? 27.615 39.562 14.055 1.0 26.27 ? 442 HOH I O 1 442 . A HETATM 1525 O O . HOH I 3 . ? 18.334 34.400 11.816 1.0 39.42 ? 443 HOH I O 1 443 . A HETATM 1526 O O . HOH I 3 . ? 30.982 36.610 12.908 1.0 43.84 ? 444 HOH I O 1 444 . A HETATM 1527 O O . HOH I 3 . ? 29.286 33.239 -11.476 1.0 39.92 ? 445 HOH I O 1 445 . A HETATM 1528 O O . HOH I 3 . ? 34.935 54.068 -14.863 1.0 59.83 ? 446 HOH I O 1 446 . A HETATM 1529 O O . HOH I 3 . ? 16.563 42.691 -14.760 1.0 58.08 ? 447 HOH I O 1 447 . A HETATM 1530 O O . HOH I 3 . ? 28.330 48.239 -9.102 1.0 27.49 ? 448 HOH I O 1 448 . A HETATM 1531 O O . HOH I 3 . ? 40.051 47.909 -4.948 1.0 51.26 ? 449 HOH I O 1 449 . A HETATM 1532 O O . HOH I 3 . ? 40.781 37.343 6.716 1.0 38.82 ? 450 HOH I O 1 450 . A HETATM 1533 O O . HOH I 3 . ? 37.419 39.811 7.562 1.0 23.42 ? 451 HOH I O 1 451 . A HETATM 1534 O O . HOH I 3 . ? 38.902 41.413 1.826 1.0 36.72 ? 452 HOH I O 1 452 . A HETATM 1535 O O . HOH I 3 . ? 40.431 45.128 3.235 1.0 25.08 ? 453 HOH I O 1 453 . A HETATM 1536 O O . HOH I 3 . ? 25.351 44.394 17.797 1.0 27.82 ? 454 HOH I O 1 454 . A HETATM 1537 O O . HOH I 3 . ? 37.631 49.239 21.669 1.0 41.24 ? 455 HOH I O 1 455 . A HETATM 1538 O O . HOH I 3 . ? 24.904 46.629 25.775 1.0 61.01 ? 456 HOH I O 1 456 . A HETATM 1539 O O . HOH I 3 . ? 29.952 51.869 20.581 1.0 46.78 ? 457 HOH I O 1 457 . A HETATM 1540 O O . HOH I 3 . ? 24.529 38.000 18.404 1.0 35.88 ? 458 HOH I O 1 458 . A HETATM 1541 O O . HOH I 3 . ? 29.358 37.282 10.219 1.0 43.92 ? 459 HOH I O 1 459 . A HETATM 1542 O O . HOH I 3 . ? 22.267 31.821 4.922 1.0 18.36 ? 460 HOH I O 1 460 . A HETATM 1543 O O . HOH I 3 . ? 22.972 32.059 2.401 1.0 22.62 ? 461 HOH I O 1 461 . A HETATM 1544 O O . HOH I 3 . ? 15.938 38.890 -11.518 1.0 38.57 ? 462 HOH I O 1 462 . A HETATM 1545 O O . HOH I 3 . ? 6.457 37.367 -7.289 1.0 56.8 ? 463 HOH I O 1 463 . A HETATM 1546 O O . HOH I 3 . ? 15.326 46.335 -11.944 1.0 29.46 ? 464 HOH I O 1 464 . A HETATM 1547 O O . HOH I 3 . ? 5.026 46.019 -2.454 1.0 48.82 ? 465 HOH I O 1 465 . A HETATM 1548 O O . HOH I 3 . ? 14.209 31.042 6.911 1.0 28.1 ? 466 HOH I O 1 466 . A HETATM 1549 O O . HOH I 3 . ? 37.374 51.623 -2.856 1.0 37.29 ? 467 HOH I O 1 467 . A HETATM 1550 O O . HOH I 3 . ? 29.023 60.488 -10.419 1.0 53.34 ? 468 HOH I O 1 468 . A HETATM 1551 O O . HOH I 3 . ? 28.843 57.579 -4.734 1.0 32.5 ? 469 HOH I O 1 469 . A HETATM 1552 O O . HOH I 3 . ? 9.368 59.539 11.507 1.0 53.67 ? 470 HOH I O 1 470 . A HETATM 1553 O O . HOH I 3 . ? 6.995 51.614 7.679 1.0 57.08 ? 471 HOH I O 1 471 . A HETATM 1554 O O . HOH I 3 . ? 3.844 46.569 4.235 1.0 54.15 ? 472 HOH I O 1 472 . A HETATM 1555 O O . HOH I 3 . ? 34.885 57.416 -2.801 1.0 40.88 ? 473 HOH I O 1 473 . A HETATM 1556 O O . HOH I 3 . ? 12.182 58.192 14.960 1.0 45.54 ? 474 HOH I O 1 474 . A HETATM 1557 O O . HOH I 3 . ? 24.481 59.850 15.758 1.0 30.05 ? 475 HOH I O 1 475 . A HETATM 1558 O O . HOH I 3 . ? 26.766 55.679 23.187 1.0 48.29 ? 476 HOH I O 1 476 . A HETATM 1559 O O . HOH I 3 . ? 11.658 58.859 23.291 1.0 54.49 ? 477 HOH I O 1 477 . A HETATM 1560 O O . HOH I 3 . ? 9.752 50.827 24.108 1.0 57.05 ? 478 HOH I O 1 478 . A HETATM 1561 O O . HOH I 3 . ? 21.570 58.965 -6.451 1.0 20.33 ? 479 HOH I O 1 479 . A HETATM 1562 O O . HOH I 3 . ? 11.501 56.736 -7.910 1.0 53.87 ? 480 HOH I O 1 480 . A HETATM 1563 O O . HOH I 3 . ? 22.796 29.026 24.472 1.0 55.82 ? 481 HOH I O 1 481 . A HETATM 1564 O O . HOH I 3 . ? 40.158 47.247 1.590 1.0 37.4 ? 482 HOH I O 1 482 . A HETATM 1565 O O . HOH I 3 . ? 23.752 53.782 -14.148 1.0 41.45 ? 483 HOH I O 1 483 . A HETATM 1566 O O . HOH I 3 . ? 12.244 28.631 2.372 1.0 49.02 ? 485 HOH I O 1 485 . A HETATM 1567 O O . HOH I 3 . ? 9.461 43.221 -11.137 1.0 48.77 ? 486 HOH I O 1 486 . A HETATM 1568 O O . HOH I 3 . ? 6.528 43.995 -6.354 1.0 48.93 ? 487 HOH I O 1 487 . A HETATM 1569 O O . HOH I 3 . ? 7.294 45.253 -4.081 1.0 41.28 ? 488 HOH I O 1 488 . A HETATM 1570 O O . HOH I 3 . ? 5.286 48.437 -0.792 1.0 40.83 ? 489 HOH I O 1 489 . A HETATM 1571 O O . HOH I 3 . ? 12.705 44.567 -8.666 1.0 28.15 ? 490 HOH I O 1 490 . A HETATM 1572 O O . HOH I 3 . ? 7.061 48.911 -7.307 1.0 34.96 ? 491 HOH I O 1 491 . A HETATM 1573 O O . HOH I 3 . ? 11.336 42.388 -7.936 1.0 39.68 ? 492 HOH I O 1 492 . A HETATM 1574 O O . HOH I 3 . ? 7.567 38.563 1.078 1.0 46.0 ? 493 HOH I O 1 493 . A HETATM 1575 O O . HOH I 3 . ? 9.855 34.640 -6.006 1.0 47.61 ? 494 HOH I O 1 494 . A HETATM 1576 O O . HOH I 3 . ? 8.174 33.009 -4.788 1.0 63.14 ? 495 HOH I O 1 495 . A HETATM 1577 O O . HOH I 3 . ? 12.249 40.097 -9.562 1.0 67.79 ? 496 HOH I O 1 496 . A HETATM 1578 O O . HOH I 3 . ? 10.584 34.893 5.068 1.0 42.71 ? 497 HOH I O 1 497 . A HETATM 1579 O O . HOH I 3 . ? 11.584 37.587 7.969 1.0 34.97 ? 498 HOH I O 1 498 . A HETATM 1580 O O . HOH I 3 . ? 15.407 31.412 -4.996 1.0 37.5 ? 499 HOH I O 1 499 . A HETATM 1581 O O . HOH I 3 . ? 16.328 31.200 9.254 1.0 45.4 ? 500 HOH I O 1 500 . A HETATM 1582 O O . HOH I 3 . ? 33.058 47.735 -10.707 1.0 22.77 ? 501 HOH I O 1 501 . A HETATM 1583 O O . HOH I 3 . ? 32.162 54.542 -9.942 1.0 42.91 ? 502 HOH I O 1 502 . A HETATM 1584 O O . HOH I 3 . ? 33.964 54.304 -5.713 1.0 47.88 ? 503 HOH I O 1 503 . A HETATM 1585 O O . HOH I 3 . ? 27.998 56.538 -11.736 1.0 33.7 ? 504 HOH I O 1 504 . A HETATM 1586 O O . HOH I 3 . ? 31.179 59.229 -10.976 1.0 52.98 ? 505 HOH I O 1 505 . A HETATM 1587 O O . HOH I 3 . ? 31.868 47.584 -13.360 1.0 34.83 ? 506 HOH I O 1 506 . A HETATM 1588 O O . HOH I 3 . ? 21.673 59.630 -13.490 1.0 20.51 ? 507 HOH I O 1 507 . A HETATM 1589 O O . HOH I 3 . ? 41.805 55.298 6.086 1.0 48.35 ? 508 HOH I O 1 508 . A HETATM 1590 O O . HOH I 3 . ? 24.315 58.962 -14.070 1.0 31.88 ? 509 HOH I O 1 509 . A HETATM 1591 O O . HOH I 3 . ? 22.009 58.289 -2.204 1.0 25.41 ? 510 HOH I O 1 510 . A HETATM 1592 O O . HOH I 3 . ? 8.443 53.022 5.682 1.0 53.67 ? 511 HOH I O 1 511 . A HETATM 1593 O O . HOH I 3 . ? 7.768 42.531 11.360 1.0 37.41 ? 512 HOH I O 1 512 . A HETATM 1594 O O . HOH I 3 . ? 5.298 47.752 1.922 1.0 33.16 ? 513 HOH I O 1 513 . A HETATM 1595 O O . HOH I 3 . ? 32.223 57.382 -3.570 1.0 36.69 ? 514 HOH I O 1 514 . A HETATM 1596 O O . HOH I 3 . ? 39.975 54.681 -0.361 1.0 36.23 ? 515 HOH I O 1 515 . A HETATM 1597 O O . HOH I 3 . ? 38.539 48.679 -1.705 1.0 27.75 ? 516 HOH I O 1 516 . A HETATM 1598 O O . HOH I 3 . ? 43.095 52.620 7.620 1.0 33.53 ? 517 HOH I O 1 517 . A HETATM 1599 O O . HOH I 3 . ? 40.393 45.933 5.675 1.0 23.72 ? 518 HOH I O 1 518 . A HETATM 1600 O O . HOH I 3 . ? 10.737 46.522 18.020 1.0 33.48 ? 519 HOH I O 1 519 . A HETATM 1601 O O . HOH I 3 . ? 13.432 37.577 23.063 1.0 49.68 ? 520 HOH I O 1 520 . A HETATM 1602 O O . HOH I 3 . ? 11.279 35.037 19.193 1.0 38.26 ? 521 HOH I O 1 521 . A HETATM 1603 O O . HOH I 3 . ? 19.348 33.918 21.640 1.0 47.23 ? 522 HOH I O 1 522 . A HETATM 1604 O O . HOH I 3 . ? 25.439 63.944 21.796 1.0 54.03 ? 523 HOH I O 1 523 . A HETATM 1605 O O . HOH I 3 . ? 22.326 59.921 1.576 1.0 47.21 ? 524 HOH I O 1 524 . A HETATM 1606 O O . HOH I 3 . ? 19.968 66.039 6.602 1.0 42.63 ? 525 HOH I O 1 525 . A HETATM 1607 O O . HOH I 3 . ? 15.471 37.186 -9.171 1.0 25.5 ? 526 HOH I O 1 526 . A HETATM 1608 O O . HOH I 3 . ? 11.580 54.070 -9.614 1.0 29.07 ? 527 HOH I O 1 527 . A HETATM 1609 O O . HOH I 3 . ? 28.778 35.052 4.807 1.0 26.86 ? 528 HOH I O 1 528 . A HETATM 1610 O O . HOH I 3 . ? 27.799 34.934 -17.445 1.0 54.87 ? 529 HOH I O 1 529 . A HETATM 1611 O O . HOH I 3 . ? 26.164 42.668 -16.773 1.0 43.95 ? 530 HOH I O 1 530 . A HETATM 1612 O O . HOH I 3 . ? 24.790 42.945 -14.457 1.0 41.84 ? 531 HOH I O 1 531 . A HETATM 1613 O O . HOH I 3 . ? 5.517 47.276 7.601 1.0 40.3 ? 532 HOH I O 1 532 . A HETATM 1614 O O . HOH I 3 . ? 2.620 43.402 9.468 1.0 43.83 ? 533 HOH I O 1 533 . A HETATM 1615 O O . HOH I 3 . ? 11.320 31.652 5.147 1.0 57.92 ? 534 HOH I O 1 534 . A HETATM 1616 O O . HOH I 3 . ? 25.487 40.252 17.260 1.0 26.44 ? 535 HOH I O 1 535 . A HETATM 1617 O O . HOH I 3 . ? 26.034 41.987 19.202 1.0 28.95 ? 536 HOH I O 1 536 . A HETATM 1618 O O . HOH I 3 . ? 29.680 39.925 18.103 1.0 63.42 ? 537 HOH I O 1 537 . A HETATM 1619 O O . HOH I 3 . ? 20.417 48.961 -17.855 1.0 57.98 ? 538 HOH I O 1 538 . A HETATM 1620 O O . HOH I 3 . ? 38.672 37.551 8.142 1.0 31.98 ? 539 HOH I O 1 539 . A HETATM 1621 O O . HOH I 3 . ? 31.842 43.020 16.541 1.0 28.5 ? 540 HOH I O 1 540 . A HETATM 1622 O O . HOH I 3 . ? 38.948 41.779 6.362 1.0 27.74 ? 541 HOH I O 1 541 . A HETATM 1623 O O . HOH I 3 . ? 40.317 36.627 0.925 1.0 45.45 ? 542 HOH I O 1 542 . A HETATM 1624 O O . HOH I 3 . ? 37.034 42.569 11.826 1.0 29.88 ? 543 HOH I O 1 543 . A HETATM 1625 O O . HOH I 3 . ? 13.754 35.889 20.502 1.0 41.98 ? 544 HOH I O 1 544 . A HETATM 1626 O O . HOH I 3 . ? 16.722 49.774 -10.931 1.0 28.12 ? 545 HOH I O 1 545 . A HETATM 1627 O O . HOH I 3 . ? 45.133 50.637 -9.495 1.0 58.19 ? 546 HOH I O 1 546 . A HETATM 1628 O O . HOH I 3 . ? 23.081 32.459 26.998 1.0 58.23 ? 547 HOH I O 1 547 . A HETATM 1629 O O . HOH I 3 . ? 21.045 31.537 22.800 1.0 58.65 ? 548 HOH I O 1 548 . A HETATM 1630 O O . HOH I 3 . ? 43.017 43.261 0.313 1.0 53.83 ? 550 HOH I O 1 550 . A HETATM 1631 O O . HOH I 3 . ? 17.657 34.083 9.251 1.0 33.1 ? 551 HOH I O 1 551 . A HETATM 1632 O O . HOH I 3 . ? 27.243 64.505 -9.960 1.0 38.41 ? 552 HOH I O 1 552 . A HETATM 1633 O O . HOH I 3 . ? 47.024 51.437 -5.988 1.0 59.48 ? 553 HOH I O 1 553 . A HETATM 1634 O O . HOH I 3 . ? 8.346 50.794 -10.161 1.0 48.36 ? 554 HOH I O 1 554 . A HETATM 1635 O O . HOH I 3 . ? 28.537 33.474 2.775 1.0 39.91 ? 555 HOH I O 1 555 . A HETATM 1636 O O . HOH I 3 . ? 29.716 34.011 0.448 1.0 40.24 ? 556 HOH I O 1 556 . A HETATM 1637 O O . HOH I 3 . ? 12.688 57.317 3.364 1.0 29.86 ? 557 HOH I O 1 557 . A HETATM 1638 O O . HOH I 3 . ? 36.575 40.369 10.330 1.0 37.36 ? 558 HOH I O 1 558 . A HETATM 1639 O O . HOH I 3 . ? 32.429 57.722 6.484 1.0 47.66 ? 559 HOH I O 1 559 . A HETATM 1640 O O . HOH I 3 . ? 37.242 56.864 -10.034 1.0 59.8 ? 560 HOH I O 1 560 . A HETATM 1641 O O . HOH I 3 . ? 36.160 35.981 7.149 1.0 51.25 ? 561 HOH I O 1 561 . A HETATM 1642 O O . HOH I 3 . ? 15.145 43.679 27.033 1.0 43.46 ? 562 HOH I O 1 562 . A HETATM 1643 O O . HOH I 3 . ? 38.917 45.695 13.989 1.0 27.32 ? 563 HOH I O 1 563 . A HETATM 1644 O O . HOH I 3 . ? 8.663 42.543 -8.156 1.0 38.25 ? 565 HOH I O 1 565 . A HETATM 1645 O O . HOH I 3 . ? 42.162 38.104 -6.571 1.0 50.73 ? 566 HOH I O 1 566 . A HETATM 1646 O O . HOH I 3 . ? 14.980 74.670 15.860 1.0 54.02 ? 568 HOH I O 1 568 . A HETATM 1647 O O . HOH I 3 . ? 39.012 62.938 2.609 1.0 60.05 ? 569 HOH I O 1 569 . A HETATM 1648 O O . HOH I 3 . ? 20.616 55.747 -13.074 1.0 23.83 ? 570 HOH I O 1 570 . A HETATM 1649 O O . HOH I 3 . ? 12.644 51.687 -8.790 1.0 25.07 ? 571 HOH I O 1 571 . A HETATM 1650 O O . HOH I 3 . ? 27.960 52.912 19.080 1.0 32.28 ? 572 HOH I O 1 572 . A HETATM 1651 O O . HOH I 3 . ? 19.053 39.502 -14.408 1.0 46.0 ? 573 HOH I O 1 573 . A HETATM 1652 O O . HOH I 3 . ? 16.778 35.721 -15.156 1.0 57.55 ? 574 HOH I O 1 574 . A HETATM 1653 O O . HOH I 3 . ? 10.388 38.031 -8.665 1.0 51.32 ? 575 HOH I O 1 575 . A HETATM 1654 O O . HOH I 3 . ? 28.515 57.627 6.569 1.0 38.42 ? 577 HOH I O 1 577 . A HETATM 1655 O O . HOH I 3 . ? 26.511 59.476 4.990 1.0 48.74 ? 578 HOH I O 1 578 . A HETATM 1656 O O . HOH I 3 . ? 20.451 62.053 14.866 1.0 42.53 ? 579 HOH I O 1 579 . A HETATM 1657 O O . HOH I 3 . ? 14.665 59.774 1.259 1.0 49.97 ? 580 HOH I O 1 580 . A HETATM 1658 O O . HOH I 3 . ? 12.125 58.214 -4.947 1.0 46.89 ? 581 HOH I O 1 581 . A HETATM 1659 O O . HOH I 3 . ? 16.770 65.787 13.663 1.0 60.07 ? 582 HOH I O 1 582 . A HETATM 1660 O O . HOH I 3 . ? 13.513 32.908 -4.466 1.0 51.15 ? 583 HOH I O 1 583 . A HETATM 1661 O O . HOH I 3 . ? 39.873 33.746 1.920 1.0 56.04 ? 584 HOH I O 1 584 . A HETATM 1662 O O . HOH I 3 . ? 15.880 33.863 -18.265 1.0 55.61 ? 585 HOH I O 1 585 . A HETATM 1663 O O . HOH I 3 . ? 38.587 43.863 0.302 1.0 34.24 ? 586 HOH I O 1 586 . A HETATM 1664 O O . HOH I 3 . ? 45.956 50.130 -11.932 1.0 60.52 ? 587 HOH I O 1 587 . A HETATM 1665 O O . HOH I 3 . ? 40.508 45.663 -5.972 1.0 50.1 ? 588 HOH I O 1 588 . A HETATM 1666 O O . HOH I 3 . ? 34.903 58.019 1.187 1.0 41.32 ? 589 HOH I O 1 589 . A HETATM 1667 O O . HOH I 3 . ? 24.935 42.154 21.740 1.0 48.64 ? 590 HOH I O 1 590 . A HETATM 1668 O O . HOH I 3 . ? 3.366 47.132 -4.895 1.0 59.35 ? 591 HOH I O 1 591 . A HETATM 1669 O O . HOH I 3 . ? 31.412 38.013 -12.392 1.0 32.45 ? 593 HOH I O 1 593 . A HETATM 1670 O O . HOH I 3 . ? 13.179 36.840 -10.012 1.0 40.68 ? 594 HOH I O 1 594 . A HETATM 1671 O O . HOH I 3 . ? 14.494 34.143 14.072 1.0 41.45 ? 595 HOH I O 1 595 . A HETATM 1672 O O . HOH I 3 . ? 29.624 53.440 23.676 1.0 53.03 ? 596 HOH I O 1 596 . A HETATM 1673 O O . HOH I 3 . ? 5.816 45.045 13.259 1.0 47.83 ? 597 HOH I O 1 597 . A HETATM 1674 O O . HOH I 3 . ? 4.048 40.079 11.684 1.0 36.48 ? 599 HOH I O 1 599 . A HETATM 1675 O O . HOH I 3 . ? 6.888 40.071 12.169 1.0 51.29 ? 600 HOH I O 1 600 . A HETATM 1676 O O . HOH I 3 . ? 25.969 62.059 2.620 1.0 48.77 ? 601 HOH I O 1 601 . A HETATM 1677 O O . HOH I 3 . ? 21.151 50.304 25.650 1.0 49.25 ? 602 HOH I O 1 602 . A HETATM 1678 O O . HOH I 3 . ? 30.328 40.206 13.529 1.0 47.52 ? 603 HOH I O 1 603 . A HETATM 1679 O O . HOH I 3 . ? 31.040 43.226 19.077 1.0 44.02 ? 604 HOH I O 1 604 . A HETATM 1680 O O . HOH I 3 . ? 27.257 39.481 -16.446 1.0 42.45 ? 605 HOH I O 1 605 . A HETATM 1681 O O . HOH I 3 . ? 41.258 41.193 5.427 1.0 33.84 ? 606 HOH I O 1 606 . A HETATM 1682 O O . HOH I 3 . ? 12.054 37.485 12.696 1.0 24.83 ? 607 HOH I O 1 607 . A HETATM 1683 O O . HOH I 3 . ? 20.562 60.465 -2.521 1.0 41.72 ? 608 HOH I O 1 608 . A HETATM 1684 O O . HOH I 3 . ? 37.525 33.206 -4.643 1.0 58.44 ? 609 HOH I O 1 609 . A HETATM 1685 O O . HOH I 3 . ? 28.868 34.889 8.639 1.0 36.6 ? 610 HOH I O 1 610 . A HETATM 1686 O O . HOH I 3 . ? 19.995 33.770 19.105 1.0 44.97 ? 611 HOH I O 1 611 . A HETATM 1687 O O . HOH I 3 . ? 35.687 47.775 -11.247 1.0 50.07 ? 612 HOH I O 1 612 . A HETATM 1688 O O . HOH I 3 . ? 42.711 51.464 3.560 1.0 49.79 ? 613 HOH I O 1 613 . A HETATM 1689 O O . HOH I 3 . ? 37.675 57.386 12.755 1.0 41.59 ? 614 HOH I O 1 614 . A HETATM 1690 O O . HOH I 3 . ? 12.344 34.909 13.115 1.0 39.34 ? 615 HOH I O 1 615 . A HETATM 1691 O O . HOH I 3 . ? 3.586 42.698 12.006 1.0 34.87 ? 616 HOH I O 1 616 . A HETATM 1692 O O . HOH I 3 . ? 37.210 47.728 19.465 1.0 53.29 ? 617 HOH I O 1 617 . A HETATM 1693 O O . HOH I 3 . ? 7.091 38.819 4.622 1.0 52.39 ? 618 HOH I O 1 618 . A HETATM 1694 O O . HOH I 3 . ? 11.824 33.121 -6.557 1.0 38.57 ? 619 HOH I O 1 619 . A HETATM 1695 O O . HOH I 3 . ? 12.318 36.505 -13.400 1.0 59.97 ? 620 HOH I O 1 620 . A HETATM 1696 O O . HOH I 3 . ? 38.608 43.045 3.674 1.0 40.25 ? 621 HOH I O 1 621 . A HETATM 1697 O O . HOH I 3 . ? 16.726 75.419 14.041 1.0 64.95 ? 622 HOH I O 1 622 . A HETATM 1698 O O . HOH I 3 . ? 27.936 58.061 23.311 1.0 55.31 ? 623 HOH I O 1 623 . A HETATM 1699 O O . HOH I 3 . ? 27.962 62.099 1.198 1.0 56.39 ? 624 HOH I O 1 624 . A HETATM 1700 O O . HOH I 3 . ? 33.941 56.314 18.812 1.0 42.24 ? 625 HOH I O 1 625 . A HETATM 1701 O O . HOH I 3 . ? 42.123 38.969 5.594 1.0 41.92 ? 626 HOH I O 1 626 . A HETATM 1702 O O . HOH I 3 . ? 17.861 63.576 15.322 1.0 47.59 ? 627 HOH I O 1 627 . A HETATM 1703 O O . HOH I 3 . ? 20.626 48.756 29.128 1.0 52.33 ? 628 HOH I O 1 628 . A HETATM 1704 O O . HOH I 3 . ? 29.744 38.008 -14.796 1.0 30.5 ? 629 HOH I O 1 629 . A HETATM 1705 O O . HOH I 3 . ? 22.805 68.687 16.273 1.0 46.88 ? 630 HOH I O 1 630 . A HETATM 1706 O O . HOH I 3 . ? 18.443 71.591 14.819 1.0 49.83 ? 631 HOH I O 1 631 . A HETATM 1707 O O . HOH I 3 . ? 18.035 71.225 18.205 1.0 46.89 ? 632 HOH I O 1 632 . A HETATM 1708 O O . HOH I 3 . ? 19.275 66.969 17.074 1.0 34.58 ? 633 HOH I O 1 633 . A HETATM 1709 O O . HOH I 3 . ? 18.433 71.524 12.467 1.0 55.83 ? 634 HOH I O 1 634 . A HETATM 1710 O O . HOH I 3 . ? 41.604 54.305 -2.590 1.0 46.13 ? 635 HOH I O 1 635 . A HETATM 1711 O O . HOH I 3 . ? 9.374 39.765 22.991 1.0 48.96 ? 636 HOH I O 1 636 . A HETATM 1712 O O . HOH I 3 . ? 36.132 52.260 19.741 1.0 38.99 ? 637 HOH I O 1 637 . A HETATM 1713 O O . HOH I 3 . ? 30.481 40.080 -15.733 1.0 17.97 ? 638 HOH I O 1 638 . A HETATM 1714 O O . HOH I 3 . ? 40.749 34.977 4.618 1.0 50.04 ? 639 HOH I O 1 639 . A HETATM 1715 O O . HOH I 3 . ? 15.540 50.716 -14.300 1.0 43.82 ? 640 HOH I O 1 640 . A HETATM 1716 O O . HOH I 3 . ? 17.707 51.289 -16.851 1.0 59.92 ? 641 HOH I O 1 641 . A HETATM 1717 O O . HOH I 3 . ? 21.373 51.483 -16.045 1.0 62.09 ? 642 HOH I O 1 642 . A HETATM 1718 O O . HOH I 3 . ? 27.517 47.246 -12.524 1.0 40.2 ? 643 HOH I O 1 643 . A HETATM 1719 O O . HOH I 3 . ? 10.568 50.083 -7.809 1.0 36.96 ? 644 HOH I O 1 644 . A HETATM 1720 O O . HOH I 3 . ? 10.724 46.358 -9.297 1.0 34.88 ? 645 HOH I O 1 645 . A HETATM 1721 O O . HOH I 3 . ? 13.689 44.396 -11.153 1.0 35.52 ? 646 HOH I O 1 646 . A HETATM 1722 O O . HOH I 3 . ? 6.523 45.653 9.183 1.0 52.77 ? 647 HOH I O 1 647 . A HETATM 1723 O O . HOH I 3 . ? 4.454 41.795 -5.177 1.0 56.48 ? 648 HOH I O 1 648 . A HETATM 1724 O O . HOH I 3 . ? 9.798 51.707 -5.496 1.0 43.37 ? 649 HOH I O 1 649 . A HETATM 1725 O O . HOH I 3 . ? 15.762 72.942 18.753 1.0 49.85 ? 650 HOH I O 1 650 . A #