data_1kug-assembly-1_atom_site # loop_ _atom_site.group_PDB _atom_site.id _atom_site.type_symbol _atom_site.label_atom_id _atom_site.label_alt_id _atom_site.label_comp_id _atom_site.label_asym_id _atom_site.label_entity_id _atom_site.label_seq_id _atom_site.pdbx_PDB_ins_code _atom_site.Cartn_x _atom_site.Cartn_y _atom_site.Cartn_z _atom_site.occupancy _atom_site.B_iso_or_equiv _atom_site.pdbx_formal_charge _atom_site.auth_seq_id _atom_site.auth_comp_id _atom_site.auth_asym_id _atom_site.auth_atom_id _atom_site.pdbx_PDB_model_num _atom_site.pdbe_label_seq_id _atom_site.orig_label_asym_id _atom_site.orig_auth_asym_id ATOM 1 N N . GLN A 1 3 ? -5.117 37.400 14.327 1.0 24.85 ? 3 GLN A N 1 3 . A ATOM 2 C CA . GLN A 1 3 ? -4.630 35.987 14.445 1.0 23.16 ? 3 GLN A CA 1 3 . A ATOM 3 C C . GLN A 1 3 ? -5.692 35.066 13.850 1.0 21.6 ? 3 GLN A C 1 3 . A ATOM 4 O O . GLN A 1 3 ? -6.877 35.140 14.204 1.0 22.03 ? 3 GLN A O 1 3 . A ATOM 5 C CB . GLN A 1 3 ? -4.395 35.613 15.919 1.0 25.04 ? 3 GLN A CB 1 3 . A ATOM 6 C CG . GLN A 1 3 ? -3.618 34.324 16.133 1.0 27.62 ? 3 GLN A CG 1 3 . A ATOM 7 C CD . GLN A 1 3 ? -2.107 34.541 16.237 1.0 28.62 ? 3 GLN A CD 1 3 . A ATOM 8 O OE1 . GLN A 1 3 ? -1.314 33.948 15.487 1.0 29.88 ? 3 GLN A OE1 1 3 . A ATOM 9 N NE2 . GLN A 1 3 ? -1.702 35.385 17.179 1.0 29.15 ? 3 GLN A NE2 1 3 . A ATOM 10 N N . ARG A 1 4 ? -5.264 34.184 12.957 1.0 18.38 ? 4 ARG A N 1 4 . A ATOM 11 C CA . ARG A 1 4 ? -6.183 33.257 12.323 1.0 15.7 ? 4 ARG A CA 1 4 . A ATOM 12 C C . ARG A 1 4 ? -6.746 32.194 13.260 1.0 14.39 ? 4 ARG A C 1 4 . A ATOM 13 O O . ARG A 1 4 ? -7.892 31.769 13.114 1.0 15.1 ? 4 ARG A O 1 4 . A ATOM 14 C CB . ARG A 1 4 ? -5.490 32.592 11.142 1.0 14.42 ? 4 ARG A CB 1 4 . A ATOM 15 C CG . ARG A 1 4 ? -6.236 31.402 10.586 1.0 14.5 ? 4 ARG A CG 1 4 . A ATOM 16 C CD . ARG A 1 4 ? -5.589 30.875 9.330 1.0 14.24 ? 4 ARG A CD 1 4 . A ATOM 17 N NE . ARG A 1 4 ? -6.325 29.702 8.863 1.0 14.75 ? 4 ARG A NE 1 4 . A ATOM 18 C CZ . ARG A 1 4 ? -6.030 29.002 7.777 1.0 13.75 ? 4 ARG A CZ 1 4 . A ATOM 19 N NH1 . ARG A 1 4 ? -5.006 29.362 7.007 1.0 15.06 ? 4 ARG A NH1 1 4 . A ATOM 20 N NH2 . ARG A 1 4 ? -6.730 27.902 7.505 1.0 14.42 ? 4 ARG A NH2 1 4 . A ATOM 21 N N . PHE A 1 5 ? -5.956 31.764 14.242 1.0 11.86 ? 5 PHE A N 1 5 . A ATOM 22 C CA . PHE A 1 5 ? -6.384 30.730 15.165 1.0 11.14 ? 5 PHE A CA 1 5 . A ATOM 23 C C . PHE A 1 5 ? -6.542 31.211 16.594 1.0 10.7 ? 5 PHE A C 1 5 . A ATOM 24 O O . PHE A 1 5 ? -5.840 32.101 17.022 1.0 10.62 ? 5 PHE A O 1 5 . A ATOM 25 C CB . PHE A 1 5 ? -5.346 29.578 15.149 1.0 9.79 ? 5 PHE A CB 1 5 . A ATOM 26 C CG . PHE A 1 5 ? -5.255 28.878 13.827 1.0 8.4 ? 5 PHE A CG 1 5 . A ATOM 27 C CD1 . PHE A 1 5 ? -4.181 29.088 12.974 1.0 9.21 ? 5 PHE A CD1 1 5 . A ATOM 28 C CD2 . PHE A 1 5 ? -6.281 28.044 13.418 1.0 8.88 ? 5 PHE A CD2 1 5 . A ATOM 29 C CE1 . PHE A 1 5 ? -4.130 28.472 11.731 1.0 8.69 ? 5 PHE A CE1 1 5 . A ATOM 30 C CE2 . PHE A 1 5 ? -6.231 27.433 12.187 1.0 9.07 ? 5 PHE A CE2 1 5 . A ATOM 31 C CZ . PHE A 1 5 ? -5.147 27.654 11.350 1.0 8.86 ? 5 PHE A CZ 1 5 . A ATOM 32 N N . PRO A 1 6 ? -7.464 30.602 17.345 1.0 11.9 ? 6 PRO A N 1 6 . A ATOM 33 C CA . PRO A 1 6 ? -7.710 30.948 18.750 1.0 12.23 ? 6 PRO A CA 1 6 . A ATOM 34 C C . PRO A 1 6 ? -6.513 30.420 19.566 1.0 12.04 ? 6 PRO A C 1 6 . A ATOM 35 O O . PRO A 1 6 ? -5.823 29.484 19.137 1.0 12.46 ? 6 PRO A O 1 6 . A ATOM 36 C CB . PRO A 1 6 ? -9.004 30.213 19.063 1.0 12.4 ? 6 PRO A CB 1 6 . A ATOM 37 C CG . PRO A 1 6 ? -8.872 28.979 18.228 1.0 12.36 ? 6 PRO A CG 1 6 . A ATOM 38 C CD . PRO A 1 6 ? -8.359 29.516 16.911 1.0 12.08 ? 6 PRO A CD 1 6 . A ATOM 39 N N . GLN A 1 7 ? -6.256 31.015 20.719 1.0 10.79 ? 7 GLN A N 1 7 . A ATOM 40 C CA . GLN A 1 7 ? -5.119 30.628 21.558 1.0 9.76 ? 7 GLN A CA 1 7 . A ATOM 41 C C . GLN A 1 7 ? -5.206 29.196 22.050 1.0 9.22 ? 7 GLN A C 1 7 . A ATOM 42 O O . GLN A 1 7 ? -6.264 28.739 22.509 1.0 9.6 ? 7 GLN A O 1 7 . A ATOM 43 C CB . GLN A 1 7 ? -5.066 31.531 22.799 1.0 10.05 ? 7 GLN A CB 1 7 . A ATOM 44 C CG . GLN A 1 7 ? -3.868 31.249 23.702 1.0 12.43 ? 7 GLN A CG 1 7 . A ATOM 45 C CD . GLN A 1 7 ? -2.577 31.763 23.093 1.0 13.15 ? 7 GLN A CD 1 7 . A ATOM 46 O OE1 . GLN A 1 7 ? -2.428 32.952 22.843 1.0 14.73 ? 7 GLN A OE1 1 7 . A ATOM 47 N NE2 . GLN A 1 7 ? -1.638 30.863 22.832 1.0 13.01 ? 7 GLN A NE2 1 7 . A ATOM 48 N N . ARG A 1 8 ? -4.088 28.478 21.908 1.0 7.83 ? 8 ARG A N 1 8 . A ATOM 49 C CA . ARG A 1 8 ? -3.996 27.130 22.471 1.0 7.8 ? 8 ARG A CA 1 8 . A ATOM 50 C C . ARG A 1 8 ? -2.637 27.041 23.157 1.0 7.16 ? 8 ARG A C 1 8 . A ATOM 51 O O . ARG A 1 8 ? -1.764 27.911 23.001 1.0 7.39 ? 8 ARG A O 1 8 . A ATOM 52 C CB . ARG A 1 8 ? -4.157 26.034 21.409 1.0 9.11 ? 8 ARG A CB 1 8 . A ATOM 53 C CG . ARG A 1 8 ? -5.551 25.972 20.816 1.0 9.07 ? 8 ARG A CG 1 8 . A ATOM 54 C CD . ARG A 1 8 ? -6.525 25.406 21.827 1.0 9.62 ? 8 ARG A CD 1 8 . A ATOM 55 N NE . ARG A 1 8 ? -7.856 25.106 21.274 1.0 10.97 ? 8 ARG A NE 1 8 . A ATOM 56 C CZ . ARG A 1 8 ? -8.820 25.998 21.071 1.0 11.7 ? 8 ARG A CZ 1 8 . A ATOM 57 N NH1 . ARG A 1 8 ? -9.983 25.584 20.585 1.0 13.09 ? 8 ARG A NH1 1 8 . A ATOM 58 N NH2 . ARG A 1 8 ? -8.628 27.280 21.350 1.0 13.45 ? 8 ARG A NH2 1 8 . A ATOM 59 N N . TYR A 1 9 ? -2.455 25.961 23.882 1.0 7.65 ? 9 TYR A N 1 9 . A ATOM 60 C CA . TYR A 1 9 ? -1.238 25.738 24.640 1.0 7.86 ? 9 TYR A CA 1 9 . A ATOM 61 C C . TYR A 1 9 ? -0.834 24.279 24.569 1.0 9.14 ? 9 TYR A C 1 9 . A ATOM 62 O O . TYR A 1 9 ? -1.686 23.409 24.701 1.0 11.8 ? 9 TYR A O 1 9 . A ATOM 63 C CB . TYR A 1 9 ? -1.445 26.062 26.117 1.0 9.89 ? 9 TYR A CB 1 9 . A ATOM 64 C CG . TYR A 1 9 ? -2.058 27.407 26.375 1.0 9.51 ? 9 TYR A CG 1 9 . A ATOM 65 C CD1 . TYR A 1 9 ? -3.438 27.573 26.337 1.0 11.11 ? 9 TYR A CD1 1 9 . A ATOM 66 C CD2 . TYR A 1 9 ? -1.258 28.512 26.646 1.0 10.66 ? 9 TYR A CD2 1 9 . A ATOM 67 C CE1 . TYR A 1 9 ? -4.015 28.823 26.569 1.0 11.29 ? 9 TYR A CE1 1 9 . A ATOM 68 C CE2 . TYR A 1 9 ? -1.830 29.768 26.881 1.0 11.15 ? 9 TYR A CE2 1 9 . A ATOM 69 C CZ . TYR A 1 9 ? -3.200 29.897 26.841 1.0 12.11 ? 9 TYR A CZ 1 9 . A ATOM 70 O OH . TYR A 1 9 ? -3.762 31.115 27.135 1.0 14.84 ? 9 TYR A OH 1 9 . A ATOM 71 N N . ILE A 1 10 ? 0.442 24.002 24.367 1.0 8.13 ? 10 ILE A N 1 10 . A ATOM 72 C CA . ILE A 1 10 ? 0.880 22.606 24.426 1.0 7.96 ? 10 ILE A CA 1 10 . A ATOM 73 C C . ILE A 1 10 ? 2.018 22.524 25.430 1.0 7.54 ? 10 ILE A C 1 10 . A ATOM 74 O O . ILE A 1 10 ? 3.069 23.147 25.255 1.0 7.64 ? 10 ILE A O 1 10 . A ATOM 75 C CB . ILE A 1 10 ? 1.350 22.040 23.061 1.0 7.74 ? 10 ILE A CB 1 10 . A ATOM 76 C CG1 . ILE A 1 10 ? 0.160 21.963 22.083 1.0 9.61 ? 10 ILE A CG1 1 10 . A ATOM 77 C CG2 . ILE A 1 10 ? 1.979 20.654 23.265 1.0 8.57 ? 10 ILE A CG2 1 10 . A ATOM 78 C CD1 . ILE A 1 10 ? 0.531 21.602 20.657 1.0 9.54 ? 10 ILE A CD1 1 10 . A ATOM 79 N N . GLU A 1 11 ? 1.769 21.786 26.503 1.0 7.35 ? 11 GLU A N 1 11 . A ATOM 80 C CA . GLU A 1 11 ? 2.755 21.565 27.557 1.0 8.07 ? 11 GLU A CA 1 11 . A ATOM 81 C C . GLU A 1 11 ? 3.493 20.286 27.217 1.0 7.11 ? 11 GLU A C 1 11 . A ATOM 82 O O . GLU A 1 11 ? 2.939 19.182 27.312 1.0 7.7 ? 11 GLU A O 1 11 . A ATOM 83 C CB . GLU A 1 11 ? 2.076 21.440 28.905 1.0 12.08 ? 11 GLU A CB 1 11 . A ATOM 84 C CG . GLU A 1 11 ? 1.719 22.777 29.461 1.0 18.78 ? 11 GLU A CG 1 11 . A ATOM 85 C CD . GLU A 1 11 ? 0.307 23.137 29.204 1.0 21.67 ? 11 GLU A CD 1 11 . A ATOM 86 O OE1 . GLU A 1 11 ? 0.019 23.770 28.160 1.0 25.55 ? 11 GLU A OE1 1 11 . A ATOM 87 O OE2 . GLU A 1 11 ? -0.524 22.773 30.062 1.0 23.76 ? 11 GLU A OE2 1 11 . A ATOM 88 N N . LEU A 1 12 ? 4.742 20.436 26.810 1.0 6.19 ? 12 LEU A N 1 12 . A ATOM 89 C CA . LEU A 1 12 ? 5.529 19.308 26.347 1.0 5.84 ? 12 LEU A CA 1 12 . A ATOM 90 C C . LEU A 1 12 ? 6.369 18.616 27.355 1.0 5.91 ? 12 LEU A C 1 12 . A ATOM 91 O O . LEU A 1 12 ? 6.912 19.246 28.266 1.0 8.08 ? 12 LEU A O 1 12 . A ATOM 92 C CB . LEU A 1 12 ? 6.529 19.771 25.283 1.0 8.01 ? 12 LEU A CB 1 12 . A ATOM 93 C CG . LEU A 1 12 ? 6.132 20.270 23.928 1.0 9.53 ? 12 LEU A CG 1 12 . A ATOM 94 C CD1 . LEU A 1 12 ? 7.406 20.679 23.202 1.0 9.92 ? 12 LEU A CD1 1 12 . A ATOM 95 C CD2 . LEU A 1 12 ? 5.467 19.151 23.162 1.0 10.11 ? 12 LEU A CD2 1 12 . A ATOM 96 N N . ALA A 1 13 ? 6.450 17.301 27.250 1.0 5.43 ? 13 ALA A N 1 13 . A ATOM 97 C CA . ALA A 1 13 ? 7.453 16.558 28.000 1.0 5.13 ? 13 ALA A CA 1 13 . A ATOM 98 C C . ALA A 1 13 ? 8.439 16.036 26.945 1.0 5.1 ? 13 ALA A C 1 13 . A ATOM 99 O O . ALA A 1 13 ? 8.042 15.582 25.855 1.0 6.52 ? 13 ALA A O 1 13 . A ATOM 100 C CB . ALA A 1 13 ? 6.858 15.390 28.762 1.0 6.77 ? 13 ALA A CB 1 13 . A ATOM 101 N N . ILE A 1 14 ? 9.721 16.163 27.234 1.0 5.38 ? 14 ILE A N 1 14 . A ATOM 102 C CA . ILE A 1 14 ? 10.762 15.630 26.350 1.0 6.35 ? 14 ILE A CA 1 14 . A ATOM 103 C C . ILE A 1 14 ? 11.536 14.627 27.172 1.0 6.7 ? 14 ILE A C 1 14 . A ATOM 104 O O . ILE A 1 14 ? 11.952 14.918 28.306 1.0 6.57 ? 14 ILE A O 1 14 . A ATOM 105 C CB . ILE A 1 14 ? 11.741 16.742 25.859 1.0 7.15 ? 14 ILE A CB 1 14 . A ATOM 106 C CG1 . ILE A 1 14 ? 11.005 17.801 25.012 1.0 7.95 ? 14 ILE A CG1 1 14 . A ATOM 107 C CG2 . ILE A 1 14 ? 12.883 16.075 25.093 1.0 8.23 ? 14 ILE A CG2 1 14 . A ATOM 108 C CD1 . ILE A 1 14 ? 10.254 17.264 23.803 1.0 10.84 ? 14 ILE A CD1 1 14 . A ATOM 109 N N . VAL A 1 15 ? 11.715 13.435 26.615 1.0 6.18 ? 15 VAL A N 1 15 . A ATOM 110 C CA . VAL A 1 15 ? 12.463 12.366 27.268 1.0 6.42 ? 15 VAL A CA 1 15 . A ATOM 111 C C . VAL A 1 15 ? 13.704 12.098 26.439 1.0 5.89 ? 15 VAL A C 1 15 . A ATOM 112 O O . VAL A 1 15 ? 13.579 11.918 25.215 1.0 7.24 ? 15 VAL A O 1 15 . A ATOM 113 C CB . VAL A 1 15 ? 11.581 11.095 27.367 1.0 7.2 ? 15 VAL A CB 1 15 . A ATOM 114 C CG1 . VAL A 1 15 ? 12.372 9.975 28.039 1.0 8.71 ? 15 VAL A CG1 1 15 . A ATOM 115 C CG2 . VAL A 1 15 ? 10.265 11.427 28.086 1.0 8.72 ? 15 VAL A CG2 1 15 . A ATOM 116 N N . VAL A 1 16 ? 14.880 12.094 27.066 1.0 6.23 ? 16 VAL A N 1 16 . A ATOM 117 C CA . VAL A 1 16 ? 16.140 11.873 26.344 1.0 6.58 ? 16 VAL A CA 1 16 . A ATOM 118 C C . VAL A 1 16 ? 16.581 10.490 26.756 1.0 6.07 ? 16 VAL A C 1 16 . A ATOM 119 O O . VAL A 1 16 ? 16.759 10.229 27.949 1.0 7.46 ? 16 VAL A O 1 16 . A ATOM 120 C CB . VAL A 1 16 ? 17.183 12.945 26.732 1.0 5.81 ? 16 VAL A CB 1 16 . A ATOM 121 C CG1 . VAL A 1 16 ? 18.557 12.617 26.108 1.0 8.41 ? 16 VAL A CG1 1 16 . A ATOM 122 C CG2 . VAL A 1 16 ? 16.700 14.322 26.268 1.0 8.05 ? 16 VAL A CG2 1 16 . A ATOM 123 N N . ASP A 1 17 ? 16.740 9.596 25.790 1.0 6.26 ? 17 ASP A N 1 17 . A ATOM 124 C CA . ASP A 1 17 ? 17.083 8.227 26.160 1.0 7.84 ? 17 ASP A CA 1 17 . A ATOM 125 C C . ASP A 1 17 ? 18.548 8.048 26.532 1.0 7.43 ? 17 ASP A C 1 17 . A ATOM 126 O O . ASP A 1 17 ? 19.346 8.968 26.432 1.0 7.55 ? 17 ASP A O 1 17 . A ATOM 127 C CB . ASP A 1 17 ? 16.585 7.258 25.068 1.0 7.39 ? 17 ASP A CB 1 17 . A ATOM 128 C CG . ASP A 1 17 ? 17.502 7.149 23.867 1.0 6.85 ? 17 ASP A CG 1 17 . A ATOM 129 O OD1 . ASP A 1 17 ? 17.205 6.254 23.079 1.0 8.57 ? 17 ASP A OD1 1 17 . A ATOM 130 O OD2 . ASP A 1 17 ? 18.448 7.915 23.704 1.0 8.41 ? 17 ASP A OD2 1 17 . A ATOM 131 N N . HIS A 1 18 ? 18.898 6.846 26.994 1.0 8.39 ? 18 HIS A N 1 18 . A ATOM 132 C CA . HIS A 1 18 ? 20.248 6.615 27.446 1.0 9.17 ? 18 HIS A CA 1 18 . A ATOM 133 C C . HIS A 1 18 ? 21.311 6.718 26.362 1.0 8.82 ? 18 HIS A C 1 18 . A ATOM 134 O O . HIS A 1 18 ? 22.407 7.199 26.636 1.0 10.13 ? 18 HIS A O 1 18 . A ATOM 135 C CB . HIS A 1 18 ? 20.322 5.271 28.174 1.0 11.22 ? 18 HIS A CB 1 18 . A ATOM 136 C CG . HIS A 1 18 ? 21.581 5.104 28.968 1.0 14.01 ? 18 HIS A CG 1 18 . A ATOM 137 N ND1 . HIS A 1 18 ? 21.856 5.869 30.084 1.0 15.48 ? 18 HIS A ND1 1 18 . A ATOM 138 C CD2 . HIS A 1 18 ? 22.665 4.314 28.774 1.0 15.64 ? 18 HIS A CD2 1 18 . A ATOM 139 C CE1 . HIS A 1 18 ? 23.060 5.559 30.537 1.0 16.68 ? 18 HIS A CE1 1 18 . A ATOM 140 N NE2 . HIS A 1 18 ? 23.572 4.621 29.761 1.0 15.9 ? 18 HIS A NE2 1 18 . A ATOM 141 N N . GLY A 1 19 ? 20.971 6.345 25.133 1.0 8.87 ? 19 GLY A N 1 19 . A ATOM 142 C CA . GLY A 1 19 ? 21.953 6.444 24.061 1.0 9.49 ? 19 GLY A CA 1 19 . A ATOM 143 C C . GLY A 1 19 ? 22.249 7.913 23.769 1.0 9.7 ? 19 GLY A C 1 19 . A ATOM 144 O O . GLY A 1 19 ? 23.393 8.298 23.515 1.0 9.8 ? 19 GLY A O 1 19 . A ATOM 145 N N . MET A 1 20 ? 21.225 8.758 23.823 1.0 9.74 ? 20 MET A N 1 20 . A ATOM 146 C CA . MET A 1 20 ? 21.493 10.172 23.549 1.0 10.42 ? 20 MET A CA 1 20 . A ATOM 147 C C . MET A 1 20 ? 22.288 10.764 24.728 1.0 10.42 ? 20 MET A C 1 20 . A ATOM 148 O O . MET A 1 20 ? 23.171 11.587 24.526 1.0 10.16 ? 20 MET A O 1 20 . A ATOM 149 C CB . MET A 1 20 ? 20.177 10.931 23.266 1.0 11.57 ? 20 MET A CB 1 20 . A ATOM 150 C CG . MET A 1 20 ? 20.391 12.425 22.976 1.0 13.31 ? 20 MET A CG 1 20 . A ATOM 151 S SD . MET A 1 20 ? 18.892 13.158 22.256 1.0 14.59 ? 20 MET A SD 1 20 . A ATOM 152 C CE . MET A 1 20 ? 19.379 14.944 22.212 1.0 16.85 ? 20 MET A CE 1 20 . A ATOM 153 N N . TYR A 1 21 ? 21.986 10.324 25.949 1.0 10.9 ? 21 TYR A N 1 21 . A ATOM 154 C CA . TYR A 1 21 ? 22.714 10.797 27.127 1.0 11.75 ? 21 TYR A CA 1 21 . A ATOM 155 C C . TYR A 1 21 ? 24.218 10.513 26.928 1.0 12.15 ? 21 TYR A C 1 21 . A ATOM 156 O O . TYR A 1 21 ? 25.040 11.395 27.129 1.0 13.46 ? 21 TYR A O 1 21 . A ATOM 157 C CB . TYR A 1 21 ? 22.202 10.072 28.379 1.0 12.72 ? 21 TYR A CB 1 21 . A ATOM 158 C CG . TYR A 1 21 ? 22.950 10.386 29.663 1.0 14.98 ? 21 TYR A CG 1 21 . A ATOM 159 C CD1 . TYR A 1 21 ? 22.828 11.620 30.259 1.0 15.91 ? 21 TYR A CD1 1 21 . A ATOM 160 C CD2 . TYR A 1 21 ? 23.748 9.424 30.281 1.0 16.93 ? 21 TYR A CD2 1 21 . A ATOM 161 C CE1 . TYR A 1 21 ? 23.465 11.905 31.446 1.0 17.25 ? 21 TYR A CE1 1 21 . A ATOM 162 C CE2 . TYR A 1 21 ? 24.392 9.696 31.472 1.0 17.14 ? 21 TYR A CE2 1 21 . A ATOM 163 C CZ . TYR A 1 21 ? 24.240 10.938 32.053 1.0 18.27 ? 21 TYR A CZ 1 21 . A ATOM 164 O OH . TYR A 1 21 ? 24.796 11.226 33.294 1.0 20.93 ? 21 TYR A OH 1 21 . A ATOM 165 N N . THR A 1 22 ? 24.543 9.297 26.499 1.0 12.03 ? 22 THR A N 1 22 . A ATOM 166 C CA . THR A 1 22 ? 25.927 8.868 26.274 1.0 13.31 ? 22 THR A CA 1 22 . A ATOM 167 C C . THR A 1 22 ? 26.565 9.638 25.118 1.0 12.55 ? 22 THR A C 1 22 . A ATOM 168 O O . THR A 1 22 ? 27.748 10.015 25.170 1.0 12.33 ? 22 THR A O 1 22 . A ATOM 169 C CB . THR A 1 22 ? 25.962 7.349 25.996 1.0 14.07 ? 22 THR A CB 1 22 . A ATOM 170 O OG1 . THR A 1 22 ? 25.383 6.673 27.122 1.0 16.66 ? 22 THR A OG1 1 22 . A ATOM 171 C CG2 . THR A 1 22 ? 27.411 6.860 25.797 1.0 15.97 ? 22 THR A CG2 1 22 . A ATOM 172 N N . LYS A 1 23 ? 25.787 9.887 24.070 1.0 12.03 ? 23 LYS A N 1 23 . A ATOM 173 C CA . LYS A 1 23 ? 26.262 10.633 22.902 1.0 12.21 ? 23 LYS A CA 1 23 . A ATOM 174 C C . LYS A 1 23 ? 26.744 12.034 23.304 1.0 12.44 ? 23 LYS A C 1 23 . A ATOM 175 O O . LYS A 1 23 ? 27.723 12.545 22.757 1.0 12.72 ? 23 LYS A O 1 23 . A ATOM 176 C CB . LYS A 1 23 ? 25.124 10.762 21.868 1.0 11.07 ? 23 LYS A CB 1 23 . A ATOM 177 C CG . LYS A 1 23 ? 25.391 11.713 20.703 1.0 10.06 ? 23 LYS A CG 1 23 . A ATOM 178 C CD . LYS A 1 23 ? 24.239 11.634 19.674 1.0 10.53 ? 23 LYS A CD 1 23 . A ATOM 179 C CE . LYS A 1 23 ? 24.442 12.622 18.554 1.0 10.6 ? 23 LYS A CE 1 23 . A ATOM 180 N NZ . LYS A 1 23 ? 23.232 12.643 17.632 1.0 11.21 ? 23 LYS A NZ 1 23 . A ATOM 181 N N . TYR A 1 24 ? 26.037 12.652 24.247 1.0 12.64 ? 24 TYR A N 1 24 . A ATOM 182 C CA . TYR A 1 24 ? 26.394 13.998 24.686 1.0 13.8 ? 24 TYR A CA 1 24 . A ATOM 183 C C . TYR A 1 24 ? 27.256 13.983 25.931 1.0 15.01 ? 24 TYR A C 1 24 . A ATOM 184 O O . TYR A 1 24 ? 27.081 14.794 26.856 1.0 15.35 ? 24 TYR A O 1 24 . A ATOM 185 C CB . TYR A 1 24 ? 25.115 14.832 24.893 1.0 14.08 ? 24 TYR A CB 1 24 . A ATOM 186 C CG . TYR A 1 24 ? 24.520 15.239 23.562 1.0 13.19 ? 24 TYR A CG 1 24 . A ATOM 187 C CD1 . TYR A 1 24 ? 25.036 16.321 22.849 1.0 14.58 ? 24 TYR A CD1 1 24 . A ATOM 188 C CD2 . TYR A 1 24 ? 23.549 14.445 22.937 1.0 12.88 ? 24 TYR A CD2 1 24 . A ATOM 189 C CE1 . TYR A 1 24 ? 24.617 16.596 21.548 1.0 15.15 ? 24 TYR A CE1 1 24 . A ATOM 190 C CE2 . TYR A 1 24 ? 23.121 14.721 21.633 1.0 12.08 ? 24 TYR A CE2 1 24 . A ATOM 191 C CZ . TYR A 1 24 ? 23.656 15.789 20.952 1.0 13.34 ? 24 TYR A CZ 1 24 . A ATOM 192 O OH . TYR A 1 24 ? 23.251 16.097 19.669 1.0 15.06 ? 24 TYR A OH 1 24 . A ATOM 193 N N . SER A 1 25 ? 28.180 13.024 25.968 1.0 15.29 ? 25 SER A N 1 25 . A ATOM 194 C CA . SER A 1 25 ? 29.118 12.895 27.093 1.0 16.67 ? 25 SER A CA 1 25 . A ATOM 195 C C . SER A 1 25 ? 28.532 12.778 28.492 1.0 16.08 ? 25 SER A C 1 25 . A ATOM 196 O O . SER A 1 25 ? 29.154 13.239 29.464 1.0 16.33 ? 25 SER A O 1 25 . A ATOM 197 C CB . SER A 1 25 ? 30.059 14.075 27.078 1.0 17.95 ? 25 SER A CB 1 25 . A ATOM 198 O OG . SER A 1 25 ? 30.621 14.199 25.798 1.0 20.66 ? 25 SER A OG 1 25 . A ATOM 199 N N . SER A 1 26 ? 27.348 12.185 28.607 1.0 15.33 ? 26 SER A N 1 26 . A ATOM 200 C CA . SER A 1 26 ? 26.703 12.019 29.900 1.0 15.51 ? 26 SER A CA 1 26 . A ATOM 201 C C . SER A 1 26 ? 26.654 13.346 30.640 1.0 15.95 ? 26 SER A C 1 26 . A ATOM 202 O O . SER A 1 26 ? 26.721 13.360 31.863 1.0 17.0 ? 26 SER A O 1 26 . A ATOM 203 C CB . SER A 1 26 ? 27.490 10.990 30.726 1.0 15.77 ? 26 SER A CB 1 26 . A ATOM 204 O OG . SER A 1 26 ? 27.590 9.785 29.983 1.0 17.28 ? 26 SER A OG 1 26 . A ATOM 205 N N . ASN A 1 27 ? 26.491 14.445 29.899 1.0 15.33 ? 27 ASN A N 1 27 . A ATOM 206 C CA . ASN A 1 27 ? 26.488 15.799 30.470 1.0 15.88 ? 27 ASN A CA 1 27 . A ATOM 207 C C . ASN A 1 27 ? 25.062 16.362 30.506 1.0 15.39 ? 27 ASN A C 1 27 . A ATOM 208 O O . ASN A 1 27 ? 24.557 16.843 29.495 1.0 14.63 ? 27 ASN A O 1 27 . A ATOM 209 C CB . ASN A 1 27 ? 27.435 16.662 29.607 1.0 16.61 ? 27 ASN A CB 1 27 . A ATOM 210 C CG . ASN A 1 27 ? 27.610 18.095 30.105 1.0 18.69 ? 27 ASN A CG 1 27 . A ATOM 211 O OD1 . ASN A 1 27 ? 28.607 18.756 29.763 1.0 22.08 ? 27 ASN A OD1 1 27 . A ATOM 212 N ND2 . ASN A 1 27 ? 26.665 18.590 30.868 1.0 16.67 ? 27 ASN A ND2 1 27 . A ATOM 213 N N . PHE A 1 28 ? 24.420 16.292 31.665 1.0 15.54 ? 28 PHE A N 1 28 . A ATOM 214 C CA . PHE A 1 28 ? 23.052 16.795 31.810 1.0 15.58 ? 28 PHE A CA 1 28 . A ATOM 215 C C . PHE A 1 28 ? 22.876 18.255 31.386 1.0 16.05 ? 28 PHE A C 1 28 . A ATOM 216 O O . PHE A 1 28 ? 21.932 18.581 30.668 1.0 15.68 ? 28 PHE A O 1 28 . A ATOM 217 C CB . PHE A 1 28 ? 22.564 16.623 33.254 1.0 17.15 ? 28 PHE A CB 1 28 . A ATOM 218 C CG . PHE A 1 28 ? 21.181 17.164 33.487 1.0 17.79 ? 28 PHE A CG 1 28 . A ATOM 219 C CD1 . PHE A 1 28 ? 20.043 16.402 33.182 1.0 18.01 ? 28 PHE A CD1 1 28 . A ATOM 220 C CD2 . PHE A 1 28 ? 21.014 18.470 33.940 1.0 17.89 ? 28 PHE A CD2 1 28 . A ATOM 221 C CE1 . PHE A 1 28 ? 18.743 16.957 33.325 1.0 18.27 ? 28 PHE A CE1 1 28 . A ATOM 222 C CE2 . PHE A 1 28 ? 19.742 19.029 34.084 1.0 18.51 ? 28 PHE A CE2 1 28 . A ATOM 223 C CZ . PHE A 1 28 ? 18.604 18.274 33.775 1.0 18.01 ? 28 PHE A CZ 1 28 . A ATOM 224 N N . LYS A 1 29 ? 23.762 19.138 31.834 1.0 15.97 ? 29 LYS A N 1 29 . A ATOM 225 C CA . LYS A 1 29 ? 23.673 20.560 31.491 1.0 16.81 ? 29 LYS A CA 1 29 . A ATOM 226 C C . LYS A 1 29 ? 23.667 20.772 29.996 1.0 15.38 ? 29 LYS A C 1 29 . A ATOM 227 O O . LYS A 1 29 ? 22.856 21.538 29.487 1.0 13.9 ? 29 LYS A O 1 29 . A ATOM 228 C CB . LYS A 1 29 ? 24.849 21.333 32.093 1.0 18.81 ? 29 LYS A CB 1 29 . A ATOM 229 C CG . LYS A 1 29 ? 24.951 21.199 33.585 1.0 22.39 ? 29 LYS A CG 1 29 . A ATOM 230 C CD . LYS A 1 29 ? 23.735 21.733 34.297 1.0 25.38 ? 29 LYS A CD 1 29 . A ATOM 231 C CE . LYS A 1 29 ? 23.833 21.453 35.802 1.0 26.98 ? 29 LYS A CE 1 29 . A ATOM 232 N NZ . LYS A 1 29 ? 22.646 21.965 36.541 1.0 29.48 ? 29 LYS A NZ 1 29 . A ATOM 233 N N . LYS A 1 30 ? 24.571 20.094 29.290 1.0 14.47 ? 30 LYS A N 1 30 . A ATOM 234 C CA . LYS A 1 30 ? 24.644 20.233 27.841 1.0 13.99 ? 30 LYS A CA 1 30 . A ATOM 235 C C . LYS A 1 30 ? 23.374 19.709 27.167 1.0 11.98 ? 30 LYS A C 1 30 . A ATOM 236 O O . LYS A 1 30 ? 22.896 20.319 26.227 1.0 12.53 ? 30 LYS A O 1 30 . A ATOM 237 C CB . LYS A 1 30 ? 25.861 19.499 27.276 1.0 16.89 ? 30 LYS A CB 1 30 . A ATOM 238 C CG . LYS A 1 30 ? 26.004 19.704 25.780 1.0 19.72 ? 30 LYS A CG 1 30 . A ATOM 239 C CD . LYS A 1 30 ? 27.045 18.792 25.151 1.0 23.78 ? 30 LYS A CD 1 30 . A ATOM 240 C CE . LYS A 1 30 ? 28.432 19.056 25.685 1.0 24.99 ? 30 LYS A CE 1 30 . A ATOM 241 N NZ . LYS A 1 30 ? 29.422 18.174 24.970 1.0 26.89 ? 30 LYS A NZ 1 30 . A ATOM 242 N N . ILE A 1 31 ? 22.849 18.594 27.654 1.0 10.45 ? 31 ILE A N 1 31 . A ATOM 243 C CA . ILE A 1 31 ? 21.621 17.994 27.105 1.0 9.61 ? 31 ILE A CA 1 31 . A ATOM 244 C C . ILE A 1 31 ? 20.442 18.942 27.364 1.0 9.33 ? 31 ILE A C 1 31 . A ATOM 245 O O . ILE A 1 31 ? 19.628 19.205 26.481 1.0 8.3 ? 31 ILE A O 1 31 . A ATOM 246 C CB . ILE A 1 31 ? 21.353 16.642 27.770 1.0 10.39 ? 31 ILE A CB 1 31 . A ATOM 247 C CG1 . ILE A 1 31 ? 22.450 15.657 27.330 1.0 11.29 ? 31 ILE A CG1 1 31 . A ATOM 248 C CG2 . ILE A 1 31 ? 19.972 16.133 27.414 1.0 10.78 ? 31 ILE A CG2 1 31 . A ATOM 249 C CD1 . ILE A 1 31 ? 22.443 14.385 28.068 1.0 13.12 ? 31 ILE A CD1 1 31 . A ATOM 250 N N . ARG A 1 32 ? 20.352 19.486 28.568 1.0 9.28 ? 32 ARG A N 1 32 . A ATOM 251 C CA . ARG A 1 32 ? 19.254 20.417 28.879 1.0 9.87 ? 32 ARG A CA 1 32 . A ATOM 252 C C . ARG A 1 32 ? 19.312 21.641 27.959 1.0 9.33 ? 32 ARG A C 1 32 . A ATOM 253 O O . ARG A 1 32 ? 18.283 22.119 27.449 1.0 8.48 ? 32 ARG A O 1 32 . A ATOM 254 C CB . ARG A 1 32 ? 19.347 20.893 30.334 1.0 11.24 ? 32 ARG A CB 1 32 . A ATOM 255 C CG . ARG A 1 32 ? 18.152 21.785 30.742 1.0 12.7 ? 32 ARG A CG 1 32 . A ATOM 256 C CD . ARG A 1 32 ? 18.199 22.118 32.241 1.0 17.68 ? 32 ARG A CD 1 32 . A ATOM 257 N NE . ARG A 1 32 ? 19.377 22.888 32.571 1.0 21.26 ? 32 ARG A NE 1 32 . A ATOM 258 C CZ . ARG A 1 32 ? 19.766 23.150 33.815 1.0 23.99 ? 32 ARG A CZ 1 32 . A ATOM 259 N NH1 . ARG A 1 32 ? 19.050 22.688 34.840 1.0 25.49 ? 32 ARG A NH1 1 32 . A ATOM 260 N NH2 . ARG A 1 32 ? 20.861 23.880 34.030 1.0 24.84 ? 32 ARG A NH2 1 32 . A ATOM 261 N N . LYS A 1 33 ? 20.497 22.181 27.746 1.0 8.94 ? 33 LYS A N 1 33 . A ATOM 262 C CA . LYS A 1 33 ? 20.617 23.337 26.873 1.0 10.22 ? 33 LYS A CA 1 33 . A ATOM 263 C C . LYS A 1 33 ? 20.125 22.990 25.462 1.0 9.08 ? 33 LYS A C 1 33 . A ATOM 264 O O . LYS A 1 33 ? 19.399 23.759 24.851 1.0 9.61 ? 33 LYS A O 1 33 . A ATOM 265 C CB . LYS A 1 33 ? 22.078 23.818 26.790 1.0 11.94 ? 33 LYS A CB 1 33 . A ATOM 266 C CG . LYS A 1 33 ? 22.272 25.041 25.922 1.0 17.49 ? 33 LYS A CG 1 33 . A ATOM 267 C CD . LYS A 1 33 ? 23.743 25.384 25.707 1.0 21.33 ? 33 LYS A CD 1 33 . A ATOM 268 C CE . LYS A 1 33 ? 23.852 26.662 24.892 1.0 23.5 ? 33 LYS A CE 1 33 . A ATOM 269 N NZ . LYS A 1 33 ? 23.314 27.871 25.619 1.0 26.83 ? 33 LYS A NZ 1 33 . A ATOM 270 N N . ARG A 1 34 ? 20.557 21.852 24.916 1.0 7.97 ? 34 ARG A N 1 34 . A ATOM 271 C CA . ARG A 1 34 ? 20.131 21.465 23.571 1.0 7.28 ? 34 ARG A CA 1 34 . A ATOM 272 C C . ARG A 1 34 ? 18.606 21.306 23.499 1.0 6.97 ? 34 ARG A C 1 34 . A ATOM 273 O O . ARG A 1 34 ? 17.977 21.753 22.525 1.0 7.96 ? 34 ARG A O 1 34 . A ATOM 274 C CB . ARG A 1 34 ? 20.786 20.139 23.194 1.0 9.27 ? 34 ARG A CB 1 34 . A ATOM 275 C CG . ARG A 1 34 ? 20.477 19.715 21.751 1.0 10.19 ? 34 ARG A CG 1 34 . A ATOM 276 C CD . ARG A 1 34 ? 21.319 18.510 21.339 1.0 12.21 ? 34 ARG A CD 1 34 . A ATOM 277 N NE . ARG A 1 34 ? 20.990 18.048 19.992 1.0 12.73 ? 34 ARG A NE 1 34 . A ATOM 278 C CZ . ARG A 1 34 ? 21.539 18.502 18.867 1.0 11.65 ? 34 ARG A CZ 1 34 . A ATOM 279 N NH1 . ARG A 1 34 ? 22.468 19.463 18.881 1.0 13.12 ? 34 ARG A NH1 1 34 . A ATOM 280 N NH2 . ARG A 1 34 ? 21.195 17.938 17.714 1.0 11.18 ? 34 ARG A NH2 1 34 . A ATOM 281 N N . VAL A 1 35 ? 18.022 20.678 24.522 1.0 6.37 ? 35 VAL A N 1 35 . A ATOM 282 C CA . VAL A 1 35 ? 16.566 20.495 24.537 1.0 6.52 ? 35 VAL A CA 1 35 . A ATOM 283 C C . VAL A 1 35 ? 15.876 21.855 24.621 1.0 5.92 ? 35 VAL A C 1 35 . A ATOM 284 O O . VAL A 1 35 ? 14.886 22.093 23.923 1.0 6.57 ? 35 VAL A O 1 35 . A ATOM 285 C CB . VAL A 1 35 ? 16.117 19.571 25.684 1.0 6.12 ? 35 VAL A CB 1 35 . A ATOM 286 C CG1 . VAL A 1 35 ? 14.604 19.565 25.769 1.0 8.54 ? 35 VAL A CG1 1 35 . A ATOM 287 C CG2 . VAL A 1 35 ? 16.667 18.171 25.452 1.0 9.28 ? 35 VAL A CG2 1 35 . A ATOM 288 N N . HIS A 1 36 ? 16.378 22.776 25.443 1.0 4.8 ? 36 HIS A N 1 36 . A ATOM 289 C CA . HIS A 1 36 ? 15.742 24.092 25.482 1.0 4.94 ? 36 HIS A CA 1 36 . A ATOM 290 C C . HIS A 1 36 ? 15.793 24.773 24.115 1.0 5.45 ? 36 HIS A C 1 36 . A ATOM 291 O O . HIS A 1 36 ? 14.831 25.414 23.718 1.0 5.4 ? 36 HIS A O 1 36 . A ATOM 292 C CB . HIS A 1 36 ? 16.394 24.988 26.553 1.0 5.72 ? 36 HIS A CB 1 36 . A ATOM 293 C CG . HIS A 1 36 ? 15.886 24.707 27.936 1.0 5.46 ? 36 HIS A CG 1 36 . A ATOM 294 N ND1 . HIS A 1 36 ? 15.407 25.702 28.766 1.0 7.2 ? 36 HIS A ND1 1 36 . A ATOM 295 C CD2 . HIS A 1 36 ? 15.731 23.547 28.610 1.0 6.97 ? 36 HIS A CD2 1 36 . A ATOM 296 C CE1 . HIS A 1 36 ? 14.983 25.163 29.894 1.0 6.95 ? 36 HIS A CE1 1 36 . A ATOM 297 N NE2 . HIS A 1 36 ? 15.168 23.854 29.826 1.0 7.78 ? 36 HIS A NE2 1 36 . A ATOM 298 N N . GLN A 1 37 ? 16.930 24.649 23.417 1.0 5.73 ? 37 GLN A N 1 37 . A ATOM 299 C CA . GLN A 1 37 ? 17.036 25.277 22.098 1.0 6.89 ? 37 GLN A CA 1 37 . A ATOM 300 C C . GLN A 1 37 ? 16.042 24.672 21.116 1.0 6.19 ? 37 GLN A C 1 37 . A ATOM 301 O O . GLN A 1 37 ? 15.492 25.385 20.259 1.0 6.35 ? 37 GLN A O 1 37 . A ATOM 302 C CB . GLN A 1 37 ? 18.455 25.171 21.544 1.0 8.58 ? 37 GLN A CB 1 37 . A ATOM 303 C CG . GLN A 1 37 ? 18.666 26.055 20.313 1.0 12.5 ? 37 GLN A CG 1 37 . A ATOM 304 C CD . GLN A 1 37 ? 20.054 26.007 19.718 1.0 13.66 ? 37 GLN A CD 1 37 . A ATOM 305 O OE1 . GLN A 1 37 ? 20.233 26.190 18.489 1.0 11.79 ? 37 GLN A OE1 1 37 . A ATOM 306 N NE2 . GLN A 1 37 ? 21.068 25.794 20.594 1.0 15.73 ? 37 GLN A NE2 1 37 . A ATOM 307 N N . MET A 1 38 ? 15.796 23.365 21.242 1.0 5.77 ? 38 MET A N 1 38 . A ATOM 308 C CA . MET A 1 38 ? 14.803 22.724 20.389 1.0 5.79 ? 38 MET A CA 1 38 . A ATOM 309 C C . MET A 1 38 ? 13.426 23.290 20.696 1.0 4.67 ? 38 MET A C 1 38 . A ATOM 310 O O . MET A 1 38 ? 12.672 23.652 19.789 1.0 5.01 ? 38 MET A O 1 38 . A ATOM 311 C CB . MET A 1 38 ? 14.803 21.226 20.619 1.0 8.14 ? 38 MET A CB 1 38 . A ATOM 312 C CG . MET A 1 38 ? 16.094 20.606 20.232 1.0 12.31 ? 38 MET A CG 1 38 . A ATOM 313 S SD . MET A 1 38 ? 16.226 18.918 20.806 1.0 16.55 ? 38 MET A SD 1 38 . A ATOM 314 C CE . MET A 1 38 ? 17.557 18.315 19.694 1.0 17.45 ? 38 MET A CE 1 38 . A ATOM 315 N N . VAL A 1 39 ? 13.099 23.397 21.981 1.0 5.11 ? 39 VAL A N 1 39 . A ATOM 316 C CA . VAL A 1 39 ? 11.793 23.948 22.367 1.0 4.79 ? 39 VAL A CA 1 39 . A ATOM 317 C C . VAL A 1 39 ? 11.621 25.373 21.866 1.0 4.98 ? 39 VAL A C 1 39 . A ATOM 318 O O . VAL A 1 39 ? 10.549 25.734 21.409 1.0 4.97 ? 39 VAL A O 1 39 . A ATOM 319 C CB . VAL A 1 39 ? 11.569 23.843 23.906 1.0 6.23 ? 39 VAL A CB 1 39 . A ATOM 320 C CG1 . VAL A 1 39 ? 10.259 24.577 24.329 1.0 7.68 ? 39 VAL A CG1 1 39 . A ATOM 321 C CG2 . VAL A 1 39 ? 11.498 22.346 24.299 1.0 8.26 ? 39 VAL A CG2 1 39 . A ATOM 322 N N . SER A 1 40 ? 12.676 26.188 21.941 1.0 4.36 ? 40 SER A N 1 40 . A ATOM 323 C CA . SER A 1 40 ? 12.559 27.580 21.485 1.0 4.82 ? 40 SER A CA 1 40 . A ATOM 324 C C . SER A 1 40 ? 12.222 27.597 19.997 1.0 4.35 ? 40 SER A C 1 40 . A ATOM 325 O O . SER A 1 40 ? 11.458 28.414 19.531 1.0 4.7 ? 40 SER A O 1 40 . A ATOM 326 C CB . SER A 1 40 ? 13.882 28.324 21.753 1.0 6.65 ? 40 SER A CB 1 40 . A ATOM 327 O OG . SER A 1 40 ? 14.145 28.395 23.151 1.0 11.82 ? 40 SER A OG 1 40 . A ATOM 328 N N . ASN A 1 41 ? 12.825 26.685 19.239 1.0 4.12 ? 41 ASN A N 1 41 . A ATOM 329 C CA . ASN A 1 41 ? 12.519 26.576 17.810 1.0 3.55 ? 41 ASN A CA 1 41 . A ATOM 330 C C . ASN A 1 41 ? 11.086 26.068 17.544 1.0 3.78 ? 41 ASN A C 1 41 . A ATOM 331 O O . ASN A 1 41 ? 10.401 26.583 16.669 1.0 3.63 ? 41 ASN A O 1 41 . A ATOM 332 C CB . ASN A 1 41 ? 13.541 25.666 17.126 1.0 4.13 ? 41 ASN A CB 1 41 . A ATOM 333 C CG . ASN A 1 41 ? 14.790 26.424 16.767 1.0 4.51 ? 41 ASN A CG 1 41 . A ATOM 334 O OD1 . ASN A 1 41 ? 14.758 27.277 15.872 1.0 6.41 ? 41 ASN A OD1 1 41 . A ATOM 335 N ND2 . ASN A 1 41 ? 15.902 26.127 17.446 1.0 5.67 ? 41 ASN A ND2 1 41 . A ATOM 336 N N . ILE A 1 42 ? 10.618 25.103 18.324 1.0 3.59 ? 42 ILE A N 1 42 . A ATOM 337 C CA . ILE A 1 42 ? 9.251 24.583 18.152 1.0 3.83 ? 42 ILE A CA 1 42 . A ATOM 338 C C . ILE A 1 42 ? 8.269 25.718 18.470 1.0 4.13 ? 42 ILE A C 1 42 . A ATOM 339 O O . ILE A 1 42 ? 7.305 25.949 17.745 1.0 4.7 ? 42 ILE A O 1 42 . A ATOM 340 C CB . ILE A 1 42 ? 8.993 23.380 19.087 1.0 4.47 ? 42 ILE A CB 1 42 . A ATOM 341 C CG1 . ILE A 1 42 ? 9.936 22.213 18.743 1.0 5.16 ? 42 ILE A CG1 1 42 . A ATOM 342 C CG2 . ILE A 1 42 ? 7.546 22.928 18.942 1.0 4.85 ? 42 ILE A CG2 1 42 . A ATOM 343 C CD1 . ILE A 1 42 ? 9.964 21.122 19.774 1.0 6.82 ? 42 ILE A CD1 1 42 . A ATOM 344 N N . ASN A 1 43 ? 8.535 26.444 19.545 1.0 3.98 ? 43 ASN A N 1 43 . A ATOM 345 C CA . ASN A 1 43 ? 7.662 27.544 19.882 1.0 4.7 ? 43 ASN A CA 1 43 . A ATOM 346 C C . ASN A 1 43 ? 7.600 28.591 18.743 1.0 3.75 ? 43 ASN A C 1 43 . A ATOM 347 O O . ASN A 1 43 ? 6.521 29.050 18.374 1.0 5.36 ? 43 ASN A O 1 43 . A ATOM 348 C CB . ASN A 1 43 ? 8.165 28.193 21.155 1.0 6.36 ? 43 ASN A CB 1 43 . A ATOM 349 C CG . ASN A 1 43 ? 7.282 29.278 21.594 1.0 9.39 ? 43 ASN A CG 1 43 . A ATOM 350 O OD1 . ASN A 1 43 ? 6.184 29.019 22.086 1.0 10.78 ? 43 ASN A OD1 1 43 . A ATOM 351 N ND2 . ASN A 1 43 ? 7.715 30.532 21.372 1.0 10.24 ? 43 ASN A ND2 1 43 . A ATOM 352 N N . GLU A 1 44 ? 8.754 28.926 18.173 1.0 4.56 ? 44 GLU A N 1 44 . A ATOM 353 C CA . GLU A 1 44 ? 8.786 29.888 17.078 1.0 4.86 ? 44 GLU A CA 1 44 . A ATOM 354 C C . GLU A 1 44 ? 7.963 29.356 15.895 1.0 4.74 ? 44 GLU A C 1 44 . A ATOM 355 O O . GLU A 1 44 ? 7.185 30.098 15.255 1.0 5.8 ? 44 GLU A O 1 44 . A ATOM 356 C CB . GLU A 1 44 ? 10.229 30.121 16.640 1.0 5.08 ? 44 GLU A CB 1 44 . A ATOM 357 C CG . GLU A 1 44 ? 10.423 30.860 15.329 1.0 6.56 ? 44 GLU A CG 1 44 . A ATOM 358 C CD . GLU A 1 44 ? 9.875 32.264 15.322 1.0 7.86 ? 44 GLU A CD 1 44 . A ATOM 359 O OE1 . GLU A 1 44 ? 9.619 32.856 16.380 1.0 7.14 ? 44 GLU A OE1 1 44 . A ATOM 360 O OE2 . GLU A 1 44 ? 9.750 32.793 14.199 1.0 10.17 ? 44 GLU A OE2 1 44 . A ATOM 361 N N . MET A 1 45 ? 8.145 28.076 15.572 1.0 4.61 ? 45 MET A N 1 45 . A ATOM 362 C CA . MET A 1 45 ? 7.396 27.517 14.434 1.0 4.32 ? 45 MET A CA 1 45 . A ATOM 363 C C . MET A 1 45 ? 5.898 27.454 14.639 1.0 3.78 ? 45 MET A C 1 45 . A ATOM 364 O O . MET A 1 45 ? 5.127 27.499 13.677 1.0 5.05 ? 45 MET A O 1 45 . A ATOM 365 C CB . MET A 1 45 ? 7.947 26.147 14.051 1.0 5.21 ? 45 MET A CB 1 45 . A ATOM 366 C CG . MET A 1 45 ? 9.301 26.299 13.310 1.0 6.09 ? 45 MET A CG 1 45 . A ATOM 367 S SD . MET A 1 45 ? 10.029 24.720 12.794 1.0 6.69 ? 45 MET A SD 1 45 . A ATOM 368 C CE . MET A 1 45 ? 11.138 24.361 14.191 1.0 5.25 ? 45 MET A CE 1 45 . A ATOM 369 N N . CYS A 1 46 ? 5.487 27.369 15.896 1.0 4.77 ? 46 CYS A N 1 46 . A ATOM 370 C CA . CYS A 1 46 ? 4.065 27.331 16.191 1.0 5.84 ? 46 CYS A CA 1 46 . A ATOM 371 C C . CYS A 1 46 ? 3.420 28.707 16.369 1.0 5.94 ? 46 CYS A C 1 46 . A ATOM 372 O O . CYS A 1 46 ? 2.218 28.793 16.564 1.0 7.02 ? 46 CYS A O 1 46 . A ATOM 373 C CB . CYS A 1 46 ? 3.809 26.469 17.422 1.0 4.99 ? 46 CYS A CB 1 46 . A ATOM 374 S SG . CYS A 1 46 ? 4.095 24.704 17.115 1.0 6.84 ? 46 CYS A SG 1 46 . A ATOM 375 N N . ARG A 1 47 ? 4.189 29.781 16.252 1.0 7.22 ? 47 ARG A N 1 47 . A ATOM 376 C CA . ARG A 1 47 ? 3.558 31.081 16.449 1.0 8.88 ? 47 ARG A CA 1 47 . A ATOM 377 C C . ARG A 1 47 ? 2.421 31.385 15.486 1.0 8.98 ? 47 ARG A C 1 47 . A ATOM 378 O O . ARG A 1 47 ? 1.379 31.906 15.903 1.0 9.79 ? 47 ARG A O 1 47 . A ATOM 379 C CB . ARG A 1 47 ? 4.577 32.197 16.376 1.0 11.72 ? 47 ARG A CB 1 47 . A ATOM 380 C CG . ARG A 1 47 ? 5.511 32.246 17.506 1.0 13.69 ? 47 ARG A CG 1 47 . A ATOM 381 C CD . ARG A 1 47 ? 6.402 33.468 17.347 1.0 15.35 ? 47 ARG A CD 1 47 . A ATOM 382 N NE . ARG A 1 47 ? 6.813 33.626 15.956 1.0 18.06 ? 47 ARG A NE 1 47 . A ATOM 383 C CZ . ARG A 1 47 ? 7.588 34.604 15.535 1.0 17.49 ? 47 ARG A CZ 1 47 . A ATOM 384 N NH1 . ARG A 1 47 ? 8.028 35.476 16.415 1.0 15.51 ? 47 ARG A NH1 1 47 . A ATOM 385 N NH2 . ARG A 1 47 ? 7.890 34.733 14.234 1.0 18.21 ? 47 ARG A NH2 1 47 . A ATOM 386 N N . PRO A 1 48 ? 2.574 31.069 14.185 1.0 9.59 ? 48 PRO A N 1 48 . A ATOM 387 C CA . PRO A 1 48 ? 1.450 31.365 13.284 1.0 9.77 ? 48 PRO A CA 1 48 . A ATOM 388 C C . PRO A 1 48 ? 0.219 30.512 13.567 1.0 9.33 ? 48 PRO A C 1 48 . A ATOM 389 O O . PRO A 1 48 ? -0.850 30.778 13.018 1.0 11.01 ? 48 PRO A O 1 48 . A ATOM 390 C CB . PRO A 1 48 ? 2.024 31.087 11.888 1.0 9.96 ? 48 PRO A CB 1 48 . A ATOM 391 C CG . PRO A 1 48 ? 3.493 31.336 12.073 1.0 9.29 ? 48 PRO A CG 1 48 . A ATOM 392 C CD . PRO A 1 48 ? 3.793 30.716 13.425 1.0 9.59 ? 48 PRO A CD 1 48 . A ATOM 393 N N . LEU A 1 49 ? 0.336 29.452 14.383 1.0 8.46 ? 49 LEU A N 1 49 . A ATOM 394 C CA . LEU A 1 49 ? -0.824 28.645 14.728 1.0 8.55 ? 49 LEU A CA 1 49 . A ATOM 395 C C . LEU A 1 49 ? -1.456 29.124 16.042 1.0 7.12 ? 49 LEU A C 1 49 . A ATOM 396 O O . LEU A 1 49 ? -2.464 28.579 16.482 1.0 8.38 ? 49 LEU A O 1 49 . A ATOM 397 C CB . LEU A 1 49 ? -0.415 27.164 14.893 1.0 7.77 ? 49 LEU A CB 1 49 . A ATOM 398 C CG . LEU A 1 49 ? 0.216 26.503 13.648 1.0 7.98 ? 49 LEU A CG 1 49 . A ATOM 399 C CD1 . LEU A 1 49 ? 0.426 25.030 13.934 1.0 9.19 ? 49 LEU A CD1 1 49 . A ATOM 400 C CD2 . LEU A 1 49 ? -0.660 26.699 12.430 1.0 9.97 ? 49 LEU A CD2 1 49 . A ATOM 401 N N . ASN A 1 50 ? -0.809 30.121 16.651 1.0 7.61 ? 50 ASN A N 1 50 . A ATOM 402 C CA . ASN A 1 50 ? -1.223 30.662 17.945 1.0 7.76 ? 50 ASN A CA 1 50 . A ATOM 403 C C . ASN A 1 50 ? -1.228 29.590 19.052 1.0 8.27 ? 50 ASN A C 1 50 . A ATOM 404 O O . ASN A 1 50 ? -2.140 29.519 19.877 1.0 8.38 ? 50 ASN A O 1 50 . A ATOM 405 C CB . ASN A 1 50 ? -2.580 31.391 17.852 1.0 9.15 ? 50 ASN A CB 1 50 . A ATOM 406 C CG . ASN A 1 50 ? -2.742 32.451 18.936 1.0 9.82 ? 50 ASN A CG 1 50 . A ATOM 407 O OD1 . ASN A 1 50 ? -1.800 32.821 19.650 1.0 10.34 ? 50 ASN A OD1 1 50 . A ATOM 408 N ND2 . ASN A 1 50 ? -3.956 32.947 19.055 1.0 10.93 ? 50 ASN A ND2 1 50 . A ATOM 409 N N . ILE A 1 51 ? -0.202 28.723 19.018 1.0 7.94 ? 51 ILE A N 1 51 . A ATOM 410 C CA . ILE A 1 51 ? -0.043 27.709 20.049 1.0 7.34 ? 51 ILE A CA 1 51 . A ATOM 411 C C . ILE A 1 51 ? 1.201 28.068 20.856 1.0 7.28 ? 51 ILE A C 1 51 . A ATOM 412 O O . ILE A 1 51 ? 2.297 28.193 20.306 1.0 7.95 ? 51 ILE A O 1 51 . A ATOM 413 C CB . ILE A 1 51 ? 0.183 26.278 19.490 1.0 6.85 ? 51 ILE A CB 1 51 . A ATOM 414 C CG1 . ILE A 1 51 ? -0.963 25.866 18.573 1.0 7.67 ? 51 ILE A CG1 1 51 . A ATOM 415 C CG2 . ILE A 1 51 ? 0.251 25.278 20.666 1.0 7.07 ? 51 ILE A CG2 1 51 . A ATOM 416 C CD1 . ILE A 1 51 ? -0.659 24.540 17.865 1.0 9.02 ? 51 ILE A CD1 1 51 . A ATOM 417 N N . ALA A 1 52 ? 1.020 28.282 22.158 1.0 6.54 ? 52 ALA A N 1 52 . A ATOM 418 C CA . ALA A 1 52 ? 2.156 28.599 23.038 1.0 6.99 ? 52 ALA A CA 1 52 . A ATOM 419 C C . ALA A 1 52 ? 2.729 27.269 23.500 1.0 6.62 ? 52 ALA A C 1 52 . A ATOM 420 O O . ALA A 1 52 ? 2.025 26.466 24.112 1.0 6.37 ? 52 ALA A O 1 52 . A ATOM 421 C CB . ALA A 1 52 ? 1.671 29.433 24.259 1.0 7.26 ? 52 ALA A CB 1 52 . A ATOM 422 N N . ILE A 1 53 ? 4.008 27.072 23.250 1.0 7.07 ? 53 ILE A N 1 53 . A ATOM 423 C CA . ILE A 1 53 ? 4.695 25.819 23.575 1.0 7.1 ? 53 ILE A CA 1 53 . A ATOM 424 C C . ILE A 1 53 ? 5.560 26.000 24.823 1.0 7.59 ? 53 ILE A C 1 53 . A ATOM 425 O O . ILE A 1 53 ? 6.344 26.953 24.900 1.0 9.24 ? 53 ILE A O 1 53 . A ATOM 426 C CB . ILE A 1 53 ? 5.646 25.418 22.391 1.0 7.79 ? 53 ILE A CB 1 53 . A ATOM 427 C CG1 . ILE A 1 53 ? 4.876 25.292 21.069 1.0 9.02 ? 53 ILE A CG1 1 53 . A ATOM 428 C CG2 . ILE A 1 53 ? 6.375 24.105 22.712 1.0 8.65 ? 53 ILE A CG2 1 53 . A ATOM 429 C CD1 . ILE A 1 53 ? 3.904 24.122 21.026 1.0 8.97 ? 53 ILE A CD1 1 53 . A ATOM 430 N N . THR A 1 54 ? 5.385 25.132 25.802 1.0 6.59 ? 54 THR A N 1 54 . A ATOM 431 C CA . THR A 1 54 ? 6.241 25.166 26.975 1.0 7.85 ? 54 THR A CA 1 54 . A ATOM 432 C C . THR A 1 54 ? 6.801 23.787 27.255 1.0 8.56 ? 54 THR A C 1 54 . A ATOM 433 O O . THR A 1 54 ? 6.202 22.770 26.851 1.0 9.49 ? 54 THR A O 1 54 . A ATOM 434 C CB . THR A 1 54 ? 5.508 25.651 28.241 1.0 9.13 ? 54 THR A CB 1 54 . A ATOM 435 O OG1 . THR A 1 54 ? 4.241 24.992 28.391 1.0 9.53 ? 54 THR A OG1 1 54 . A ATOM 436 C CG2 . THR A 1 54 ? 5.355 27.161 28.205 1.0 11.23 ? 54 THR A CG2 1 54 . A ATOM 437 N N . LEU A 1 55 ? 7.963 23.750 27.908 1.0 6.97 ? 55 LEU A N 1 55 . A ATOM 438 C CA . LEU A 1 55 ? 8.601 22.507 28.345 1.0 7.28 ? 55 LEU A CA 1 55 . A ATOM 439 C C . LEU A 1 55 ? 8.134 22.252 29.769 1.0 7.67 ? 55 LEU A C 1 55 . A ATOM 440 O O . LEU A 1 55 ? 8.656 22.843 30.713 1.0 9.2 ? 55 LEU A O 1 55 . A ATOM 441 C CB . LEU A 1 55 ? 10.135 22.646 28.294 1.0 7.56 ? 55 LEU A CB 1 55 . A ATOM 442 C CG . LEU A 1 55 ? 10.929 21.399 28.701 1.0 8.48 ? 55 LEU A CG 1 55 . A ATOM 443 C CD1 . LEU A 1 55 ? 10.580 20.257 27.766 1.0 9.78 ? 55 LEU A CD1 1 55 . A ATOM 444 C CD2 . LEU A 1 55 ? 12.410 21.698 28.648 1.0 9.93 ? 55 LEU A CD2 1 55 . A ATOM 445 N N . ALA A 1 56 ? 7.113 21.415 29.928 1.0 7.07 ? 56 ALA A N 1 56 . A ATOM 446 C CA . ALA A 1 56 ? 6.588 21.082 31.255 1.0 7.34 ? 56 ALA A CA 1 56 . A ATOM 447 C C . ALA A 1 56 ? 7.507 20.132 31.996 1.0 8.03 ? 56 ALA A C 1 56 . A ATOM 448 O O . ALA A 1 56 ? 7.577 20.161 33.216 1.0 8.91 ? 56 ALA A O 1 56 . A ATOM 449 C CB . ALA A 1 56 ? 5.203 20.431 31.112 1.0 8.82 ? 56 ALA A CB 1 56 . A ATOM 450 N N . LEU A 1 57 ? 8.203 19.266 31.275 1.0 8.29 ? 57 LEU A N 1 57 . A ATOM 451 C CA . LEU A 1 57 ? 9.025 18.254 31.895 1.0 9.22 ? 57 LEU A CA 1 57 . A ATOM 452 C C . LEU A 1 57 ? 10.143 17.761 31.017 1.0 8.83 ? 57 LEU A C 1 57 . A ATOM 453 O O . LEU A 1 57 ? 9.914 17.523 29.822 1.0 9.1 ? 57 LEU A O 1 57 . A ATOM 454 C CB . LEU A 1 57 ? 8.136 17.062 32.222 1.0 10.96 ? 57 LEU A CB 1 57 . A ATOM 455 C CG . LEU A 1 57 ? 8.652 15.841 32.945 1.0 13.57 ? 57 LEU A CG 1 57 . A ATOM 456 C CD1 . LEU A 1 57 ? 8.988 16.273 34.367 1.0 14.96 ? 57 LEU A CD1 1 57 . A ATOM 457 C CD2 . LEU A 1 57 ? 7.560 14.768 32.960 1.0 14.49 ? 57 LEU A CD2 1 57 . A ATOM 458 N N . LEU A 1 58 ? 11.340 17.615 31.579 1.0 8.55 ? 58 LEU A N 1 58 . A ATOM 459 C CA . LEU A 1 58 ? 12.503 17.059 30.871 1.0 8.84 ? 58 LEU A CA 1 58 . A ATOM 460 C C . LEU A 1 58 ? 12.920 15.856 31.696 1.0 9.37 ? 58 LEU A C 1 58 . A ATOM 461 O O . LEU A 1 58 ? 13.148 15.960 32.910 1.0 10.46 ? 58 LEU A O 1 58 . A ATOM 462 C CB . LEU A 1 58 ? 13.666 18.067 30.792 1.0 9.67 ? 58 LEU A CB 1 58 . A ATOM 463 C CG . LEU A 1 58 ? 15.000 17.462 30.356 1.0 10.08 ? 58 LEU A CG 1 58 . A ATOM 464 C CD1 . LEU A 1 58 ? 14.868 16.894 28.936 1.0 10.24 ? 58 LEU A CD1 1 58 . A ATOM 465 C CD2 . LEU A 1 58 ? 16.121 18.532 30.384 1.0 11.6 ? 58 LEU A CD2 1 58 . A ATOM 466 N N . ASP A 1 59 ? 12.976 14.694 31.076 1.0 8.0 ? 59 ASP A N 1 59 . A ATOM 467 C CA . ASP A 1 59 ? 13.381 13.482 31.771 1.0 7.84 ? 59 ASP A CA 1 59 . A ATOM 468 C C . ASP A 1 59 ? 14.540 12.902 30.991 1.0 8.6 ? 59 ASP A C 1 59 . A ATOM 469 O O . ASP A 1 59 ? 14.376 12.541 29.829 1.0 8.16 ? 59 ASP A O 1 59 . A ATOM 470 C CB . ASP A 1 59 ? 12.213 12.487 31.846 1.0 9.71 ? 59 ASP A CB 1 59 . A ATOM 471 C CG . ASP A 1 59 ? 12.569 11.204 32.571 1.0 12.33 ? 59 ASP A CG 1 59 . A ATOM 472 O OD1 . ASP A 1 59 ? 13.504 11.207 33.396 1.0 15.32 ? 59 ASP A OD1 1 59 . A ATOM 473 O OD2 . ASP A 1 59 ? 11.899 10.176 32.340 1.0 13.79 ? 59 ASP A OD2 1 59 . A ATOM 474 N N . VAL A 1 60 ? 15.716 12.815 31.602 1.0 8.66 ? 60 VAL A N 1 60 . A ATOM 475 C CA . VAL A 1 60 ? 16.903 12.283 30.927 1.0 9.3 ? 60 VAL A CA 1 60 . A ATOM 476 C C . VAL A 1 60 ? 17.200 10.941 31.557 1.0 9.57 ? 60 VAL A C 1 60 . A ATOM 477 O O . VAL A 1 60 ? 17.354 10.851 32.776 1.0 9.83 ? 60 VAL A O 1 60 . A ATOM 478 C CB . VAL A 1 60 ? 18.087 13.232 31.126 1.0 9.97 ? 60 VAL A CB 1 60 . A ATOM 479 C CG1 . VAL A 1 60 ? 19.362 12.660 30.504 1.0 10.27 ? 60 VAL A CG1 1 60 . A ATOM 480 C CG2 . VAL A 1 60 ? 17.712 14.581 30.546 1.0 9.75 ? 60 VAL A CG2 1 60 . A ATOM 481 N N . TRP A 1 61 ? 17.237 9.899 30.735 1.0 9.76 ? 61 TRP A N 1 61 . A ATOM 482 C CA . TRP A 1 61 ? 17.482 8.527 31.204 1.0 9.52 ? 61 TRP A CA 1 61 . A ATOM 483 C C . TRP A 1 61 ? 18.984 8.300 31.356 1.0 11.2 ? 61 TRP A C 1 61 . A ATOM 484 O O . TRP A 1 61 ? 19.619 7.626 30.551 1.0 11.73 ? 61 TRP A O 1 61 . A ATOM 485 C CB . TRP A 1 61 ? 16.854 7.526 30.221 1.0 9.52 ? 61 TRP A CB 1 61 . A ATOM 486 C CG . TRP A 1 61 ? 15.342 7.555 30.202 1.0 7.72 ? 61 TRP A CG 1 61 . A ATOM 487 C CD1 . TRP A 1 61 ? 14.495 8.212 31.089 1.0 8.27 ? 61 TRP A CD1 1 61 . A ATOM 488 C CD2 . TRP A 1 61 ? 14.493 6.843 29.309 1.0 7.55 ? 61 TRP A CD2 1 61 . A ATOM 489 N NE1 . TRP A 1 61 ? 13.183 7.929 30.787 1.0 8.41 ? 61 TRP A NE1 1 61 . A ATOM 490 C CE2 . TRP A 1 61 ? 13.148 7.089 29.701 1.0 7.46 ? 61 TRP A CE2 1 61 . A ATOM 491 C CE3 . TRP A 1 61 ? 14.732 5.998 28.208 1.0 8.12 ? 61 TRP A CE3 1 61 . A ATOM 492 C CZ2 . TRP A 1 61 ? 12.054 6.522 29.031 1.0 7.94 ? 61 TRP A CZ2 1 61 . A ATOM 493 C CZ3 . TRP A 1 61 ? 13.666 5.453 27.557 1.0 7.86 ? 61 TRP A CZ3 1 61 . A ATOM 494 C CH2 . TRP A 1 61 ? 12.333 5.704 27.955 1.0 7.84 ? 61 TRP A CH2 1 61 . A ATOM 495 N N . SER A 1 62 ? 19.535 8.887 32.421 1.0 12.25 ? 62 SER A N 1 62 . A ATOM 496 C CA . SER A 1 62 ? 20.958 8.838 32.714 1.0 14.27 ? 62 SER A CA 1 62 . A ATOM 497 C C . SER A 1 62 ? 21.503 7.496 33.195 1.0 15.33 ? 62 SER A C 1 62 . A ATOM 498 O O . SER A 1 62 ? 22.709 7.308 33.178 1.0 16.63 ? 62 SER A O 1 62 . A ATOM 499 C CB . SER A 1 62 ? 21.287 9.896 33.757 1.0 14.2 ? 62 SER A CB 1 62 . A ATOM 500 O OG . SER A 1 62 ? 20.467 9.735 34.894 1.0 16.4 ? 62 SER A OG 1 62 . A ATOM 501 N N . GLU A 1 63 ? 20.624 6.602 33.625 1.0 16.11 ? 63 GLU A N 1 63 . A ATOM 502 C CA . GLU A 1 63 ? 21.052 5.294 34.133 1.0 18.02 ? 63 GLU A CA 1 63 . A ATOM 503 C C . GLU A 1 63 ? 20.834 4.178 33.105 1.0 17.85 ? 63 GLU A C 1 63 . A ATOM 504 O O . GLU A 1 63 ? 21.769 3.417 32.779 1.0 18.43 ? 63 GLU A O 1 63 . A ATOM 505 C CB . GLU A 1 63 ? 20.286 4.979 35.430 1.0 21.19 ? 63 GLU A CB 1 63 . A ATOM 506 C CG . GLU A 1 63 ? 20.601 3.617 36.082 1.0 25.38 ? 63 GLU A CG 1 63 . A ATOM 507 C CD . GLU A 1 63 ? 19.561 3.202 37.140 1.0 27.97 ? 63 GLU A CD 1 63 . A ATOM 508 O OE1 . GLU A 1 63 ? 19.682 2.086 37.698 1.0 29.85 ? 63 GLU A OE1 1 63 . A ATOM 509 O OE2 . GLU A 1 63 ? 18.618 3.987 37.423 1.0 30.02 ? 63 GLU A OE2 1 63 . A ATOM 510 N N . LYS A 1 64 ? 19.609 4.084 32.591 1.0 16.62 ? 64 LYS A N 1 64 . A ATOM 511 C CA . LYS A 1 64 ? 19.259 3.052 31.610 1.0 15.32 ? 64 LYS A CA 1 64 . A ATOM 512 C C . LYS A 1 64 ? 17.960 3.408 30.901 1.0 14.01 ? 64 LYS A C 1 64 . A ATOM 513 O O . LYS A 1 64 ? 17.222 4.279 31.367 1.0 14.34 ? 64 LYS A O 1 64 . A ATOM 514 C CB . LYS A 1 64 ? 19.064 1.715 32.324 1.0 17.12 ? 64 LYS A CB 1 64 . A ATOM 515 C CG . LYS A 1 64 ? 17.866 1.666 33.262 1.0 19.15 ? 64 LYS A CG 1 64 . A ATOM 516 C CD . LYS A 1 64 ? 17.812 0.304 33.922 1.0 22.29 ? 64 LYS A CD 1 64 . A ATOM 517 C CE . LYS A 1 64 ? 16.540 0.085 34.702 1.0 23.64 ? 64 LYS A CE 1 64 . A ATOM 518 N NZ . LYS A 1 64 ? 16.606 -1.279 35.352 1.0 26.26 ? 64 LYS A NZ 1 64 . A ATOM 519 N N . ASP A 1 65 ? 17.682 2.749 29.778 1.0 12.48 ? 65 ASP A N 1 65 . A ATOM 520 C CA . ASP A 1 65 ? 16.417 2.956 29.077 1.0 12.07 ? 65 ASP A CA 1 65 . A ATOM 521 C C . ASP A 1 65 ? 15.311 2.242 29.840 1.0 11.33 ? 65 ASP A C 1 65 . A ATOM 522 O O . ASP A 1 65 ? 15.496 1.095 30.301 1.0 12.42 ? 65 ASP A O 1 65 . A ATOM 523 C CB . ASP A 1 65 ? 16.466 2.377 27.676 1.0 12.26 ? 65 ASP A CB 1 65 . A ATOM 524 C CG . ASP A 1 65 ? 17.279 3.228 26.730 1.0 12.28 ? 65 ASP A CG 1 65 . A ATOM 525 O OD1 . ASP A 1 65 ? 17.762 2.681 25.719 1.0 12.61 ? 65 ASP A OD1 1 65 . A ATOM 526 O OD2 . ASP A 1 65 ? 17.417 4.434 26.996 1.0 12.97 ? 65 ASP A OD2 1 65 . A ATOM 527 N N . PHE A 1 66 ? 14.161 2.884 29.949 1.0 10.22 ? 66 PHE A N 1 66 . A ATOM 528 C CA . PHE A 1 66 ? 13.021 2.323 30.648 1.0 10.52 ? 66 PHE A CA 1 66 . A ATOM 529 C C . PHE A 1 66 ? 12.038 1.575 29.742 1.0 11.19 ? 66 PHE A C 1 66 . A ATOM 530 O O . PHE A 1 66 ? 11.047 1.005 30.214 1.0 11.92 ? 66 PHE A O 1 66 . A ATOM 531 C CB . PHE A 1 66 ? 12.341 3.438 31.474 1.0 10.7 ? 66 PHE A CB 1 66 . A ATOM 532 C CG . PHE A 1 66 ? 13.165 3.859 32.666 1.0 12.33 ? 66 PHE A CG 1 66 . A ATOM 533 C CD1 . PHE A 1 66 ? 13.691 5.131 32.755 1.0 13.67 ? 66 PHE A CD1 1 66 . A ATOM 534 C CD2 . PHE A 1 66 ? 13.485 2.933 33.660 1.0 14.39 ? 66 PHE A CD2 1 66 . A ATOM 535 C CE1 . PHE A 1 66 ? 14.537 5.495 33.817 1.0 15.59 ? 66 PHE A CE1 1 66 . A ATOM 536 C CE2 . PHE A 1 66 ? 14.333 3.288 34.722 1.0 15.76 ? 66 PHE A CE2 1 66 . A ATOM 537 C CZ . PHE A 1 66 ? 14.856 4.578 34.790 1.0 15.73 ? 66 PHE A CZ 1 66 . A ATOM 538 N N . ILE A 1 67 ? 12.304 1.619 28.435 1.0 9.97 ? 67 ILE A N 1 67 . A ATOM 539 C CA . ILE A 1 67 ? 11.544 0.871 27.443 1.0 10.56 ? 67 ILE A CA 1 67 . A ATOM 540 C C . ILE A 1 67 ? 12.569 0.306 26.482 1.0 11.0 ? 67 ILE A C 1 67 . A ATOM 541 O O . ILE A 1 67 ? 13.712 0.738 26.492 1.0 10.79 ? 67 ILE A O 1 67 . A ATOM 542 C CB . ILE A 1 67 ? 10.530 1.727 26.628 1.0 9.76 ? 67 ILE A CB 1 67 . A ATOM 543 C CG1 . ILE A 1 67 ? 11.262 2.713 25.708 1.0 8.83 ? 67 ILE A CG1 1 67 . A ATOM 544 C CG2 . ILE A 1 67 ? 9.570 2.414 27.555 1.0 10.58 ? 67 ILE A CG2 1 67 . A ATOM 545 C CD1 . ILE A 1 67 ? 10.302 3.474 24.796 1.0 9.42 ? 67 ILE A CD1 1 67 . A ATOM 546 N N . THR A 1 68 ? 12.142 -0.652 25.667 1.0 11.98 ? 68 THR A N 1 68 . A ATOM 547 C CA . THR A 1 68 ? 13.031 -1.233 24.694 1.0 13.18 ? 68 THR A CA 1 68 . A ATOM 548 C C . THR A 1 68 ? 13.058 -0.316 23.450 1.0 10.71 ? 68 THR A C 1 68 . A ATOM 549 O O . THR A 1 68 ? 12.192 -0.450 22.575 1.0 11.65 ? 68 THR A O 1 68 . A ATOM 550 C CB . THR A 1 68 ? 12.535 -2.638 24.313 1.0 14.58 ? 68 THR A CB 1 68 . A ATOM 551 O OG1 . THR A 1 68 ? 12.222 -3.390 25.505 1.0 18.4 ? 68 THR A OG1 1 68 . A ATOM 552 C CG2 . THR A 1 68 ? 13.608 -3.352 23.531 1.0 16.88 ? 68 THR A CG2 1 68 . A ATOM 553 N N . VAL A 1 69 ? 14.000 0.630 23.407 1.0 11.0 ? 69 VAL A N 1 69 . A ATOM 554 C CA . VAL A 1 69 ? 14.116 1.541 22.268 1.0 10.05 ? 69 VAL A CA 1 69 . A ATOM 555 C C . VAL A 1 69 ? 14.661 0.567 21.240 1.0 11.24 ? 69 VAL A C 1 69 . A ATOM 556 O O . VAL A 1 69 ? 15.536 -0.264 21.559 1.0 13.72 ? 69 VAL A O 1 69 . A ATOM 557 C CB . VAL A 1 69 ? 15.074 2.747 22.557 1.0 10.46 ? 69 VAL A CB 1 69 . A ATOM 558 C CG1 . VAL A 1 69 ? 15.009 3.797 21.431 1.0 11.57 ? 69 VAL A CG1 1 69 . A ATOM 559 C CG2 . VAL A 1 69 ? 14.636 3.433 23.853 1.0 10.86 ? 69 VAL A CG2 1 69 . A ATOM 560 N N . GLN A 1 70 ? 14.095 0.587 20.056 1.0 7.96 ? 70 GLN A N 1 70 . A ATOM 561 C CA . GLN A 1 70 ? 14.510 -0.359 19.024 1.0 7.33 ? 70 GLN A CA 1 70 . A ATOM 562 C C . GLN A 1 70 ? 14.396 0.244 17.638 1.0 7.47 ? 70 GLN A C 1 70 . A ATOM 563 O O . GLN A 1 70 ? 13.906 1.366 17.459 1.0 7.63 ? 70 GLN A O 1 70 . A ATOM 564 C CB . GLN A 1 70 ? 13.664 -1.628 19.155 1.0 7.48 ? 70 GLN A CB 1 70 . A ATOM 565 C CG . GLN A 1 70 ? 12.170 -1.387 19.152 1.0 7.97 ? 70 GLN A CG 1 70 . A ATOM 566 C CD . GLN A 1 70 ? 11.413 -2.645 19.496 1.0 7.95 ? 70 GLN A CD 1 70 . A ATOM 567 O OE1 . GLN A 1 70 ? 11.191 -3.481 18.624 1.0 7.75 ? 70 GLN A OE1 1 70 . A ATOM 568 N NE2 . GLN A 1 70 ? 11.033 -2.796 20.760 1.0 9.86 ? 70 GLN A NE2 1 70 . A ATOM 569 N N . ALA A 1 71 ? 14.796 -0.531 16.633 1.0 8.08 ? 71 ALA A N 1 71 . A ATOM 570 C CA . ALA A 1 71 ? 14.857 -0.010 15.276 1.0 8.45 ? 71 ALA A CA 1 71 . A ATOM 571 C C . ALA A 1 71 ? 13.545 0.369 14.644 1.0 8.42 ? 71 ALA A C 1 71 . A ATOM 572 O O . ALA A 1 71 ? 13.498 1.348 13.892 1.0 9.17 ? 71 ALA A O 1 71 . A ATOM 573 C CB . ALA A 1 71 ? 15.658 -0.987 14.362 1.0 9.58 ? 71 ALA A CB 1 71 . A ATOM 574 N N . ASP A 1 72 ? 12.464 -0.351 14.912 1.0 8.27 ? 72 ASP A N 1 72 . A ATOM 575 C CA . ASP A 1 72 ? 11.194 0.049 14.320 1.0 8.01 ? 72 ASP A CA 1 72 . A ATOM 576 C C . ASP A 1 72 ? 10.602 1.222 15.114 1.0 7.68 ? 72 ASP A C 1 72 . A ATOM 577 O O . ASP A 1 72 ? 10.231 1.098 16.302 1.0 8.31 ? 72 ASP A O 1 72 . A ATOM 578 C CB . ASP A 1 72 ? 10.227 -1.134 14.280 1.0 9.38 ? 72 ASP A CB 1 72 . A ATOM 579 C CG . ASP A 1 72 ? 8.969 -0.808 13.540 1.0 10.05 ? 72 ASP A CG 1 72 . A ATOM 580 O OD1 . ASP A 1 72 ? 9.056 -0.575 12.322 1.0 12.38 ? 72 ASP A OD1 1 72 . A ATOM 581 O OD2 . ASP A 1 72 ? 7.906 -0.738 14.172 1.0 11.95 ? 72 ASP A OD2 1 72 . A ATOM 582 N N . ALA A 1 73 ? 10.510 2.371 14.458 1.0 7.24 ? 73 ALA A N 1 73 . A ATOM 583 C CA . ALA A 1 73 ? 10.037 3.558 15.140 1.0 6.92 ? 73 ALA A CA 1 73 . A ATOM 584 C C . ALA A 1 73 ? 8.608 3.426 15.646 1.0 6.75 ? 73 ALA A C 1 73 . A ATOM 585 O O . ALA A 1 73 ? 8.333 3.817 16.778 1.0 5.95 ? 73 ALA A O 1 73 . A ATOM 586 C CB . ALA A 1 73 ? 10.201 4.813 14.229 1.0 7.03 ? 73 ALA A CB 1 73 . A ATOM 587 N N . PRO A 1 74 ? 7.685 2.865 14.844 1.0 7.07 ? 74 PRO A N 1 74 . A ATOM 588 C CA . PRO A 1 74 ? 6.300 2.739 15.348 1.0 7.57 ? 74 PRO A CA 1 74 . A ATOM 589 C C . PRO A 1 74 ? 6.211 1.850 16.590 1.0 6.81 ? 74 PRO A C 1 74 . A ATOM 590 O O . PRO A 1 74 ? 5.455 2.143 17.515 1.0 7.65 ? 74 PRO A O 1 74 . A ATOM 591 C CB . PRO A 1 74 ? 5.520 2.192 14.146 1.0 8.1 ? 74 PRO A CB 1 74 . A ATOM 592 C CG . PRO A 1 74 ? 6.298 2.728 12.984 1.0 9.64 ? 74 PRO A CG 1 74 . A ATOM 593 C CD . PRO A 1 74 ? 7.762 2.575 13.394 1.0 8.21 ? 74 PRO A CD 1 74 . A ATOM 594 N N . THR A 1 75 ? 7.004 0.778 16.621 1.0 7.19 ? 75 THR A N 1 75 . A ATOM 595 C CA . THR A 1 75 ? 7.017 -0.136 17.772 1.0 7.14 ? 75 THR A CA 1 75 . A ATOM 596 C C . THR A 1 75 ? 7.552 0.610 18.995 1.0 6.38 ? 75 THR A C 1 75 . A ATOM 597 O O . THR A 1 75 ? 6.964 0.554 20.088 1.0 6.81 ? 75 THR A O 1 75 . A ATOM 598 C CB . THR A 1 75 ? 7.851 -1.394 17.494 1.0 8.25 ? 75 THR A CB 1 75 . A ATOM 599 O OG1 . THR A 1 75 ? 7.289 -2.057 16.349 1.0 8.31 ? 75 THR A OG1 1 75 . A ATOM 600 C CG2 . THR A 1 75 ? 7.780 -2.350 18.646 1.0 8.72 ? 75 THR A CG2 1 75 . A ATOM 601 N N . THR A 1 76 ? 8.645 1.357 18.814 1.0 6.04 ? 76 THR A N 1 76 . A ATOM 602 C CA . THR A 1 76 ? 9.207 2.145 19.904 1.0 5.55 ? 76 THR A CA 1 76 . A ATOM 603 C C . THR A 1 76 ? 8.180 3.181 20.377 1.0 5.82 ? 76 THR A C 1 76 . A ATOM 604 O O . THR A 1 76 ? 8.047 3.413 21.588 1.0 6.57 ? 76 THR A O 1 76 . A ATOM 605 C CB . THR A 1 76 ? 10.475 2.854 19.427 1.0 5.79 ? 76 THR A CB 1 76 . A ATOM 606 O OG1 . THR A 1 76 ? 11.467 1.845 19.130 1.0 6.22 ? 76 THR A OG1 1 76 . A ATOM 607 C CG2 . THR A 1 76 ? 11.016 3.847 20.512 1.0 6.22 ? 76 THR A CG2 1 76 . A ATOM 608 N N . ALA A 1 77 ? 7.460 3.813 19.458 1.0 6.0 ? 77 ALA A N 1 77 . A ATOM 609 C CA . ALA A 1 77 ? 6.450 4.798 19.840 1.0 6.05 ? 77 ALA A CA 1 77 . A ATOM 610 C C . ALA A 1 77 ? 5.348 4.172 20.703 1.0 5.98 ? 77 ALA A C 1 77 . A ATOM 611 O O . ALA A 1 77 ? 4.858 4.781 21.644 1.0 5.97 ? 77 ALA A O 1 77 . A ATOM 612 C CB . ALA A 1 77 ? 5.852 5.464 18.574 1.0 6.79 ? 77 ALA A CB 1 77 . A ATOM 613 N N . GLY A 1 78 ? 4.926 2.969 20.362 1.0 6.25 ? 78 GLY A N 1 78 . A ATOM 614 C CA . GLY A 1 78 ? 3.887 2.306 21.136 1.0 6.51 ? 78 GLY A CA 1 78 . A ATOM 615 C C . GLY A 1 78 ? 4.363 1.983 22.541 1.0 6.66 ? 78 GLY A C 1 78 . A ATOM 616 O O . GLY A 1 78 ? 3.622 2.168 23.513 1.0 8.15 ? 78 GLY A O 1 78 . A ATOM 617 N N . LEU A 1 79 ? 5.595 1.508 22.666 1.0 6.44 ? 79 LEU A N 1 79 . A ATOM 618 C CA . LEU A 1 79 ? 6.137 1.216 23.991 1.0 7.15 ? 79 LEU A CA 1 79 . A ATOM 619 C C . LEU A 1 79 ? 6.298 2.518 24.785 1.0 6.93 ? 79 LEU A C 1 79 . A ATOM 620 O O . LEU A 1 79 ? 6.049 2.555 25.997 1.0 7.57 ? 79 LEU A O 1 79 . A ATOM 621 C CB . LEU A 1 79 ? 7.496 0.534 23.893 1.0 7.85 ? 79 LEU A CB 1 79 . A ATOM 622 C CG . LEU A 1 79 ? 7.427 -0.874 23.268 1.0 9.11 ? 79 LEU A CG 1 79 . A ATOM 623 C CD1 . LEU A 1 79 ? 8.859 -1.353 23.093 1.0 10.88 ? 79 LEU A CD1 1 79 . A ATOM 624 C CD2 . LEU A 1 79 ? 6.621 -1.860 24.162 1.0 11.35 ? 79 LEU A CD2 1 79 . A ATOM 625 N N . PHE A 1 80 ? 6.704 3.590 24.097 1.0 6.61 ? 80 PHE A N 1 80 . A ATOM 626 C CA . PHE A 1 80 ? 6.874 4.894 24.735 1.0 6.01 ? 80 PHE A CA 1 80 . A ATOM 627 C C . PHE A 1 80 ? 5.523 5.432 25.191 1.0 5.42 ? 80 PHE A C 1 80 . A ATOM 628 O O . PHE A 1 80 ? 5.411 5.960 26.305 1.0 6.26 ? 80 PHE A O 1 80 . A ATOM 629 C CB . PHE A 1 80 ? 7.563 5.858 23.779 1.0 5.97 ? 80 PHE A CB 1 80 . A ATOM 630 C CG . PHE A 1 80 ? 7.810 7.210 24.380 1.0 5.41 ? 80 PHE A CG 1 80 . A ATOM 631 C CD1 . PHE A 1 80 ? 8.617 7.354 25.495 1.0 6.43 ? 80 PHE A CD1 1 80 . A ATOM 632 C CD2 . PHE A 1 80 ? 7.233 8.341 23.821 1.0 4.83 ? 80 PHE A CD2 1 80 . A ATOM 633 C CE1 . PHE A 1 80 ? 8.859 8.633 26.058 1.0 6.42 ? 80 PHE A CE1 1 80 . A ATOM 634 C CE2 . PHE A 1 80 ? 7.472 9.637 24.391 1.0 5.84 ? 80 PHE A CE2 1 80 . A ATOM 635 C CZ . PHE A 1 80 ? 8.281 9.758 25.494 1.0 7.06 ? 80 PHE A CZ 1 80 . A ATOM 636 N N . GLY A 1 81 ? 4.497 5.314 24.355 1.0 5.44 ? 81 GLY A N 1 81 . A ATOM 637 C CA . GLY A 1 81 ? 3.169 5.766 24.753 1.0 7.0 ? 81 GLY A CA 1 81 . A ATOM 638 C C . GLY A 1 81 ? 2.636 5.010 25.964 1.0 7.37 ? 81 GLY A C 1 81 . A ATOM 639 O O . GLY A 1 81 ? 2.005 5.596 26.858 1.0 7.57 ? 81 GLY A O 1 81 . A ATOM 640 N N . ASP A 1 82 ? 2.912 3.715 26.019 1.0 7.26 ? 82 ASP A N 1 82 . A ATOM 641 C CA . ASP A 1 82 ? 2.441 2.905 27.156 1.0 8.27 ? 82 ASP A CA 1 82 . A ATOM 642 C C . ASP A 1 82 ? 3.167 3.396 28.416 1.0 8.39 ? 82 ASP A C 1 82 . A ATOM 643 O O . ASP A 1 82 ? 2.538 3.568 29.477 1.0 8.81 ? 82 ASP A O 1 82 . A ATOM 644 C CB . ASP A 1 82 ? 2.800 1.435 26.937 1.0 10.22 ? 82 ASP A CB 1 82 . A ATOM 645 C CG . ASP A 1 82 ? 1.882 0.745 25.951 1.0 12.84 ? 82 ASP A CG 1 82 . A ATOM 646 O OD1 . ASP A 1 82 ? 2.260 -0.348 25.449 1.0 15.63 ? 82 ASP A OD1 1 82 . A ATOM 647 O OD2 . ASP A 1 82 ? 0.787 1.288 25.693 1.0 14.2 ? 82 ASP A OD2 1 82 . A ATOM 648 N N . TRP A 1 83 ? 4.472 3.618 28.311 1.0 8.02 ? 83 TRP A N 1 83 . A ATOM 649 C CA . TRP A 1 83 ? 5.276 4.056 29.445 1.0 8.66 ? 83 TRP A CA 1 83 . A ATOM 650 C C . TRP A 1 83 ? 4.878 5.484 29.846 1.0 8.43 ? 83 TRP A C 1 83 . A ATOM 651 O O . TRP A 1 83 ? 4.839 5.813 31.041 1.0 9.63 ? 83 TRP A O 1 83 . A ATOM 652 C CB . TRP A 1 83 ? 6.762 3.955 29.102 1.0 8.61 ? 83 TRP A CB 1 83 . A ATOM 653 C CG . TRP A 1 83 ? 7.663 4.412 30.182 1.0 9.24 ? 83 TRP A CG 1 83 . A ATOM 654 C CD1 . TRP A 1 83 ? 8.098 3.695 31.265 1.0 9.36 ? 83 TRP A CD1 1 83 . A ATOM 655 C CD2 . TRP A 1 83 ? 8.201 5.720 30.327 1.0 8.84 ? 83 TRP A CD2 1 83 . A ATOM 656 N NE1 . TRP A 1 83 ? 8.864 4.478 32.068 1.0 10.75 ? 83 TRP A NE1 1 83 . A ATOM 657 C CE2 . TRP A 1 83 ? 8.950 5.734 31.525 1.0 9.73 ? 83 TRP A CE2 1 83 . A ATOM 658 C CE3 . TRP A 1 83 ? 8.122 6.887 29.569 1.0 9.47 ? 83 TRP A CE3 1 83 . A ATOM 659 C CZ2 . TRP A 1 83 ? 9.619 6.888 31.986 1.0 10.02 ? 83 TRP A CZ2 1 83 . A ATOM 660 C CZ3 . TRP A 1 83 ? 8.789 8.032 30.030 1.0 10.43 ? 83 TRP A CZ3 1 83 . A ATOM 661 C CH2 . TRP A 1 83 ? 9.522 8.021 31.224 1.0 9.73 ? 83 TRP A CH2 1 83 . A ATOM 662 N N . ARG A 1 84 ? 4.552 6.328 28.873 1.0 8.18 ? 84 ARG A N 1 84 . A ATOM 663 C CA . ARG A 1 84 ? 4.096 7.679 29.199 1.0 8.2 ? 84 ARG A CA 1 84 . A ATOM 664 C C . ARG A 1 84 ? 2.781 7.623 30.018 1.0 8.48 ? 84 ARG A C 1 84 . A ATOM 665 O O . ARG A 1 84 ? 2.631 8.385 30.994 1.0 8.9 ? 84 ARG A O 1 84 . A ATOM 666 C CB . ARG A 1 84 ? 3.840 8.463 27.914 1.0 8.02 ? 84 ARG A CB 1 84 . A ATOM 667 C CG . ARG A 1 84 ? 3.256 9.818 28.231 1.0 10.01 ? 84 ARG A CG 1 84 . A ATOM 668 C CD . ARG A 1 84 ? 2.640 10.506 27.066 1.0 10.11 ? 84 ARG A CD 1 84 . A ATOM 669 N NE . ARG A 1 84 ? 2.186 11.832 27.474 1.0 9.31 ? 84 ARG A NE 1 84 . A ATOM 670 C CZ . ARG A 1 84 ? 0.967 12.305 27.239 1.0 10.44 ? 84 ARG A CZ 1 84 . A ATOM 671 N NH1 . ARG A 1 84 ? 0.047 11.571 26.620 1.0 9.95 ? 84 ARG A NH1 1 84 . A ATOM 672 N NH2 . ARG A 1 84 ? 0.695 13.548 27.566 1.0 8.09 ? 84 ARG A NH2 1 84 . A ATOM 673 N N . GLU A 1 85 ? 1.841 6.779 29.615 1.0 8.31 ? 85 GLU A N 1 85 . A ATOM 674 C CA . GLU A 1 85 ? 0.573 6.696 30.326 1.0 8.92 ? 85 GLU A CA 1 85 . A ATOM 675 C C . GLU A 1 85 ? 0.752 6.079 31.711 1.0 9.46 ? 85 GLU A C 1 85 . A ATOM 676 O O . GLU A 1 85 ? 0.126 6.543 32.689 1.0 11.07 ? 85 GLU A O 1 85 . A ATOM 677 C CB . GLU A 1 85 ? -0.438 5.850 29.531 1.0 10.26 ? 85 GLU A CB 1 85 . A ATOM 678 C CG . GLU A 1 85 ? -1.864 5.738 30.145 1.0 12.02 ? 85 GLU A CG 1 85 . A ATOM 679 C CD . GLU A 1 85 ? -2.064 4.634 31.222 1.0 14.9 ? 85 GLU A CD 1 85 . A ATOM 680 O OE1 . GLU A 1 85 ? -1.261 3.688 31.345 1.0 13.8 ? 85 GLU A OE1 1 85 . A ATOM 681 O OE2 . GLU A 1 85 ? -3.081 4.732 31.940 1.0 14.86 ? 85 GLU A OE2 1 85 . A ATOM 682 N N . ARG A 1 86 ? 1.642 5.106 31.834 1.0 8.93 ? 86 ARG A N 1 86 . A ATOM 683 C CA . ARG A 1 86 ? 1.810 4.400 33.113 1.0 10.7 ? 86 ARG A CA 1 86 . A ATOM 684 C C . ARG A 1 86 ? 2.714 5.114 34.083 1.0 10.42 ? 86 ARG A C 1 86 . A ATOM 685 O O . ARG A 1 86 ? 2.442 5.159 35.310 1.0 12.78 ? 86 ARG A O 1 86 . A ATOM 686 C CB . ARG A 1 86 ? 2.371 2.996 32.843 1.0 11.2 ? 86 ARG A CB 1 86 . A ATOM 687 C CG . ARG A 1 86 ? 2.579 2.161 34.110 1.0 14.02 ? 86 ARG A CG 1 86 . A ATOM 688 C CD . ARG A 1 86 ? 2.969 0.713 33.784 1.0 15.64 ? 86 ARG A CD 1 86 . A ATOM 689 N NE . ARG A 1 86 ? 4.180 0.622 32.986 1.0 18.82 ? 86 ARG A NE 1 86 . A ATOM 690 C CZ . ARG A 1 86 ? 5.418 0.699 33.466 1.0 19.92 ? 86 ARG A CZ 1 86 . A ATOM 691 N NH1 . ARG A 1 86 ? 5.636 0.869 34.774 1.0 22.62 ? 86 ARG A NH1 1 86 . A ATOM 692 N NH2 . ARG A 1 86 ? 6.448 0.595 32.636 1.0 21.53 ? 86 ARG A NH2 1 86 . A ATOM 693 N N . VAL A 1 87 ? 3.761 5.735 33.563 1.0 10.58 ? 87 VAL A N 1 87 . A ATOM 694 C CA . VAL A 1 87 ? 4.764 6.370 34.396 1.0 10.3 ? 87 VAL A CA 1 87 . A ATOM 695 C C . VAL A 1 87 ? 4.917 7.880 34.245 1.0 11.12 ? 87 VAL A C 1 87 . A ATOM 696 O O . VAL A 1 87 ? 4.727 8.617 35.204 1.0 11.02 ? 87 VAL A O 1 87 . A ATOM 697 C CB . VAL A 1 87 ? 6.161 5.701 34.146 1.0 10.84 ? 87 VAL A CB 1 87 . A ATOM 698 C CG1 . VAL A 1 87 ? 7.266 6.357 34.986 1.0 11.77 ? 87 VAL A CG1 1 87 . A ATOM 699 C CG2 . VAL A 1 87 ? 6.087 4.220 34.452 1.0 11.47 ? 87 VAL A CG2 1 87 . A ATOM 700 N N . LEU A 1 88 ? 5.236 8.347 33.046 1.0 11.26 ? 88 LEU A N 1 88 . A ATOM 701 C CA . LEU A 1 88 ? 5.505 9.779 32.889 1.0 11.0 ? 88 LEU A CA 1 88 . A ATOM 702 C C . LEU A 1 88 ? 4.372 10.729 33.303 1.0 10.08 ? 88 LEU A C 1 88 . A ATOM 703 O O . LEU A 1 88 ? 4.634 11.742 33.950 1.0 11.18 ? 88 LEU A O 1 88 . A ATOM 704 C CB . LEU A 1 88 ? 5.952 10.068 31.454 1.0 12.05 ? 88 LEU A CB 1 88 . A ATOM 705 C CG . LEU A 1 88 ? 6.680 11.397 31.238 1.0 12.59 ? 88 LEU A CG 1 88 . A ATOM 706 C CD1 . LEU A 1 88 ? 8.024 11.420 31.971 1.0 14.8 ? 88 LEU A CD1 1 88 . A ATOM 707 C CD2 . LEU A 1 88 ? 6.864 11.578 29.739 1.0 12.5 ? 88 LEU A CD2 1 88 . A ATOM 708 N N . LEU A 1 89 ? 3.134 10.421 32.927 1.0 9.74 ? 89 LEU A N 1 89 . A ATOM 709 C CA . LEU A 1 89 ? 1.995 11.259 33.293 1.0 9.62 ? 89 LEU A CA 1 89 . A ATOM 710 C C . LEU A 1 89 ? 1.742 11.284 34.790 1.0 11.3 ? 89 LEU A C 1 89 . A ATOM 711 O O . LEU A 1 89 ? 1.113 12.219 35.284 1.0 11.31 ? 89 LEU A O 1 89 . A ATOM 712 C CB . LEU A 1 89 ? 0.730 10.822 32.567 1.0 9.28 ? 89 LEU A CB 1 89 . A ATOM 713 C CG . LEU A 1 89 ? 0.647 11.399 31.143 1.0 9.7 ? 89 LEU A CG 1 89 . A ATOM 714 C CD1 . LEU A 1 89 ? -0.443 10.702 30.351 1.0 10.87 ? 89 LEU A CD1 1 89 . A ATOM 715 C CD2 . LEU A 1 89 ? 0.339 12.898 31.231 1.0 10.39 ? 89 LEU A CD2 1 89 . A ATOM 716 N N . LYS A 1 90 ? 2.217 10.270 35.508 1.0 11.37 ? 90 LYS A N 1 90 . A ATOM 717 C CA . LYS A 1 90 ? 2.058 10.236 36.973 1.0 13.15 ? 90 LYS A CA 1 90 . A ATOM 718 C C . LYS A 1 90 ? 3.111 11.131 37.632 1.0 13.66 ? 90 LYS A C 1 90 . A ATOM 719 O O . LYS A 1 90 ? 2.949 11.534 38.788 1.0 15.12 ? 90 LYS A O 1 90 . A ATOM 720 C CB . LYS A 1 90 ? 2.176 8.797 37.486 1.0 14.29 ? 90 LYS A CB 1 90 . A ATOM 721 C CG . LYS A 1 90 ? 1.074 7.849 37.007 1.0 17.85 ? 90 LYS A CG 1 90 . A ATOM 722 C CD . LYS A 1 90 ? -0.314 8.361 37.321 1.0 21.94 ? 90 LYS A CD 1 90 . A ATOM 723 C CE . LYS A 1 90 ? -1.401 7.358 36.869 1.0 23.36 ? 90 LYS A CE 1 90 . A ATOM 724 N NZ . LYS A 1 90 ? -1.394 7.083 35.406 1.0 24.84 ? 90 LYS A NZ 1 90 . A ATOM 725 N N . LYS A 1 91 ? 4.172 11.465 36.912 1.0 12.75 ? 91 LYS A N 1 91 . A ATOM 726 C CA . LYS A 1 91 ? 5.221 12.327 37.448 1.0 13.9 ? 91 LYS A CA 1 91 . A ATOM 727 C C . LYS A 1 91 ? 4.783 13.785 37.372 1.0 13.0 ? 91 LYS A C 1 91 . A ATOM 728 O O . LYS A 1 91 ? 4.929 14.530 38.338 1.0 14.35 ? 91 LYS A O 1 91 . A ATOM 729 C CB . LYS A 1 91 ? 6.518 12.172 36.662 1.0 15.39 ? 91 LYS A CB 1 91 . A ATOM 730 C CG . LYS A 1 91 ? 7.087 10.768 36.663 1.0 19.11 ? 91 LYS A CG 1 91 . A ATOM 731 C CD . LYS A 1 91 ? 8.586 10.775 36.614 1.0 21.61 ? 91 LYS A CD 1 91 . A ATOM 732 C CE . LYS A 1 91 ? 9.108 11.582 35.439 1.0 22.0 ? 91 LYS A CE 1 91 . A ATOM 733 N NZ . LYS A 1 91 ? 10.589 11.570 35.387 1.0 23.46 ? 91 LYS A NZ 1 91 . A ATOM 734 N N . LYS A 1 92 ? 4.267 14.201 36.219 1.0 11.96 ? 92 LYS A N 1 92 . A ATOM 735 C CA . LYS A 1 92 ? 3.797 15.568 36.040 1.0 11.48 ? 92 LYS A CA 1 92 . A ATOM 736 C C . LYS A 1 92 ? 2.873 15.597 34.846 1.0 10.78 ? 92 LYS A C 1 92 . A ATOM 737 O O . LYS A 1 92 ? 3.190 15.002 33.795 1.0 10.47 ? 92 LYS A O 1 92 . A ATOM 738 C CB . LYS A 1 92 ? 4.976 16.525 35.808 1.0 11.09 ? 92 LYS A CB 1 92 . A ATOM 739 C CG . LYS A 1 92 ? 4.568 17.990 35.871 1.0 11.51 ? 92 LYS A CG 1 92 . A ATOM 740 C CD . LYS A 1 92 ? 5.791 18.922 35.715 1.0 12.25 ? 92 LYS A CD 1 92 . A ATOM 741 C CE . LYS A 1 92 ? 5.388 20.414 35.767 1.0 12.1 ? 92 LYS A CE 1 92 . A ATOM 742 N NZ . LYS A 1 92 ? 6.541 21.281 35.491 1.0 12.84 ? 92 LYS A NZ 1 92 . A ATOM 743 N N . ASN A 1 93 ? 1.738 16.280 34.970 1.0 10.5 ? 93 ASN A N 1 93 . A ATOM 744 C CA . ASN A 1 93 ? 0.821 16.325 33.852 1.0 11.78 ? 93 ASN A CA 1 93 . A ATOM 745 C C . ASN A 1 93 ? 1.388 17.155 32.726 1.0 10.24 ? 93 ASN A C 1 93 . A ATOM 746 O O . ASN A 1 93 ? 2.113 18.110 32.940 1.0 10.76 ? 93 ASN A O 1 93 . A ATOM 747 C CB . ASN A 1 93 ? -0.523 16.892 34.242 1.0 15.53 ? 93 ASN A CB 1 93 . A ATOM 748 C CG . ASN A 1 93 ? -1.521 16.772 33.114 1.0 18.08 ? 93 ASN A CG 1 93 . A ATOM 749 O OD1 . ASN A 1 93 ? -1.673 15.695 32.506 1.0 19.61 ? 93 ASN A OD1 1 93 . A ATOM 750 N ND2 . ASN A 1 93 ? -2.195 17.871 32.804 1.0 20.97 ? 93 ASN A ND2 1 93 . A ATOM 751 N N . HIS A 1 94 ? 1.101 16.712 31.514 1.0 9.17 ? 94 HIS A N 1 94 . A ATOM 752 C CA . HIS A 1 94 ? 1.547 17.403 30.312 1.0 7.43 ? 94 HIS A CA 1 94 . A ATOM 753 C C . HIS A 1 94 ? 0.656 16.909 29.162 1.0 7.1 ? 94 HIS A C 1 94 . A ATOM 754 O O . HIS A 1 94 ? -0.106 15.931 29.298 1.0 6.78 ? 94 HIS A O 1 94 . A ATOM 755 C CB . HIS A 1 94 ? 3.022 17.124 30.041 1.0 7.83 ? 94 HIS A CB 1 94 . A ATOM 756 C CG . HIS A 1 94 ? 3.332 15.670 29.890 1.0 6.72 ? 94 HIS A CG 1 94 . A ATOM 757 N ND1 . HIS A 1 94 ? 3.477 14.819 30.970 1.0 7.99 ? 94 HIS A ND1 1 94 . A ATOM 758 C CD2 . HIS A 1 94 ? 3.493 14.911 28.782 1.0 6.38 ? 94 HIS A CD2 1 94 . A ATOM 759 C CE1 . HIS A 1 94 ? 3.715 13.596 30.524 1.0 8.13 ? 94 HIS A CE1 1 94 . A ATOM 760 N NE2 . HIS A 1 94 ? 3.735 13.625 29.202 1.0 7.36 ? 94 HIS A NE2 1 94 . A ATOM 761 N N . ASP A 1 95 ? 0.772 17.571 28.023 1.0 6.07 ? 95 ASP A N 1 95 . A ATOM 762 C CA . ASP A 1 95 ? -0.096 17.291 26.894 1.0 5.97 ? 95 ASP A CA 1 95 . A ATOM 763 C C . ASP A 1 95 ? 0.390 16.367 25.805 1.0 5.59 ? 95 ASP A C 1 95 . A ATOM 764 O O . ASP A 1 95 ? -0.424 15.739 25.127 1.0 6.03 ? 95 ASP A O 1 95 . A ATOM 765 C CB . ASP A 1 95 ? -0.475 18.609 26.196 1.0 7.08 ? 95 ASP A CB 1 95 . A ATOM 766 C CG . ASP A 1 95 ? -1.132 19.598 27.124 1.0 9.14 ? 95 ASP A CG 1 95 . A ATOM 767 O OD1 . ASP A 1 95 ? -0.832 20.807 26.975 1.0 9.37 ? 95 ASP A OD1 1 95 . A ATOM 768 O OD2 . ASP A 1 95 ? -1.933 19.173 27.982 1.0 10.52 ? 95 ASP A OD2 1 95 . A ATOM 769 N N . HIS A 1 96 ? 1.696 16.340 25.613 1.0 4.75 ? 96 HIS A N 1 96 . A ATOM 770 C CA . HIS A 1 96 ? 2.304 15.577 24.523 1.0 4.9 ? 96 HIS A CA 1 96 . A ATOM 771 C C . HIS A 1 96 ? 3.714 15.300 24.953 1.0 4.47 ? 96 HIS A C 1 96 . A ATOM 772 O O . HIS A 1 96 ? 4.360 16.160 25.572 1.0 5.06 ? 96 HIS A O 1 96 . A ATOM 773 C CB . HIS A 1 96 ? 2.319 16.460 23.253 1.0 4.75 ? 96 HIS A CB 1 96 . A ATOM 774 C CG . HIS A 1 96 ? 2.885 15.791 22.029 1.0 4.42 ? 96 HIS A CG 1 96 . A ATOM 775 N ND1 . HIS A 1 96 ? 4.162 15.990 21.530 1.0 7.95 ? 96 HIS A ND1 1 96 . A ATOM 776 C CD2 . HIS A 1 96 ? 2.279 14.942 21.173 1.0 3.16 ? 96 HIS A CD2 1 96 . A ATOM 777 C CE1 . HIS A 1 96 ? 4.312 15.285 20.412 1.0 3.51 ? 96 HIS A CE1 1 96 . A ATOM 778 N NE2 . HIS A 1 96 ? 3.181 14.640 20.182 1.0 6.54 ? 96 HIS A NE2 1 96 . A ATOM 779 N N . ALA A 1 97 ? 4.226 14.118 24.645 1.0 5.21 ? 97 ALA A N 1 97 . A ATOM 780 C CA . ALA A 1 97 ? 5.605 13.787 24.985 1.0 4.76 ? 97 ALA A CA 1 97 . A ATOM 781 C C . ALA A 1 97 ? 6.375 13.279 23.767 1.0 4.5 ? 97 ALA A C 1 97 . A ATOM 782 O O . ALA A 1 97 ? 5.834 12.518 22.952 1.0 5.1 ? 97 ALA A O 1 97 . A ATOM 783 C CB . ALA A 1 97 ? 5.635 12.679 26.034 1.0 6.06 ? 97 ALA A CB 1 97 . A ATOM 784 N N . GLN A 1 98 ? 7.634 13.702 23.651 1.0 4.56 ? 98 GLN A N 1 98 . A ATOM 785 C CA . GLN A 1 98 ? 8.477 13.173 22.572 1.0 4.2 ? 98 GLN A CA 1 98 . A ATOM 786 C C . GLN A 1 98 ? 9.716 12.518 23.143 1.0 5.02 ? 98 GLN A C 1 98 . A ATOM 787 O O . GLN A 1 98 ? 10.324 13.035 24.096 1.0 5.03 ? 98 GLN A O 1 98 . A ATOM 788 C CB . GLN A 1 98 ? 8.891 14.273 21.607 1.0 4.38 ? 98 GLN A CB 1 98 . A ATOM 789 C CG . GLN A 1 98 ? 7.688 14.981 21.010 1.0 4.6 ? 98 GLN A CG 1 98 . A ATOM 790 C CD . GLN A 1 98 ? 8.011 15.699 19.724 1.0 4.66 ? 98 GLN A CD 1 98 . A ATOM 791 O OE1 . GLN A 1 98 ? 9.186 15.940 19.371 1.0 6.85 ? 98 GLN A OE1 1 98 . A ATOM 792 N NE2 . GLN A 1 98 ? 6.954 16.062 18.996 1.0 4.91 ? 98 GLN A NE2 1 98 . A ATOM 793 N N . LEU A 1 99 ? 10.079 11.376 22.568 1.0 4.95 ? 99 LEU A N 1 99 . A ATOM 794 C CA . LEU A 1 99 ? 11.281 10.657 22.944 1.0 5.46 ? 99 LEU A CA 1 99 . A ATOM 795 C C . LEU A 1 99 ? 12.365 11.035 21.953 1.0 5.35 ? 99 LEU A C 1 99 . A ATOM 796 O O . LEU A 1 99 ? 12.180 10.824 20.755 1.0 5.93 ? 99 LEU A O 1 99 . A ATOM 797 C CB . LEU A 1 99 ? 11.017 9.137 22.861 1.0 6.2 ? 99 LEU A CB 1 99 . A ATOM 798 C CG . LEU A 1 99 ? 12.249 8.270 23.140 1.0 6.93 ? 99 LEU A CG 1 99 . A ATOM 799 C CD1 . LEU A 1 99 ? 12.674 8.370 24.613 1.0 9.02 ? 99 LEU A CD1 1 99 . A ATOM 800 C CD2 . LEU A 1 99 ? 11.888 6.832 22.757 1.0 9.39 ? 99 LEU A CD2 1 99 . A ATOM 801 N N . LEU A 1 100 ? 13.477 11.555 22.433 1.0 5.39 ? 100 LEU A N 1 100 . A ATOM 802 C CA . LEU A 1 100 ? 14.622 11.895 21.592 1.0 5.26 ? 100 LEU A CA 1 100 . A ATOM 803 C C . LEU A 1 100 ? 15.635 10.761 21.781 1.0 5.7 ? 100 LEU A C 1 100 . A ATOM 804 O O . LEU A 1 100 ? 15.984 10.415 22.903 1.0 7.6 ? 100 LEU A O 1 100 . A ATOM 805 C CB . LEU A 1 100 ? 15.247 13.227 22.032 1.0 7.81 ? 100 LEU A CB 1 100 . A ATOM 806 C CG . LEU A 1 100 ? 14.515 14.493 21.629 1.0 9.21 ? 100 LEU A CG 1 100 . A ATOM 807 C CD1 . LEU A 1 100 ? 15.243 15.671 22.271 1.0 11.71 ? 100 LEU A CD1 1 100 . A ATOM 808 C CD2 . LEU A 1 100 ? 14.554 14.678 20.112 1.0 12.75 ? 100 LEU A CD2 1 100 . A ATOM 809 N N . THR A 1 101 ? 16.158 10.251 20.664 1.0 6.25 ? 101 THR A N 1 101 . A ATOM 810 C CA . THR A 1 101 ? 17.072 9.117 20.715 1.0 6.21 ? 101 THR A CA 1 101 . A ATOM 811 C C . THR A 1 101 ? 18.114 9.218 19.625 1.0 6.26 ? 101 THR A C 1 101 . A ATOM 812 O O . THR A 1 101 ? 17.910 9.929 18.636 1.0 6.74 ? 101 THR A O 1 101 . A ATOM 813 C CB . THR A 1 101 ? 16.241 7.807 20.512 1.0 6.89 ? 101 THR A CB 1 101 . A ATOM 814 O OG1 . THR A 1 101 ? 17.098 6.660 20.605 1.0 8.81 ? 101 THR A OG1 1 101 . A ATOM 815 C CG2 . THR A 1 101 ? 15.593 7.778 19.150 1.0 8.07 ? 101 THR A CG2 1 101 . A ATOM 816 N N . ASP A 1 102 ? 19.242 8.521 19.783 1.0 6.08 ? 102 ASP A N 1 102 . A ATOM 817 C CA . ASP A 1 102 ? 20.208 8.486 18.710 1.0 7.0 ? 102 ASP A CA 1 102 . A ATOM 818 C C . ASP A 1 102 ? 20.080 7.189 17.887 1.0 6.28 ? 102 ASP A C 1 102 . A ATOM 819 O O . ASP A 1 102 ? 20.900 6.897 17.023 1.0 8.05 ? 102 ASP A O 1 102 . A ATOM 820 C CB . ASP A 1 102 ? 21.611 8.598 19.270 1.0 8.76 ? 102 ASP A CB 1 102 . A ATOM 821 C CG . ASP A 1 102 ? 22.603 8.873 18.211 1.0 10.99 ? 102 ASP A CG 1 102 . A ATOM 822 O OD1 . ASP A 1 102 ? 23.625 8.172 18.208 1.0 14.59 ? 102 ASP A OD1 1 102 . A ATOM 823 O OD2 . ASP A 1 102 ? 22.375 9.790 17.385 1.0 14.73 ? 102 ASP A OD2 1 102 . A ATOM 824 N N . THR A 1 103 ? 19.050 6.406 18.186 1.0 6.09 ? 103 THR A N 1 103 . A ATOM 825 C CA . THR A 1 103 ? 18.815 5.127 17.503 1.0 6.2 ? 103 THR A CA 1 103 . A ATOM 826 C C . THR A 1 103 ? 18.736 5.271 16.010 1.0 6.68 ? 103 THR A C 1 103 . A ATOM 827 O O . THR A 1 103 ? 18.073 6.151 15.496 1.0 6.47 ? 103 THR A O 1 103 . A ATOM 828 C CB . THR A 1 103 ? 17.491 4.493 18.011 1.0 5.69 ? 103 THR A CB 1 103 . A ATOM 829 O OG1 . THR A 1 103 ? 17.613 4.238 19.415 1.0 7.61 ? 103 THR A OG1 1 103 . A ATOM 830 C CG2 . THR A 1 103 ? 17.163 3.201 17.273 1.0 6.66 ? 103 THR A CG2 1 103 . A ATOM 831 N N . ASN A 1 104 ? 19.438 4.389 15.293 1.0 6.29 ? 104 ASN A N 1 104 . A ATOM 832 C CA . ASN A 1 104 ? 19.379 4.392 13.837 1.0 7.96 ? 104 ASN A CA 1 104 . A ATOM 833 C C . ASN A 1 104 ? 18.094 3.615 13.464 1.0 7.69 ? 104 ASN A C 1 104 . A ATOM 834 O O . ASN A 1 104 ? 18.131 2.403 13.178 1.0 8.06 ? 104 ASN A O 1 104 . A ATOM 835 C CB . ASN A 1 104 ? 20.652 3.692 13.288 1.0 9.12 ? 104 ASN A CB 1 104 . A ATOM 836 C CG . ASN A 1 104 ? 20.825 3.871 11.817 1.0 11.14 ? 104 ASN A CG 1 104 . A ATOM 837 O OD1 . ASN A 1 104 ? 21.771 3.343 11.222 1.0 15.08 ? 104 ASN A OD1 1 104 . A ATOM 838 N ND2 . ASN A 1 104 ? 19.952 4.610 11.219 1.0 11.04 ? 104 ASN A ND2 1 104 . A ATOM 839 N N . PHE A 1 105 ? 16.952 4.293 13.483 1.0 6.32 ? 105 PHE A N 1 105 . A ATOM 840 C CA . PHE A 1 105 ? 15.688 3.654 13.165 1.0 6.26 ? 105 PHE A CA 1 105 . A ATOM 841 C C . PHE A 1 105 ? 15.683 3.072 11.770 1.0 6.61 ? 105 PHE A C 1 105 . A ATOM 842 O O . PHE A 1 105 ? 16.304 3.607 10.837 1.0 7.32 ? 105 PHE A O 1 105 . A ATOM 843 C CB . PHE A 1 105 ? 14.504 4.625 13.266 1.0 7.18 ? 105 PHE A CB 1 105 . A ATOM 844 C CG . PHE A 1 105 ? 14.177 5.093 14.658 1.0 7.11 ? 105 PHE A CG 1 105 . A ATOM 845 C CD1 . PHE A 1 105 ? 14.049 6.460 14.901 1.0 8.81 ? 105 PHE A CD1 1 105 . A ATOM 846 C CD2 . PHE A 1 105 ? 13.873 4.197 15.684 1.0 7.63 ? 105 PHE A CD2 1 105 . A ATOM 847 C CE1 . PHE A 1 105 ? 13.604 6.940 16.150 1.0 9.72 ? 105 PHE A CE1 1 105 . A ATOM 848 C CE2 . PHE A 1 105 ? 13.431 4.691 16.923 1.0 7.19 ? 105 PHE A CE2 1 105 . A ATOM 849 C CZ . PHE A 1 105 ? 13.296 6.059 17.147 1.0 8.81 ? 105 PHE A CZ 1 105 . A ATOM 850 N N . ALA A 1 106 ? 14.940 1.982 11.646 1.0 6.72 ? 106 ALA A N 1 106 . A ATOM 851 C CA . ALA A 1 106 ? 14.779 1.250 10.403 1.0 7.99 ? 106 ALA A CA 1 106 . A ATOM 852 C C . ALA A 1 106 ? 14.155 2.144 9.339 1.0 8.71 ? 106 ALA A C 1 106 . A ATOM 853 O O . ALA A 1 106 ? 13.449 3.116 9.643 1.0 8.01 ? 106 ALA A O 1 106 . A ATOM 854 C CB . ALA A 1 106 ? 13.873 0.060 10.661 1.0 8.24 ? 106 ALA A CB 1 106 . A ATOM 855 N N . ARG A 1 107 ? 14.338 1.749 8.082 1.0 9.18 ? 107 ARG A N 1 107 . A ATOM 856 C CA . ARG A 1 107 ? 13.805 2.479 6.923 1.0 9.88 ? 107 ARG A CA 1 107 . A ATOM 857 C C . ARG A 1 107 ? 14.258 3.935 6.848 1.0 9.28 ? 107 ARG A C 1 107 . A ATOM 858 O O . ARG A 1 107 ? 13.508 4.807 6.392 1.0 9.58 ? 107 ARG A O 1 107 . A ATOM 859 C CB . ARG A 1 107 ? 12.278 2.339 6.881 1.0 11.83 ? 107 ARG A CB 1 107 . A ATOM 860 C CG . ARG A 1 107 ? 11.845 0.894 6.865 1.0 14.83 ? 107 ARG A CG 1 107 . A ATOM 861 C CD . ARG A 1 107 ? 10.378 0.734 6.507 1.0 18.21 ? 107 ARG A CD 1 107 . A ATOM 862 N NE . ARG A 1 107 ? 10.007 1.529 5.338 1.0 22.71 ? 107 ARG A NE 1 107 . A ATOM 863 C CZ . ARG A 1 107 ? 8.752 1.751 4.943 1.0 24.11 ? 107 ARG A CZ 1 107 . A ATOM 864 N NH1 . ARG A 1 107 ? 7.734 1.232 5.623 1.0 25.83 ? 107 ARG A NH1 1 107 . A ATOM 865 N NH2 . ARG A 1 107 ? 8.512 2.511 3.874 1.0 25.96 ? 107 ARG A NH2 1 107 . A ATOM 866 N N . ASN A 1 108 ? 15.473 4.213 7.304 1.0 8.19 ? 108 ASN A N 1 108 . A ATOM 867 C CA . ASN A 1 108 ? 16.043 5.556 7.235 1.0 8.85 ? 108 ASN A CA 1 108 . A ATOM 868 C C . ASN A 1 108 ? 15.036 6.532 7.876 1.0 8.19 ? 108 ASN A C 1 108 . A ATOM 869 O O . ASN A 1 108 ? 14.778 7.631 7.345 1.0 9.07 ? 108 ASN A O 1 108 . A ATOM 870 C CB . ASN A 1 108 ? 16.277 5.911 5.745 1.0 10.64 ? 108 ASN A CB 1 108 . A ATOM 871 C CG . ASN A 1 108 ? 17.249 7.032 5.548 1.0 12.49 ? 108 ASN A CG 1 108 . A ATOM 872 O OD1 . ASN A 1 108 ? 17.227 7.687 4.491 1.0 15.71 ? 108 ASN A OD1 1 108 . A ATOM 873 N ND2 . ASN A 1 108 ? 18.128 7.260 6.515 1.0 13.95 ? 108 ASN A ND2 1 108 . A ATOM 874 N N . THR A 1 109 ? 14.485 6.153 9.028 1.0 6.48 ? 109 THR A N 1 109 . A ATOM 875 C CA . THR A 1 109 ? 13.453 6.976 9.679 1.0 6.37 ? 109 THR A CA 1 109 . A ATOM 876 C C . THR A 1 109 ? 14.044 7.932 10.694 1.0 6.3 ? 109 THR A C 1 109 . A ATOM 877 O O . THR A 1 109 ? 14.878 7.554 11.509 1.0 6.74 ? 109 THR A O 1 109 . A ATOM 878 C CB . THR A 1 109 ? 12.446 6.063 10.384 1.0 5.17 ? 109 THR A CB 1 109 . A ATOM 879 O OG1 . THR A 1 109 ? 11.758 5.296 9.386 1.0 6.94 ? 109 THR A OG1 1 109 . A ATOM 880 C CG2 . THR A 1 109 ? 11.397 6.853 11.189 1.0 6.88 ? 109 THR A CG2 1 109 . A ATOM 881 N N . ILE A 1 110 ? 13.630 9.196 10.627 1.0 5.33 ? 110 ILE A N 1 110 . A ATOM 882 C CA . ILE A 1 110 ? 14.120 10.200 11.558 1.0 4.77 ? 110 ILE A CA 1 110 . A ATOM 883 C C . ILE A 1 110 ? 13.067 10.681 12.562 1.0 4.73 ? 110 ILE A C 1 110 . A ATOM 884 O O . ILE A 1 110 ? 13.391 11.420 13.505 1.0 4.37 ? 110 ILE A O 1 110 . A ATOM 885 C CB . ILE A 1 110 ? 14.737 11.406 10.810 1.0 5.64 ? 110 ILE A CB 1 110 . A ATOM 886 C CG1 . ILE A 1 110 ? 13.698 12.028 9.869 1.0 5.5 ? 110 ILE A CG1 1 110 . A ATOM 887 C CG2 . ILE A 1 110 ? 16.004 10.935 10.074 1.0 7.18 ? 110 ILE A CG2 1 110 . A ATOM 888 C CD1 . ILE A 1 110 ? 14.148 13.412 9.264 1.0 7.25 ? 110 ILE A CD1 1 110 . A ATOM 889 N N . GLY A 1 111 ? 11.812 10.271 12.349 1.0 4.28 ? 111 GLY A N 1 111 . A ATOM 890 C CA . GLY A 1 111 ? 10.750 10.620 13.275 1.0 4.58 ? 111 GLY A CA 1 111 . A ATOM 891 C C . GLY A 1 111 ? 9.456 9.911 12.936 1.0 4.73 ? 111 GLY A C 1 111 . A ATOM 892 O O . GLY A 1 111 ? 9.267 9.495 11.785 1.0 4.91 ? 111 GLY A O 1 111 . A ATOM 893 N N . TRP A 1 112 ? 8.586 9.740 13.931 1.0 4.02 ? 112 TRP A N 1 112 . A ATOM 894 C CA . TRP A 1 112 ? 7.285 9.103 13.718 1.0 4.47 ? 112 TRP A CA 1 112 . A ATOM 895 C C . TRP A 1 112 ? 6.324 9.519 14.825 1.0 4.82 ? 112 TRP A C 1 112 . A ATOM 896 O O . TRP A 1 112 ? 6.736 9.735 15.973 1.0 5.88 ? 112 TRP A O 1 112 . A ATOM 897 C CB . TRP A 1 112 ? 7.454 7.573 13.731 1.0 5.77 ? 112 TRP A CB 1 112 . A ATOM 898 C CG . TRP A 1 112 ? 6.241 6.825 13.225 1.0 6.59 ? 112 TRP A CG 1 112 . A ATOM 899 C CD1 . TRP A 1 112 ? 5.978 6.477 11.924 1.0 8.76 ? 112 TRP A CD1 1 112 . A ATOM 900 C CD2 . TRP A 1 112 ? 5.134 6.379 13.995 1.0 7.88 ? 112 TRP A CD2 1 112 . A ATOM 901 N NE1 . TRP A 1 112 ? 4.761 5.835 11.846 1.0 10.62 ? 112 TRP A NE1 1 112 . A ATOM 902 C CE2 . TRP A 1 112 ? 4.226 5.763 13.106 1.0 9.29 ? 112 TRP A CE2 1 112 . A ATOM 903 C CE3 . TRP A 1 112 ? 4.813 6.441 15.355 1.0 8.09 ? 112 TRP A CE3 1 112 . A ATOM 904 C CZ2 . TRP A 1 112 ? 3.014 5.206 13.532 1.0 10.3 ? 112 TRP A CZ2 1 112 . A ATOM 905 C CZ3 . TRP A 1 112 ? 3.605 5.891 15.779 1.0 8.56 ? 112 TRP A CZ3 1 112 . A ATOM 906 C CH2 . TRP A 1 112 ? 2.725 5.283 14.871 1.0 10.0 ? 112 TRP A CH2 1 112 . A ATOM 907 N N . ALA A 1 113 ? 5.042 9.641 14.496 1.0 4.46 ? 113 ALA A N 1 113 . A ATOM 908 C CA . ALA A 1 113 ? 4.065 9.981 15.511 1.0 5.42 ? 113 ALA A CA 1 113 . A ATOM 909 C C . ALA A 1 113 ? 2.697 9.473 15.061 1.0 5.71 ? 113 ALA A C 1 113 . A ATOM 910 O O . ALA A 1 113 ? 2.485 9.161 13.903 1.0 7.58 ? 113 ALA A O 1 113 . A ATOM 911 C CB . ALA A 1 113 ? 3.996 11.516 15.678 1.0 6.47 ? 113 ALA A CB 1 113 . A ATOM 912 N N . TYR A 1 114 ? 1.775 9.412 16.013 1.0 5.58 ? 114 TYR A N 1 114 . A ATOM 913 C CA . TYR A 1 114 ? 0.379 9.045 15.703 1.0 5.96 ? 114 TYR A CA 1 114 . A ATOM 914 C C . TYR A 1 114 ? -0.293 10.301 15.142 1.0 7.1 ? 114 TYR A C 1 114 . A ATOM 915 O O . TYR A 1 114 ? -0.028 11.421 15.582 1.0 7.19 ? 114 TYR A O 1 114 . A ATOM 916 C CB . TYR A 1 114 ? -0.345 8.632 16.979 1.0 6.19 ? 114 TYR A CB 1 114 . A ATOM 917 C CG . TYR A 1 114 ? 0.219 7.394 17.600 1.0 6.37 ? 114 TYR A CG 1 114 . A ATOM 918 C CD1 . TYR A 1 114 ? -0.124 6.126 17.107 1.0 7.94 ? 114 TYR A CD1 1 114 . A ATOM 919 C CD2 . TYR A 1 114 ? 1.129 7.473 18.653 1.0 6.81 ? 114 TYR A CD2 1 114 . A ATOM 920 C CE1 . TYR A 1 114 ? 0.447 4.959 17.662 1.0 8.67 ? 114 TYR A CE1 1 114 . A ATOM 921 C CE2 . TYR A 1 114 ? 1.692 6.318 19.224 1.0 7.13 ? 114 TYR A CE2 1 114 . A ATOM 922 C CZ . TYR A 1 114 ? 1.334 5.071 18.708 1.0 8.45 ? 114 TYR A CZ 1 114 . A ATOM 923 O OH . TYR A 1 114 ? 1.885 3.940 19.285 1.0 10.53 ? 114 TYR A OH 1 114 . A ATOM 924 N N . VAL A 1 115 ? -1.199 10.115 14.200 1.0 7.68 ? 115 VAL A N 1 115 . A ATOM 925 C CA . VAL A 1 115 ? -1.898 11.229 13.615 1.0 7.62 ? 115 VAL A CA 1 115 . A ATOM 926 C C . VAL A 1 115 ? -3.176 11.608 14.334 1.0 7.56 ? 115 VAL A C 1 115 . A ATOM 927 O O . VAL A 1 115 ? -4.036 10.750 14.609 1.0 8.19 ? 115 VAL A O 1 115 . A ATOM 928 C CB . VAL A 1 115 ? -2.273 10.945 12.146 1.0 8.68 ? 115 VAL A CB 1 115 . A ATOM 929 C CG1 . VAL A 1 115 ? -3.057 12.106 11.572 1.0 10.38 ? 115 VAL A CG1 1 115 . A ATOM 930 C CG2 . VAL A 1 115 ? -0.999 10.686 11.363 1.0 9.94 ? 115 VAL A CG2 1 115 . A ATOM 931 N N . GLY A 1 116 ? -3.272 12.879 14.688 1.0 6.99 ? 116 GLY A N 1 116 . A ATOM 932 C CA . GLY A 1 116 ? -4.491 13.416 15.261 1.0 7.47 ? 116 GLY A CA 1 116 . A ATOM 933 C C . GLY A 1 116 ? -4.854 12.978 16.647 1.0 7.94 ? 116 GLY A C 1 116 . A ATOM 934 O O . GLY A 1 116 ? -6.037 13.061 16.986 1.0 10.25 ? 116 GLY A O 1 116 . A ATOM 935 N N . ARG A 1 117 ? -3.879 12.584 17.459 1.0 7.31 ? 117 ARG A N 1 117 . A ATOM 936 C CA . ARG A 1 117 ? -4.199 12.113 18.801 1.0 7.62 ? 117 ARG A CA 1 117 . A ATOM 937 C C . ARG A 1 117 ? -3.681 13.013 19.934 1.0 7.04 ? 117 ARG A C 1 117 . A ATOM 938 O O . ARG A 1 117 ? -3.477 12.557 21.064 1.0 6.32 ? 117 ARG A O 1 117 . A ATOM 939 C CB . ARG A 1 117 ? -3.693 10.675 18.993 1.0 8.92 ? 117 ARG A CB 1 117 . A ATOM 940 C CG . ARG A 1 117 ? -4.257 9.628 18.004 1.0 11.95 ? 117 ARG A CG 1 117 . A ATOM 941 C CD . ARG A 1 117 ? -5.749 9.717 17.804 1.0 16.96 ? 117 ARG A CD 1 117 . A ATOM 942 N NE . ARG A 1 117 ? -6.356 8.409 17.569 1.0 22.78 ? 117 ARG A NE 1 117 . A ATOM 943 C CZ . ARG A 1 117 ? -6.575 7.536 18.552 1.0 24.13 ? 117 ARG A CZ 1 117 . A ATOM 944 N NH1 . ARG A 1 117 ? -6.237 7.864 19.785 1.0 25.45 ? 117 ARG A NH1 1 117 . A ATOM 945 N NH2 . ARG A 1 117 ? -7.121 6.360 18.312 1.0 26.25 ? 117 ARG A NH2 1 117 . A ATOM 946 N N . MET A 1 118 ? -3.461 14.287 19.637 1.0 5.94 ? 118 MET A N 1 118 . A ATOM 947 C CA . MET A 1 118 ? -3.041 15.232 20.672 1.0 6.27 ? 118 MET A CA 1 118 . A ATOM 948 C C . MET A 1 118 ? -3.967 15.108 21.898 1.0 6.67 ? 118 MET A C 1 118 . A ATOM 949 O O . MET A 1 118 ? -5.191 15.067 21.764 1.0 8.4 ? 118 MET A O 1 118 . A ATOM 950 C CB . MET A 1 118 ? -3.107 16.650 20.082 1.0 6.4 ? 118 MET A CB 1 118 . A ATOM 951 C CG . MET A 1 118 ? -2.857 17.762 21.110 1.0 6.38 ? 118 MET A CG 1 118 . A ATOM 952 S SD . MET A 1 118 ? -1.226 17.694 21.930 1.0 6.81 ? 118 MET A SD 1 118 . A ATOM 953 C CE . MET A 1 118 ? -0.059 17.751 20.488 1.0 7.13 ? 118 MET A CE 1 118 . A ATOM 954 N N . CYS A 1 119 ? -3.341 15.045 23.069 1.0 6.41 ? 119 CYS A N 1 119 . A ATOM 955 C CA . CYS A 1 119 ? -3.964 14.930 24.402 1.0 7.52 ? 119 CYS A CA 1 119 . A ATOM 956 C C . CYS A 1 119 ? -4.265 13.513 24.845 1.0 7.47 ? 119 CYS A C 1 119 . A ATOM 957 O O . CYS A 1 119 ? -4.448 13.306 26.025 1.0 8.72 ? 119 CYS A O 1 119 . A ATOM 958 C CB . CYS A 1 119 ? -5.244 15.750 24.561 1.0 7.93 ? 119 CYS A CB 1 119 . A ATOM 959 S SG . CYS A 1 119 ? -4.993 17.539 24.365 1.0 10.93 ? 119 CYS A SG 1 119 . A ATOM 960 N N . ASP A 1 120 ? -4.282 12.554 23.924 1.0 7.09 ? 120 ASP A N 1 120 . A ATOM 961 C CA . ASP A 1 120 ? -4.572 11.162 24.307 1.0 7.77 ? 120 ASP A CA 1 120 . A ATOM 962 C C . ASP A 1 120 ? -3.453 10.651 25.205 1.0 7.56 ? 120 ASP A C 1 120 . A ATOM 963 O O . ASP A 1 120 ? -2.278 10.869 24.920 1.0 7.77 ? 120 ASP A O 1 120 . A ATOM 964 C CB . ASP A 1 120 ? -4.686 10.288 23.071 1.0 9.42 ? 120 ASP A CB 1 120 . A ATOM 965 C CG . ASP A 1 120 ? -5.126 8.895 23.399 1.0 12.4 ? 120 ASP A CG 1 120 . A ATOM 966 O OD1 . ASP A 1 120 ? -4.286 8.086 23.820 1.0 11.56 ? 120 ASP A OD1 1 120 . A ATOM 967 O OD2 . ASP A 1 120 ? -6.340 8.638 23.268 1.0 15.7 ? 120 ASP A OD2 1 120 . A ATOM 968 N N . GLU A 1 121 ? -3.800 9.989 26.306 1.0 8.0 ? 121 GLU A N 1 121 . A ATOM 969 C CA . GLU A 1 121 ? -2.766 9.543 27.226 1.0 8.34 ? 121 GLU A CA 1 121 . A ATOM 970 C C . GLU A 1 121 ? -1.694 8.640 26.624 1.0 8.4 ? 121 GLU A C 1 121 . A ATOM 971 O O . GLU A 1 121 ? -0.521 8.753 26.971 1.0 9.85 ? 121 GLU A O 1 121 . A ATOM 972 C CB . GLU A 1 121 ? -3.348 8.786 28.419 1.0 9.86 ? 121 GLU A CB 1 121 . A ATOM 973 C CG . GLU A 1 121 ? -4.161 9.563 29.396 1.0 13.96 ? 121 GLU A CG 1 121 . A ATOM 974 C CD . GLU A 1 121 ? -4.535 8.663 30.569 1.0 16.66 ? 121 GLU A CD 1 121 . A ATOM 975 O OE1 . GLU A 1 121 ? -5.222 7.648 30.337 1.0 19.23 ? 121 GLU A OE1 1 121 . A ATOM 976 O OE2 . GLU A 1 121 ? -4.096 8.955 31.696 1.0 21.76 ? 121 GLU A OE2 1 121 . A ATOM 977 N N . LYS A 1 122 ? -2.089 7.713 25.759 1.0 8.03 ? 122 LYS A N 1 122 . A ATOM 978 C CA . LYS A 1 122 ? -1.118 6.832 25.145 1.0 8.54 ? 122 LYS A CA 1 122 . A ATOM 979 C C . LYS A 1 122 ? -0.647 7.307 23.769 1.0 7.68 ? 122 LYS A C 1 122 . A ATOM 980 O O . LYS A 1 122 ? 0.471 6.967 23.372 1.0 9.54 ? 122 LYS A O 1 122 . A ATOM 981 C CB . LYS A 1 122 ? -1.762 5.445 24.947 1.0 10.28 ? 122 LYS A CB 1 122 . A ATOM 982 C CG . LYS A 1 122 ? -0.902 4.463 24.180 1.0 15.46 ? 122 LYS A CG 1 122 . A ATOM 983 C CD . LYS A 1 122 ? -1.488 3.059 24.153 1.0 17.51 ? 122 LYS A CD 1 122 . A ATOM 984 C CE . LYS A 1 122 ? -0.944 2.260 22.974 1.0 19.08 ? 122 LYS A CE 1 122 . A ATOM 985 N NZ . LYS A 1 122 ? 0.459 2.018 23.092 1.0 17.94 ? 122 LYS A NZ 1 122 . A ATOM 986 N N . TYR A 1 123 ? -1.473 8.072 23.051 1.0 7.26 ? 123 TYR A N 1 123 . A ATOM 987 C CA . TYR A 1 123 ? -1.137 8.423 21.678 1.0 7.06 ? 123 TYR A CA 1 123 . A ATOM 988 C C . TYR A 1 123 ? -0.653 9.829 21.392 1.0 5.89 ? 123 TYR A C 1 123 . A ATOM 989 O O . TYR A 1 123 ? -0.354 10.154 20.236 1.0 5.85 ? 123 TYR A O 1 123 . A ATOM 990 C CB . TYR A 1 123 ? -2.300 8.046 20.763 1.0 9.03 ? 123 TYR A CB 1 123 . A ATOM 991 C CG . TYR A 1 123 ? -2.619 6.563 20.844 1.0 11.2 ? 123 TYR A CG 1 123 . A ATOM 992 C CD1 . TYR A 1 123 ? -3.795 6.100 21.441 1.0 13.43 ? 123 TYR A CD1 1 123 . A ATOM 993 C CD2 . TYR A 1 123 ? -1.733 5.627 20.317 1.0 13.26 ? 123 TYR A CD2 1 123 . A ATOM 994 C CE1 . TYR A 1 123 ? -4.063 4.707 21.498 1.0 16.4 ? 123 TYR A CE1 1 123 . A ATOM 995 C CE2 . TYR A 1 123 ? -1.993 4.256 20.363 1.0 15.89 ? 123 TYR A CE2 1 123 . A ATOM 996 C CZ . TYR A 1 123 ? -3.156 3.809 20.955 1.0 16.43 ? 123 TYR A CZ 1 123 . A ATOM 997 O OH . TYR A 1 123 ? -3.396 2.439 20.964 1.0 18.91 ? 123 TYR A OH 1 123 . A ATOM 998 N N . SER A 1 124 ? -0.619 10.667 22.417 1.0 5.64 ? 124 SER A N 1 124 . A ATOM 999 C CA . SER A 1 124 ? -0.058 12.019 22.237 1.0 4.77 ? 124 SER A CA 1 124 . A ATOM 1000 C C . SER A 1 124 ? 1.476 11.955 22.424 1.0 4.6 ? 124 SER A C 1 124 . A ATOM 1001 O O . SER A 1 124 ? 2.052 12.504 23.390 1.0 4.88 ? 124 SER A O 1 124 . A ATOM 1002 C CB . SER A 1 124 ? -0.649 12.967 23.257 1.0 5.45 ? 124 SER A CB 1 124 . A ATOM 1003 O OG . SER A 1 124 ? -0.395 14.313 22.845 1.0 5.49 ? 124 SER A OG 1 124 . A ATOM 1004 N N . VAL A 1 125 ? 2.108 11.233 21.495 1.0 5.0 ? 125 VAL A N 1 125 . A ATOM 1005 C CA . VAL A 1 125 ? 3.548 11.054 21.555 1.0 5.18 ? 125 VAL A CA 1 125 . A ATOM 1006 C C . VAL A 1 125 ? 4.162 11.007 20.181 1.0 5.24 ? 125 VAL A C 1 125 . A ATOM 1007 O O . VAL A 1 125 ? 3.467 10.775 19.177 1.0 6.27 ? 125 VAL A O 1 125 . A ATOM 1008 C CB . VAL A 1 125 ? 3.953 9.706 22.266 1.0 5.41 ? 125 VAL A CB 1 125 . A ATOM 1009 C CG1 . VAL A 1 125 ? 3.439 9.689 23.705 1.0 6.06 ? 125 VAL A CG1 1 125 . A ATOM 1010 C CG2 . VAL A 1 125 ? 3.435 8.486 21.495 1.0 5.54 ? 125 VAL A CG2 1 125 . A ATOM 1011 N N . ALA A 1 126 ? 5.483 11.224 20.167 1.0 5.06 ? 126 ALA A N 1 126 . A ATOM 1012 C CA . ALA A 1 126 ? 6.294 11.096 18.969 1.0 4.98 ? 126 ALA A CA 1 126 . A ATOM 1013 C C . ALA A 1 126 ? 7.655 10.550 19.382 1.0 4.25 ? 126 ALA A C 1 126 . A ATOM 1014 O O . ALA A 1 126 ? 8.046 10.669 20.551 1.0 4.46 ? 126 ALA A O 1 126 . A ATOM 1015 C CB . ALA A 1 126 ? 6.504 12.448 18.289 1.0 5.83 ? 126 ALA A CB 1 126 . A ATOM 1016 N N . VAL A 1 127 ? 8.356 9.939 18.425 1.0 4.01 ? 127 VAL A N 1 127 . A ATOM 1017 C CA . VAL A 1 127 ? 9.734 9.513 18.648 1.0 4.56 ? 127 VAL A CA 1 127 . A ATOM 1018 C C . VAL A 1 127 ? 10.549 10.236 17.584 1.0 3.98 ? 127 VAL A C 1 127 . A ATOM 1019 O O . VAL A 1 127 ? 10.106 10.334 16.420 1.0 4.81 ? 127 VAL A O 1 127 . A ATOM 1020 C CB . VAL A 1 127 ? 9.906 7.971 18.609 1.0 5.23 ? 127 VAL A CB 1 127 . A ATOM 1021 C CG1 . VAL A 1 127 ? 9.020 7.339 19.664 1.0 6.6 ? 127 VAL A CG1 1 127 . A ATOM 1022 C CG2 . VAL A 1 127 ? 9.572 7.399 17.230 1.0 6.69 ? 127 VAL A CG2 1 127 . A ATOM 1023 N N . VAL A 1 128 ? 11.705 10.768 17.969 1.0 4.5 ? 128 VAL A N 1 128 . A ATOM 1024 C CA . VAL A 1 128 ? 12.500 11.566 17.050 1.0 4.44 ? 128 VAL A CA 1 128 . A ATOM 1025 C C . VAL A 1 128 ? 13.974 11.237 17.202 1.0 4.46 ? 128 VAL A C 1 128 . A ATOM 1026 O O . VAL A 1 128 ? 14.489 11.145 18.315 1.0 4.82 ? 128 VAL A O 1 128 . A ATOM 1027 C CB . VAL A 1 128 ? 12.277 13.092 17.354 1.0 4.82 ? 128 VAL A CB 1 128 . A ATOM 1028 C CG1 . VAL A 1 128 ? 13.281 13.964 16.522 1.0 5.83 ? 128 VAL A CG1 1 128 . A ATOM 1029 C CG2 . VAL A 1 128 ? 10.835 13.486 17.044 1.0 6.57 ? 128 VAL A CG2 1 128 . A ATOM 1030 N N . LYS A 1 129 ? 14.646 11.042 16.075 1.0 4.74 ? 129 LYS A N 1 129 . A ATOM 1031 C CA . LYS A 1 129 ? 16.046 10.755 16.071 1.0 4.63 ? 129 LYS A CA 1 129 . A ATOM 1032 C C . LYS A 1 129 ? 16.821 12.062 16.106 1.0 4.96 ? 129 LYS A C 1 129 . A ATOM 1033 O O . LYS A 1 129 ? 16.475 12.986 15.380 1.0 6.42 ? 129 LYS A O 1 129 . A ATOM 1034 C CB . LYS A 1 129 ? 16.388 9.999 14.780 1.0 5.03 ? 129 LYS A CB 1 129 . A ATOM 1035 C CG . LYS A 1 129 ? 17.851 9.563 14.718 1.0 6.18 ? 129 LYS A CG 1 129 . A ATOM 1036 C CD . LYS A 1 129 ? 18.165 8.856 13.409 1.0 7.14 ? 129 LYS A CD 1 129 . A ATOM 1037 C CE . LYS A 1 129 ? 19.579 8.344 13.386 1.0 8.98 ? 129 LYS A CE 1 129 . A ATOM 1038 N NZ . LYS A 1 129 ? 19.907 7.650 12.087 1.0 10.92 ? 129 LYS A NZ 1 129 . A ATOM 1039 N N . ASP A 1 130 ? 17.859 12.129 16.949 1.0 4.81 ? 130 ASP A N 1 130 . A ATOM 1040 C CA . ASP A 1 130 ? 18.733 13.322 17.017 1.0 5.84 ? 130 ASP A CA 1 130 . A ATOM 1041 C C . ASP A 1 130 ? 19.680 13.143 15.816 1.0 6.47 ? 130 ASP A C 1 130 . A ATOM 1042 O O . ASP A 1 130 ? 20.859 12.807 15.957 1.0 9.17 ? 130 ASP A O 1 130 . A ATOM 1043 C CB . ASP A 1 130 ? 19.495 13.266 18.344 1.0 7.07 ? 130 ASP A CB 1 130 . A ATOM 1044 C CG . ASP A 1 130 ? 20.278 14.518 18.604 1.0 8.05 ? 130 ASP A CG 1 130 . A ATOM 1045 O OD1 . ASP A 1 130 ? 21.472 14.377 18.931 1.0 10.36 ? 130 ASP A OD1 1 130 . A ATOM 1046 O OD2 . ASP A 1 130 ? 19.713 15.621 18.497 1.0 8.93 ? 130 ASP A OD2 1 130 . A ATOM 1047 N N . HIS A 1 131 ? 19.126 13.375 14.624 1.0 6.28 ? 131 HIS A N 1 131 . A ATOM 1048 C CA . HIS A 1 131 ? 19.790 13.050 13.350 1.0 6.19 ? 131 HIS A CA 1 131 . A ATOM 1049 C C . HIS A 1 131 ? 20.672 14.072 12.672 1.0 7.27 ? 131 HIS A C 1 131 . A ATOM 1050 O O . HIS A 1 131 ? 21.087 13.862 11.510 1.0 8.77 ? 131 HIS A O 1 131 . A ATOM 1051 C CB . HIS A 1 131 ? 18.725 12.594 12.351 1.0 6.37 ? 131 HIS A CB 1 131 . A ATOM 1052 C CG . HIS A 1 131 ? 17.800 13.688 11.922 1.0 6.11 ? 131 HIS A CG 1 131 . A ATOM 1053 N ND1 . HIS A 1 131 ? 18.074 14.508 10.840 1.0 6.37 ? 131 HIS A ND1 1 131 . A ATOM 1054 C CD2 . HIS A 1 131 ? 16.617 14.103 12.439 1.0 6.63 ? 131 HIS A CD2 1 131 . A ATOM 1055 C CE1 . HIS A 1 131 ? 17.081 15.386 10.724 1.0 5.83 ? 131 HIS A CE1 1 131 . A ATOM 1056 N NE2 . HIS A 1 131 ? 16.188 15.157 11.680 1.0 7.16 ? 131 HIS A NE2 1 131 . A ATOM 1057 N N . SER A 1 132 ? 20.969 15.157 13.367 1.0 6.56 ? 132 SER A N 1 132 . A ATOM 1058 C CA . SER A 1 132 ? 21.828 16.206 12.813 1.0 7.7 ? 132 SER A CA 1 132 . A ATOM 1059 C C . SER A 1 132 ? 22.464 16.972 13.955 1.0 8.74 ? 132 SER A C 1 132 . A ATOM 1060 O O . SER A 1 132 ? 21.881 17.092 15.022 1.0 8.52 ? 132 SER A O 1 132 . A ATOM 1061 C CB . SER A 1 132 ? 20.978 17.194 12.017 1.0 7.12 ? 132 SER A CB 1 132 . A ATOM 1062 O OG . SER A 1 132 ? 21.756 18.286 11.490 1.0 8.56 ? 132 SER A OG 1 132 . A ATOM 1063 N N . SER A 1 133 ? 23.653 17.514 13.718 1.0 10.34 ? 133 SER A N 1 133 . A ATOM 1064 C CA . SER A 1 133 ? 24.280 18.336 14.725 1.0 11.16 ? 133 SER A CA 1 133 . A ATOM 1065 C C . SER A 1 133 ? 23.532 19.672 14.721 1.0 10.53 ? 133 SER A C 1 133 . A ATOM 1066 O O . SER A 1 133 ? 23.592 20.379 15.724 1.0 13.24 ? 133 SER A O 1 133 . A ATOM 1067 C CB . SER A 1 133 ? 25.767 18.555 14.393 1.0 12.63 ? 133 SER A CB 1 133 . A ATOM 1068 O OG . SER A 1 133 ? 25.927 19.086 13.108 1.0 14.47 ? 133 SER A OG 1 133 . A ATOM 1069 N N . LYS A 1 134 ? 22.834 20.014 13.632 1.0 9.66 ? 134 LYS A N 1 134 . A ATOM 1070 C CA . LYS A 1 134 ? 22.094 21.290 13.543 1.0 9.45 ? 134 LYS A CA 1 134 . A ATOM 1071 C C . LYS A 1 134 ? 20.788 21.173 14.318 1.0 7.53 ? 134 LYS A C 1 134 . A ATOM 1072 O O . LYS A 1 134 ? 19.876 20.418 13.938 1.0 8.16 ? 134 LYS A O 1 134 . A ATOM 1073 C CB . LYS A 1 134 ? 21.773 21.618 12.090 1.0 11.24 ? 134 LYS A CB 1 134 . A ATOM 1074 C CG . LYS A 1 134 ? 23.010 21.794 11.187 1.0 13.1 ? 134 LYS A CG 1 134 . A ATOM 1075 C CD . LYS A 1 134 ? 22.594 22.087 9.770 1.0 16.4 ? 134 LYS A CD 1 134 . A ATOM 1076 C CE . LYS A 1 134 ? 23.805 22.276 8.881 1.0 18.96 ? 134 LYS A CE 1 134 . A ATOM 1077 N NZ . LYS A 1 134 ? 23.389 22.461 7.473 1.0 22.66 ? 134 LYS A NZ 1 134 . A ATOM 1078 N N . VAL A 1 135 ? 20.716 21.911 15.408 1.0 6.6 ? 135 VAL A N 1 135 . A ATOM 1079 C CA . VAL A 1 135 ? 19.535 21.925 16.261 1.0 6.11 ? 135 VAL A CA 1 135 . A ATOM 1080 C C . VAL A 1 135 ? 18.259 22.154 15.464 1.0 5.61 ? 135 VAL A C 1 135 . A ATOM 1081 O O . VAL A 1 135 ? 17.256 21.459 15.698 1.0 5.47 ? 135 VAL A O 1 135 . A ATOM 1082 C CB . VAL A 1 135 ? 19.672 23.020 17.340 1.0 7.68 ? 135 VAL A CB 1 135 . A ATOM 1083 C CG1 . VAL A 1 135 ? 18.384 23.205 18.122 1.0 8.44 ? 135 VAL A CG1 1 135 . A ATOM 1084 C CG2 . VAL A 1 135 ? 20.812 22.656 18.278 1.0 10.37 ? 135 VAL A CG2 1 135 . A ATOM 1085 N N . PHE A 1 136 ? 18.285 23.070 14.508 1.0 5.27 ? 136 PHE A N 1 136 . A ATOM 1086 C CA . PHE A 1 136 ? 17.060 23.321 13.783 1.0 4.96 ? 136 PHE A CA 1 136 . A ATOM 1087 C C . PHE A 1 136 ? 16.570 22.098 13.020 1.0 5.3 ? 136 PHE A C 1 136 . A ATOM 1088 O O . PHE A 1 136 ? 15.350 21.882 12.921 1.0 4.68 ? 136 PHE A O 1 136 . A ATOM 1089 C CB . PHE A 1 136 ? 17.214 24.505 12.813 1.0 5.85 ? 136 PHE A CB 1 136 . A ATOM 1090 C CG . PHE A 1 136 ? 15.971 24.785 12.014 1.0 5.19 ? 136 PHE A CG 1 136 . A ATOM 1091 C CD1 . PHE A 1 136 ? 14.936 25.494 12.561 1.0 6.73 ? 136 PHE A CD1 1 136 . A ATOM 1092 C CD2 . PHE A 1 136 ? 15.823 24.285 10.747 1.0 6.32 ? 136 PHE A CD2 1 136 . A ATOM 1093 C CE1 . PHE A 1 136 ? 13.768 25.708 11.845 1.0 7.99 ? 136 PHE A CE1 1 136 . A ATOM 1094 C CE2 . PHE A 1 136 ? 14.664 24.493 10.033 1.0 7.02 ? 136 PHE A CE2 1 136 . A ATOM 1095 C CZ . PHE A 1 136 ? 13.638 25.208 10.593 1.0 7.38 ? 136 PHE A CZ 1 136 . A ATOM 1096 N N . MET A 1 137 ? 17.478 21.313 12.440 1.0 4.57 ? 137 MET A N 1 137 . A ATOM 1097 C CA . MET A 1 137 ? 17.029 20.132 11.706 1.0 5.65 ? 137 MET A CA 1 137 . A ATOM 1098 C C . MET A 1 137 ? 16.318 19.127 12.591 1.0 4.9 ? 137 MET A C 1 137 . A ATOM 1099 O O . MET A 1 137 ? 15.365 18.487 12.152 1.0 6.16 ? 137 MET A O 1 137 . A ATOM 1100 C CB . MET A 1 137 ? 18.202 19.489 10.974 1.0 8.2 ? 137 MET A CB 1 137 . A ATOM 1101 C CG . MET A 1 137 ? 18.728 20.446 9.888 1.0 10.1 ? 137 MET A CG 1 137 . A ATOM 1102 S SD . MET A 1 137 ? 17.473 20.844 8.599 1.0 19.06 ? 137 MET A SD 1 137 . A ATOM 1103 C CE . MET A 1 137 ? 17.765 19.542 7.986 1.0 10.45 ? 137 MET A CE 1 137 . A ATOM 1104 N N . VAL A 1 138 ? 16.756 18.985 13.840 1.0 4.26 ? 138 VAL A N 1 138 . A ATOM 1105 C CA . VAL A 1 138 ? 16.076 18.086 14.752 1.0 3.99 ? 138 VAL A CA 1 138 . A ATOM 1106 C C . VAL A 1 138 ? 14.771 18.774 15.226 1.0 3.93 ? 138 VAL A C 1 138 . A ATOM 1107 O O . VAL A 1 138 ? 13.719 18.134 15.289 1.0 4.14 ? 138 VAL A O 1 138 . A ATOM 1108 C CB . VAL A 1 138 ? 16.987 17.699 15.925 1.0 4.5 ? 138 VAL A CB 1 138 . A ATOM 1109 C CG1 . VAL A 1 138 ? 16.263 16.771 16.855 1.0 6.21 ? 138 VAL A CG1 1 138 . A ATOM 1110 C CG2 . VAL A 1 138 ? 18.261 17.019 15.374 1.0 6.34 ? 138 VAL A CG2 1 138 . A ATOM 1111 N N . ALA A 1 139 ? 14.818 20.072 15.543 1.0 3.84 ? 139 ALA A N 1 139 . A ATOM 1112 C CA . ALA A 1 139 ? 13.597 20.762 16.013 1.0 3.63 ? 139 ALA A CA 1 139 . A ATOM 1113 C C . ALA A 1 139 ? 12.501 20.744 14.955 1.0 3.3 ? 139 ALA A C 1 139 . A ATOM 1114 O O . ALA A 1 139 ? 11.331 20.621 15.309 1.0 4.05 ? 139 ALA A O 1 139 . A ATOM 1115 C CB . ALA A 1 139 ? 13.934 22.195 16.375 1.0 4.54 ? 139 ALA A CB 1 139 . A ATOM 1116 N N . VAL A 1 140 ? 12.862 20.906 13.679 1.0 2.94 ? 140 VAL A N 1 140 . A ATOM 1117 C CA . VAL A 1 140 ? 11.802 20.892 12.659 1.0 3.13 ? 140 VAL A CA 1 140 . A ATOM 1118 C C . VAL A 1 140 ? 11.213 19.466 12.516 1.0 3.29 ? 140 VAL A C 1 140 . A ATOM 1119 O O . VAL A 1 140 ? 10.034 19.299 12.159 1.0 3.75 ? 140 VAL A O 1 140 . A ATOM 1120 C CB . VAL A 1 140 ? 12.301 21.515 11.312 1.0 3.4 ? 140 VAL A CB 1 140 . A ATOM 1121 C CG1 . VAL A 1 140 ? 13.221 20.585 10.569 1.0 4.46 ? 140 VAL A CG1 1 140 . A ATOM 1122 C CG2 . VAL A 1 140 ? 11.086 21.933 10.465 1.0 5.0 ? 140 VAL A CG2 1 140 . A ATOM 1123 N N . THR A 1 141 ? 12.019 18.453 12.845 1.0 2.77 ? 141 THR A N 1 141 . A ATOM 1124 C CA . THR A 1 141 ? 11.511 17.076 12.837 1.0 3.02 ? 141 THR A CA 1 141 . A ATOM 1125 C C . THR A 1 141 ? 10.528 16.912 14.007 1.0 2.88 ? 141 THR A C 1 141 . A ATOM 1126 O O . THR A 1 141 ? 9.452 16.330 13.818 1.0 3.15 ? 141 THR A O 1 141 . A ATOM 1127 C CB . THR A 1 141 ? 12.662 16.097 12.958 1.0 2.98 ? 141 THR A CB 1 141 . A ATOM 1128 O OG1 . THR A 1 141 ? 13.556 16.303 11.843 1.0 5.56 ? 141 THR A OG1 1 141 . A ATOM 1129 C CG2 . THR A 1 141 ? 12.143 14.680 12.907 1.0 4.28 ? 141 THR A CG2 1 141 . A ATOM 1130 N N . MET A 1 142 ? 10.891 17.440 15.183 1.0 2.99 ? 142 MET A N 1 142 . A ATOM 1131 C CA . MET A 1 142 ? 9.968 17.380 16.327 1.0 3.05 ? 142 MET A CA 1 142 . A ATOM 1132 C C . MET A 1 142 ? 8.649 18.117 15.994 1.0 3.63 ? 142 MET A C 1 142 . A ATOM 1133 O O . MET A 1 142 ? 7.552 17.662 16.340 1.0 3.89 ? 142 MET A O 1 142 . A ATOM 1134 C CB . MET A 1 142 ? 10.591 18.052 17.570 1.0 4.01 ? 142 MET A CB 1 142 . A ATOM 1135 C CG . MET A 1 142 ? 11.830 17.295 18.027 1.0 3.81 ? 142 MET A CG 1 142 . A ATOM 1136 S SD . MET A 1 142 ? 12.795 18.170 19.272 1.0 7.02 ? 142 MET A SD 1 142 . A ATOM 1137 C CE . MET A 1 142 ? 11.913 17.848 20.641 1.0 9.81 ? 142 MET A CE 1 142 . A ATOM 1138 N N . THR A 1 143 ? 8.757 19.242 15.287 1.0 2.77 ? 143 THR A N 1 143 . A ATOM 1139 C CA . THR A 1 143 ? 7.598 20.056 14.917 1.0 3.41 ? 143 THR A CA 1 143 . A ATOM 1140 C C . THR A 1 143 ? 6.742 19.344 13.859 1.0 3.3 ? 143 THR A C 1 143 . A ATOM 1141 O O . THR A 1 143 ? 5.512 19.395 13.922 1.0 4.01 ? 143 THR A O 1 143 . A ATOM 1142 C CB . THR A 1 143 ? 8.054 21.447 14.433 1.0 4.02 ? 143 THR A CB 1 143 . A ATOM 1143 O OG1 . THR A 1 143 ? 8.838 22.056 15.474 1.0 3.89 ? 143 THR A OG1 1 143 . A ATOM 1144 C CG2 . THR A 1 143 ? 6.854 22.362 14.213 1.0 4.25 ? 143 THR A CG2 1 143 . A ATOM 1145 N N . HIS A 1 144 ? 7.385 18.675 12.890 1.0 3.19 ? 144 HIS A N 1 144 . A ATOM 1146 C CA . HIS A 1 144 ? 6.673 17.892 11.870 1.0 3.3 ? 144 HIS A CA 1 144 . A ATOM 1147 C C . HIS A 1 144 ? 5.854 16.770 12.581 1.0 2.93 ? 144 HIS A C 1 144 . A ATOM 1148 O O . HIS A 1 144 ? 4.666 16.562 12.279 1.0 3.59 ? 144 HIS A O 1 144 . A ATOM 1149 C CB . HIS A 1 144 ? 7.736 17.279 10.941 1.0 3.96 ? 144 HIS A CB 1 144 . A ATOM 1150 C CG . HIS A 1 144 ? 7.186 16.368 9.887 1.0 3.12 ? 144 HIS A CG 1 144 . A ATOM 1151 N ND1 . HIS A 1 144 ? 7.015 16.758 8.582 1.0 3.0 ? 144 HIS A ND1 1 144 . A ATOM 1152 C CD2 . HIS A 1 144 ? 6.796 15.071 9.950 1.0 3.09 ? 144 HIS A CD2 1 144 . A ATOM 1153 C CE1 . HIS A 1 144 ? 6.564 15.724 7.872 1.0 4.24 ? 144 HIS A CE1 1 144 . A ATOM 1154 N NE2 . HIS A 1 144 ? 6.411 14.683 8.686 1.0 3.29 ? 144 HIS A NE2 1 144 . A ATOM 1155 N N . GLU A 1 145 ? 6.470 16.055 13.536 1.0 2.88 ? 145 GLU A N 1 145 . A ATOM 1156 C CA . GLU A 1 145 ? 5.723 14.998 14.246 1.0 3.56 ? 145 GLU A CA 1 145 . A ATOM 1157 C C . GLU A 1 145 ? 4.596 15.591 15.113 1.0 3.91 ? 145 GLU A C 1 145 . A ATOM 1158 O O . GLU A 1 145 ? 3.509 15.017 15.219 1.0 4.37 ? 145 GLU A O 1 145 . A ATOM 1159 C CB . GLU A 1 145 ? 6.676 14.115 15.087 1.0 4.91 ? 145 GLU A CB 1 145 . A ATOM 1160 C CG . GLU A 1 145 ? 7.845 13.551 14.263 1.0 4.59 ? 145 GLU A CG 1 145 . A ATOM 1161 C CD . GLU A 1 145 ? 7.433 12.796 13.015 1.0 5.31 ? 145 GLU A CD 1 145 . A ATOM 1162 O OE1 . GLU A 1 145 ? 8.320 12.667 12.109 1.0 5.01 ? 145 GLU A OE1 1 145 . A ATOM 1163 O OE2 . GLU A 1 145 ? 6.272 12.331 12.903 1.0 5.37 ? 145 GLU A OE2 1 145 . A ATOM 1164 N N . LEU A 1 146 ? 4.862 16.738 15.751 1.0 3.35 ? 146 LEU A N 1 146 . A ATOM 1165 C CA . LEU A 1 146 ? 3.821 17.427 16.511 1.0 4.1 ? 146 LEU A CA 1 146 . A ATOM 1166 C C . LEU A 1 146 ? 2.674 17.768 15.552 1.0 4.21 ? 146 LEU A C 1 146 . A ATOM 1167 O O . LEU A 1 146 ? 1.480 17.598 15.907 1.0 4.75 ? 146 LEU A O 1 146 . A ATOM 1168 C CB . LEU A 1 146 ? 4.395 18.703 17.123 1.0 5.36 ? 146 LEU A CB 1 146 . A ATOM 1169 C CG . LEU A 1 146 ? 3.439 19.502 18.015 1.0 5.42 ? 146 LEU A CG 1 146 . A ATOM 1170 C CD1 . LEU A 1 146 ? 3.164 18.722 19.318 1.0 7.85 ? 146 LEU A CD1 1 146 . A ATOM 1171 C CD2 . LEU A 1 146 ? 4.095 20.840 18.398 1.0 6.63 ? 146 LEU A CD2 1 146 . A ATOM 1172 N N . GLY A 1 147 ? 3.000 18.284 14.366 1.0 3.64 ? 147 GLY A N 1 147 . A ATOM 1173 C CA . GLY A 1 147 ? 1.969 18.609 13.370 1.0 4.99 ? 147 GLY A CA 1 147 . A ATOM 1174 C C . GLY A 1 147 ? 1.131 17.390 13.052 1.0 3.89 ? 147 GLY A C 1 147 . A ATOM 1175 O O . GLY A 1 147 ? -0.106 17.482 12.986 1.0 4.58 ? 147 GLY A O 1 147 . A ATOM 1176 N N . HIS A 1 148 ? 1.774 16.241 12.821 1.0 4.18 ? 148 HIS A N 1 148 . A ATOM 1177 C CA . HIS A 1 148 ? 0.968 15.036 12.608 1.0 4.2 ? 148 HIS A CA 1 148 . A ATOM 1178 C C . HIS A 1 148 ? 0.024 14.788 13.789 1.0 5.35 ? 148 HIS A C 1 148 . A ATOM 1179 O O . HIS A 1 148 ? -1.138 14.451 13.588 1.0 5.72 ? 148 HIS A O 1 148 . A ATOM 1180 C CB . HIS A 1 148 ? 1.839 13.776 12.473 1.0 4.86 ? 148 HIS A CB 1 148 . A ATOM 1181 C CG . HIS A 1 148 ? 2.450 13.580 11.124 1.0 5.11 ? 148 HIS A CG 1 148 . A ATOM 1182 N ND1 . HIS A 1 148 ? 1.706 13.579 9.961 1.0 4.94 ? 148 HIS A ND1 1 148 . A ATOM 1183 C CD2 . HIS A 1 148 ? 3.714 13.254 10.760 1.0 4.57 ? 148 HIS A CD2 1 148 . A ATOM 1184 C CE1 . HIS A 1 148 ? 2.488 13.251 8.943 1.0 4.44 ? 148 HIS A CE1 1 148 . A ATOM 1185 N NE2 . HIS A 1 148 ? 3.714 13.048 9.397 1.0 4.77 ? 148 HIS A NE2 1 148 . A ATOM 1186 N N . ASN A 1 149 ? 0.528 14.942 15.014 1.0 4.57 ? 149 ASN A N 1 149 . A ATOM 1187 C CA . ASN A 1 149 ? -0.307 14.667 16.192 1.0 4.24 ? 149 ASN A CA 1 149 . A ATOM 1188 C C . ASN A 1 149 ? -1.471 15.669 16.297 1.0 5.19 ? 149 ASN A C 1 149 . A ATOM 1189 O O . ASN A 1 149 ? -2.485 15.372 16.955 1.0 5.64 ? 149 ASN A O 1 149 . A ATOM 1190 C CB . ASN A 1 149 ? 0.591 14.627 17.448 1.0 5.47 ? 149 ASN A CB 1 149 . A ATOM 1191 C CG . ASN A 1 149 ? 0.034 13.748 18.562 1.0 5.51 ? 149 ASN A CG 1 149 . A ATOM 1192 O OD1 . ASN A 1 149 ? -0.120 14.200 19.707 1.0 5.0 ? 149 ASN A OD1 1 149 . A ATOM 1193 N ND2 . ASN A 1 149 ? -0.247 12.480 18.251 1.0 6.09 ? 149 ASN A ND2 1 149 . A ATOM 1194 N N . LEU A 1 150 ? -1.330 16.844 15.650 1.0 4.7 ? 150 LEU A N 1 150 . A ATOM 1195 C CA . LEU A 1 150 ? -2.390 17.873 15.562 1.0 5.84 ? 150 LEU A CA 1 150 . A ATOM 1196 C C . LEU A 1 150 ? -3.278 17.671 14.335 1.0 6.31 ? 150 LEU A C 1 150 . A ATOM 1197 O O . LEU A 1 150 ? -3.978 18.607 13.930 1.0 7.03 ? 150 LEU A O 1 150 . A ATOM 1198 C CB . LEU A 1 150 ? -1.785 19.287 15.559 1.0 6.01 ? 150 LEU A CB 1 150 . A ATOM 1199 C CG . LEU A 1 150 ? -1.117 19.655 16.880 1.0 6.15 ? 150 LEU A CG 1 150 . A ATOM 1200 C CD1 . LEU A 1 150 ? -0.247 20.905 16.705 1.0 7.38 ? 150 LEU A CD1 1 150 . A ATOM 1201 C CD2 . LEU A 1 150 ? -2.175 19.961 17.981 1.0 6.82 ? 150 LEU A CD2 1 150 . A ATOM 1202 N N . GLY A 1 151 ? -3.229 16.472 13.731 1.0 5.66 ? 151 GLY A N 1 151 . A ATOM 1203 C CA . GLY A 1 151 ? -4.104 16.147 12.603 1.0 6.98 ? 151 GLY A CA 1 151 . A ATOM 1204 C C . GLY A 1 151 ? -3.613 16.495 11.217 1.0 6.89 ? 151 GLY A C 1 151 . A ATOM 1205 O O . GLY A 1 151 ? -4.387 16.456 10.267 1.0 8.28 ? 151 GLY A O 1 151 . A ATOM 1206 N N . MET A 1 152 ? -2.348 16.849 11.068 1.0 5.97 ? 152 MET A N 1 152 . A ATOM 1207 C CA . MET A 1 152 ? -1.833 17.197 9.751 1.0 5.86 ? 152 MET A CA 1 152 . A ATOM 1208 C C . MET A 1 152 ? -1.268 16.000 9.027 1.0 6.18 ? 152 MET A C 1 152 . A ATOM 1209 O O . MET A 1 152 ? -0.638 15.134 9.648 1.0 6.58 ? 152 MET A O 1 152 . A ATOM 1210 C CB . MET A 1 152 ? -0.694 18.225 9.882 1.0 5.6 ? 152 MET A CB 1 152 . A ATOM 1211 C CG . MET A 1 152 ? -1.106 19.510 10.575 1.0 5.63 ? 152 MET A CG 1 152 . A ATOM 1212 S SD . MET A 1 152 ? 0.374 20.550 10.818 1.0 5.04 ? 152 MET A SD 1 152 . A ATOM 1213 C CE . MET A 1 152 ? -0.358 21.909 11.738 1.0 7.08 ? 152 MET A CE 1 152 . A ATOM 1214 N N . GLU A 1 153 ? -1.550 15.930 7.723 1.0 5.9 ? 153 GLU A N 1 153 . A ATOM 1215 C CA . GLU A 1 153 ? -0.920 14.948 6.842 1.0 6.02 ? 153 GLU A CA 1 153 . A ATOM 1216 C C . GLU A 1 153 ? 0.159 15.700 6.074 1.0 5.77 ? 153 GLU A C 1 153 . A ATOM 1217 O O . GLU A 1 153 ? 0.339 16.907 6.240 1.0 6.57 ? 153 GLU A O 1 153 . A ATOM 1218 C CB . GLU A 1 153 ? -1.928 14.351 5.849 1.0 7.64 ? 153 GLU A CB 1 153 . A ATOM 1219 C CG . GLU A 1 153 ? -3.101 13.620 6.527 1.0 10.83 ? 153 GLU A CG 1 153 . A ATOM 1220 C CD . GLU A 1 153 ? -2.700 12.321 7.269 1.0 13.4 ? 153 GLU A CD 1 153 . A ATOM 1221 O OE1 . GLU A 1 153 ? -1.570 11.820 7.118 1.0 16.93 ? 153 GLU A OE1 1 153 . A ATOM 1222 O OE2 . GLU A 1 153 ? -3.532 11.774 8.024 1.0 18.13 ? 153 GLU A OE2 1 153 . A ATOM 1223 N N . HIS A 1 154 ? 0.912 14.990 5.251 1.0 5.08 ? 154 HIS A N 1 154 . A ATOM 1224 C CA . HIS A 1 154 ? 1.930 15.656 4.457 1.0 3.98 ? 154 HIS A CA 1 154 . A ATOM 1225 C C . HIS A 1 154 ? 1.345 16.624 3.465 1.0 5.54 ? 154 HIS A C 1 154 . A ATOM 1226 O O . HIS A 1 154 ? 0.211 16.433 2.963 1.0 7.3 ? 154 HIS A O 1 154 . A ATOM 1227 C CB . HIS A 1 154 ? 2.766 14.630 3.667 1.0 5.18 ? 154 HIS A CB 1 154 . A ATOM 1228 C CG . HIS A 1 154 ? 3.642 13.803 4.546 1.0 5.36 ? 154 HIS A CG 1 154 . A ATOM 1229 N ND1 . HIS A 1 154 ? 4.165 12.589 4.160 1.0 6.58 ? 154 HIS A ND1 1 154 . A ATOM 1230 C CD2 . HIS A 1 154 ? 4.091 14.025 5.808 1.0 5.25 ? 154 HIS A CD2 1 154 . A ATOM 1231 C CE1 . HIS A 1 154 ? 4.895 12.091 5.147 1.0 5.73 ? 154 HIS A CE1 1 154 . A ATOM 1232 N NE2 . HIS A 1 154 ? 4.862 12.937 6.168 1.0 5.69 ? 154 HIS A NE2 1 154 . A ATOM 1233 N N . ASP A 1 155 ? 2.120 17.654 3.161 1.0 4.35 ? 155 ASP A N 1 155 . A ATOM 1234 C CA . ASP A 1 155 ? 1.733 18.624 2.141 1.0 4.65 ? 155 ASP A CA 1 155 . A ATOM 1235 C C . ASP A 1 155 ? 1.546 17.869 0.816 1.0 5.2 ? 155 ASP A C 1 155 . A ATOM 1236 O O . ASP A 1 155 ? 2.265 16.944 0.497 1.0 5.75 ? 155 ASP A O 1 155 . A ATOM 1237 C CB . ASP A 1 155 ? 2.812 19.707 2.022 1.0 4.82 ? 155 ASP A CB 1 155 . A ATOM 1238 C CG . ASP A 1 155 ? 2.826 20.625 3.221 1.0 4.54 ? 155 ASP A CG 1 155 . A ATOM 1239 O OD1 . ASP A 1 155 ? 1.776 20.757 3.888 1.0 5.57 ? 155 ASP A OD1 1 155 . A ATOM 1240 O OD2 . ASP A 1 155 ? 3.898 21.219 3.460 1.0 5.44 ? 155 ASP A OD2 1 155 . A ATOM 1241 N N . ASP A 1 156 ? 0.575 18.328 0.029 1.0 4.38 ? 156 ASP A N 1 156 . A ATOM 1242 C CA . ASP A 1 156 ? 0.187 17.706 -1.251 1.0 4.93 ? 156 ASP A CA 1 156 . A ATOM 1243 C C . ASP A 1 156 ? 0.047 18.846 -2.257 1.0 5.28 ? 156 ASP A C 1 156 . A ATOM 1244 O O . ASP A 1 156 ? -0.652 19.828 -1.968 1.0 4.92 ? 156 ASP A O 1 156 . A ATOM 1245 C CB . ASP A 1 156 ? -1.140 16.974 -1.013 1.0 6.52 ? 156 ASP A CB 1 156 . A ATOM 1246 C CG . ASP A 1 156 ? -1.724 16.334 -2.297 1.0 8.44 ? 156 ASP A CG 1 156 . A ATOM 1247 O OD1 . ASP A 1 156 ? -2.169 17.069 -3.179 1.0 9.92 ? 156 ASP A OD1 1 156 . A ATOM 1248 O OD2 . ASP A 1 156 ? -1.786 15.101 -2.436 1.0 8.39 ? 156 ASP A OD2 1 156 . A ATOM 1249 N N . LYS A 1 157 ? 0.748 18.724 -3.387 1.0 5.6 ? 157 LYS A N 1 157 . A ATOM 1250 C CA . LYS A 1 157 ? 0.759 19.771 -4.409 1.0 6.04 ? 157 LYS A CA 1 157 . A ATOM 1251 C C . LYS A 1 157 ? -0.601 20.155 -4.966 1.0 6.1 ? 157 LYS A C 1 157 . A ATOM 1252 O O . LYS A 1 157 ? -0.781 21.283 -5.410 1.0 7.94 ? 157 LYS A O 1 157 . A ATOM 1253 C CB . LYS A 1 157 ? 1.706 19.376 -5.546 1.0 8.27 ? 157 LYS A CB 1 157 . A ATOM 1254 C CG . LYS A 1 157 ? 3.156 19.322 -5.146 1.0 11.97 ? 157 LYS A CG 1 157 . A ATOM 1255 C CD . LYS A 1 157 ? 3.577 20.668 -4.565 1.0 15.97 ? 157 LYS A CD 1 157 . A ATOM 1256 C CE . LYS A 1 157 ? 3.453 21.761 -5.585 1.0 18.91 ? 157 LYS A CE 1 157 . A ATOM 1257 N NZ . LYS A 1 157 ? 2.091 21.953 -6.162 1.0 23.3 ? 157 LYS A NZ 1 157 . A ATOM 1258 N N . ASP A 1 158 ? -1.539 19.226 -4.980 1.0 5.57 ? 158 ASP A N 1 158 . A ATOM 1259 C CA . ASP A 1 158 ? -2.876 19.587 -5.447 1.0 7.33 ? 158 ASP A CA 1 158 . A ATOM 1260 C C . ASP A 1 158 ? -3.594 20.487 -4.459 1.0 7.76 ? 158 ASP A C 1 158 . A ATOM 1261 O O . ASP A 1 158 ? -4.455 21.240 -4.855 1.0 8.49 ? 158 ASP A O 1 158 . A ATOM 1262 C CB . ASP A 1 158 ? -3.714 18.346 -5.701 1.0 7.84 ? 158 ASP A CB 1 158 . A ATOM 1263 C CG . ASP A 1 158 ? -3.133 17.479 -6.753 1.0 9.4 ? 158 ASP A CG 1 158 . A ATOM 1264 O OD1 . ASP A 1 158 ? -2.901 18.003 -7.866 1.0 13.22 ? 158 ASP A OD1 1 158 . A ATOM 1265 O OD2 . ASP A 1 158 ? -2.877 16.294 -6.482 1.0 8.93 ? 158 ASP A OD2 1 158 . A ATOM 1266 N N . LYS A 1 159 ? -3.226 20.447 -3.188 1.0 6.85 ? 159 LYS A N 1 159 . A ATOM 1267 C CA . LYS A 1 159 ? -3.876 21.251 -2.155 1.0 6.8 ? 159 LYS A CA 1 159 . A ATOM 1268 C C . LYS A 1 159 ? -3.159 22.534 -1.822 1.0 6.65 ? 159 LYS A C 1 159 . A ATOM 1269 O O . LYS A 1 159 ? -3.816 23.517 -1.472 1.0 8.73 ? 159 LYS A O 1 159 . A ATOM 1270 C CB . LYS A 1 159 ? -4.045 20.399 -0.907 1.0 7.54 ? 159 LYS A CB 1 159 . A ATOM 1271 C CG . LYS A 1 159 ? -5.133 19.356 -1.069 1.0 8.92 ? 159 LYS A CG 1 159 . A ATOM 1272 C CD . LYS A 1 159 ? -5.120 18.323 0.093 1.0 11.35 ? 159 LYS A CD 1 159 . A ATOM 1273 C CE . LYS A 1 159 ? -5.200 18.972 1.472 1.0 14.23 ? 159 LYS A CE 1 159 . A ATOM 1274 N NZ . LYS A 1 159 ? -6.535 19.554 1.825 1.0 17.1 ? 159 LYS A NZ 1 159 . A ATOM 1275 N N . CYS A 1 160 ? -1.839 22.556 -1.903 1.0 5.2 ? 160 CYS A N 1 160 . A ATOM 1276 C CA . CYS A 1 160 ? -1.092 23.791 -1.614 1.0 6.68 ? 160 CYS A CA 1 160 . A ATOM 1277 C C . CYS A 1 160 ? 0.251 23.718 -2.343 1.0 6.52 ? 160 CYS A C 1 160 . A ATOM 1278 O O . CYS A 1 160 ? 0.765 22.654 -2.631 1.0 7.49 ? 160 CYS A O 1 160 . A ATOM 1279 C CB . CYS A 1 160 ? -0.917 23.983 -0.068 1.0 7.23 ? 160 CYS A CB 1 160 . A ATOM 1280 S SG . CYS A 1 160 ? 0.088 22.680 0.718 1.0 9.88 ? 160 CYS A SG 1 160 . A ATOM 1281 N N . LYS A 1 161 ? 0.866 24.860 -2.571 1.0 7.49 ? 161 LYS A N 1 161 . A ATOM 1282 C CA . LYS A 1 161 ? 2.050 24.837 -3.376 1.0 9.38 ? 161 LYS A CA 1 161 . A ATOM 1283 C C . LYS A 1 161 ? 3.406 24.800 -2.669 1.0 8.99 ? 161 LYS A C 1 161 . A ATOM 1284 O O . LYS A 1 161 ? 4.402 24.522 -3.304 1.0 9.8 ? 161 LYS A O 1 161 . A ATOM 1285 C CB . LYS A 1 161 ? 1.936 25.995 -4.369 1.0 11.7 ? 161 LYS A CB 1 161 . A ATOM 1286 C CG . LYS A 1 161 ? 0.663 25.892 -5.294 1.0 12.93 ? 161 LYS A CG 1 161 . A ATOM 1287 C CD . LYS A 1 161 ? 0.469 24.493 -5.979 1.0 14.46 ? 161 LYS A CD 1 161 . A ATOM 1288 C CE . LYS A 1 161 ? -0.785 24.458 -6.894 1.0 15.43 ? 161 LYS A CE 1 161 . A ATOM 1289 N NZ . LYS A 1 161 ? -1.161 23.057 -7.442 1.0 14.61 ? 161 LYS A NZ 1 161 . A ATOM 1290 N N . CYS A 1 162 ? 3.433 25.022 -1.356 1.0 8.79 ? 162 CYS A N 1 162 . A ATOM 1291 C CA . CYS A 1 162 ? 4.724 25.045 -0.659 1.0 9.34 ? 162 CYS A CA 1 162 . A ATOM 1292 C C . CYS A 1 162 ? 5.556 23.797 -0.858 1.0 8.98 ? 162 CYS A C 1 162 . A ATOM 1293 O O . CYS A 1 162 ? 5.038 22.706 -0.726 1.0 10.39 ? 162 CYS A O 1 162 . A ATOM 1294 C CB . CYS A 1 162 ? 4.495 25.250 0.829 1.0 9.22 ? 162 CYS A CB 1 162 . A ATOM 1295 S SG . CYS A 1 162 ? 6.064 25.585 1.679 1.0 9.84 ? 162 CYS A SG 1 162 . A ATOM 1296 N N . THR A 1 163 ? 6.856 23.944 -1.146 1.0 9.81 ? 163 THR A N 1 163 . A ATOM 1297 C CA . THR A 1 163 ? 7.726 22.777 -1.344 1.0 11.75 ? 163 THR A CA 1 163 . A ATOM 1298 C C . THR A 1 163 ? 8.692 22.438 -0.191 1.0 10.81 ? 163 THR A C 1 163 . A ATOM 1299 O O . THR A 1 163 ? 9.242 21.337 -0.155 1.0 13.74 ? 163 THR A O 1 163 . A ATOM 1300 C CB . THR A 1 163 ? 8.602 22.917 -2.602 1.0 13.01 ? 163 THR A CB 1 163 . A ATOM 1301 O OG1 . THR A 1 163 ? 9.302 24.168 -2.543 1.0 16.97 ? 163 THR A OG1 1 163 . A ATOM 1302 C CG2 . THR A 1 163 ? 7.766 22.776 -3.886 1.0 16.07 ? 163 THR A CG2 1 163 . A ATOM 1303 N N . THR A 1 164 ? 8.886 23.371 0.730 1.0 9.05 ? 164 THR A N 1 164 . A ATOM 1304 C CA . THR A 1 164 ? 9.833 23.176 1.835 1.0 8.52 ? 164 THR A CA 1 164 . A ATOM 1305 C C . THR A 1 164 ? 9.226 23.480 3.201 1.0 7.66 ? 164 THR A C 1 164 . A ATOM 1306 O O . THR A 1 164 ? 9.955 23.710 4.198 1.0 7.54 ? 164 THR A O 1 164 . A ATOM 1307 C CB . THR A 1 164 ? 11.097 24.071 1.671 1.0 9.22 ? 164 THR A CB 1 164 . A ATOM 1308 O OG1 . THR A 1 164 ? 10.717 25.452 1.680 1.0 12.37 ? 164 THR A OG1 1 164 . A ATOM 1309 C CG2 . THR A 1 164 ? 11.840 23.742 0.359 1.0 10.35 ? 164 THR A CG2 1 164 . A ATOM 1310 N N . CYS A 1 165 ? 7.905 23.436 3.292 1.0 5.5 ? 165 CYS A N 1 165 . A ATOM 1311 C CA . CYS A 1 165 ? 7.226 23.710 4.553 1.0 4.95 ? 165 CYS A CA 1 165 . A ATOM 1312 C C . CYS A 1 165 ? 7.384 22.540 5.520 1.0 3.98 ? 165 CYS A C 1 165 . A ATOM 1313 O O . CYS A 1 165 ? 7.796 21.455 5.132 1.0 4.6 ? 165 CYS A O 1 165 . A ATOM 1314 C CB . CYS A 1 165 ? 5.768 24.055 4.297 1.0 4.76 ? 165 CYS A CB 1 165 . A ATOM 1315 S SG . CYS A 1 165 ? 5.580 25.756 3.643 1.0 6.83 ? 165 CYS A SG 1 165 . A ATOM 1316 N N . ILE A 1 166 ? 7.040 22.777 6.783 1.0 4.08 ? 166 ILE A N 1 166 . A ATOM 1317 C CA . ILE A 1 166 ? 7.267 21.796 7.823 1.0 3.76 ? 166 ILE A CA 1 166 . A ATOM 1318 C C . ILE A 1 166 ? 6.709 20.407 7.517 1.0 4.34 ? 166 ILE A C 1 166 . A ATOM 1319 O O . ILE A 1 166 ? 7.399 19.448 7.792 1.0 4.15 ? 166 ILE A O 1 166 . A ATOM 1320 C CB . ILE A 1 166 ? 6.680 22.330 9.153 1.0 3.58 ? 166 ILE A CB 1 166 . A ATOM 1321 C CG1 . ILE A 1 166 ? 7.500 23.551 9.613 1.0 4.17 ? 166 ILE A CG1 1 166 . A ATOM 1322 C CG2 . ILE A 1 166 ? 6.725 21.230 10.254 1.0 4.71 ? 166 ILE A CG2 1 166 . A ATOM 1323 C CD1 . ILE A 1 166 ? 6.782 24.401 10.694 1.0 5.21 ? 166 ILE A CD1 1 166 . A ATOM 1324 N N . MET A 1 167 ? 5.501 20.329 6.941 1.0 3.32 ? 167 MET A N 1 167 . A ATOM 1325 C CA . MET A 1 167 ? 4.894 19.027 6.635 1.0 4.46 ? 167 MET A CA 1 167 . A ATOM 1326 C C . MET A 1 167 ? 5.232 18.499 5.249 1.0 4.39 ? 167 MET A C 1 167 . A ATOM 1327 O O . MET A 1 167 ? 4.495 17.662 4.708 1.0 4.68 ? 167 MET A O 1 167 . A ATOM 1328 C CB . MET A 1 167 ? 3.382 19.084 6.847 1.0 3.98 ? 167 MET A CB 1 167 . A ATOM 1329 C CG . MET A 1 167 ? 3.004 19.451 8.311 1.0 4.0 ? 167 MET A CG 1 167 . A ATOM 1330 S SD . MET A 1 167 ? 3.742 18.440 9.605 1.0 4.27 ? 167 MET A SD 1 167 . A ATOM 1331 C CE . MET A 1 167 ? 3.154 16.796 9.137 1.0 6.21 ? 167 MET A CE 1 167 . A ATOM 1332 N N . SER A 1 168 ? 6.354 18.938 4.668 1.0 3.71 ? 168 SER A N 1 168 . A ATOM 1333 C CA . SER A 1 168 ? 6.782 18.367 3.385 1.0 4.11 ? 168 SER A CA 1 168 . A ATOM 1334 C C . SER A 1 168 ? 6.947 16.866 3.589 1.0 5.36 ? 168 SER A C 1 168 . A ATOM 1335 O O . SER A 1 168 ? 7.293 16.389 4.677 1.0 5.14 ? 168 SER A O 1 168 . A ATOM 1336 C CB . SER A 1 168 ? 8.089 19.019 2.919 1.0 4.77 ? 168 SER A CB 1 168 . A ATOM 1337 O OG . SER A 1 168 ? 9.148 18.812 3.837 1.0 7.24 ? 168 SER A OG 1 168 . A ATOM 1338 N N . ALA A 1 169 ? 6.718 16.118 2.511 1.0 6.68 ? 169 ALA A N 1 169 . A ATOM 1339 C CA . ALA A 1 169 ? 6.830 14.673 2.610 1.0 7.31 ? 169 ALA A CA 1 169 . A ATOM 1340 C C . ALA A 1 169 ? 8.220 14.157 3.016 1.0 7.01 ? 169 ALA A C 1 169 . A ATOM 1341 O O . ALA A 1 169 ? 8.333 13.106 3.636 1.0 7.2 ? 169 ALA A O 1 169 . A ATOM 1342 C CB . ALA A 1 169 ? 6.388 14.057 1.275 1.0 7.83 ? 169 ALA A CB 1 169 . A ATOM 1343 N N . VAL A 1 170 ? 9.257 14.897 2.645 1.0 6.21 ? 170 VAL A N 1 170 . A ATOM 1344 C CA . VAL A 1 170 ? 10.635 14.585 2.964 1.0 7.51 ? 170 VAL A CA 1 170 . A ATOM 1345 C C . VAL A 1 170 ? 11.332 15.853 3.422 1.0 6.73 ? 170 VAL A C 1 170 . A ATOM 1346 O O . VAL A 1 170 ? 11.066 16.928 2.912 1.0 7.68 ? 170 VAL A O 1 170 . A ATOM 1347 C CB . VAL A 1 170 ? 11.355 14.052 1.724 1.0 8.04 ? 170 VAL A CB 1 170 . A ATOM 1348 C CG1 . VAL A 1 170 ? 12.686 13.448 2.114 1.0 9.63 ? 170 VAL A CG1 1 170 . A ATOM 1349 C CG2 . VAL A 1 170 ? 10.415 13.094 1.034 1.0 11.17 ? 170 VAL A CG2 1 170 . A ATOM 1350 N N . ILE A 1 171 ? 12.224 15.702 4.390 1.0 5.98 ? 171 ILE A N 1 171 . A ATOM 1351 C CA . ILE A 1 171 ? 13.010 16.815 4.877 1.0 6.34 ? 171 ILE A CA 1 171 . A ATOM 1352 C C . ILE A 1 171 ? 14.107 17.124 3.849 1.0 6.69 ? 171 ILE A C 1 171 . A ATOM 1353 O O . ILE A 1 171 ? 14.488 16.257 3.038 1.0 7.85 ? 171 ILE A O 1 171 . A ATOM 1354 C CB . ILE A 1 171 ? 13.692 16.437 6.263 1.0 5.52 ? 171 ILE A CB 1 171 . A ATOM 1355 C CG1 . ILE A 1 171 ? 14.206 17.690 6.980 1.0 6.02 ? 171 ILE A CG1 1 171 . A ATOM 1356 C CG2 . ILE A 1 171 ? 14.839 15.460 6.052 1.0 7.15 ? 171 ILE A CG2 1 171 . A ATOM 1357 C CD1 . ILE A 1 171 ? 14.687 17.407 8.444 1.0 7.26 ? 171 ILE A CD1 1 171 . A ATOM 1358 N N . SER A 1 172 ? 14.622 18.348 3.875 1.0 6.82 ? 172 SER A N 1 172 . A ATOM 1359 C CA . SER A 1 172 ? 15.771 18.716 3.040 1.0 7.45 ? 172 SER A CA 1 172 . A ATOM 1360 C C . SER A 1 172 ? 16.605 19.769 3.753 1.0 8.24 ? 172 SER A C 1 172 . A ATOM 1361 O O . SER A 1 172 ? 16.191 20.342 4.767 1.0 8.04 ? 172 SER A O 1 172 . A ATOM 1362 C CB . SER A 1 172 ? 15.358 19.252 1.662 1.0 7.65 ? 172 SER A CB 1 172 . A ATOM 1363 O OG . SER A 1 172 ? 14.958 20.614 1.765 1.0 9.67 ? 172 SER A OG 1 172 . A ATOM 1364 N N . ASP A 1 173 ? 17.783 20.034 3.210 1.0 9.85 ? 173 ASP A N 1 173 . A ATOM 1365 C CA . ASP A 1 173 ? 18.663 21.022 3.789 1.0 10.76 ? 173 ASP A CA 1 173 . A ATOM 1366 C C . ASP A 1 173 ? 18.138 22.448 3.617 1.0 10.99 ? 173 ASP A C 1 173 . A ATOM 1367 O O . ASP A 1 173 ? 18.680 23.368 4.199 1.0 13.29 ? 173 ASP A O 1 173 . A ATOM 1368 C CB . ASP A 1 173 ? 20.078 20.841 3.212 1.0 12.55 ? 173 ASP A CB 1 173 . A ATOM 1369 C CG . ASP A 1 173 ? 20.189 21.235 1.756 1.0 14.01 ? 173 ASP A CG 1 173 . A ATOM 1370 O OD1 . ASP A 1 173 ? 19.176 21.310 1.035 1.0 15.66 ? 173 ASP A OD1 1 173 . A ATOM 1371 O OD2 . ASP A 1 173 ? 21.341 21.477 1.303 1.0 17.25 ? 173 ASP A OD2 1 173 . A ATOM 1372 N N . LYS A 1 174 ? 17.057 22.618 2.870 1.0 10.53 ? 174 LYS A N 1 174 . A ATOM 1373 C CA . LYS A 1 174 ? 16.463 23.936 2.681 1.0 11.79 ? 174 LYS A CA 1 174 . A ATOM 1374 C C . LYS A 1 174 ? 15.139 24.015 3.444 1.0 9.92 ? 174 LYS A C 1 174 . A ATOM 1375 O O . LYS A 1 174 ? 14.318 24.873 3.156 1.0 9.83 ? 174 LYS A O 1 174 . A ATOM 1376 C CB . LYS A 1 174 ? 16.203 24.193 1.196 1.0 14.64 ? 174 LYS A CB 1 174 . A ATOM 1377 C CG . LYS A 1 174 ? 17.391 23.904 0.270 1.0 19.49 ? 174 LYS A CG 1 174 . A ATOM 1378 C CD . LYS A 1 174 ? 18.560 24.804 0.597 1.0 21.56 ? 174 LYS A CD 1 174 . A ATOM 1379 C CE . LYS A 1 174 ? 18.945 25.659 -0.613 1.0 23.46 ? 174 LYS A CE 1 174 . A ATOM 1380 N NZ . LYS A 1 174 ? 19.739 26.865 -0.197 1.0 23.87 ? 174 LYS A NZ 1 174 . A ATOM 1381 N N . GLN A 1 175 ? 14.947 23.104 4.399 1.0 8.65 ? 175 GLN A N 1 175 . A ATOM 1382 C CA . GLN A 1 175 ? 13.696 23.086 5.173 1.0 7.86 ? 175 GLN A CA 1 175 . A ATOM 1383 C C . GLN A 1 175 ? 13.350 24.467 5.716 1.0 7.76 ? 175 GLN A C 1 175 . A ATOM 1384 O O . GLN A 1 175 ? 14.201 25.139 6.327 1.0 8.25 ? 175 GLN A O 1 175 . A ATOM 1385 C CB . GLN A 1 175 ? 13.782 22.095 6.355 1.0 7.11 ? 175 GLN A CB 1 175 . A ATOM 1386 C CG . GLN A 1 175 ? 12.423 21.602 6.781 1.0 7.07 ? 175 GLN A CG 1 175 . A ATOM 1387 C CD . GLN A 1 175 ? 11.773 20.752 5.718 1.0 6.43 ? 175 GLN A CD 1 175 . A ATOM 1388 O OE1 . GLN A 1 175 ? 12.454 20.050 5.008 1.0 7.67 ? 175 GLN A OE1 1 175 . A ATOM 1389 N NE2 . GLN A 1 175 ? 10.441 20.797 5.620 1.0 8.54 ? 175 GLN A NE2 1 175 . A ATOM 1390 N N . SER A 1 176 ? 12.111 24.907 5.504 1.0 7.46 ? 176 SER A N 1 176 . A ATOM 1391 C CA . SER A 1 176 ? 11.700 26.197 6.038 1.0 7.78 ? 176 SER A CA 1 176 . A ATOM 1392 C C . SER A 1 176 ? 11.041 25.996 7.406 1.0 7.91 ? 176 SER A C 1 176 . A ATOM 1393 O O . SER A 1 176 ? 10.702 24.866 7.805 1.0 8.84 ? 176 SER A O 1 176 . A ATOM 1394 C CB . SER A 1 176 ? 10.742 26.887 5.070 1.0 11.47 ? 176 SER A CB 1 176 . A ATOM 1395 O OG . SER A 1 176 ? 9.431 26.576 5.377 1.0 12.87 ? 176 SER A OG 1 176 . A ATOM 1396 N N . LYS A 1 177 ? 10.834 27.102 8.107 1.0 6.79 ? 177 LYS A N 1 177 . A ATOM 1397 C CA . LYS A 1 177 ? 10.222 27.055 9.423 1.0 6.84 ? 177 LYS A CA 1 177 . A ATOM 1398 C C . LYS A 1 177 ? 8.729 27.353 9.336 1.0 6.24 ? 177 LYS A C 1 177 . A ATOM 1399 O O . LYS A 1 177 ? 8.096 27.563 10.371 1.0 6.93 ? 177 LYS A O 1 177 . A ATOM 1400 C CB . LYS A 1 177 ? 10.902 28.078 10.328 1.0 8.49 ? 177 LYS A CB 1 177 . A ATOM 1401 C CG . LYS A 1 177 ? 10.638 29.486 9.955 1.0 10.36 ? 177 LYS A CG 1 177 . A ATOM 1402 C CD . LYS A 1 177 ? 11.259 30.353 11.056 1.0 12.45 ? 177 LYS A CD 1 177 . A ATOM 1403 C CE . LYS A 1 177 ? 11.004 31.818 10.831 1.0 13.8 ? 177 LYS A CE 1 177 . A ATOM 1404 N NZ . LYS A 1 177 ? 11.547 32.579 12.031 1.0 11.9 ? 177 LYS A NZ 1 177 . A ATOM 1405 N N . LEU A 1 178 ? 8.166 27.381 8.128 1.0 5.32 ? 178 LEU A N 1 178 . A ATOM 1406 C CA . LEU A 1 178 ? 6.744 27.684 7.943 1.0 5.55 ? 178 LEU A CA 1 178 . A ATOM 1407 C C . LEU A 1 178 ? 5.842 26.486 7.694 1.0 4.92 ? 178 LEU A C 1 178 . A ATOM 1408 O O . LEU A 1 178 ? 6.237 25.490 7.069 1.0 5.13 ? 178 LEU A O 1 178 . A ATOM 1409 C CB . LEU A 1 178 ? 6.551 28.640 6.746 1.0 6.85 ? 178 LEU A CB 1 178 . A ATOM 1410 C CG . LEU A 1 178 ? 7.262 29.983 6.884 1.0 7.82 ? 178 LEU A CG 1 178 . A ATOM 1411 C CD1 . LEU A 1 178 ? 7.048 30.765 5.575 1.0 9.6 ? 178 LEU A CD1 1 178 . A ATOM 1412 C CD2 . LEU A 1 178 ? 6.719 30.758 8.061 1.0 10.77 ? 178 LEU A CD2 1 178 . A ATOM 1413 N N . PHE A 1 179 ? 4.629 26.582 8.229 1.0 4.61 ? 179 PHE A N 1 179 . A ATOM 1414 C CA . PHE A 1 179 ? 3.579 25.602 7.935 1.0 5.5 ? 179 PHE A CA 1 179 . A ATOM 1415 C C . PHE A 1 179 ? 2.907 26.097 6.652 1.0 6.11 ? 179 PHE A C 1 179 . A ATOM 1416 O O . PHE A 1 179 ? 2.638 27.296 6.472 1.0 6.83 ? 179 PHE A O 1 179 . A ATOM 1417 C CB . PHE A 1 179 ? 2.520 25.564 9.043 1.0 5.65 ? 179 PHE A CB 1 179 . A ATOM 1418 C CG . PHE A 1 179 ? 2.921 24.768 10.226 1.0 4.25 ? 179 PHE A CG 1 179 . A ATOM 1419 C CD1 . PHE A 1 179 ? 2.966 23.366 10.155 1.0 5.09 ? 179 PHE A CD1 1 179 . A ATOM 1420 C CD2 . PHE A 1 179 ? 3.287 25.390 11.420 1.0 6.26 ? 179 PHE A CD2 1 179 . A ATOM 1421 C CE1 . PHE A 1 179 ? 3.366 22.605 11.256 1.0 6.19 ? 179 PHE A CE1 1 179 . A ATOM 1422 C CE2 . PHE A 1 179 ? 3.688 24.640 12.509 1.0 6.39 ? 179 PHE A CE2 1 179 . A ATOM 1423 C CZ . PHE A 1 179 ? 3.728 23.257 12.440 1.0 6.98 ? 179 PHE A CZ 1 179 . A ATOM 1424 N N . SER A 1 180 ? 2.615 25.160 5.760 1.0 5.22 ? 180 SER A N 1 180 . A ATOM 1425 C CA . SER A 1 180 ? 1.913 25.450 4.509 1.0 5.23 ? 180 SER A CA 1 180 . A ATOM 1426 C C . SER A 1 180 ? 0.428 25.753 4.753 1.0 5.2 ? 180 SER A C 1 180 . A ATOM 1427 O O . SER A 1 180 ? -0.121 25.558 5.849 1.0 5.27 ? 180 SER A O 1 180 . A ATOM 1428 C CB . SER A 1 180 ? 1.978 24.221 3.628 1.0 4.33 ? 180 SER A CB 1 180 . A ATOM 1429 O OG . SER A 1 180 ? 1.084 23.249 4.157 1.0 4.92 ? 180 SER A OG 1 180 . A ATOM 1430 N N . ASP A 1 181 ? -0.259 26.140 3.678 1.0 5.85 ? 181 ASP A N 1 181 . A ATOM 1431 C CA . ASP A 1 181 ? -1.703 26.357 3.782 1.0 6.34 ? 181 ASP A CA 1 181 . A ATOM 1432 C C . ASP A 1 181 ? -2.385 25.002 3.978 1.0 5.71 ? 181 ASP A C 1 181 . A ATOM 1433 O O . ASP A 1 181 ? -3.418 24.936 4.612 1.0 6.88 ? 181 ASP A O 1 181 . A ATOM 1434 C CB . ASP A 1 181 ? -2.303 26.992 2.513 1.0 9.39 ? 181 ASP A CB 1 181 . A ATOM 1435 C CG . ASP A 1 181 ? -3.844 27.201 2.639 1.0 12.62 ? 181 ASP A CG 1 181 . A ATOM 1436 O OD1 . ASP A 1 181 ? -4.267 27.912 3.590 1.0 17.07 ? 181 ASP A OD1 1 181 . A ATOM 1437 O OD2 . ASP A 1 181 ? -4.635 26.648 1.831 1.0 16.36 ? 181 ASP A OD2 1 181 . A ATOM 1438 N N . CYS A 1 182 ? -1.807 23.919 3.462 1.0 6.02 ? 182 CYS A N 1 182 . A ATOM 1439 C CA . CYS A 1 182 ? -2.399 22.597 3.653 1.0 6.57 ? 182 CYS A CA 1 182 . A ATOM 1440 C C . CYS A 1 182 ? -2.430 22.300 5.163 1.0 5.32 ? 182 CYS A C 1 182 . A ATOM 1441 O O . CYS A 1 182 ? -3.410 21.813 5.707 1.0 5.43 ? 182 CYS A O 1 182 . A ATOM 1442 C CB . CYS A 1 182 ? -1.505 21.507 3.069 1.0 7.75 ? 182 CYS A CB 1 182 . A ATOM 1443 S SG . CYS A 1 182 ? -1.340 21.255 1.261 1.0 11.2 ? 182 CYS A SG 1 182 . A ATOM 1444 N N . SER A 1 183 ? -1.297 22.569 5.817 1.0 4.38 ? 183 SER A N 1 183 . A ATOM 1445 C CA . SER A 1 183 ? -1.151 22.307 7.252 1.0 4.85 ? 183 SER A CA 1 183 . A ATOM 1446 C C . SER A 1 183 ? -2.067 23.160 8.101 1.0 4.84 ? 183 SER A C 1 183 . A ATOM 1447 O O . SER A 1 183 ? -2.691 22.663 9.044 1.0 5.52 ? 183 SER A O 1 183 . A ATOM 1448 C CB . SER A 1 183 ? 0.299 22.582 7.658 1.0 5.41 ? 183 SER A CB 1 183 . A ATOM 1449 O OG . SER A 1 183 ? 1.158 21.637 7.039 1.0 5.06 ? 183 SER A OG 1 183 . A ATOM 1450 N N . LYS A 1 184 ? -2.161 24.447 7.771 1.0 5.13 ? 184 LYS A N 1 184 . A ATOM 1451 C CA . LYS A 1 184 ? -3.038 25.328 8.537 1.0 5.8 ? 184 LYS A CA 1 184 . A ATOM 1452 C C . LYS A 1 184 ? -4.479 24.862 8.365 1.0 6.54 ? 184 LYS A C 1 184 . A ATOM 1453 O O . LYS A 1 184 ? -5.223 24.850 9.328 1.0 7.3 ? 184 LYS A O 1 184 . A ATOM 1454 C CB . LYS A 1 184 ? -2.832 26.776 8.095 1.0 7.08 ? 184 LYS A CB 1 184 . A ATOM 1455 C CG . LYS A 1 184 ? -1.467 27.303 8.484 1.0 7.58 ? 184 LYS A CG 1 184 . A ATOM 1456 C CD . LYS A 1 184 ? -1.298 28.717 7.966 1.0 10.8 ? 184 LYS A CD 1 184 . A ATOM 1457 C CE . LYS A 1 184 ? 0.036 29.221 8.382 1.0 11.88 ? 184 LYS A CE 1 184 . A ATOM 1458 N NZ . LYS A 1 184 ? 0.146 30.648 7.986 1.0 15.78 ? 184 LYS A NZ 1 184 . A ATOM 1459 N N . ASP A 1 185 ? -4.859 24.447 7.150 1.0 6.19 ? 185 ASP A N 1 185 . A ATOM 1460 C CA . ASP A 1 185 ? -6.232 23.969 6.950 1.0 6.79 ? 185 ASP A CA 1 185 . A ATOM 1461 C C . ASP A 1 185 ? -6.472 22.678 7.751 1.0 6.5 ? 185 ASP A C 1 185 . A ATOM 1462 O O . ASP A 1 185 ? -7.545 22.499 8.309 1.0 8.02 ? 185 ASP A O 1 185 . A ATOM 1463 C CB . ASP A 1 185 ? -6.504 23.736 5.462 1.0 7.65 ? 185 ASP A CB 1 185 . A ATOM 1464 C CG . ASP A 1 185 ? -6.612 25.018 4.678 1.0 9.61 ? 185 ASP A CG 1 185 . A ATOM 1465 O OD1 . ASP A 1 185 ? -6.508 26.104 5.264 1.0 10.64 ? 185 ASP A OD1 1 185 . A ATOM 1466 O OD2 . ASP A 1 185 ? -6.785 24.946 3.436 1.0 9.6 ? 185 ASP A OD2 1 185 . A ATOM 1467 N N . TYR A 1 186 ? -5.497 21.761 7.784 1.0 6.08 ? 186 TYR A N 1 186 . A ATOM 1468 C CA . TYR A 1 186 ? -5.631 20.551 8.600 1.0 6.04 ? 186 TYR A CA 1 186 . A ATOM 1469 C C . TYR A 1 186 ? -5.826 20.909 10.063 1.0 6.17 ? 186 TYR A C 1 186 . A ATOM 1470 O O . TYR A 1 186 ? -6.601 20.262 10.760 1.0 7.2 ? 186 TYR A O 1 186 . A ATOM 1471 C CB . TYR A 1 186 ? -4.390 19.641 8.525 1.0 6.07 ? 186 TYR A CB 1 186 . A ATOM 1472 C CG . TYR A 1 186 ? -4.336 18.732 7.300 1.0 6.93 ? 186 TYR A CG 1 186 . A ATOM 1473 C CD1 . TYR A 1 186 ? -3.240 18.759 6.445 1.0 6.86 ? 186 TYR A CD1 1 186 . A ATOM 1474 C CD2 . TYR A 1 186 ? -5.396 17.848 7.003 1.0 8.07 ? 186 TYR A CD2 1 186 . A ATOM 1475 C CE1 . TYR A 1 186 ? -3.183 17.946 5.323 1.0 7.02 ? 186 TYR A CE1 1 186 . A ATOM 1476 C CE2 . TYR A 1 186 ? -5.339 17.036 5.874 1.0 9.06 ? 186 TYR A CE2 1 186 . A ATOM 1477 C CZ . TYR A 1 186 ? -4.241 17.095 5.049 1.0 7.77 ? 186 TYR A CZ 1 186 . A ATOM 1478 O OH . TYR A 1 186 ? -4.172 16.337 3.901 1.0 10.67 ? 186 TYR A OH 1 186 . A ATOM 1479 N N . TYR A 1 187 ? -5.100 21.916 10.544 1.0 6.03 ? 187 TYR A N 1 187 . A ATOM 1480 C CA . TYR A 1 187 ? -5.232 22.323 11.939 1.0 7.59 ? 187 TYR A CA 1 187 . A ATOM 1481 C C . TYR A 1 187 ? -6.620 22.894 12.199 1.0 7.83 ? 187 TYR A C 1 187 . A ATOM 1482 O O . TYR A 1 187 ? -7.203 22.617 13.255 1.0 7.8 ? 187 TYR A O 1 187 . A ATOM 1483 C CB . TYR A 1 187 ? -4.108 23.314 12.307 1.0 6.34 ? 187 TYR A CB 1 187 . A ATOM 1484 C CG . TYR A 1 187 ? -4.124 23.712 13.774 1.0 6.03 ? 187 TYR A CG 1 187 . A ATOM 1485 C CD1 . TYR A 1 187 ? -4.115 22.752 14.780 1.0 6.82 ? 187 TYR A CD1 1 187 . A ATOM 1486 C CD2 . TYR A 1 187 ? -4.155 25.053 14.134 1.0 6.21 ? 187 TYR A CD2 1 187 . A ATOM 1487 C CE1 . TYR A 1 187 ? -4.137 23.146 16.132 1.0 7.57 ? 187 TYR A CE1 1 187 . A ATOM 1488 C CE2 . TYR A 1 187 ? -4.185 25.445 15.462 1.0 7.37 ? 187 TYR A CE2 1 187 . A ATOM 1489 C CZ . TYR A 1 187 ? -4.173 24.483 16.452 1.0 7.49 ? 187 TYR A CZ 1 187 . A ATOM 1490 O OH . TYR A 1 187 ? -4.202 24.817 17.803 1.0 7.53 ? 187 TYR A OH 1 187 . A ATOM 1491 N N . GLN A 1 188 ? -7.156 23.677 11.268 1.0 8.44 ? 188 GLN A N 1 188 . A ATOM 1492 C CA . GLN A 1 188 ? -8.497 24.206 11.476 1.0 9.41 ? 188 GLN A CA 1 188 . A ATOM 1493 C C . GLN A 1 188 ? -9.481 23.037 11.583 1.0 10.19 ? 188 GLN A C 1 188 . A ATOM 1494 O O . GLN A 1 188 ? -10.377 23.041 12.440 1.0 9.87 ? 188 GLN A O 1 188 . A ATOM 1495 C CB . GLN A 1 188 ? -8.928 25.118 10.322 1.0 10.54 ? 188 GLN A CB 1 188 . A ATOM 1496 C CG . GLN A 1 188 ? -10.338 25.664 10.560 1.0 12.46 ? 188 GLN A CG 1 188 . A ATOM 1497 C CD . GLN A 1 188 ? -10.403 26.456 11.862 1.0 13.14 ? 188 GLN A CD 1 188 . A ATOM 1498 O OE1 . GLN A 1 188 ? -11.024 26.043 12.871 1.0 15.25 ? 188 GLN A OE1 1 188 . A ATOM 1499 N NE2 . GLN A 1 188 ? -9.751 27.574 11.866 1.0 13.08 ? 188 GLN A NE2 1 188 . A ATOM 1500 N N . THR A 1 189 ? -9.313 22.030 10.727 1.0 9.79 ? 189 THR A N 1 189 . A ATOM 1501 C CA . THR A 1 189 ? -10.204 20.871 10.747 1.0 9.83 ? 189 THR A CA 1 189 . A ATOM 1502 C C . THR A 1 189 ? -10.132 20.184 12.112 1.0 10.84 ? 189 THR A C 1 189 . A ATOM 1503 O O . THR A 1 189 ? -11.161 19.810 12.701 1.0 11.41 ? 189 THR A O 1 189 . A ATOM 1504 C CB . THR A 1 189 ? -9.816 19.927 9.597 1.0 10.56 ? 189 THR A CB 1 189 . A ATOM 1505 O OG1 . THR A 1 189 ? -10.112 20.585 8.347 1.0 10.12 ? 189 THR A OG1 1 189 . A ATOM 1506 C CG2 . THR A 1 189 ? -10.593 18.617 9.673 1.0 10.76 ? 189 THR A CG2 1 189 . A ATOM 1507 N N . PHE A 1 190 ? -8.910 20.018 12.618 1.0 9.77 ? 190 PHE A N 1 190 . A ATOM 1508 C CA . PHE A 1 190 ? -8.676 19.424 13.926 1.0 10.05 ? 190 PHE A CA 1 190 . A ATOM 1509 C C . PHE A 1 190 ? -9.358 20.209 15.056 1.0 9.92 ? 190 PHE A C 1 190 . A ATOM 1510 O O . PHE A 1 190 ? -10.006 19.597 15.925 1.0 9.52 ? 190 PHE A O 1 190 . A ATOM 1511 C CB . PHE A 1 190 ? -7.163 19.372 14.182 1.0 9.65 ? 190 PHE A CB 1 190 . A ATOM 1512 C CG . PHE A 1 190 ? -6.796 18.625 15.424 1.0 10.91 ? 190 PHE A CG 1 190 . A ATOM 1513 C CD1 . PHE A 1 190 ? -6.985 17.251 15.497 1.0 11.72 ? 190 PHE A CD1 1 190 . A ATOM 1514 C CD2 . PHE A 1 190 ? -6.294 19.300 16.517 1.0 12.38 ? 190 PHE A CD2 1 190 . A ATOM 1515 C CE1 . PHE A 1 190 ? -6.668 16.560 16.662 1.0 12.55 ? 190 PHE A CE1 1 190 . A ATOM 1516 C CE2 . PHE A 1 190 ? -5.976 18.595 17.698 1.0 11.87 ? 190 PHE A CE2 1 190 . A ATOM 1517 C CZ . PHE A 1 190 ? -6.166 17.240 17.754 1.0 11.81 ? 190 PHE A CZ 1 190 . A ATOM 1518 N N . LEU A 1 191 ? -9.219 21.538 15.074 1.0 10.0 ? 191 LEU A N 1 191 . A ATOM 1519 C CA . LEU A 1 191 ? -9.847 22.353 16.122 1.0 10.54 ? 191 LEU A CA 1 191 . A ATOM 1520 C C . LEU A 1 191 ? -11.365 22.292 16.035 1.0 12.26 ? 191 LEU A C 1 191 . A ATOM 1521 O O . LEU A 1 191 ? -12.057 22.386 17.054 1.0 13.04 ? 191 LEU A O 1 191 . A ATOM 1522 C CB . LEU A 1 191 ? -9.412 23.800 15.992 1.0 9.97 ? 191 LEU A CB 1 191 . A ATOM 1523 C CG . LEU A 1 191 ? -7.948 24.075 16.364 1.0 10.3 ? 191 LEU A CG 1 191 . A ATOM 1524 C CD1 . LEU A 1 191 ? -7.738 25.595 16.325 1.0 11.98 ? 191 LEU A CD1 1 191 . A ATOM 1525 C CD2 . LEU A 1 191 ? -7.659 23.534 17.775 1.0 11.37 ? 191 LEU A CD2 1 191 . A ATOM 1526 N N . THR A 1 192 ? -11.868 22.101 14.834 1.0 11.85 ? 192 THR A N 1 192 . A ATOM 1527 C CA . THR A 1 192 ? -13.305 22.025 14.608 1.0 14.45 ? 192 THR A CA 1 192 . A ATOM 1528 C C . THR A 1 192 ? -13.900 20.672 14.944 1.0 14.78 ? 192 THR A C 1 192 . A ATOM 1529 O O . THR A 1 192 ? -14.903 20.593 15.674 1.0 16.15 ? 192 THR A O 1 192 . A ATOM 1530 C CB . THR A 1 192 ? -13.619 22.346 13.160 1.0 14.66 ? 192 THR A CB 1 192 . A ATOM 1531 O OG1 . THR A 1 192 ? -13.308 23.719 12.901 1.0 15.6 ? 192 THR A OG1 1 192 . A ATOM 1532 C CG2 . THR A 1 192 ? -15.114 22.081 12.852 1.0 16.07 ? 192 THR A CG2 1 192 . A ATOM 1533 N N . ASN A 1 193 ? -13.286 19.608 14.440 1.0 14.35 ? 193 ASN A N 1 193 . A ATOM 1534 C CA . ASN A 1 193 ? -13.806 18.254 14.643 1.0 15.07 ? 193 ASN A CA 1 193 . A ATOM 1535 C C . ASN A 1 193 ? -13.394 17.549 15.917 1.0 15.44 ? 193 ASN A C 1 193 . A ATOM 1536 O O . ASN A 1 193 ? -14.159 16.757 16.452 1.0 15.93 ? 193 ASN A O 1 193 . A ATOM 1537 C CB . ASN A 1 193 ? -13.425 17.339 13.467 1.0 15.07 ? 193 ASN A CB 1 193 . A ATOM 1538 C CG . ASN A 1 193 ? -14.020 17.796 12.155 1.0 16.13 ? 193 ASN A CG 1 193 . A ATOM 1539 O OD1 . ASN A 1 193 ? -14.912 18.643 12.135 1.0 18.6 ? 193 ASN A OD1 1 193 . A ATOM 1540 N ND2 . ASN A 1 193 ? -13.524 17.247 11.057 1.0 17.66 ? 193 ASN A ND2 1 193 . A ATOM 1541 N N . ASP A 1 194 ? -12.194 17.831 16.410 1.0 14.78 ? 194 ASP A N 1 194 . A ATOM 1542 C CA . ASP A 1 194 ? -11.655 17.171 17.597 1.0 15.55 ? 194 ASP A CA 1 194 . A ATOM 1543 C C . ASP A 1 194 ? -11.615 18.099 18.809 1.0 14.89 ? 194 ASP A C 1 194 . A ATOM 1544 O O . ASP A 1 194 ? -12.129 17.754 19.871 1.0 15.32 ? 194 ASP A O 1 194 . A ATOM 1545 C CB . ASP A 1 194 ? -10.244 16.617 17.274 1.0 17.33 ? 194 ASP A CB 1 194 . A ATOM 1546 C CG . ASP A 1 194 ? -9.788 15.541 18.252 1.0 20.76 ? 194 ASP A CG 1 194 . A ATOM 1547 O OD1 . ASP A 1 194 ? -9.290 14.482 17.788 1.0 22.61 ? 194 ASP A OD1 1 194 . A ATOM 1548 O OD2 . ASP A 1 194 ? -9.913 15.741 19.480 1.0 21.12 ? 194 ASP A OD2 1 194 . A ATOM 1549 N N . ASN A 1 195 ? -10.975 19.255 18.666 1.0 14.71 ? 195 ASN A N 1 195 . A ATOM 1550 C CA . ASN A 1 195 ? -10.904 20.264 19.726 1.0 14.22 ? 195 ASN A CA 1 195 . A ATOM 1551 C C . ASN A 1 195 ? -10.605 19.656 21.097 1.0 13.58 ? 195 ASN A C 1 195 . A ATOM 1552 O O . ASN A 1 195 ? -11.393 19.817 22.043 1.0 14.68 ? 195 ASN A O 1 195 . A ATOM 1553 C CB . ASN A 1 195 ? -12.246 21.014 19.766 1.0 15.52 ? 195 ASN A CB 1 195 . A ATOM 1554 C CG . ASN A 1 195 ? -12.152 22.346 20.472 1.0 17.25 ? 195 ASN A CG 1 195 . A ATOM 1555 O OD1 . ASN A 1 195 ? -11.070 22.949 20.570 1.0 16.6 ? 195 ASN A OD1 1 195 . A ATOM 1556 N ND2 . ASN A 1 195 ? -13.298 22.845 20.947 1.0 19.07 ? 195 ASN A ND2 1 195 . A ATOM 1557 N N . PRO A 1 196 ? -9.462 18.951 21.236 1.0 12.99 ? 196 PRO A N 1 196 . A ATOM 1558 C CA . PRO A 1 196 ? -9.178 18.365 22.545 1.0 13.02 ? 196 PRO A CA 1 196 . A ATOM 1559 C C . PRO A 1 196 ? -9.038 19.392 23.652 1.0 13.14 ? 196 PRO A C 1 196 . A ATOM 1560 O O . PRO A 1 196 ? -8.498 20.480 23.474 1.0 12.08 ? 196 PRO A O 1 196 . A ATOM 1561 C CB . PRO A 1 196 ? -7.900 17.563 22.300 1.0 14.0 ? 196 PRO A CB 1 196 . A ATOM 1562 C CG . PRO A 1 196 ? -7.209 18.366 21.303 1.0 12.94 ? 196 PRO A CG 1 196 . A ATOM 1563 C CD . PRO A 1 196 ? -8.310 18.768 20.334 1.0 13.73 ? 196 PRO A CD 1 196 . A ATOM 1564 N N . GLN A 1 197 ? -9.561 19.040 24.812 1.0 13.58 ? 197 GLN A N 1 197 . A ATOM 1565 C CA . GLN A 1 197 ? -9.540 19.958 25.935 1.0 13.94 ? 197 GLN A CA 1 197 . A ATOM 1566 C C . GLN A 1 197 ? -8.197 20.310 26.556 1.0 12.68 ? 197 GLN A C 1 197 . A ATOM 1567 O O . GLN A 1 197 ? -8.009 21.430 27.026 1.0 13.07 ? 197 GLN A O 1 197 . A ATOM 1568 C CB . GLN A 1 197 ? -10.442 19.417 27.046 1.0 16.78 ? 197 GLN A CB 1 197 . A ATOM 1569 C CG . GLN A 1 197 ? -10.377 20.228 28.348 1.0 21.48 ? 197 GLN A CG 1 197 . A ATOM 1570 C CD . GLN A 1 197 ? -11.099 21.557 28.267 1.0 24.18 ? 197 GLN A CD 1 197 . A ATOM 1571 O OE1 . GLN A 1 197 ? -12.237 21.625 27.782 1.0 26.39 ? 197 GLN A OE1 1 197 . A ATOM 1572 N NE2 . GLN A 1 197 ? -10.456 22.627 28.762 1.0 25.22 ? 197 GLN A NE2 1 197 . A ATOM 1573 N N . CYS A 1 198 ? -7.243 19.381 26.541 1.0 12.05 ? 198 CYS A N 1 198 . A ATOM 1574 C CA . CYS A 1 198 ? -6.004 19.683 27.235 1.0 12.34 ? 198 CYS A CA 1 198 . A ATOM 1575 C C . CYS A 1 198 ? -5.265 20.885 26.701 1.0 12.34 ? 198 CYS A C 1 198 . A ATOM 1576 O O . CYS A 1 198 ? -4.620 21.582 27.471 1.0 12.93 ? 198 CYS A O 1 198 . A ATOM 1577 C CB . CYS A 1 198 ? -5.085 18.450 27.295 1.0 12.1 ? 198 CYS A CB 1 198 . A ATOM 1578 S SG . CYS A 1 198 ? -3.897 18.124 25.946 1.0 13.77 ? 198 CYS A SG 1 198 . A ATOM 1579 N N . ILE A 1 199 ? -5.403 21.188 25.416 1.0 11.1 ? 199 ILE A N 1 199 . A ATOM 1580 C CA . ILE A 1 199 ? -4.659 22.313 24.862 1.0 11.28 ? 199 ILE A CA 1 199 . A ATOM 1581 C C . ILE A 1 199 ? -5.376 23.656 25.015 1.0 11.27 ? 199 ILE A C 1 199 . A ATOM 1582 O O . ILE A 1 199 ? -4.851 24.691 24.624 1.0 10.24 ? 199 ILE A O 1 199 . A ATOM 1583 C CB . ILE A 1 199 ? -4.221 22.049 23.388 1.0 10.78 ? 199 ILE A CB 1 199 . A ATOM 1584 C CG1 . ILE A 1 199 ? -5.414 21.796 22.479 1.0 11.91 ? 199 ILE A CG1 1 199 . A ATOM 1585 C CG2 . ILE A 1 199 ? -3.269 20.835 23.352 1.0 11.48 ? 199 ILE A CG2 1 199 . A ATOM 1586 C CD1 . ILE A 1 199 ? -5.066 21.876 20.985 1.0 12.44 ? 199 ILE A CD1 1 199 . A ATOM 1587 N N . LEU A 1 200 ? -6.539 23.637 25.664 1.0 12.38 ? 200 LEU A N 1 200 . A ATOM 1588 C CA . LEU A 1 200 ? -7.252 24.877 25.932 1.0 14.43 ? 200 LEU A CA 1 200 . A ATOM 1589 C C . LEU A 1 200 ? -6.746 25.400 27.258 1.0 16.08 ? 200 LEU A C 1 200 . A ATOM 1590 O O . LEU A 1 200 ? -6.955 26.555 27.573 1.0 17.57 ? 200 LEU A O 1 200 . A ATOM 1591 C CB . LEU A 1 200 ? -8.759 24.618 26.035 1.0 15.77 ? 200 LEU A CB 1 200 . A ATOM 1592 C CG . LEU A 1 200 ? -9.492 24.617 24.694 1.0 17.06 ? 200 LEU A CG 1 200 . A ATOM 1593 C CD1 . LEU A 1 200 ? -9.622 26.036 24.198 1.0 18.67 ? 200 LEU A CD1 1 200 . A ATOM 1594 C CD2 . LEU A 1 200 ? -8.761 23.768 23.709 1.0 20.06 ? 200 LEU A CD2 1 200 . A ATOM 1595 N N . ASN A 1 201 ? -6.055 24.541 28.007 1.0 17.24 ? 201 ASN A N 1 201 . A ATOM 1596 C CA . ASN A 1 201 ? -5.549 24.889 29.324 1.0 18.51 ? 201 ASN A CA 1 201 . A ATOM 1597 C C . ASN A 1 201 ? -4.168 25.535 29.377 1.0 17.75 ? 201 ASN A C 1 201 . A ATOM 1598 O O . ASN A 1 201 ? -3.165 24.921 29.011 1.0 18.62 ? 201 ASN A O 1 201 . A ATOM 1599 C CB . ASN A 1 201 ? -5.532 23.651 30.228 1.0 20.54 ? 201 ASN A CB 1 201 . A ATOM 1600 C CG . ASN A 1 201 ? -6.869 22.942 30.287 1.0 22.04 ? 201 ASN A CG 1 201 . A ATOM 1601 O OD1 . ASN A 1 201 ? -7.931 23.570 30.251 1.0 23.52 ? 201 ASN A OD1 1 201 . A ATOM 1602 N ND2 . ASN A 1 201 ? -6.826 21.623 30.406 1.0 22.77 ? 201 ASN A ND2 1 201 . A ATOM 1603 N N . ALA A 1 202 ? -4.114 26.773 29.842 1.0 17.76 ? 202 ALA A N 1 202 . A ATOM 1604 C CA . ALA A 1 202 ? -2.834 27.456 29.991 1.0 17.08 ? 202 ALA A CA 1 202 . A ATOM 1605 C C . ALA A 1 202 ? -2.150 26.833 31.219 1.0 16.75 ? 202 ALA A C 1 202 . A ATOM 1606 O O . ALA A 1 202 ? -2.828 26.358 32.134 1.0 17.82 ? 202 ALA A O 1 202 . A ATOM 1607 C CB . ALA A 1 202 ? -3.056 28.935 30.227 1.0 17.58 ? 202 ALA A CB 1 202 . A ATOM 1608 N N . PRO A 1 203 ? -0.811 26.811 31.257 1.0 15.27 ? 203 PRO A N 1 203 . A ATOM 1609 C CA . PRO A 1 203 ? -0.092 26.233 32.404 1.0 15.89 ? 203 PRO A CA 1 203 . A ATOM 1610 C C . PRO A 1 203 ? -0.439 26.974 33.699 1.0 17.34 ? 203 PRO A C 1 203 . A ATOM 1611 O O . PRO A 1 203 ? -0.748 28.172 33.639 1.0 17.89 ? 203 PRO A O 1 203 . A ATOM 1612 C CB . PRO A 1 203 ? 1.375 26.423 32.029 1.0 15.81 ? 203 PRO A CB 1 203 . A ATOM 1613 C CG . PRO A 1 203 ? 1.365 26.401 30.503 1.0 14.61 ? 203 PRO A CG 1 203 . A ATOM 1614 C CD . PRO A 1 203 ? 0.116 27.207 30.176 1.0 15.4 ? 203 PRO A CD 1 203 . A ATOM 1615 O OXT . PRO A 1 203 ? -0.355 26.351 34.772 1.0 16.93 ? 203 PRO A OXT 1 203 . A HETATM 1616 N N . PCA B 2 1 ? 14.734 9.722 3.561 1.0 15.64 ? 251 PCA B N 1 1 . B HETATM 1617 C CA . PCA B 2 1 ? 14.531 9.796 5.017 1.0 13.22 ? 251 PCA B CA 1 1 . B HETATM 1618 C CB . PCA B 2 1 ? 15.157 11.083 5.544 1.0 15.39 ? 251 PCA B CB 1 1 . B HETATM 1619 C CG . PCA B 2 1 ? 15.572 11.809 4.311 1.0 15.97 ? 251 PCA B CG 1 1 . B HETATM 1620 C CD . PCA B 2 1 ? 15.240 10.889 3.172 1.0 16.08 ? 251 PCA B CD 1 1 . B HETATM 1621 O OE . PCA B 2 1 ? 15.420 11.182 1.994 1.0 16.73 ? 251 PCA B OE 1 1 . B HETATM 1622 C C . PCA B 2 1 ? 13.033 9.810 5.258 1.0 12.54 ? 251 PCA B C 1 1 . B HETATM 1623 O O . PCA B 2 1 ? 12.295 10.584 4.639 1.0 12.05 ? 251 PCA B O 1 1 . B ATOM 1624 N N . ASN B 2 2 ? 12.569 8.957 6.158 1.0 9.77 ? 252 ASN B N 1 2 . B ATOM 1625 C CA . ASN B 2 2 ? 11.147 8.896 6.452 1.0 9.06 ? 252 ASN B CA 1 2 . B ATOM 1626 C C . ASN B 2 2 ? 10.890 9.684 7.729 1.0 7.91 ? 252 ASN B C 1 2 . B ATOM 1627 O O . ASN B 2 2 ? 11.633 9.558 8.692 1.0 8.28 ? 252 ASN B O 1 2 . B ATOM 1628 C CB . ASN B 2 2 ? 10.699 7.448 6.707 1.0 9.21 ? 252 ASN B CB 1 2 . B ATOM 1629 C CG . ASN B 2 2 ? 10.382 6.690 5.425 1.0 11.24 ? 252 ASN B CG 1 2 . B ATOM 1630 O OD1 . ASN B 2 2 ? 9.514 7.094 4.643 1.0 12.87 ? 252 ASN B OD1 1 2 . B ATOM 1631 N ND2 . ASN B 2 2 ? 11.082 5.578 5.210 1.0 12.25 ? 252 ASN B ND2 1 2 . B ATOM 1632 N N . TRP B 2 3 ? 9.848 10.506 7.709 1.0 6.65 ? 253 TRP B N 1 3 . B ATOM 1633 C CA . TRP B 2 3 ? 9.428 11.272 8.882 1.0 5.48 ? 253 TRP B CA 1 3 . B ATOM 1634 C C . TRP B 2 3 ? 7.945 11.541 8.792 1.0 6.1 ? 253 TRP B C 1 3 . B ATOM 1635 O O . TRP B 2 3 ? 7.318 11.929 9.786 1.0 6.35 ? 253 TRP B O 1 3 . B ATOM 1636 C CB . TRP B 2 3 ? 10.199 12.586 9.017 1.0 5.11 ? 253 TRP B CB 1 3 . B ATOM 1637 C CG . TRP B 2 3 ? 9.899 13.717 8.013 1.0 4.35 ? 253 TRP B CG 1 3 . B ATOM 1638 C CD1 . TRP B 2 3 ? 9.256 13.647 6.800 1.0 4.41 ? 253 TRP B CD1 1 3 . B ATOM 1639 C CD2 . TRP B 2 3 ? 10.240 15.084 8.204 1.0 3.66 ? 253 TRP B CD2 1 3 . B ATOM 1640 N NE1 . TRP B 2 3 ? 9.180 14.905 6.225 1.0 5.11 ? 253 TRP B NE1 1 3 . B ATOM 1641 C CE2 . TRP B 2 3 ? 9.773 15.810 7.065 1.0 3.95 ? 253 TRP B CE2 1 3 . B ATOM 1642 C CE3 . TRP B 2 3 ? 10.886 15.775 9.218 1.0 4.21 ? 253 TRP B CE3 1 3 . B ATOM 1643 C CZ2 . TRP B 2 3 ? 9.936 17.198 6.936 1.0 4.38 ? 253 TRP B CZ2 1 3 . B ATOM 1644 C CZ3 . TRP B 2 3 ? 11.063 17.155 9.099 1.0 4.62 ? 253 TRP B CZ3 1 3 . B ATOM 1645 C CH2 . TRP B 2 3 ? 10.591 17.857 7.971 1.0 4.54 ? 253 TRP B CH2 1 3 . B ATOM 1646 O OXT . TRP B 2 3 ? 7.374 11.384 7.691 1.0 6.66 ? 253 TRP B OXT 1 3 . B HETATM 1647 CD CD . CD C 3 . ? 5.554 12.624 8.212 1.0 6.68 ? 981 CD C CD 1 981 . A HETATM 1648 CD CD . CD D 3 . ? 15.466 28.026 28.239 1.0 9.01 ? 982 CD D CD 1 982 . A HETATM 1649 CD CD . CD E 3 . ? -6.631 27.175 2.810 1.0 15.89 ? 983 CD E CD 1 983 . A HETATM 1650 CD CD . CD F 3 . ? 25.592 3.636 30.178 1.0 43.42 ? 984 CD F CD 1 984 . A HETATM 1651 CD CD . CD G 3 . ? -1.280 34.121 21.325 1.0 19.71 ? 985 CD G CD 1 985 . A HETATM 1652 CD CD . CD H 3 . ? -8.897 13.826 20.002 1.0 49.46 ? 986 CD H CD 1 986 . A HETATM 1653 CD CD . CD I 3 . ? -0.782 28.393 35.956 1.0 25.41 ? 987 CD I CD 1 987 . A HETATM 1654 CD CD . CD J 3 . ? 19.743 14.230 9.381 1.0 12.6 ? 988 CD J CD 1 988 . A HETATM 1655 CD CD . CD K 3 . ? 0.333 28.604 -0.122 1.0 19.95 ? 989 CD K CD 1 989 . A HETATM 1656 CD CD . CD L 3 . ? -2.524 2.550 32.844 0.5 11.19 ? 990 CD L CD 1 990 . A HETATM 1657 CD CD . CD M 3 . ? -5.559 5.804 31.495 1.0 33.86 ? 991 CD M CD 1 991 . A HETATM 1658 O O . HOH N 4 . ? 22.690 24.171 15.324 1.0 13.3 ? 301 HOH N O 1 301 . A HETATM 1659 O O . HOH N 4 . ? 20.528 24.710 13.799 1.0 8.33 ? 302 HOH N O 1 302 . A HETATM 1660 O O . HOH N 4 . ? 20.866 25.359 10.871 1.0 19.07 ? 303 HOH N O 1 303 . A HETATM 1661 O O . HOH N 4 . ? 12.154 -3.215 16.093 1.0 7.81 ? 304 HOH N O 1 304 . A HETATM 1662 O O . HOH N 4 . ? 11.333 2.782 11.665 1.0 10.15 ? 305 HOH N O 1 305 . A HETATM 1663 O O . HOH N 4 . ? 12.622 29.278 7.009 1.0 16.86 ? 306 HOH N O 1 306 . A HETATM 1664 O O . HOH N 4 . ? 14.065 31.015 7.954 1.0 18.09 ? 307 HOH N O 1 307 . A HETATM 1665 O O . HOH N 4 . ? 10.250 32.199 6.506 1.0 25.43 ? 308 HOH N O 1 308 . A HETATM 1666 O O . HOH N 4 . ? 10.409 -0.104 10.216 1.0 24.18 ? 309 HOH N O 1 309 . A HETATM 1667 O O . HOH N 4 . ? 13.991 -2.451 8.438 1.0 17.93 ? 310 HOH N O 1 310 . A HETATM 1668 O O . HOH N 4 . ? 16.716 0.032 7.780 1.0 10.21 ? 311 HOH N O 1 311 . A HETATM 1669 O O . HOH N 4 . ? 8.891 16.195 -0.219 1.0 14.63 ? 312 HOH N O 1 312 . A HETATM 1670 O O . HOH N 4 . ? 19.872 0.417 12.283 1.0 8.89 ? 313 HOH N O 1 313 . A HETATM 1671 O O . HOH N 4 . ? 4.140 30.037 19.672 1.0 11.16 ? 314 HOH N O 1 314 . A HETATM 1672 O O . HOH N 4 . ? -10.787 29.128 22.055 1.0 25.48 ? 315 HOH N O 1 315 . A HETATM 1673 O O . HOH N 4 . ? 5.906 33.355 20.745 1.0 23.86 ? 316 HOH N O 1 316 . A HETATM 1674 O O . HOH N 4 . ? 1.721 31.736 19.435 1.0 27.42 ? 317 HOH N O 1 317 . A HETATM 1675 O O . HOH N 4 . ? -8.529 22.280 21.273 1.0 11.08 ? 318 HOH N O 1 318 . A HETATM 1676 O O . HOH N 4 . ? -3.381 35.540 20.956 1.0 13.48 ? 319 HOH N O 1 319 . A HETATM 1677 O O . HOH N 4 . ? 0.571 32.388 21.659 1.0 18.35 ? 320 HOH N O 1 320 . A HETATM 1678 O O . HOH N 4 . ? 20.343 -1.776 8.824 1.0 12.87 ? 321 HOH N O 1 321 . A HETATM 1679 O O . HOH N 4 . ? 2.211 28.991 27.937 1.0 15.84 ? 322 HOH N O 1 322 . A HETATM 1680 O O . HOH N 4 . ? -7.345 7.100 24.853 1.0 20.14 ? 323 HOH N O 1 323 . A HETATM 1681 O O . HOH N 4 . ? -2.129 13.332 27.706 1.0 12.57 ? 324 HOH N O 1 324 . A HETATM 1682 O O . HOH N 4 . ? 3.870 22.678 33.443 1.0 8.82 ? 325 HOH N O 1 325 . A HETATM 1683 O O . HOH N 4 . ? 14.247 22.049 32.059 1.0 12.33 ? 326 HOH N O 1 326 . A HETATM 1684 O O . HOH N 4 . ? 24.370 4.146 25.870 1.0 23.25 ? 327 HOH N O 1 327 . A HETATM 1685 O O . HOH N 4 . ? 17.752 6.135 33.401 1.0 17.25 ? 328 HOH N O 1 328 . A HETATM 1686 O O . HOH N 4 . ? 12.586 11.969 39.939 1.0 47.48 ? 329 HOH N O 1 329 . A HETATM 1687 O O . HOH N 4 . ? 27.425 7.766 31.720 1.0 44.42 ? 330 HOH N O 1 330 . A HETATM 1688 O O . HOH N 4 . ? 19.107 4.387 24.116 1.0 14.08 ? 331 HOH N O 1 331 . A HETATM 1689 O O . HOH N 4 . ? 20.199 4.190 21.790 1.0 25.47 ? 332 HOH N O 1 332 . A HETATM 1690 O O . HOH N 4 . ? 29.441 9.588 27.518 1.0 30.23 ? 333 HOH N O 1 333 . A HETATM 1691 O O . HOH N 4 . ? -0.496 13.967 38.422 1.0 41.4 ? 334 HOH N O 1 334 . A HETATM 1692 O O . HOH N 4 . ? 1.166 18.022 37.314 1.0 16.04 ? 335 HOH N O 1 335 . A HETATM 1693 O O . HOH N 4 . ? 2.954 18.688 39.467 1.0 19.45 ? 336 HOH N O 1 336 . A HETATM 1694 O O . HOH N 4 . ? 5.642 16.794 42.826 1.0 35.94 ? 337 HOH N O 1 337 . A HETATM 1695 O O . HOH N 4 . ? 4.995 17.070 39.592 1.0 21.35 ? 338 HOH N O 1 338 . A HETATM 1696 O O . HOH N 4 . ? 1.311 10.312 43.869 1.0 44.35 ? 339 HOH N O 1 339 . A HETATM 1697 O O . HOH N 4 . ? -2.886 17.356 29.881 1.0 22.87 ? 340 HOH N O 1 340 . A HETATM 1698 O O . HOH N 4 . ? -2.133 22.145 28.852 1.0 18.43 ? 341 HOH N O 1 341 . A HETATM 1699 O O . HOH N 4 . ? -4.522 20.222 30.914 1.0 30.67 ? 342 HOH N O 1 342 . A HETATM 1700 O O . HOH N 4 . ? 29.066 4.021 21.227 1.0 28.02 ? 343 HOH N O 1 343 . A HETATM 1701 O O . HOH N 4 . ? 23.217 11.420 7.540 1.0 38.53 ? 344 HOH N O 1 344 . A HETATM 1702 O O . HOH N 4 . ? 17.449 6.298 10.984 1.0 8.48 ? 345 HOH N O 1 345 . A HETATM 1703 O O . HOH N 4 . ? 17.788 2.814 8.667 1.0 10.49 ? 346 HOH N O 1 346 . A HETATM 1704 O O . HOH N 4 . ? -8.088 16.409 26.613 1.0 18.55 ? 347 HOH N O 1 347 . A HETATM 1705 O O . HOH N 4 . ? 17.759 28.191 27.510 1.0 5.29 ? 348 HOH N O 1 348 . A HETATM 1706 O O . HOH N 4 . ? 14.783 30.168 27.510 1.0 15.41 ? 349 HOH N O 1 349 . A HETATM 1707 O O . HOH N 4 . ? 11.153 21.774 32.318 1.0 24.61 ? 350 HOH N O 1 350 . A HETATM 1708 O O . HOH N 4 . ? 11.619 19.008 34.186 1.0 18.3 ? 351 HOH N O 1 351 . A HETATM 1709 O O . HOH N 4 . ? 24.143 21.868 24.405 1.0 17.47 ? 352 HOH N O 1 352 . A HETATM 1710 O O . HOH N 4 . ? 21.480 16.875 7.208 1.0 8.17 ? 353 HOH N O 1 353 . A HETATM 1711 O O . HOH N 4 . ? 19.658 11.879 9.189 1.0 16.82 ? 354 HOH N O 1 354 . A HETATM 1712 O O . HOH N 4 . ? 19.344 16.613 8.567 1.0 8.81 ? 355 HOH N O 1 355 . A HETATM 1713 O O . HOH N 4 . ? 18.594 13.292 7.542 1.0 24.37 ? 356 HOH N O 1 356 . A HETATM 1714 O O . HOH N 4 . ? 8.961 2.844 10.002 1.0 35.13 ? 357 HOH N O 1 357 . A HETATM 1715 O O . HOH N 4 . ? 5.987 21.639 1.718 1.0 7.72 ? 358 HOH N O 1 358 . A HETATM 1716 O O . HOH N 4 . ? 6.460 19.518 -0.171 1.0 15.14 ? 359 HOH N O 1 359 . A HETATM 1717 O O . HOH N 4 . ? -6.982 17.553 10.369 1.0 11.29 ? 360 HOH N O 1 360 . A HETATM 1718 O O . HOH N 4 . ? -8.763 16.269 12.217 1.0 17.33 ? 361 HOH N O 1 361 . A HETATM 1719 O O . HOH N 4 . ? -2.163 17.689 2.105 1.0 14.51 ? 362 HOH N O 1 362 . A HETATM 1720 O O . HOH N 4 . ? 2.001 14.213 -0.011 1.0 16.98 ? 363 HOH N O 1 363 . A HETATM 1721 O O . HOH N 4 . ? 0.352 11.581 2.913 1.0 40.26 ? 364 HOH N O 1 364 . A HETATM 1722 O O . HOH N 4 . ? 0.081 19.583 5.678 1.0 6.49 ? 365 HOH N O 1 365 . A HETATM 1723 O O . HOH N 4 . ? 0.761 12.102 5.671 1.0 13.58 ? 366 HOH N O 1 366 . A HETATM 1724 O O . HOH N 4 . ? -4.167 9.523 8.928 1.0 30.03 ? 367 HOH N O 1 367 . A HETATM 1725 O O . HOH N 4 . ? 3.562 22.370 6.010 1.0 4.19 ? 368 HOH N O 1 368 . A HETATM 1726 O O . HOH N 4 . ? 5.057 17.161 0.398 1.0 10.69 ? 369 HOH N O 1 369 . A HETATM 1727 O O . HOH N 4 . ? 2.211 15.912 -3.825 1.0 2.75 ? 370 HOH N O 1 370 . A HETATM 1728 O O . HOH N 4 . ? -8.068 17.132 2.853 1.0 20.29 ? 371 HOH N O 1 371 . A HETATM 1729 O O . HOH N 4 . ? -9.016 17.560 5.709 1.0 25.12 ? 372 HOH N O 1 372 . A HETATM 1730 O O . HOH N 4 . ? -12.917 11.478 9.267 1.0 46.58 ? 373 HOH N O 1 373 . A HETATM 1731 O O . HOH N 4 . ? -5.715 20.594 4.412 1.0 12.49 ? 374 HOH N O 1 374 . A HETATM 1732 O O . HOH N 4 . ? 2.737 21.124 -1.132 1.0 11.23 ? 375 HOH N O 1 375 . A HETATM 1733 O O . HOH N 4 . ? 8.967 27.732 -4.045 1.0 36.52 ? 376 HOH N O 1 376 . A HETATM 1734 O O . HOH N 4 . ? 9.682 19.072 -3.587 1.0 38.25 ? 377 HOH N O 1 377 . A HETATM 1735 O O . HOH N 4 . ? 4.185 -1.665 26.889 1.0 20.61 ? 378 HOH N O 1 378 . A HETATM 1736 O O . HOH N 4 . ? 4.877 0.702 30.172 1.0 18.09 ? 379 HOH N O 1 379 . A HETATM 1737 O O . HOH N 4 . ? -1.106 27.318 -1.837 1.0 7.68 ? 380 HOH N O 1 380 . A HETATM 1738 O O . HOH N 4 . ? 13.084 17.170 -1.154 1.0 17.74 ? 381 HOH N O 1 381 . A HETATM 1739 O O . HOH N 4 . ? 2.915 35.991 16.367 1.0 40.26 ? 382 HOH N O 1 382 . A HETATM 1740 O O . HOH N 4 . ? 5.922 28.807 11.433 1.0 8.51 ? 383 HOH N O 1 383 . A HETATM 1741 O O . HOH N 4 . ? 3.734 28.776 9.710 1.0 8.13 ? 384 HOH N O 1 384 . A HETATM 1742 O O . HOH N 4 . ? 2.997 31.201 8.399 1.0 13.6 ? 385 HOH N O 1 385 . A HETATM 1743 O O . HOH N 4 . ? 1.285 26.699 0.830 1.0 1.0 ? 386 HOH N O 1 386 . A HETATM 1744 O O . HOH N 4 . ? 12.370 20.619 2.372 1.0 11.37 ? 387 HOH N O 1 387 . A HETATM 1745 O O . HOH N 4 . ? 3.323 29.049 4.350 1.0 15.03 ? 388 HOH N O 1 388 . A HETATM 1746 O O . HOH N 4 . ? -9.843 23.636 6.867 1.0 16.62 ? 389 HOH N O 1 389 . A HETATM 1747 O O . HOH N 4 . ? -9.867 21.902 4.466 1.0 24.07 ? 390 HOH N O 1 390 . A HETATM 1748 O O . HOH N 4 . ? -4.635 23.921 1.439 1.0 26.52 ? 391 HOH N O 1 391 . A HETATM 1749 O O . HOH N 4 . ? -3.234 31.767 5.776 1.0 29.07 ? 392 HOH N O 1 392 . A HETATM 1750 O O . HOH N 4 . ? -10.642 14.761 8.912 1.0 29.39 ? 393 HOH N O 1 393 . A HETATM 1751 O O . HOH N 4 . ? -11.322 15.425 11.529 1.0 23.62 ? 394 HOH N O 1 394 . A HETATM 1752 O O . HOH N 4 . ? -9.664 29.586 13.689 1.0 23.68 ? 395 HOH N O 1 395 . A HETATM 1753 O O . HOH N 4 . ? -8.861 28.673 9.737 1.0 18.99 ? 396 HOH N O 1 396 . A HETATM 1754 O O . HOH N 4 . ? -12.771 29.449 19.347 1.0 38.1 ? 397 HOH N O 1 397 . A HETATM 1755 O O . HOH N 4 . ? -15.412 14.746 22.936 1.0 46.51 ? 398 HOH N O 1 398 . A HETATM 1756 O O . HOH N 4 . ? -12.983 25.086 17.498 1.0 32.68 ? 399 HOH N O 1 399 . A HETATM 1757 O O . HOH N 4 . ? 0.921 39.116 17.860 1.0 39.93 ? 400 HOH N O 1 400 . A HETATM 1758 O O . HOH N 4 . ? -2.793 34.751 11.688 1.0 26.83 ? 401 HOH N O 1 401 . A HETATM 1759 O O . HOH N 4 . ? -10.305 33.481 17.009 1.0 41.12 ? 402 HOH N O 1 402 . A HETATM 1760 O O . HOH N 4 . ? -11.981 27.255 15.772 1.0 29.4 ? 403 HOH N O 1 403 . A HETATM 1761 O O . HOH N 4 . ? -7.909 33.360 21.442 1.0 21.09 ? 404 HOH N O 1 404 . A HETATM 1762 O O . HOH N 4 . ? 2.118 26.354 27.072 1.0 8.82 ? 405 HOH N O 1 405 . A HETATM 1763 O O . HOH N 4 . ? 4.293 24.216 30.951 1.0 18.32 ? 406 HOH N O 1 406 . A HETATM 1764 O O . HOH N 4 . ? 4.534 26.803 32.150 1.0 16.02 ? 407 HOH N O 1 407 . A HETATM 1765 O O . HOH N 4 . ? 16.111 13.632 34.395 1.0 19.24 ? 408 HOH N O 1 408 . A HETATM 1766 O O . HOH N 4 . ? 25.094 6.567 22.219 1.0 13.59 ? 409 HOH N O 1 409 . A HETATM 1767 O O . HOH N 4 . ? 22.158 10.815 12.704 1.0 27.06 ? 410 HOH N O 1 410 . A HETATM 1768 O O . HOH N 4 . ? 20.275 1.507 28.857 1.0 23.31 ? 411 HOH N O 1 411 . A HETATM 1769 O O . HOH N 4 . ? 15.671 16.391 -1.238 1.0 15.9 ? 414 HOH N O 1 414 . A HETATM 1770 O O . HOH N 4 . ? 18.673 17.978 1.393 1.0 17.99 ? 415 HOH N O 1 415 . A HETATM 1771 O O . HOH N 4 . ? 4.962 10.065 11.472 1.0 15.66 ? 416 HOH N O 1 416 . A HETATM 1772 O O . HOH N 4 . ? 4.846 19.874 -2.388 1.0 20.55 ? 417 HOH N O 1 417 . A HETATM 1773 O O . HOH N 4 . ? -6.291 14.355 3.817 1.0 38.04 ? 418 HOH N O 1 418 . A HETATM 1774 O O . HOH N 4 . ? -1.555 7.320 13.112 1.0 17.25 ? 419 HOH N O 1 419 . A HETATM 1775 O O . HOH N 4 . ? 5.511 28.553 -5.897 1.0 42.66 ? 420 HOH N O 1 420 . A HETATM 1776 O O . HOH N 4 . ? 18.306 27.938 2.617 1.0 34.98 ? 421 HOH N O 1 421 . A HETATM 1777 O O . HOH N 4 . ? 19.375 0.737 9.450 1.0 17.68 ? 422 HOH N O 1 422 . A HETATM 1778 O O . HOH N 4 . ? 23.587 21.595 20.221 1.0 26.09 ? 423 HOH N O 1 423 . A HETATM 1779 O O . HOH N 4 . ? 22.019 14.609 8.610 1.0 17.4 ? 424 HOH N O 1 424 . A HETATM 1780 O O . HOH N 4 . ? 22.460 1.508 30.762 1.0 22.67 ? 425 HOH N O 1 425 . A HETATM 1781 O O . HOH N 4 . ? 10.961 -1.588 37.213 1.0 51.5 ? 426 HOH N O 1 426 . A HETATM 1782 O O . HOH N 4 . ? 6.519 29.134 -1.035 1.0 39.67 ? 427 HOH N O 1 427 . A HETATM 1783 O O . HOH N 4 . ? 15.275 20.294 34.047 1.0 19.84 ? 428 HOH N O 1 428 . A HETATM 1784 O O . HOH N 4 . ? 19.757 27.766 29.084 1.0 17.04 ? 429 HOH N O 1 429 . A HETATM 1785 O O . HOH N 4 . ? 8.672 23.089 33.395 1.0 21.53 ? 430 HOH N O 1 430 . A HETATM 1786 O O . HOH N 4 . ? -8.396 27.951 4.091 1.0 21.02 ? 431 HOH N O 1 431 . A HETATM 1787 O O . HOH N 4 . ? -9.394 26.369 6.532 1.0 17.5 ? 432 HOH N O 1 432 . A HETATM 1788 O O . HOH N 4 . ? -6.494 29.452 2.316 1.0 19.13 ? 433 HOH N O 1 433 . A HETATM 1789 O O . HOH N 4 . ? -8.242 20.206 6.078 1.0 14.32 ? 434 HOH N O 1 434 . A HETATM 1790 O O . HOH N 4 . ? -11.612 17.455 5.476 1.0 29.32 ? 435 HOH N O 1 435 . A HETATM 1791 O O . HOH N 4 . ? -3.048 32.282 14.325 1.0 12.71 ? 436 HOH N O 1 436 . A HETATM 1792 O O . HOH N 4 . ? 28.938 4.321 27.650 1.0 50.75 ? 437 HOH N O 1 437 . A HETATM 1793 O O . HOH N 4 . ? -0.495 35.401 23.236 1.0 21.26 ? 438 HOH N O 1 438 . A HETATM 1794 O O . HOH N 4 . ? -4.205 27.490 18.146 1.0 10.35 ? 439 HOH N O 1 439 . A HETATM 1795 O O . HOH N 4 . ? 4.688 31.378 23.031 1.0 33.92 ? 440 HOH N O 1 440 . A HETATM 1796 O O . HOH N 4 . ? -1.554 31.638 10.484 1.0 20.63 ? 441 HOH N O 1 441 . A HETATM 1797 O O . HOH N 4 . ? -7.569 11.441 20.688 1.0 31.08 ? 442 HOH N O 1 442 . A HETATM 1798 O O . HOH N 4 . ? -13.029 20.481 26.009 1.0 37.18 ? 443 HOH N O 1 443 . A HETATM 1799 O O . HOH N 4 . ? -11.111 16.581 25.053 1.0 29.17 ? 444 HOH N O 1 444 . A HETATM 1800 O O . HOH N 4 . ? -6.749 9.561 26.832 1.0 15.94 ? 445 HOH N O 1 445 . A HETATM 1801 O O . HOH N 4 . ? 1.241 1.877 15.017 1.0 32.64 ? 446 HOH N O 1 446 . A HETATM 1802 O O . HOH N 4 . ? 2.954 -0.952 22.495 1.0 23.24 ? 447 HOH N O 1 447 . A HETATM 1803 O O . HOH N 4 . ? -12.829 20.382 7.660 1.0 28.61 ? 448 HOH N O 1 448 . A HETATM 1804 O O . HOH N 4 . ? -5.514 13.966 9.217 1.0 19.11 ? 449 HOH N O 1 449 . A HETATM 1805 O O . HOH N 4 . ? 6.113 0.180 27.520 1.0 12.82 ? 450 HOH N O 1 450 . A HETATM 1806 O O . HOH N 4 . ? 4.883 -1.304 20.595 1.0 15.04 ? 451 HOH N O 1 451 . A HETATM 1807 O O . HOH N 4 . ? 8.313 28.074 3.015 1.0 19.48 ? 452 HOH N O 1 452 . A HETATM 1808 O O . HOH N 4 . ? -5.798 1.881 26.152 1.0 34.78 ? 453 HOH N O 1 453 . A HETATM 1809 O O . HOH N 4 . ? -2.967 3.038 27.432 1.0 38.35 ? 454 HOH N O 1 454 . A HETATM 1810 O O . HOH N 4 . ? -5.383 4.190 29.603 1.0 16.72 ? 455 HOH N O 1 455 . A HETATM 1811 O O . HOH N 4 . ? 8.647 -1.476 27.251 1.0 14.12 ? 456 HOH N O 1 456 . A HETATM 1812 O O . HOH N 4 . ? 25.863 18.286 33.991 1.0 23.43 ? 457 HOH N O 1 457 . A HETATM 1813 O O . HOH N 4 . ? 18.019 25.424 31.837 1.0 40.15 ? 458 HOH N O 1 458 . A HETATM 1814 O O . HOH N 4 . ? 22.572 26.058 17.201 1.0 13.78 ? 459 HOH N O 1 459 . A HETATM 1815 O O . HOH N 4 . ? 25.077 16.418 11.370 1.0 17.69 ? 460 HOH N O 1 460 . A HETATM 1816 O O . HOH N 4 . ? 1.218 20.119 35.447 1.0 37.95 ? 461 HOH N O 1 461 . A HETATM 1817 O O . HOH N 4 . ? 22.014 3.140 25.148 1.0 29.04 ? 462 HOH N O 1 462 . A HETATM 1818 O O . HOH N 4 . ? 22.902 2.784 22.062 1.0 14.62 ? 463 HOH N O 1 463 . A HETATM 1819 O O . HOH N 4 . ? 23.263 0.549 20.429 1.0 17.75 ? 464 HOH N O 1 464 . A HETATM 1820 O O . HOH N 4 . ? 25.035 -1.510 30.202 1.0 22.69 ? 465 HOH N O 1 465 . A HETATM 1821 O O . HOH N 4 . ? 29.521 5.846 29.571 1.0 40.47 ? 466 HOH N O 1 466 . A HETATM 1822 O O . HOH N 4 . ? 27.451 0.845 26.999 1.0 18.88 ? 467 HOH N O 1 467 . A HETATM 1823 O O . HOH N 4 . ? 27.470 3.126 23.517 1.0 24.19 ? 468 HOH N O 1 468 . A HETATM 1824 O O . HOH N 4 . ? 24.950 17.030 17.739 1.0 20.81 ? 469 HOH N O 1 469 . A HETATM 1825 O O . HOH N 4 . ? 36.639 9.671 28.634 1.0 46.22 ? 470 HOH N O 1 470 . A HETATM 1826 O O . HOH N 4 . ? 40.171 13.001 27.197 1.0 42.82 ? 471 HOH N O 1 471 . A HETATM 1827 O O . HOH N 4 . ? 13.130 20.433 34.831 1.0 38.85 ? 472 HOH N O 1 472 . A HETATM 1828 O O . HOH N 4 . ? 21.677 23.697 30.949 1.0 32.92 ? 473 HOH N O 1 473 . A HETATM 1829 O O . HOH N 4 . ? 15.548 27.163 33.171 1.0 26.31 ? 474 HOH N O 1 474 . A HETATM 1830 O O . HOH N 4 . ? 8.390 -1.514 36.353 1.0 45.27 ? 475 HOH N O 1 475 . A HETATM 1831 O O . HOH N 4 . ? 13.826 10.086 35.463 1.0 22.52 ? 476 HOH N O 1 476 . A HETATM 1832 O O . HOH N 4 . ? 16.498 -3.517 33.766 1.0 33.8 ? 477 HOH N O 1 477 . A HETATM 1833 O O . HOH N 4 . ? 11.901 0.485 36.313 1.0 45.51 ? 478 HOH N O 1 478 . A HETATM 1834 O O . HOH N 4 . ? -1.169 13.547 34.815 1.0 24.79 ? 479 HOH N O 1 479 . A HETATM 1835 O O . HOH N 4 . ? 0.520 10.806 40.312 1.0 28.62 ? 480 HOH N O 1 480 . A HETATM 1836 O O . HOH N 4 . ? 5.455 34.040 13.553 1.0 24.7 ? 481 HOH N O 1 481 . A HETATM 1837 O O . HOH N 4 . ? 27.574 10.786 13.173 1.0 45.85 ? 482 HOH N O 1 482 . A HETATM 1838 O O . HOH N 4 . ? 19.714 9.690 10.080 1.0 29.39 ? 483 HOH N O 1 483 . A HETATM 1839 O O . HOH N 4 . ? 22.604 6.649 12.784 1.0 21.57 ? 484 HOH N O 1 484 . A HETATM 1840 O O . HOH N 4 . ? 25.533 19.028 6.239 1.0 46.56 ? 485 HOH N O 1 485 . A HETATM 1841 O O . HOH N 4 . ? 21.417 15.148 5.485 1.0 38.9 ? 486 HOH N O 1 486 . A HETATM 1842 O O . HOH N 4 . ? 19.720 4.889 8.467 1.0 21.26 ? 487 HOH N O 1 487 . A HETATM 1843 O O . HOH N 4 . ? 26.769 19.144 18.635 1.0 35.37 ? 488 HOH N O 1 488 . A HETATM 1844 O O . HOH N 4 . ? 28.551 14.406 20.292 1.0 46.09 ? 489 HOH N O 1 489 . A HETATM 1845 O O . HOH N 4 . ? 10.735 -4.008 7.394 1.0 30.74 ? 490 HOH N O 1 490 . A HETATM 1846 O O . HOH N 4 . ? 7.658 11.292 -1.124 1.0 30.76 ? 491 HOH N O 1 491 . A HETATM 1847 O O . HOH N 4 . ? 8.177 7.989 9.649 1.0 11.4 ? 492 HOH N O 1 492 . A HETATM 1848 O O . HOH N 4 . ? 22.497 8.387 8.784 1.0 38.91 ? 493 HOH N O 1 493 . A HETATM 1849 O O . HOH N 4 . ? -8.310 16.217 8.066 1.0 19.52 ? 495 HOH N O 1 495 . A HETATM 1850 O O . HOH N 4 . ? -13.685 25.529 22.699 1.0 29.91 ? 496 HOH N O 1 496 . A HETATM 1851 O O . HOH N 4 . ? -3.927 5.903 15.910 1.0 37.89 ? 497 HOH N O 1 497 . A HETATM 1852 O O . HOH N 4 . ? 0.729 0.111 21.248 1.0 23.52 ? 498 HOH N O 1 498 . A HETATM 1853 O O . HOH N 4 . ? 2.422 -0.390 30.465 1.0 24.06 ? 499 HOH N O 1 499 . A HETATM 1854 O O . HOH N 4 . ? 31.076 28.454 12.062 1.0 48.25 ? 500 HOH N O 1 500 . A HETATM 1855 O O . HOH N 4 . ? 3.394 11.966 1.455 1.0 14.12 ? 501 HOH N O 1 501 . A HETATM 1856 O O . HOH N 4 . ? 7.670 26.836 -1.735 1.0 23.36 ? 502 HOH N O 1 502 . A HETATM 1857 O O . HOH N 4 . ? 16.834 24.261 6.978 1.0 21.4 ? 503 HOH N O 1 503 . A HETATM 1858 O O . HOH N 4 . ? 0.824 31.418 27.490 1.0 31.06 ? 504 HOH N O 1 504 . A HETATM 1859 O O . HOH N 4 . ? -8.037 29.740 24.207 1.0 28.47 ? 505 HOH N O 1 505 . A HETATM 1860 O O . HOH N 4 . ? 12.555 11.528 37.038 1.0 38.05 ? 506 HOH N O 1 506 . A HETATM 1861 O O . HOH N 4 . ? -10.435 34.052 19.730 1.0 39.82 ? 507 HOH N O 1 507 . A HETATM 1862 O O . HOH N 4 . ? 2.334 10.224 6.899 1.0 18.04 ? 508 HOH N O 1 508 . A HETATM 1863 O O . HOH N 4 . ? 27.635 7.378 21.555 1.0 24.09 ? 509 HOH N O 1 509 . A HETATM 1864 O O . HOH N 4 . ? 27.895 8.821 19.566 1.0 32.74 ? 510 HOH N O 1 510 . A HETATM 1865 O O . HOH N 4 . ? 10.451 21.264 34.878 1.0 28.15 ? 511 HOH N O 1 511 . A HETATM 1866 O O . HOH N 4 . ? 0.233 3.884 36.551 1.0 25.4 ? 512 HOH N O 1 512 . A HETATM 1867 O O . HOH N 4 . ? -15.894 20.940 4.742 1.0 41.23 ? 513 HOH N O 1 513 . A HETATM 1868 O O . HOH N 4 . ? -8.128 12.502 15.408 1.0 37.2 ? 514 HOH N O 1 514 . A HETATM 1869 O O . HOH N 4 . ? -17.792 16.651 15.300 1.0 45.58 ? 515 HOH N O 1 515 . A HETATM 1870 O O . HOH N 4 . ? -0.861 4.570 13.429 1.0 38.31 ? 516 HOH N O 1 516 . A HETATM 1871 O O . HOH N 4 . ? 6.698 4.609 6.398 1.0 44.88 ? 517 HOH N O 1 517 . A HETATM 1872 O O . HOH N 4 . ? 1.910 5.868 9.950 1.0 26.79 ? 518 HOH N O 1 518 . A HETATM 1873 O O . HOH N 4 . ? 5.478 -1.534 12.919 1.0 29.12 ? 519 HOH N O 1 519 . A HETATM 1874 O O . HOH N 4 . ? 24.020 25.208 19.307 1.0 29.02 ? 520 HOH N O 1 520 . A HETATM 1875 O O . HOH N 4 . ? -7.165 14.143 13.031 1.0 24.95 ? 521 HOH N O 1 521 . A HETATM 1876 O O . HOH N 4 . ? -6.163 9.682 11.297 1.0 39.25 ? 522 HOH N O 1 522 . A HETATM 1877 O O . HOH N 4 . ? -8.331 17.850 29.299 1.0 41.64 ? 523 HOH N O 1 523 . A HETATM 1878 O O . HOH N 4 . ? -8.305 6.838 11.398 1.0 45.09 ? 524 HOH N O 1 524 . A HETATM 1879 O O . HOH N 4 . ? 41.567 8.380 28.822 1.0 47.58 ? 526 HOH N O 1 526 . A HETATM 1880 O O . HOH N 4 . ? -13.019 21.405 5.063 1.0 40.04 ? 527 HOH N O 1 527 . A HETATM 1881 O O . HOH N 4 . ? 25.532 15.224 34.141 1.0 31.7 ? 528 HOH N O 1 528 . A HETATM 1882 O O . HOH N 4 . ? 21.633 8.375 37.044 1.0 45.86 ? 529 HOH N O 1 529 . A HETATM 1883 O O . HOH N 4 . ? 22.722 23.229 22.323 1.0 26.58 ? 530 HOH N O 1 530 . A HETATM 1884 O O . HOH N 4 . ? -6.948 13.888 6.824 1.0 41.57 ? 531 HOH N O 1 531 . A HETATM 1885 O O . HOH N 4 . ? 23.924 18.152 36.619 1.0 48.85 ? 532 HOH N O 1 532 . A HETATM 1886 O O . HOH N 4 . ? 28.832 24.200 19.922 1.0 45.0 ? 533 HOH N O 1 533 . A HETATM 1887 O O . HOH N 4 . ? 26.202 21.908 12.991 1.0 22.82 ? 534 HOH N O 1 534 . A HETATM 1888 O O . HOH N 4 . ? 32.409 18.529 16.613 1.0 46.98 ? 535 HOH N O 1 535 . A HETATM 1889 O O . HOH N 4 . ? 21.935 19.797 6.943 1.0 36.09 ? 536 HOH N O 1 536 . A HETATM 1890 O O . HOH N 4 . ? 22.962 18.699 3.405 1.0 43.59 ? 537 HOH N O 1 537 . A HETATM 1891 O O . HOH N 4 . ? 13.387 29.653 3.130 1.0 27.31 ? 538 HOH N O 1 538 . A HETATM 1892 O O . HOH N 4 . ? 13.190 26.961 1.851 1.0 17.12 ? 539 HOH N O 1 539 . A HETATM 1893 O O . HOH N 4 . ? 14.967 27.940 5.916 1.0 27.05 ? 540 HOH N O 1 540 . A HETATM 1894 O O . HOH N 4 . ? 25.253 26.444 11.665 1.0 32.57 ? 541 HOH N O 1 541 . A HETATM 1895 O O . HOH N 4 . ? 14.617 24.380 -2.116 1.0 29.62 ? 542 HOH N O 1 542 . A HETATM 1896 O O . HOH N 4 . ? 9.379 10.834 4.515 1.0 19.66 ? 543 HOH N O 1 543 . A HETATM 1897 O O . HOH N 4 . ? 5.986 -3.565 30.227 1.0 35.91 ? 544 HOH N O 1 544 . A HETATM 1898 O O . HOH N 4 . ? 9.866 3.268 34.551 1.0 26.51 ? 545 HOH N O 1 545 . A HETATM 1899 O O . HOH N 4 . ? 6.758 15.619 -2.277 1.0 17.44 ? 546 HOH N O 1 546 . A HETATM 1900 O O . HOH N 4 . ? 11.481 18.506 0.762 1.0 17.0 ? 547 HOH N O 1 547 . A HETATM 1901 O O . HOH N 4 . ? 8.981 18.774 -0.870 1.0 20.29 ? 548 HOH N O 1 548 . A HETATM 1902 O O . HOH N 4 . ? 1.507 22.204 -8.499 1.0 25.49 ? 549 HOH N O 1 549 . A HETATM 1903 O O . HOH N 4 . ? 2.122 28.775 -1.865 1.0 28.59 ? 550 HOH N O 1 550 . A HETATM 1904 O O . HOH N 4 . ? 2.011 29.105 0.567 1.0 15.84 ? 551 HOH N O 1 551 . A HETATM 1905 O O . HOH N 4 . ? -0.326 30.697 -0.801 1.0 21.77 ? 552 HOH N O 1 552 . A HETATM 1906 O O . HOH N 4 . ? 25.905 9.157 17.756 1.0 27.07 ? 553 HOH N O 1 553 . A HETATM 1907 O O . HOH N 4 . ? 23.075 9.347 14.814 1.0 33.94 ? 554 HOH N O 1 554 . A HETATM 1908 O O . HOH N 4 . ? 30.780 10.444 32.727 1.0 42.06 ? 555 HOH N O 1 555 . A HETATM 1909 O O . HOH N 4 . ? 27.189 22.717 20.976 1.0 42.07 ? 556 HOH N O 1 556 . A HETATM 1910 O O . HOH N 4 . ? 12.081 28.073 14.536 1.0 21.96 ? 557 HOH N O 1 557 . A HETATM 1911 O O . HOH N 4 . ? 8.309 8.060 38.407 1.0 41.11 ? 558 HOH N O 1 558 . A HETATM 1912 O O . HOH N 4 . ? 36.173 22.968 38.537 1.0 44.24 ? 559 HOH N O 1 559 . A HETATM 1913 O O . HOH N 4 . ? 27.501 24.054 33.236 1.0 45.3 ? 560 HOH N O 1 560 . A HETATM 1914 O O . HOH N 4 . ? 12.059 13.990 35.061 1.0 35.19 ? 561 HOH N O 1 561 . A HETATM 1915 O O . HOH N 4 . ? 17.169 6.986 36.054 1.0 36.94 ? 562 HOH N O 1 562 . A HETATM 1916 O O . HOH N 4 . ? 12.268 8.321 34.229 1.0 36.01 ? 563 HOH N O 1 563 . A HETATM 1917 O O . HOH N 4 . ? 28.291 24.401 41.033 1.0 43.64 ? 564 HOH N O 1 564 . A HETATM 1918 O O . HOH N 4 . ? 39.134 8.702 29.298 1.0 50.65 ? 565 HOH N O 1 565 . A HETATM 1919 O O . HOH N 4 . ? 31.151 15.596 30.428 1.0 38.78 ? 566 HOH N O 1 566 . A HETATM 1920 O O . HOH N 4 . ? 24.538 11.880 36.890 1.0 45.84 ? 567 HOH N O 1 567 . A HETATM 1921 O O . HOH N 4 . ? -2.718 37.161 24.280 1.0 47.36 ? 568 HOH N O 1 568 . A HETATM 1922 O O . HOH N 4 . ? 21.206 29.653 30.593 1.0 40.54 ? 569 HOH N O 1 569 . A HETATM 1923 O O . HOH N 4 . ? -3.485 7.314 10.903 1.0 40.99 ? 570 HOH N O 1 570 . A HETATM 1924 O O . HOH N 4 . ? -6.758 14.326 19.672 1.0 19.16 ? 571 HOH N O 1 571 . A HETATM 1925 O O . HOH N 4 . ? -16.768 28.074 25.430 1.0 44.17 ? 572 HOH N O 1 572 . A HETATM 1926 O O . HOH N 4 . ? -14.556 25.786 14.259 1.0 38.41 ? 573 HOH N O 1 573 . A HETATM 1927 O O . HOH N 4 . ? -12.275 27.067 19.093 1.0 46.47 ? 574 HOH N O 1 574 . A HETATM 1928 O O . HOH N 4 . ? -2.916 14.362 30.005 1.0 34.04 ? 575 HOH N O 1 575 . A HETATM 1929 O O . HOH N 4 . ? -2.984 -1.169 21.953 1.0 43.34 ? 576 HOH N O 1 576 . A HETATM 1930 O O . HOH N 4 . ? -8.720 16.705 33.714 1.0 44.55 ? 577 HOH N O 1 577 . A HETATM 1931 O O . HOH N 4 . ? 2.783 1.590 17.278 1.0 35.26 ? 578 HOH N O 1 578 . A HETATM 1932 O O . HOH N 4 . ? -8.643 3.195 26.772 1.0 39.47 ? 579 HOH N O 1 579 . A HETATM 1933 O O . HOH N 4 . ? -13.707 28.081 10.703 1.0 39.97 ? 580 HOH N O 1 580 . A HETATM 1934 O O . HOH N 4 . ? -11.675 29.140 8.855 1.0 36.82 ? 581 HOH N O 1 581 . A HETATM 1935 O O . HOH N 4 . ? -14.198 17.718 8.352 1.0 39.74 ? 582 HOH N O 1 582 . A HETATM 1936 O O . HOH N 4 . ? 25.012 1.227 30.432 1.0 24.97 ? 583 HOH N O 1 583 . A HETATM 1937 O O . HOH N 4 . ? 27.962 6.925 35.394 1.0 42.72 ? 584 HOH N O 1 584 . A HETATM 1938 O O . HOH N 4 . ? -6.679 31.207 26.393 1.0 35.64 ? 585 HOH N O 1 585 . A HETATM 1939 O O . HOH N 4 . ? 1.387 14.738 39.661 1.0 39.52 ? 586 HOH N O 1 586 . A HETATM 1940 O O . HOH N 4 . ? -4.344 4.150 17.434 1.0 42.08 ? 587 HOH N O 1 587 . A HETATM 1941 O O . HOH N 4 . ? -9.858 15.751 28.824 1.0 40.07 ? 588 HOH N O 1 588 . A HETATM 1942 O O . HOH N 4 . ? -13.513 13.262 22.225 1.0 41.31 ? 589 HOH N O 1 589 . A HETATM 1943 O O . HOH N 4 . ? 1.537 -4.631 25.262 1.0 46.06 ? 590 HOH N O 1 590 . A HETATM 1944 O O . HOH N 4 . ? 3.781 3.665 9.450 1.0 40.68 ? 591 HOH N O 1 591 . A HETATM 1945 O O . HOH N 4 . ? -19.130 19.594 17.482 1.0 47.92 ? 592 HOH N O 1 592 . A HETATM 1946 O O . HOH N 4 . ? -17.591 18.992 11.200 1.0 42.07 ? 593 HOH N O 1 593 . A HETATM 1947 O O . HOH N 4 . ? -8.289 28.557 26.767 1.0 35.84 ? 594 HOH N O 1 594 . A HETATM 1948 O O . HOH N 4 . ? 28.214 16.974 44.421 1.0 46.89 ? 595 HOH N O 1 595 . A HETATM 1949 O O . HOH N 4 . ? 19.366 12.506 39.707 1.0 45.18 ? 596 HOH N O 1 596 . A HETATM 1950 O O . HOH N 4 . ? 24.503 3.251 33.584 1.0 44.53 ? 597 HOH N O 1 597 . A HETATM 1951 O O . HOH N 4 . ? -0.304 29.930 4.922 1.0 36.08 ? 598 HOH N O 1 598 . A HETATM 1952 O O . HOH N 4 . ? 12.525 23.558 -3.652 1.0 41.53 ? 599 HOH N O 1 599 . A HETATM 1953 O O . HOH N 4 . ? 26.350 25.645 15.576 1.0 40.86 ? 600 HOH N O 1 600 . A HETATM 1954 O O . HOH N 4 . ? 25.387 20.505 22.479 1.0 42.8 ? 601 HOH N O 1 601 . A HETATM 1955 O O . HOH N 4 . ? 26.503 23.281 25.890 1.0 43.16 ? 602 HOH N O 1 602 . A HETATM 1956 O O . HOH N 4 . ? 24.779 24.324 13.752 1.0 22.94 ? 603 HOH N O 1 603 . A HETATM 1957 O O . HOH N 4 . ? 28.373 26.346 12.573 1.0 41.0 ? 604 HOH N O 1 604 . A HETATM 1958 O O . HOH N 4 . ? 23.611 16.689 5.975 1.0 37.31 ? 605 HOH N O 1 605 . A HETATM 1959 O O . HOH N 4 . ? 14.228 28.391 8.555 1.0 29.03 ? 606 HOH N O 1 606 . A HETATM 1960 O O . HOH N 4 . ? 12.968 30.201 13.018 1.0 24.2 ? 607 HOH N O 1 607 . A HETATM 1961 O O . HOH N 4 . ? 22.506 18.301 8.826 1.0 22.93 ? 608 HOH N O 1 608 . A HETATM 1962 O O . HOH N 4 . ? 30.649 3.927 31.740 1.0 40.7 ? 609 HOH N O 1 609 . A HETATM 1963 O O . HOH N 4 . ? 19.566 3.018 42.986 1.0 38.91 ? 610 HOH N O 1 610 . A HETATM 1964 O O . HOH N 4 . ? 7.223 0.380 10.440 1.0 29.38 ? 611 HOH N O 1 611 . A HETATM 1965 O O . HOH N 4 . ? 9.035 5.424 9.034 1.0 15.28 ? 612 HOH N O 1 612 . A HETATM 1966 O O . HOH N 4 . ? 0.260 2.092 29.573 1.0 18.67 ? 613 HOH N O 1 613 . A HETATM 1967 O O . HOH N 4 . ? 2.004 -2.615 28.873 1.0 27.49 ? 614 HOH N O 1 614 . A HETATM 1968 O O . HOH N 4 . ? 1.781 5.126 39.556 1.0 33.54 ? 615 HOH N O 1 615 . A HETATM 1969 O O . HOH N 4 . ? 9.780 0.973 33.115 1.0 36.15 ? 616 HOH N O 1 616 . A HETATM 1970 O O . HOH N 4 . ? -0.748 0.764 32.788 0.5 7.8 ? 617 HOH N O 1 617 . A HETATM 1971 O O . HOH N 4 . ? -1.244 3.415 34.958 1.0 12.13 ? 618 HOH N O 1 618 . A HETATM 1972 O O . HOH N 4 . ? -6.566 13.562 27.564 1.0 29.93 ? 619 HOH N O 1 619 . A HETATM 1973 O O . HOH N 4 . ? -11.335 20.003 32.329 1.0 40.74 ? 620 HOH N O 1 620 . A HETATM 1974 O O . HOH N 4 . ? -10.196 22.226 33.926 1.0 37.28 ? 621 HOH N O 1 621 . A HETATM 1975 O O . HOH N 4 . ? -13.484 18.678 29.164 1.0 37.0 ? 622 HOH N O 1 622 . A HETATM 1976 O O . HOH N 4 . ? -7.401 14.546 34.055 1.0 36.37 ? 623 HOH N O 1 623 . A HETATM 1977 O O . HOH N 4 . ? -8.806 26.551 30.333 1.0 35.02 ? 624 HOH N O 1 624 . A HETATM 1978 O O . HOH N 4 . ? -11.109 28.071 27.148 1.0 38.17 ? 625 HOH N O 1 625 . A HETATM 1979 O O . HOH N 4 . ? -12.675 27.659 23.580 1.0 30.31 ? 626 HOH N O 1 626 . A HETATM 1980 O O . HOH N 4 . ? -14.430 24.075 24.457 1.0 34.52 ? 627 HOH N O 1 627 . A HETATM 1981 O O . HOH N 4 . ? -15.898 21.208 20.175 1.0 30.33 ? 628 HOH N O 1 628 . A HETATM 1982 O O . HOH N 4 . ? -20.021 30.193 22.188 1.0 41.81 ? 629 HOH N O 1 629 . A HETATM 1983 O O . HOH N 4 . ? -17.851 22.541 31.983 1.0 39.87 ? 630 HOH N O 1 630 . A HETATM 1984 O O . HOH N 4 . ? 40.239 15.903 26.310 1.0 37.26 ? 631 HOH N O 1 631 . A HETATM 1985 O O . HOH N 4 . ? -14.321 23.407 26.999 1.0 31.01 ? 632 HOH N O 1 632 . A HETATM 1986 O O . HOH N 4 . ? -10.379 14.595 23.291 1.0 38.05 ? 633 HOH N O 1 633 . A HETATM 1987 O O . HOH N 4 . ? -8.188 12.614 24.665 1.0 37.9 ? 634 HOH N O 1 634 . A HETATM 1988 O O . HOH N 4 . ? -11.930 13.807 13.229 1.0 34.37 ? 635 HOH N O 1 635 . A HETATM 1989 O O . HOH N 4 . ? -15.663 14.538 10.976 1.0 35.9 ? 636 HOH N O 1 636 . A HETATM 1990 O O . HOH N 4 . ? -10.601 11.596 11.990 1.0 36.96 ? 637 HOH N O 1 637 . A HETATM 1991 O O . HOH N 4 . ? -10.602 11.113 17.302 1.0 39.92 ? 638 HOH N O 1 638 . A HETATM 1992 O O . HOH N 4 . ? -16.527 15.294 13.687 1.0 39.11 ? 639 HOH N O 1 639 . A HETATM 1993 O O . HOH N 4 . ? -21.965 15.223 19.555 1.0 37.42 ? 640 HOH N O 1 640 . A HETATM 1994 O O . HOH N 4 . ? -10.188 13.112 14.576 1.0 37.79 ? 641 HOH N O 1 641 . A HETATM 1995 O O . HOH N 4 . ? 1.182 7.401 11.931 1.0 26.77 ? 642 HOH N O 1 642 . A HETATM 1996 O O . HOH N 4 . ? -4.871 7.629 6.873 1.0 39.14 ? 643 HOH N O 1 643 . A HETATM 1997 O O . HOH N 4 . ? -5.456 5.247 10.791 1.0 43.19 ? 644 HOH N O 1 644 . A HETATM 1998 O O . HOH N 4 . ? -1.891 7.891 9.158 1.0 34.42 ? 645 HOH N O 1 645 . A HETATM 1999 O O . HOH N 4 . ? 2.151 10.435 11.507 1.0 21.06 ? 646 HOH N O 1 646 . A HETATM 2000 O O . HOH N 4 . ? -4.124 1.779 12.115 1.0 39.49 ? 647 HOH N O 1 647 . A HETATM 2001 O O . HOH N 4 . ? -2.182 -2.553 12.547 1.0 39.79 ? 648 HOH N O 1 648 . A HETATM 2002 O O . HOH N 4 . ? 1.277 4.392 22.275 1.0 16.14 ? 649 HOH N O 1 649 . A HETATM 2003 O O . HOH N 4 . ? -4.470 -2.225 20.535 1.0 38.8 ? 650 HOH N O 1 650 . A HETATM 2004 O O . HOH N 4 . ? -2.936 -5.664 19.589 1.0 34.72 ? 651 HOH N O 1 651 . A HETATM 2005 O O . HOH N 4 . ? -9.267 4.913 17.843 1.0 36.89 ? 652 HOH N O 1 652 . A HETATM 2006 O O . HOH N 4 . ? 1.045 -4.812 16.074 1.0 42.21 ? 653 HOH N O 1 653 . A HETATM 2007 O O . HOH N 4 . ? 0.793 1.596 18.736 1.0 25.66 ? 654 HOH N O 1 654 . A HETATM 2008 O O . HOH N 4 . ? -1.551 1.571 16.986 1.0 37.09 ? 655 HOH N O 1 655 . A HETATM 2009 O O . HOH N 4 . ? -7.166 3.720 19.186 1.0 38.18 ? 656 HOH N O 1 656 . A HETATM 2010 O O . HOH N 4 . ? -5.423 5.889 24.999 1.0 31.48 ? 657 HOH N O 1 657 . A HETATM 2011 O O . HOH N 4 . ? -6.474 3.797 24.320 1.0 36.65 ? 658 HOH N O 1 658 . A HETATM 2012 O O . HOH N 4 . ? -8.324 9.719 22.401 1.0 34.18 ? 659 HOH N O 1 659 . A HETATM 2013 O O . HOH N 4 . ? -21.920 17.978 20.088 1.0 41.94 ? 660 HOH N O 1 660 . A HETATM 2014 O O . HOH N 4 . ? -20.601 20.392 22.586 1.0 39.04 ? 661 HOH N O 1 661 . A HETATM 2015 O O . HOH N 4 . ? -9.816 32.968 11.683 1.0 23.69 ? 662 HOH N O 1 662 . A HETATM 2016 O O . HOH N 4 . ? -6.062 38.514 17.219 1.0 36.0 ? 663 HOH N O 1 663 . A HETATM 2017 O O . HOH N 4 . ? 1.280 33.796 18.076 1.0 24.16 ? 664 HOH N O 1 664 . A HETATM 2018 O O . HOH N 4 . ? 4.129 37.987 19.531 1.0 35.8 ? 665 HOH N O 1 665 . A HETATM 2019 O O . HOH N 4 . ? -0.202 35.330 19.709 1.0 22.09 ? 666 HOH N O 1 666 . A HETATM 2020 O O . HOH N 4 . ? 6.694 36.610 12.964 1.0 15.53 ? 667 HOH N O 1 667 . A HETATM 2021 O O . HOH N 4 . ? 10.576 37.213 11.232 1.0 15.81 ? 668 HOH N O 1 668 . A HETATM 2022 O O . HOH N 4 . ? -12.683 31.558 11.310 1.0 38.87 ? 669 HOH N O 1 669 . A HETATM 2023 O O . HOH N 4 . ? -9.451 34.901 13.852 1.0 37.91 ? 670 HOH N O 1 670 . A HETATM 2024 O O . HOH N 4 . ? -16.001 35.451 17.967 1.0 38.54 ? 671 HOH N O 1 671 . A HETATM 2025 O O . HOH N 4 . ? -5.559 32.964 4.007 1.0 35.34 ? 672 HOH N O 1 672 . A HETATM 2026 O O . HOH N 4 . ? -2.360 34.744 5.454 1.0 36.52 ? 673 HOH N O 1 673 . A HETATM 2027 O O . HOH N 4 . ? -6.959 36.151 9.780 1.0 40.29 ? 674 HOH N O 1 674 . A HETATM 2028 O O . HOH N 4 . ? -4.724 21.724 33.650 1.0 35.66 ? 675 HOH N O 1 675 . A HETATM 2029 O O . HOH N 4 . ? 16.615 29.767 34.870 1.0 21.38 ? 676 HOH N O 1 676 . A HETATM 2030 O O . HOH N 4 . ? 17.961 25.149 35.206 1.0 34.34 ? 677 HOH N O 1 677 . A HETATM 2031 O O . HOH N 4 . ? 21.876 29.470 36.726 1.0 39.97 ? 678 HOH N O 1 678 . A HETATM 2032 O O . HOH N 4 . ? 7.395 10.655 2.976 1.0 28.48 ? 679 HOH N O 1 679 . A HETATM 2033 O O . HOH N 4 . ? 4.670 17.191 -2.383 1.0 22.79 ? 680 HOH N O 1 680 . A HETATM 2034 O O . HOH N 4 . ? 10.909 3.564 2.888 1.0 24.59 ? 681 HOH N O 1 681 . A HETATM 2035 O O . HOH N 4 . ? 2.873 8.388 4.829 1.0 39.34 ? 683 HOH N O 1 683 . A HETATM 2036 O O . HOH N 4 . ? 5.919 5.404 4.317 1.0 38.43 ? 684 HOH N O 1 684 . A HETATM 2037 O O . HOH N 4 . ? -0.620 9.519 7.772 1.0 27.8 ? 685 HOH N O 1 685 . A HETATM 2038 O O . HOH N 4 . ? 24.668 24.143 36.452 1.0 36.81 ? 686 HOH N O 1 686 . A HETATM 2039 O O . HOH N 4 . ? -6.549 4.915 8.425 1.0 42.3 ? 687 HOH N O 1 687 . A HETATM 2040 O O . HOH N 4 . ? 1.658 -2.844 10.585 1.0 40.97 ? 688 HOH N O 1 688 . A HETATM 2041 O O . HOH N 4 . ? -5.670 -5.406 10.078 1.0 39.53 ? 689 HOH N O 1 689 . A HETATM 2042 O O . HOH N 4 . ? 4.343 0.311 10.991 1.0 39.79 ? 690 HOH N O 1 690 . A HETATM 2043 O O . HOH N 4 . ? -0.999 1.472 27.475 1.0 36.76 ? 691 HOH N O 1 691 . A HETATM 2044 O O . HOH N 4 . ? 8.762 -0.330 30.375 1.0 23.64 ? 692 HOH N O 1 692 . A HETATM 2045 O O . HOH N 4 . ? 4.455 -3.297 32.126 1.0 38.1 ? 693 HOH N O 1 693 . A HETATM 2046 O O . HOH N 4 . ? 3.704 5.292 37.706 1.0 30.57 ? 694 HOH N O 1 694 . A HETATM 2047 O O . HOH N 4 . ? 5.660 7.951 37.805 1.0 31.46 ? 695 HOH N O 1 695 . A HETATM 2048 O O . HOH N 4 . ? 6.706 9.884 42.779 1.0 38.57 ? 696 HOH N O 1 696 . A HETATM 2049 O O . HOH N 4 . ? 9.157 2.771 36.932 1.0 40.75 ? 697 HOH N O 1 697 . A HETATM 2050 O O . HOH N 4 . ? 32.111 19.452 14.268 1.0 38.27 ? 698 HOH N O 1 698 . A HETATM 2051 O O . HOH N 4 . ? 14.840 6.200 42.054 1.0 38.07 ? 699 HOH N O 1 699 . A HETATM 2052 O O . HOH N 4 . ? -16.720 23.193 7.499 1.0 33.52 ? 700 HOH N O 1 700 . A HETATM 2053 O O . HOH N 4 . ? -23.382 13.365 19.381 1.0 38.44 ? 701 HOH N O 1 701 . A HETATM 2054 O O . HOH N 4 . ? -1.536 -3.351 8.820 1.0 41.72 ? 702 HOH N O 1 702 . A HETATM 2055 O O . HOH N 4 . ? 27.000 28.403 14.500 1.0 35.35 ? 703 HOH N O 1 703 . A HETATM 2056 O O . HOH N 4 . ? 25.500 25.154 31.950 1.0 37.91 ? 704 HOH N O 1 704 . A HETATM 2057 O O . HOH N 4 . ? 30.745 25.713 33.898 1.0 39.17 ? 705 HOH N O 1 705 . A HETATM 2058 O O . HOH N 4 . ? 29.947 28.558 34.378 1.0 38.53 ? 706 HOH N O 1 706 . A HETATM 2059 O O . HOH N 4 . ? 30.956 17.849 26.658 1.0 40.21 ? 707 HOH N O 1 707 . A HETATM 2060 O O . HOH N 4 . ? 11.281 27.039 -2.260 1.0 37.8 ? 708 HOH N O 1 708 . A HETATM 2061 O O . HOH N 4 . ? 11.356 25.603 -4.160 1.0 19.81 ? 709 HOH N O 1 709 . A HETATM 2062 O O . HOH N 4 . ? 25.522 14.451 7.503 1.0 40.69 ? 710 HOH N O 1 710 . A HETATM 2063 O O . HOH N 4 . ? 17.980 21.492 -1.349 1.0 27.11 ? 711 HOH N O 1 711 . A HETATM 2064 O O . HOH N 4 . ? 15.046 21.685 -0.881 1.0 19.73 ? 712 HOH N O 1 712 . A HETATM 2065 O O . HOH N 4 . ? 16.978 18.234 -5.246 1.0 32.71 ? 713 HOH N O 1 713 . A HETATM 2066 O O . HOH N 4 . ? 14.220 18.643 -5.201 1.0 27.92 ? 714 HOH N O 1 714 . A HETATM 2067 O O . HOH N 4 . ? 10.230 23.742 -4.691 1.0 39.6 ? 715 HOH N O 1 715 . A HETATM 2068 O O . HOH N 4 . ? 10.014 29.335 -0.670 1.0 34.16 ? 716 HOH N O 1 716 . A HETATM 2069 O O . HOH N 4 . ? 18.791 10.652 7.332 1.0 30.34 ? 717 HOH N O 1 717 . A HETATM 2070 O O . HOH N 4 . ? 23.831 14.071 10.291 1.0 35.81 ? 718 HOH N O 1 718 . A HETATM 2071 O O . HOH N 4 . ? 24.167 14.375 15.615 1.0 30.21 ? 719 HOH N O 1 719 . A HETATM 2072 O O . HOH N 4 . ? 25.079 4.057 23.199 1.0 22.87 ? 720 HOH N O 1 720 . A HETATM 2073 O O . HOH N 4 . ? 25.836 3.036 27.972 1.0 21.93 ? 721 HOH N O 1 721 . A HETATM 2074 O O . HOH N 4 . ? 28.043 12.268 34.061 1.0 34.14 ? 722 HOH N O 1 722 . A HETATM 2075 O O . HOH N 4 . ? 23.938 13.206 34.651 1.0 39.59 ? 723 HOH N O 1 723 . A HETATM 2076 O O . HOH N 4 . ? -4.396 34.630 23.941 1.0 31.48 ? 724 HOH N O 1 724 . A HETATM 2077 O O . HOH N 4 . ? -6.109 38.402 25.632 1.0 40.42 ? 725 HOH N O 1 725 . A HETATM 2078 O O . HOH N 4 . ? 13.461 -0.432 0.624 1.0 27.95 ? 726 HOH N O 1 726 . A HETATM 2079 O O . HOH N 4 . ? 1.709 10.114 1.668 1.0 32.93 ? 727 HOH N O 1 727 . A HETATM 2080 O O . HOH N 4 . ? 19.758 25.418 29.799 1.0 36.87 ? 728 HOH N O 1 728 . A HETATM 2081 O O . HOH N 4 . ? -1.988 0.486 12.633 1.0 37.33 ? 729 HOH N O 1 729 . A HETATM 2082 O O . HOH N 4 . ? 2.220 1.849 11.782 1.0 35.02 ? 730 HOH N O 1 730 . A HETATM 2083 O O . HOH N 4 . ? 24.417 20.875 17.731 1.0 35.78 ? 731 HOH N O 1 731 . A HETATM 2084 O O . HOH N 4 . ? 25.958 27.841 16.432 1.0 31.79 ? 732 HOH N O 1 732 . A HETATM 2085 O O . HOH N 4 . ? 11.648 -2.382 9.865 1.0 30.54 ? 733 HOH N O 1 733 . A HETATM 2086 O O . HOH N 4 . ? 20.755 18.378 5.250 1.0 29.63 ? 734 HOH N O 1 734 . A HETATM 2087 O O . HOH N 4 . ? 27.663 22.494 7.771 1.0 34.85 ? 735 HOH N O 1 735 . A HETATM 2088 O O . HOH N 4 . ? 18.882 25.126 7.356 1.0 12.81 ? 736 HOH N O 1 736 . A HETATM 2089 O O . HOH N 4 . ? 21.297 26.096 7.062 1.0 24.71 ? 737 HOH N O 1 737 . A HETATM 2090 O O . HOH N 4 . ? 21.994 24.721 2.951 1.0 41.4 ? 738 HOH N O 1 738 . A HETATM 2091 O O . HOH N 4 . ? 20.417 26.270 2.422 1.0 33.9 ? 739 HOH N O 1 739 . A HETATM 2092 O O . HOH N 4 . ? 12.390 18.975 -3.298 1.0 30.88 ? 740 HOH N O 1 740 . A HETATM 2093 O O . HOH N 4 . ? 25.921 19.231 9.941 1.0 37.43 ? 741 HOH N O 1 741 . A HETATM 2094 O O . HOH N 4 . ? 23.737 21.296 3.103 1.0 33.7 ? 742 HOH N O 1 742 . A HETATM 2095 O O . HOH N 4 . ? 26.941 16.978 3.845 1.0 37.25 ? 743 HOH N O 1 743 . A HETATM 2096 O O . HOH N 4 . ? 16.581 28.621 1.016 1.0 31.51 ? 744 HOH N O 1 744 . A HETATM 2097 O O . HOH N 4 . ? 0.169 -2.044 25.370 1.0 31.93 ? 745 HOH N O 1 745 . A HETATM 2098 O O . HOH N 4 . ? -0.894 30.070 35.234 1.0 27.27 ? 746 HOH N O 1 746 . A HETATM 2099 O O . HOH N 4 . ? 1.258 28.235 36.382 1.0 24.21 ? 747 HOH N O 1 747 . A HETATM 2100 O O . HOH N 4 . ? -0.335 0.037 30.257 1.0 21.67 ? 748 HOH N O 1 748 . A HETATM 2101 O O . HOH N 4 . ? 5.323 23.700 -5.621 1.0 31.54 ? 749 HOH N O 1 749 . A HETATM 2102 O O . HOH N 4 . ? -6.901 12.114 10.675 1.0 32.71 ? 750 HOH N O 1 750 . A HETATM 2103 O O . HOH N 4 . ? 34.407 8.475 29.273 1.0 38.44 ? 751 HOH N O 1 751 . A HETATM 2104 O O . HOH N 4 . ? 39.729 11.232 25.427 1.0 35.4 ? 752 HOH N O 1 752 . A HETATM 2105 O O . HOH N 4 . ? 31.410 10.984 23.749 1.0 38.6 ? 753 HOH N O 1 753 . A HETATM 2106 O O . HOH N 4 . ? 36.512 8.182 26.669 1.0 38.0 ? 754 HOH N O 1 754 . A HETATM 2107 O O . HOH N 4 . ? 31.127 17.088 28.744 1.0 33.32 ? 755 HOH N O 1 755 . A HETATM 2108 O O . HOH N 4 . ? 26.898 23.173 28.464 1.0 35.51 ? 756 HOH N O 1 756 . A HETATM 2109 O O . HOH N 4 . ? 29.474 18.990 14.698 1.0 38.19 ? 757 HOH N O 1 757 . A HETATM 2110 O O . HOH N 4 . ? 28.193 16.855 20.019 1.0 36.19 ? 758 HOH N O 1 758 . A HETATM 2111 O O . HOH N 4 . ? 26.045 22.435 6.092 1.0 36.35 ? 759 HOH N O 1 759 . A HETATM 2112 O O . HOH N 4 . ? 29.099 19.420 12.081 1.0 36.87 ? 760 HOH N O 1 760 . A HETATM 2113 O O . HOH N 4 . ? 27.463 26.756 9.512 1.0 33.0 ? 761 HOH N O 1 761 . A HETATM 2114 O O . HOH N 4 . ? 19.825 25.305 36.982 1.0 40.03 ? 762 HOH N O 1 762 . A HETATM 2115 O O . HOH N 4 . ? 38.398 25.130 37.361 1.0 34.62 ? 763 HOH N O 1 763 . A HETATM 2116 O O . HOH N 4 . ? 3.271 3.478 5.769 1.0 32.4 ? 764 HOH N O 1 764 . A HETATM 2117 O O . HOH N 4 . ? 10.568 5.018 0.404 1.0 24.85 ? 765 HOH N O 1 765 . A HETATM 2118 O O . HOH N 4 . ? 2.705 3.774 2.995 1.0 38.8 ? 766 HOH N O 1 766 . A HETATM 2119 O O . HOH N 4 . ? 2.157 0.593 7.081 1.0 36.04 ? 767 HOH N O 1 767 . A HETATM 2120 O O . HOH N 4 . ? 2.618 8.152 9.998 1.0 22.7 ? 768 HOH N O 1 768 . A HETATM 2121 O O . HOH N 4 . ? 7.857 13.535 -2.074 1.0 30.02 ? 769 HOH N O 1 769 . A HETATM 2122 O O . HOH N 4 . ? -5.156 -2.029 15.768 1.0 42.25 ? 770 HOH N O 1 770 . A HETATM 2123 O O . HOH N 4 . ? 1.787 20.730 32.063 1.0 24.07 ? 771 HOH N O 1 771 . A HETATM 2124 O O . HOH N 4 . ? -2.868 23.612 33.040 1.0 31.55 ? 772 HOH N O 1 772 . A HETATM 2125 O O . HOH N 4 . ? 6.879 17.963 40.887 1.0 34.96 ? 773 HOH N O 1 773 . A HETATM 2126 O O . HOH N 4 . ? -2.024 8.629 33.419 1.0 33.98 ? 774 HOH N O 1 774 . A HETATM 2127 O O . HOH N 4 . ? -3.517 15.566 38.248 1.0 39.06 ? 775 HOH N O 1 775 . A HETATM 2128 O O . HOH N 4 . ? -5.300 19.396 35.049 1.0 37.56 ? 776 HOH N O 1 776 . A HETATM 2129 O O . HOH N 4 . ? -3.172 0.853 23.223 1.0 34.31 ? 777 HOH N O 1 777 . A HETATM 2130 O O . HOH N 4 . ? 28.072 19.441 39.904 1.0 41.22 ? 778 HOH N O 1 778 . A HETATM 2131 O O . HOH N 4 . ? 26.272 15.877 42.765 1.0 37.13 ? 779 HOH N O 1 779 . A HETATM 2132 O O . HOH N 4 . ? 26.033 15.546 45.222 1.0 40.09 ? 780 HOH N O 1 780 . A HETATM 2133 O O . HOH N 4 . ? 22.987 15.590 36.630 1.0 36.96 ? 781 HOH N O 1 781 . A HETATM 2134 O O . HOH N 4 . ? 29.884 14.515 32.251 1.0 37.71 ? 782 HOH N O 1 782 . A HETATM 2135 O O . HOH N 4 . ? 33.070 29.295 35.265 1.0 35.65 ? 783 HOH N O 1 783 . A HETATM 2136 O O . HOH N 4 . ? 29.248 16.030 23.950 1.0 32.02 ? 784 HOH N O 1 784 . A HETATM 2137 O O . HOH N 4 . ? 30.134 20.059 23.539 1.0 38.8 ? 785 HOH N O 1 785 . A HETATM 2138 O O . HOH N 4 . ? 29.187 11.313 20.756 1.0 25.77 ? 786 HOH N O 1 786 . A HETATM 2139 O O . HOH N 4 . ? 35.902 17.788 15.527 1.0 37.0 ? 787 HOH N O 1 787 . A HETATM 2140 O O . HOH N 4 . ? 32.435 21.181 16.580 1.0 37.26 ? 788 HOH N O 1 788 . A HETATM 2141 O O . HOH N 4 . ? 32.900 15.203 14.987 1.0 37.68 ? 789 HOH N O 1 789 . A HETATM 2142 O O . HOH N 4 . ? 30.896 14.578 16.251 1.0 40.51 ? 790 HOH N O 1 790 . A HETATM 2143 O O . HOH N 4 . ? 10.513 6.103 40.459 1.0 36.87 ? 791 HOH N O 1 791 . A HETATM 2144 O O . HOH N 4 . ? 12.627 6.065 37.015 1.0 38.68 ? 792 HOH N O 1 792 . A HETATM 2145 O O . HOH N 4 . ? 14.603 8.235 36.819 1.0 36.13 ? 793 HOH N O 1 793 . A HETATM 2146 O O . HOH N 4 . ? 8.084 0.904 40.419 1.0 36.52 ? 794 HOH N O 1 794 . A HETATM 2147 O O . HOH N 4 . ? 9.571 9.173 43.407 1.0 40.19 ? 795 HOH N O 1 795 . A HETATM 2148 O O . HOH N 4 . ? 5.348 9.412 39.952 1.0 40.55 ? 796 HOH N O 1 796 . A HETATM 2149 O O . HOH N 4 . ? -0.164 14.456 45.566 1.0 38.6 ? 797 HOH N O 1 797 . A HETATM 2150 O O . HOH N 4 . ? -16.538 24.428 10.029 1.0 35.54 ? 798 HOH N O 1 798 . A HETATM 2151 O O . HOH N 4 . ? -13.611 18.699 4.012 1.0 33.08 ? 799 HOH N O 1 799 . A HETATM 2152 O O . HOH N 4 . ? 20.750 -0.688 30.659 1.0 36.38 ? 800 HOH N O 1 800 . A HETATM 2153 O O . HOH N 4 . ? 29.791 3.776 25.455 1.0 35.68 ? 801 HOH N O 1 801 . A HETATM 2154 O O . HOH N 4 . ? -0.542 35.100 13.142 1.0 33.11 ? 802 HOH N O 1 802 . A HETATM 2155 O O . HOH N 4 . ? -4.402 6.624 32.797 1.0 11.91 ? 803 HOH N O 1 803 . A HETATM 2156 O O . HOH N 4 . ? 3.118 34.603 13.448 1.0 29.35 ? 804 HOH N O 1 804 . A HETATM 2157 O O . HOH N 4 . ? 8.326 25.632 -5.238 1.0 41.12 ? 805 HOH N O 1 805 . A HETATM 2158 O O . HOH N 4 . ? 20.215 23.105 6.559 1.0 26.99 ? 806 HOH N O 1 806 . A HETATM 2159 O O . HOH N 4 . ? -9.756 12.173 9.497 1.0 37.32 ? 807 HOH N O 1 807 . A HETATM 2160 O O . HOH N 4 . ? -19.360 17.488 37.838 1.0 36.57 ? 808 HOH N O 1 808 . A HETATM 2161 O O . HOH N 4 . ? 6.874 -5.296 24.885 1.0 36.71 ? 809 HOH N O 1 809 . A HETATM 2162 O O . HOH N 4 . ? -0.625 34.750 26.266 1.0 38.29 ? 810 HOH N O 1 810 . A HETATM 2163 O O . HOH N 4 . ? 11.582 -0.277 3.410 1.0 36.99 ? 811 HOH N O 1 811 . A HETATM 2164 O O . HOH N 4 . ? -0.181 22.352 33.528 1.0 33.52 ? 812 HOH N O 1 812 . A HETATM 2165 O O . HOH N 4 . ? -1.323 23.760 35.066 1.0 36.93 ? 813 HOH N O 1 813 . A HETATM 2166 O O . HOH N 4 . ? 11.269 29.793 4.714 1.0 29.45 ? 814 HOH N O 1 814 . A HETATM 2167 O O . HOH N 4 . ? 9.055 0.057 8.438 1.0 34.85 ? 815 HOH N O 1 815 . A HETATM 2168 O O . HOH N 4 . ? -8.612 32.366 24.329 1.0 28.65 ? 816 HOH N O 1 816 . A HETATM 2169 O O . HOH N 4 . ? 2.717 33.306 24.518 1.0 38.07 ? 817 HOH N O 1 817 . A HETATM 2170 O O . HOH N 4 . ? 0.521 32.659 25.209 1.0 37.77 ? 818 HOH N O 1 818 . A HETATM 2171 O O . HOH N 4 . ? 7.310 24.505 32.456 1.0 26.44 ? 819 HOH N O 1 819 . A HETATM 2172 O O . HOH N 4 . ? 8.107 24.651 35.352 1.0 24.86 ? 820 HOH N O 1 820 . A HETATM 2173 O O . HOH N 4 . ? 26.033 4.938 32.073 1.0 34.33 ? 821 HOH N O 1 821 . A HETATM 2174 O O . HOH N 4 . ? 8.944 35.097 12.437 1.0 26.36 ? 822 HOH N O 1 822 . A HETATM 2175 O O . HOH N 4 . ? 6.142 36.848 16.788 1.0 18.8 ? 823 HOH N O 1 823 . A HETATM 2176 O O . HOH N 4 . ? 5.666 36.025 14.791 1.0 33.93 ? 824 HOH N O 1 824 . A HETATM 2177 O O . HOH N 4 . ? -7.949 30.410 4.887 1.0 36.81 ? 825 HOH N O 1 825 . A HETATM 2178 O O . HOH N 4 . ? -6.041 16.814 29.146 1.0 40.97 ? 826 HOH N O 1 826 . A HETATM 2179 O O . HOH N 4 . ? -3.052 20.438 29.459 1.0 14.31 ? 827 HOH N O 1 827 . A HETATM 2180 O O . HOH N 4 . ? 12.776 1.538 3.528 1.0 33.31 ? 828 HOH N O 1 828 . A HETATM 2181 O O . HOH N 4 . ? 11.676 -1.729 1.523 1.0 40.91 ? 829 HOH N O 1 829 . A HETATM 2182 O O . HOH N 4 . ? 15.490 24.183 33.896 1.0 29.89 ? 830 HOH N O 1 830 . A HETATM 2183 O O . HOH N 4 . ? 20.213 27.811 36.511 1.0 36.93 ? 831 HOH N O 1 831 . A HETATM 2184 O O . HOH N 4 . ? -4.783 4.231 13.491 1.0 36.01 ? 832 HOH N O 1 832 . A HETATM 2185 O O . HOH N 4 . ? -4.283 7.865 14.249 1.0 30.05 ? 833 HOH N O 1 833 . A HETATM 2186 O O . HOH N 4 . ? 2.439 -0.410 19.273 1.0 32.19 ? 834 HOH N O 1 834 . A HETATM 2187 O O . HOH N 4 . ? 12.103 21.117 -1.832 1.0 30.6 ? 835 HOH N O 1 835 . A HETATM 2188 O O . HOH N 4 . ? -1.039 28.863 1.379 1.0 16.25 ? 836 HOH N O 1 836 . A HETATM 2189 O O . HOH N 4 . ? -1.447 29.407 37.518 1.0 21.36 ? 837 HOH N O 1 837 . A HETATM 2190 O O . HOH N 4 . ? -12.628 35.172 17.822 1.0 39.97 ? 838 HOH N O 1 838 . A HETATM 2191 O O . HOH N 4 . ? -11.133 40.550 12.025 1.0 36.22 ? 839 HOH N O 1 839 . A HETATM 2192 O O . HOH N 4 . ? -10.271 42.024 14.700 1.0 33.89 ? 840 HOH N O 1 840 . A HETATM 2193 O O . HOH N 4 . ? -11.226 8.615 20.619 1.0 35.37 ? 841 HOH N O 1 841 . A HETATM 2194 O O . HOH N 4 . ? 1.402 9.911 9.054 1.0 31.0 ? 843 HOH N O 1 843 . A HETATM 2195 O O . HOH N 4 . ? -1.440 32.993 12.080 1.0 27.18 ? 844 HOH N O 1 844 . A HETATM 2196 O O . HOH N 4 . ? 39.764 11.354 29.454 1.0 37.52 ? 845 HOH N O 1 845 . A HETATM 2197 O O . HOH N 4 . ? 5.930 2.519 8.928 1.0 40.02 ? 846 HOH N O 1 846 . A HETATM 2198 O O . HOH N 4 . ? 3.354 6.160 5.788 1.0 37.04 ? 847 HOH N O 1 847 . A HETATM 2199 O O . HOH N 4 . ? -2.639 0.754 19.018 1.0 33.82 ? 848 HOH N O 1 848 . A HETATM 2200 O O . HOH N 4 . ? -22.133 22.006 18.124 1.0 35.15 ? 849 HOH N O 1 849 . A HETATM 2201 O O . HOH N 4 . ? -17.554 19.208 23.404 1.0 33.43 ? 850 HOH N O 1 850 . A HETATM 2202 O O . HOH N 4 . ? -9.630 10.052 30.279 1.0 36.24 ? 851 HOH N O 1 851 . A HETATM 2203 O O . HOH N 4 . ? -7.327 7.354 28.057 1.0 34.19 ? 852 HOH N O 1 852 . A HETATM 2204 O O . HOH N 4 . ? 18.093 9.345 36.092 1.0 36.42 ? 854 HOH N O 1 854 . A HETATM 2205 O O . HOH N 4 . ? 14.871 12.319 36.036 1.0 39.29 ? 855 HOH N O 1 855 . A HETATM 2206 O O . HOH N 4 . ? 15.572 9.055 34.577 1.0 35.54 ? 856 HOH N O 1 856 . A HETATM 2207 O O . HOH N 4 . ? 10.741 7.612 35.954 1.0 36.25 ? 857 HOH N O 1 857 . A HETATM 2208 O O . HOH N 4 . ? 6.677 11.248 40.764 1.0 35.75 ? 858 HOH N O 1 858 . A HETATM 2209 O O . HOH N 4 . ? 8.371 4.919 38.879 1.0 37.11 ? 859 HOH N O 1 859 . A HETATM 2210 O O . HOH N 4 . ? 6.023 2.975 38.260 1.0 38.87 ? 860 HOH N O 1 860 . A HETATM 2211 O O . HOH N 4 . ? -1.741 -0.152 25.614 1.0 29.79 ? 861 HOH N O 1 861 . A HETATM 2212 O O . HOH N 4 . ? 4.835 -4.151 26.077 1.0 29.67 ? 862 HOH N O 1 862 . A HETATM 2213 O O . HOH N 4 . ? 27.128 23.719 17.248 1.0 36.02 ? 863 HOH N O 1 863 . A HETATM 2214 O O . HOH N 4 . ? 27.200 19.047 21.358 1.0 36.82 ? 864 HOH N O 1 864 . A HETATM 2215 O O . HOH N 4 . ? 32.818 20.431 22.741 1.0 38.98 ? 865 HOH N O 1 865 . A HETATM 2216 O O . HOH N 4 . ? 31.356 9.110 17.961 1.0 36.96 ? 866 HOH N O 1 866 . A HETATM 2217 O O . HOH N 4 . ? 32.419 15.081 18.008 1.0 37.64 ? 867 HOH N O 1 867 . A HETATM 2218 O O . HOH N 4 . ? 29.665 13.865 23.220 1.0 35.75 ? 868 HOH N O 1 868 . A HETATM 2219 O O . HOH N 4 . ? 27.597 15.368 13.173 1.0 37.43 ? 869 HOH N O 1 869 . A HETATM 2220 O O . HOH N 4 . ? 30.679 15.044 13.853 1.0 38.55 ? 870 HOH N O 1 870 . A HETATM 2221 O O . HOH N 4 . ? 0.962 -2.493 18.073 1.0 39.85 ? 871 HOH N O 1 871 . A HETATM 2222 O O . HOH N 4 . ? -4.458 -5.157 13.255 1.0 37.87 ? 872 HOH N O 1 872 . A HETATM 2223 O O . HOH N 4 . ? -0.303 12.486 42.183 1.0 34.86 ? 873 HOH N O 1 873 . A HETATM 2224 O O . HOH N 4 . ? -17.151 25.473 12.564 1.0 37.86 ? 874 HOH N O 1 874 . A HETATM 2225 O O . HOH N 4 . ? -16.674 18.678 18.407 1.0 38.09 ? 875 HOH N O 1 875 . A HETATM 2226 O O . HOH N 4 . ? -15.954 24.239 18.524 1.0 39.35 ? 876 HOH N O 1 876 . A HETATM 2227 O O . HOH N 4 . ? -16.546 22.114 16.734 1.0 30.2 ? 877 HOH N O 1 877 . A HETATM 2228 O O . HOH N 4 . ? -13.858 10.662 25.305 1.0 39.33 ? 878 HOH N O 1 878 . A HETATM 2229 O O . HOH N 4 . ? -12.049 15.374 21.173 1.0 29.22 ? 879 HOH N O 1 879 . A HETATM 2230 O O . HOH N 4 . ? -11.399 12.320 23.189 1.0 40.5 ? 880 HOH N O 1 880 . A HETATM 2231 O O . HOH N 4 . ? -9.970 7.578 26.215 1.0 34.18 ? 881 HOH N O 1 881 . A HETATM 2232 O O . HOH N 4 . ? 6.581 27.045 -4.193 1.0 35.02 ? 882 HOH N O 1 882 . A HETATM 2233 O O . HOH N 4 . ? 8.903 26.606 0.786 1.0 28.51 ? 883 HOH N O 1 883 . A HETATM 2234 O O . HOH N 4 . ? 4.395 28.305 -0.048 1.0 34.86 ? 884 HOH N O 1 884 . A HETATM 2235 O O . HOH N 4 . ? 1.285 29.212 2.801 1.0 35.56 ? 885 HOH N O 1 885 . A HETATM 2236 O O . HOH N 4 . ? 24.607 0.843 34.810 1.0 34.63 ? 886 HOH N O 1 886 . A HETATM 2237 O O . HOH N 4 . ? -8.320 34.636 17.145 1.0 35.84 ? 887 HOH N O 1 887 . A HETATM 2238 O O . HOH N 4 . ? -11.649 31.713 16.059 1.0 34.56 ? 888 HOH N O 1 888 . A HETATM 2239 O O . HOH N 4 . ? -14.388 37.262 11.362 1.0 40.9 ? 889 HOH N O 1 889 . A HETATM 2240 O O . HOH N 4 . ? -12.598 35.756 15.164 1.0 36.59 ? 890 HOH N O 1 890 . A HETATM 2241 O O . HOH N 4 . ? -11.685 37.036 19.266 1.0 37.78 ? 891 HOH N O 1 891 . A HETATM 2242 O O . HOH N 4 . ? -13.121 39.645 15.049 1.0 40.25 ? 892 HOH N O 1 892 . A HETATM 2243 O O . HOH N 4 . ? -7.857 37.983 21.725 1.0 33.49 ? 893 HOH N O 1 893 . A HETATM 2244 O O . HOH N 4 . ? -5.235 36.756 27.320 1.0 33.38 ? 894 HOH N O 1 894 . A HETATM 2245 O O . HOH N 4 . ? -0.616 38.770 25.775 1.0 40.89 ? 895 HOH N O 1 895 . A HETATM 2246 O O . HOH N 4 . ? -0.629 36.879 27.083 1.0 37.76 ? 896 HOH N O 1 896 . A HETATM 2247 O O . HOH N 4 . ? 5.306 33.908 23.128 1.0 33.85 ? 897 HOH N O 1 897 . A HETATM 2248 O O . HOH N 4 . ? -3.073 34.016 7.771 1.0 36.26 ? 898 HOH N O 1 898 . A HETATM 2249 O O . HOH N 4 . ? 34.534 8.191 25.338 1.0 38.12 ? 899 HOH N O 1 899 . A HETATM 2250 O O . HOH N 4 . ? 42.251 12.025 28.757 1.0 37.91 ? 900 HOH N O 1 900 . A HETATM 2251 O O . HOH N 4 . ? 42.592 9.409 24.564 1.0 38.69 ? 901 HOH N O 1 901 . A HETATM 2252 O O . HOH N 4 . ? -8.107 18.788 31.803 1.0 36.08 ? 902 HOH N O 1 902 . A HETATM 2253 O O . HOH N 4 . ? 2.723 20.842 34.009 1.0 33.04 ? 903 HOH N O 1 903 . A HETATM 2254 O O . HOH N 4 . ? 14.915 27.793 28.229 1.0 6.73 ? 904 HOH N O 1 904 . A HETATM 2255 O O . HOH N 4 . ? 21.461 11.112 38.234 1.0 37.29 ? 905 HOH N O 1 905 . A HETATM 2256 O O . HOH N 4 . ? 29.408 21.409 31.153 1.0 38.55 ? 906 HOH N O 1 906 . A HETATM 2257 O O . HOH N 4 . ? 29.202 25.710 28.412 1.0 37.14 ? 907 HOH N O 1 907 . A HETATM 2258 O O . HOH N 4 . ? 30.706 18.608 33.188 1.0 36.14 ? 908 HOH N O 1 908 . A HETATM 2259 O O . HOH N 4 . ? 27.980 20.088 33.514 1.0 37.47 ? 909 HOH N O 1 909 . A HETATM 2260 O O . HOH N 4 . ? 31.084 20.057 37.867 1.0 36.22 ? 910 HOH N O 1 910 . A HETATM 2261 O O . HOH N 4 . ? 36.257 24.138 40.522 1.0 40.33 ? 911 HOH N O 1 911 . A HETATM 2262 O O . HOH N 4 . ? 27.852 22.014 42.208 1.0 38.58 ? 912 HOH N O 1 912 . A HETATM 2263 O O . HOH N 4 . ? 31.928 22.537 42.018 1.0 38.36 ? 913 HOH N O 1 913 . A HETATM 2264 O O . HOH N 4 . ? 26.480 6.527 29.443 1.0 34.82 ? 914 HOH N O 1 914 . A HETATM 2265 O O . HOH N 4 . ? -6.754 28.043 30.415 1.0 29.28 ? 915 HOH N O 1 915 . A HETATM 2266 O O . HOH N 4 . ? -4.648 27.503 33.625 1.0 30.58 ? 916 HOH N O 1 916 . A HETATM 2267 O O . HOH N 4 . ? 13.652 4.212 2.358 1.0 34.43 ? 917 HOH N O 1 917 . A HETATM 2268 O O . HOH N 4 . ? 8.171 3.043 7.281 1.0 38.44 ? 920 HOH N O 1 920 . A HETATM 2269 O O . HOH N 4 . ? 2.942 -0.648 8.997 1.0 36.49 ? 921 HOH N O 1 921 . A HETATM 2270 O O . HOH N 4 . ? 4.613 1.443 6.310 1.0 36.67 ? 922 HOH N O 1 922 . A HETATM 2271 O O . HOH N 4 . ? -0.478 4.486 6.731 1.0 40.22 ? 923 HOH N O 1 923 . A HETATM 2272 O O . HOH N 4 . ? -2.788 5.267 9.662 1.0 35.54 ? 924 HOH N O 1 924 . A HETATM 2273 O O . HOH N 4 . ? -15.648 26.220 28.894 1.0 34.85 ? 925 HOH N O 1 925 . A HETATM 2274 O O . HOH N 4 . ? -18.501 23.355 34.958 1.0 38.67 ? 926 HOH N O 1 926 . A HETATM 2275 O O . HOH N 4 . ? -5.281 -5.225 1.219 1.0 39.35 ? 927 HOH N O 1 927 . A HETATM 2276 O O . HOH N 4 . ? -22.864 17.734 22.383 1.0 37.77 ? 928 HOH N O 1 928 . A HETATM 2277 O O . HOH N 4 . ? -20.502 13.558 22.895 1.0 35.66 ? 929 HOH N O 1 929 . A HETATM 2278 O O . HOH N 4 . ? -4.189 7.836 36.682 1.0 40.84 ? 930 HOH N O 1 930 . A HETATM 2279 O O . HOH O 4 . ? 7.563 9.180 5.485 1.0 16.06 ? 412 HOH O O 1 412 . B HETATM 2280 O O . HOH O 4 . ? 4.657 10.385 8.417 1.0 13.14 ? 413 HOH O O 1 413 . B HETATM 2281 O O . HOH O 4 . ? 12.213 13.109 5.803 1.0 8.7 ? 494 HOH O O 1 494 . B HETATM 2282 O O . HOH O 4 . ? 4.239 6.654 8.068 1.0 26.27 ? 525 HOH O O 1 525 . B HETATM 2283 O O . HOH O 4 . ? 6.458 8.435 7.618 1.0 16.37 ? 682 HOH O O 1 682 . B HETATM 2284 O O . HOH O 4 . ? 5.399 8.554 9.603 1.0 25.25 ? 842 HOH O O 1 842 . B HETATM 2285 O O . HOH O 4 . ? 11.306 11.310 0.010 0.5 33.46 ? 853 HOH O O 1 853 . B HETATM 2286 O O . HOH O 4 . ? 8.190 5.908 2.594 1.0 32.35 ? 918 HOH O O 1 918 . B HETATM 2287 O O . HOH O 4 . ? 7.396 3.288 0.585 1.0 38.94 ? 919 HOH O O 1 919 . B #